A0A077Z8X7_TRITR Loading...

Kinesin protein KIF14

AlphaFold DB , UniProt , Accession A0A077Z8X7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,150 aa.

						>A0A077Z8X7_TRITR|A0A077Z8X7
MVSRKKKAQDAAVFTAVVVFLHRSSEELFKKPAAFVRPSSQSGVTLTPRTSSVKSSRNDEIAICVAVRVRQILSNEIETTSDPTISIDVDSQLGTICFGKGDQERVFNFDHCIRDLANDGKTANDRQKDLFDRLGAPMVSDVLSGINCTLFAYGQTGTGKTYSLFGTSGEPGLIPRTCKLLLNKLQSTGPETQWSMEISFLEMYNEKLRDLLIPEENAPALKIRDYPGDGVFVQGLSVVPVERFEDIQALIEIGCGRRITACTVNNSRSSRSHVLFTVKVKIDKKITANNETYCFRTTRSSLTMVDLAGSERLSSTTSLKETTSINKSLSCLGMVIDQLSENARFVNHRDSALTWYANGSFLRVRRGEKNCLFRLLKDSLGGNAKTTVLATISPAQRNINETLRTLRYANRAKRMINRVRVNSDGKSSKIVAELVDQLESRNRLLMENHEEIERLQRELSMANSASSKVANRTSVADVQLQYDNESKKSGKNISSSSLIQAPSEPFVVLLSPDPQISEGLLFSLSPGENRIGTDRCCDVVVHGSRIAPLHCTLSLKKDNDAIIVPTKGNDVFVNGILTEDVRTLRNGDRLCLAGEQYFILYLESPKRCNMDGLFDKAQVEYLRAQNERLLDKVESMRVVKKVASESVAVETRIPMRSIGIQENHTEKIVSTPTRRCANTQTARHEAAVSISAEAIDACGSIVAVDFMVLEANSIMESSNDPFRFALCDKVKVEEGEPLCLTVKMINLSMDISIVMPASDFQDHWAVLLALHQSGKRKRFSDYLNSIFFAPEKEENEPTRRVSNLFPLAIAALKESHRTSIASFDGRVTDDPTLTLTPDALKALSGQSALFDEGFASINNIQCSSPKMPIDWFLLSAGNFERLLERFRSNPNEYIFPVMFGLQHMHVCELIYADYPNRMPGVDASRQLFRTAMKRLWNAILSTLKVNNYGGPVRAEPREILSILLGEVVEAAASLSFVMPSVAGSHLLTDRCDLCMLSPHLMKAVLRGAYYGYKQLAMITGTLLDQQFSDQFISRSKVEAVLFGLESLKPIAKFCKVARGDLRDGRFIAFCLLRPLMHSLCCVAGFNDVSFKAERVQNVKTFLDDLKLCPKSAIDTEALKKALISVYPYLQDLHSFENNAMLFSQRKHSVV
					

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(Predicted Aligned Error values between residue pairs)

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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	38.6	Very low	51.4	Low	208 Å²	208	132.3 Å²	132.3	100%	1.025	67%	0.67	S	S	*	*				0	-37.9	0	-85.6	-171.3	173.4	0	0	113.9	S3 R4 K5	M1-S3 PolarHBondContact O-N 3.45Å; M1-R4 PolarHBondContact O-N 3.15Å; M1-K5 PolarHBondContact O-N 3.07Å
2	V	38.7	Very low	53.1	Low	124 Å²	124	126.2 Å²	126.2	75%	0.752	66%	0.655	S	S	*	*	H	α-helix	trans	-63.1	-39.5	-175.5	-176.9	0	0	0	0	113.7	R4 K5 K6	V2-R4 PolarHBondContact O-N 3.15Å; V2-K5 PolarHBondContact O-N 2.93Å; V2-K6 PolarHBondContact O-N 2.64Å; V2-K6 VanDerWaalsContact O-N 3.1Å
3	S	39.8	Very low	54.5	Low	95 Å²	95	123.5 Å²	123.5	66%	0.664	65%	0.647	S	S	*	*	H	α-helix	trans	-70.8	-29.1	179.2	79.1	0	0	0	0	113.9	M1 K6 K7	M1-S3 PolarHBondContact O-N 3.45Å; S3-K6 PolarHBondContact O-N 3.49Å; S3-K7 PolarHBondContact O-N 3.12Å
4	R	42.2	Very low	55.1	Low	216 Å²	216	125.5 Å²	125.5	82%	0.815	65%	0.649	S	S	*	*	H	α-helix	trans	-70.1	-34.6	171.7	-75.8	-171.1	179.7	179.2	-0.2	111.8	M1 V2 A8	M1-R4 PolarHBondContact O-N 3.15Å; V2-R4 PolarHBondContact O-N 3.15Å; R4-A8 WeakPolarHBondContact O-CB 3.27Å; R4-A8 PolarHBondContact O-N 3.07Å; R4-A8 VanDerWaalsContact O-N 3.09Å
5	K	48.3	Very low	56.4	Low	158 Å²	158	122.7 Å²	122.7	69%	0.687	64%	0.64	S	S	*	*	H	α-helix	trans	-66.1	-40.2	173.5	-96.7	-173.2	174.2	-177.1	0	112.3	M1 V2 A8 Q9	M1-K5 PolarHBondContact O-N 3.07Å; V2-K5 PolarHBondContact O-N 2.93Å; K5-A8 PolarHBondContact O-N 3.4Å; K5-Q9 PolarHBondContact O-N 3.4Å
6	K	47.6	Very low	57.3	Low	140 Å²	140	118.8 Å²	118.8	61%	0.609	63%	0.63	S	S	*	*	H	α-helix	trans	-67.2	-45.8	-179.8	-147.7	174.3	-175.4	-177	0	111.8	V2 S3 A8 Q9 D10	V2-K6 PolarHBondContact O-N 2.64Å; V2-K6 VanDerWaalsContact O-N 3.1Å; S3-K6 PolarHBondContact O-N 3.49Å; K6-A8 VanDerWaalsContact C-N 3.29Å; K6-A8 PolarHBondContact O-N 3.02Å; K6-Q9 PolarHBondContact O-N 3.16Å; K6-Q9 VanDerWaalsContact O-N 3.12Å; K6-D10 PolarHBondContact O-N 3.47Å
7	K	49.8	Very low	57.8	Low	169 Å²	169	116.2 Å²	116.2	74%	0.735	62%	0.62	S	S	*	*	H	α-helix	trans	-60.5	-35.6	172.1	-81.6	-171.2	174.4	-175.5	0	113.3	S3 A11	S3-K7 PolarHBondContact O-N 3.12Å; K7-A11 VanDerWaalsContact O-CB 3.28Å; K7-A11 WeakPolarHBondContact O-CB 3.35Å; K7-A11 PolarHBondContact O-N 3.46Å
8	A	63.7	Low	58.2	Low	61 Å²	61	113.5 Å²	113.5	50%	0.504	61%	0.608	S	S	.	*	H	α-helix	trans	-70	-36.2	175.4	0	0	0	0	0	112.4	R4 K5 K6 A12	R4-A8 WeakPolarHBondContact O-CB 3.27Å; R4-A8 PolarHBondContact O-N 3.07Å; R4-A8 VanDerWaalsContact O-N 3.09Å; K5-A8 PolarHBondContact O-N 3.4Å; K6-A8 VanDerWaalsContact C-N 3.29Å; K6-A8 PolarHBondContact O-N 3.02Å; A8-A12 VanDerWaalsContact O-CB 3.3Å; A8-A12 WeakPolarHBondContact O-CB 3.31Å; A8-A12 PolarHBondContact O-N 3.19Å
9	Q	67.5	Low	59	Low	131 Å²	131	111.5 Å²	111.5	61%	0.612	60%	0.601	S	S	*	*	H	α-helix	trans	-67.7	-44.9	173.2	-82.4	178.5	-38.4	0	0	111.8	K5 K6 A11 A12 V13	K5-Q9 PolarHBondContact O-N 3.4Å; K6-Q9 PolarHBondContact O-N 3.16Å; K6-Q9 VanDerWaalsContact O-N 3.12Å; Q9-A11 VanDerWaalsContact C-N 3.34Å; Q9-A11 PolarHBondContact O-N 3.07Å; Q9-A12 WeakPolarHBondContact O-CB 3.46Å; Q9-A12 PolarHBondContact O-N 3.41Å; Q9-A12 VanDerWaalsContact O-N 3.15Å; Q9-V13 WeakPolarHBondContact O-CG2 3.39Å; Q9-V13 PolarHBondContact O-N 3.34Å
10	D	63	Low	59	Low	100 Å²	100	113.3 Å²	113.3	54%	0.535	60%	0.603	S	S	.	*	H	α-helix	trans	-64.2	-40.7	178.8	-63.8	-25.5	0	0	0	111.2	K6 A12 V13 F14	K6-D10 PolarHBondContact O-N 3.47Å; D10-A12 PolarHBondContact O-N 2.86Å; D10-V13 PolarHBondContact O-N 3.32Å; D10-F14 WeakPolarHBondContact O-CB 3.3Å; D10-F14 PolarHBondContact O-N 3.06Å
11	A	66.1	Low	58.4	Low	53 Å²	53	113 Å²	113	44%	0.438	60%	0.601	S	S	.	*	H	α-helix	trans	-64.5	-37.5	173.4	0	0	0	0	0	112.6	K7 Q9 T15	K7-A11 VanDerWaalsContact O-CB 3.28Å; K7-A11 WeakPolarHBondContact O-CB 3.35Å; K7-A11 PolarHBondContact O-N 3.46Å; Q9-A11 VanDerWaalsContact C-N 3.34Å; Q9-A11 PolarHBondContact O-N 3.07Å; A11-T15 WeakPolarHBondContact O-CB 3.46Å; A11-T15 PolarHBondContact O-N 2.83Å; A11-T15 PolarHBondContact O-OG1 3.42Å
12	A	71.5	Confident	58.9	Low	59 Å²	59	108.8 Å²	108.8	49%	0.488	58%	0.578	S	S	.	*	H	α-helix	trans	-67.5	-40.2	174.9	0	0	0	0	0	112.3	A8 Q9 D10 T15 A16	A8-A12 VanDerWaalsContact O-CB 3.3Å; A8-A12 WeakPolarHBondContact O-CB 3.31Å; A8-A12 PolarHBondContact O-N 3.19Å; Q9-A12 WeakPolarHBondContact O-CB 3.46Å; Q9-A12 PolarHBondContact O-N 3.41Å; Q9-A12 VanDerWaalsContact O-N 3.15Å; D10-A12 PolarHBondContact O-N 2.86Å; A12-T15 PolarHBondContact O-N 3.1Å; A12-A16 VanDerWaalsContact O-CB 3.28Å; A12-A16 WeakPolarHBondContact O-CB 3.36Å; A12-A16 PolarHBondContact O-N 3.09Å
13	V	72	Confident	59.2	Low	91 Å²	91	111.5 Å²	111.5	55%	0.552	58%	0.575	S	S	*	*	H	α-helix	trans	-65.9	-44.7	175.6	173.6	0	0	0	0	110.3	Q9 D10 T15 A16 V17	Q9-V13 WeakPolarHBondContact O-CG2 3.39Å; Q9-V13 PolarHBondContact O-N 3.34Å; D10-V13 PolarHBondContact O-N 3.32Å; V13-T15 VanDerWaalsContact C-N 3.33Å; V13-T15 PolarHBondContact O-N 3.29Å; V13-A16 PolarHBondContact O-N 2.96Å; V13-V17 HydrophobicContact CG1-CG2 4.42Å; V13-V17 WeakPolarHBondContact O-CG2 3.34Å; V13-V17 PolarHBondContact O-N 2.89Å
14	F	61.9	Low	59.2	Low	152 Å²	152	109 Å²	109	67%	0.667	56%	0.558	S	S	*	*	H	α-helix	trans	-63.4	-41.7	178.1	-161.2	-91.1	0	0	0	111.4	D10 V17 V18	D10-F14 WeakPolarHBondContact O-CB 3.3Å; D10-F14 PolarHBondContact O-N 3.06Å; F14-V17 PolarHBondContact O-N 2.7Å; F14-V18 HydrophobicContact CD1-CG2 3.96Å; F14-V18 HydrophobicContact CE1-CG2 3.81Å; F14-V18 VanDerWaalsContact O-CG2 3.28Å; F14-V18 WeakPolarHBondContact O-CG2 3.15Å; F14-V18 PolarHBondContact O-N 3.13Å
15	T	75	Confident	58.9	Low	84 Å²	84	101.3 Å²	101.3	52%	0.515	54%	0.537	S	S	.	.	H	α-helix	trans	-65.5	-39.7	175.8	-52.9	0	0	0	0	111.1	A11 A12 V13 V18 V19	A11-T15 WeakPolarHBondContact O-CB 3.46Å; A11-T15 PolarHBondContact O-N 2.83Å; A11-T15 PolarHBondContact O-OG1 3.42Å; A12-T15 PolarHBondContact O-N 3.1Å; V13-T15 VanDerWaalsContact C-N 3.33Å; V13-T15 PolarHBondContact O-N 3.29Å; T15-V18 PolarHBondContact O-N 2.71Å; T15-V19 HydrophobicContact CG2-CG2 4.35Å; T15-V19 WeakPolarHBondContact O-CB 3.4Å; T15-V19 WeakPolarHBondContact O-CG2 3.22Å; T15-V19 PolarHBondContact O-N 2.69Å
16	A	71.4	Confident	58.5	Low	59 Å²	59	100.2 Å²	100.2	49%	0.488	53%	0.534	S	S	.	.	H	α-helix	trans	-65.3	-40.6	175.9	0	0	0	0	0	112.1	A12 V13 V19 F20	A12-A16 VanDerWaalsContact O-CB 3.28Å; A12-A16 WeakPolarHBondContact O-CB 3.36Å; A12-A16 PolarHBondContact O-N 3.09Å; V13-A16 PolarHBondContact O-N 2.96Å; A16-V19 PolarHBondContact O-N 3.05Å; A16-F20 WeakPolarHBondContact O-CB 3.32Å; A16-F20 PolarHBondContact O-N 3.41Å
17	V	66.1	Low	58	Low	76 Å²	76	100.6 Å²	100.6	46%	0.461	54%	0.538	S	S	.	.	H	α-helix	trans	-65.9	-43.6	175.6	172.2	0	0	0	0	110.6	V13 F14 F20 L21	V13-V17 HydrophobicContact CG1-CG2 4.42Å; V13-V17 WeakPolarHBondContact O-CG2 3.34Å; V13-V17 PolarHBondContact O-N 2.89Å; F14-V17 PolarHBondContact O-N 2.7Å; V17-F20 PolarHBondContact O-N 3.49Å; V17-L21 HydrophobicContact CG1-CD1 3.92Å; V17-L21 HydrophobicContact CG1-CG 4.38Å; V17-L21 WeakPolarHBondContact O-CB 3.2Å; V17-L21 VanDerWaalsContact O-CG 3.26Å; V17-L21 WeakPolarHBondContact O-CG 2.98Å; V17-L21 PolarHBondContact O-N 3.24Å
18	V	64.3	Low	57.1	Low	67 Å²	67	99.7 Å²	99.7	41%	0.406	54%	0.54	S	S	.	.	H	α-helix	trans	-63.7	-44.6	176.5	172.8	0	0	0	0	110.9	F14 T15 F20 L21 H22	F14-V18 HydrophobicContact CD1-CG2 3.96Å; F14-V18 HydrophobicContact CE1-CG2 3.81Å; F14-V18 VanDerWaalsContact O-CG2 3.28Å; F14-V18 WeakPolarHBondContact O-CG2 3.15Å; F14-V18 PolarHBondContact O-N 3.13Å; T15-V18 PolarHBondContact O-N 2.71Å; V18-F20 VanDerWaalsContact C-N 3.35Å; V18-F20 PolarHBondContact O-N 3.32Å; V18-L21 PolarHBondContact O-N 2.93Å; V18-H22 WeakPolarHBondContact O-CB 3.31Å; V18-H22 PolarHBondContact O-N 2.99Å
19	V	72.6	Confident	55.5	Low	76 Å²	76	105 Å²	105	46%	0.461	55%	0.553	S	S	.	*	H	α-helix	trans	-65.6	-37.2	176.5	171.5	0	0	0	0	111.6	T15 A16 H22 R23	T15-V19 HydrophobicContact CG2-CG2 4.35Å; T15-V19 WeakPolarHBondContact O-CB 3.4Å; T15-V19 WeakPolarHBondContact O-CG2 3.22Å; T15-V19 PolarHBondContact O-N 2.69Å; A16-V19 PolarHBondContact O-N 3.05Å; V19-H22 PolarHBondContact O-N 2.89Å; V19-R23 WeakPolarHBondContact O-CB 3.24Å; V19-R23 PolarHBondContact O-N 2.72Å
20	F	59.8	Low	53.7	Low	146 Å²	146	106.9 Å²	106.9	64%	0.64	56%	0.559	S	S	*	*	H	α-helix	trans	-66.4	-43.6	175.6	-173.5	-93.8	0	0	0	111.4	A16 V17 V18 H22 R23 S24	A16-F20 WeakPolarHBondContact O-CB 3.32Å; A16-F20 PolarHBondContact O-N 3.41Å; V17-F20 PolarHBondContact O-N 3.49Å; V18-F20 VanDerWaalsContact C-N 3.35Å; V18-F20 PolarHBondContact O-N 3.32Å; F20-H22 VanDerWaalsContact C-N 3.33Å; F20-R23 PolarHBondContact O-N 3.37Å; F20-S24 VanDerWaalsContact O-CB 3.28Å; F20-S24 WeakPolarHBondContact O-CB 3.45Å; F20-S24 PolarHBondContact O-N 3.16Å; F20-S24 PolarHBondContact O-OG 3.34Å
21	L	45.7	Very low	52	Low	108 Å²	108	111.1 Å²	111.1	57%	0.565	57%	0.572	S	S	*	*	H	α-helix	trans	-64.4	-38.8	174.3	-71.6	171.9	0	0	0	111.3	V17 V18 S24 S25	V17-L21 HydrophobicContact CG1-CD1 3.92Å; V17-L21 HydrophobicContact CG1-CG 4.38Å; V17-L21 WeakPolarHBondContact O-CB 3.2Å; V17-L21 VanDerWaalsContact O-CG 3.26Å; V17-L21 WeakPolarHBondContact O-CG 2.98Å; V17-L21 PolarHBondContact O-N 3.24Å; V18-L21 PolarHBondContact O-N 2.93Å; L21-S24 PolarHBondContact O-N 3.15Å; L21-S25 PolarHBondContact O-N 3.16Å; L21-S25 PolarHBondContact O-OG 2.93Å
22	H	48.9	Very low	50.1	Low	119 Å²	119	114.5 Å²	114.5	55%	0.551	59%	0.59	S	S	*	*	H	α-helix	trans	-70.4	-39.6	178.6	-139.9	-49.2	0	0	0	112.3	V18 V19 F20 S25 E26	V18-H22 WeakPolarHBondContact O-CB 3.31Å; V18-H22 PolarHBondContact O-N 2.99Å; V19-H22 PolarHBondContact O-N 2.89Å; F20-H22 VanDerWaalsContact C-N 3.33Å; H22-S25 WeakPolarHBondContact CA-OG 3.48Å; H22-S25 PolarHBondContact O-N 3.45Å; H22-S25 PolarHBondContact O-OG 2.9Å; H22-E26 PolarHBondContact O-N 2.87Å
23	R	45.9	Very low	48	Very low	182 Å²	182	116.4 Å²	116.4	69%	0.687	61%	0.606	S	S	*	*	H	α-helix	trans	-66.6	-40.3	172	-89.3	-173.2	170.8	178.7	-1.8	112.2	V19 F20 S25 E26 E27	V19-R23 WeakPolarHBondContact O-CB 3.24Å; V19-R23 PolarHBondContact O-N 2.72Å; F20-R23 PolarHBondContact O-N 3.37Å; R23-S25 VanDerWaalsContact C-N 3.27Å; R23-S25 PolarHBondContact O-N 3.1Å; R23-E26 PolarHBondContact O-N 2.95Å; R23-E27 PolarHBondContact O-N 2.86Å
24	S	40.2	Very low	45.8	Very low	42 Å²	42	116.6 Å²	116.6	29%	0.294	62%	0.617	S	S	.	*	H	α-helix	trans	-65.2	-34.2	177.6	-58.1	0	0	0	0	111.6	F20 L21 L28	F20-S24 VanDerWaalsContact O-CB 3.28Å; F20-S24 WeakPolarHBondContact O-CB 3.45Å; F20-S24 PolarHBondContact O-N 3.16Å; F20-S24 PolarHBondContact O-OG 3.34Å; L21-S24 PolarHBondContact O-N 3.15Å; S24-L28 PolarHBondContact O-N 2.83Å
25	S	35.4	Very low	44.1	Very low	55 Å²	55	118.5 Å²	118.5	39%	0.385	63%	0.625	S	S	.	*	H	α-helix	trans	-75.9	-31.7	175.3	34.5	0	0	0	0	112.8	L21 H22 R23 F29	L21-S25 PolarHBondContact O-N 3.16Å; L21-S25 PolarHBondContact O-OG 2.93Å; H22-S25 WeakPolarHBondContact CA-OG 3.48Å; H22-S25 PolarHBondContact O-N 3.45Å; H22-S25 PolarHBondContact O-OG 2.9Å; R23-S25 VanDerWaalsContact C-N 3.27Å; R23-S25 PolarHBondContact O-N 3.1Å; S25-F29 WeakPolarHBondContact O-CD2 3.44Å
26	E	39.6	Very low	41.6	Very low	134 Å²	134	120.7 Å²	120.7	63%	0.626	64%	0.638	S	S	*	*	H	α-helix	trans	-70.9	-34.4	171.5	-78.2	-169.2	166.6	0	0	113.5	H22 R23 L28 F29	H22-E26 PolarHBondContact O-N 2.87Å; R23-E26 PolarHBondContact O-N 2.95Å; E26-L28 VanDerWaalsContact C-N 3.33Å; E26-L28 PolarHBondContact O-N 2.89Å; E26-F29 PolarHBondContact O-N 2.77Å
27	E	37	Very low	39.4	Very low	149 Å²	149	128.7 Å²	128.7	70%	0.696	66%	0.656	S	S	*	*	H	α-helix	trans	-69.4	-30.1	177.4	-76.8	-166.2	160.5	0	0	113.2	R23 F29	R23-E27 PolarHBondContact O-N 2.86Å; E27-F29 VanDerWaalsContact C-N 3.26Å; E27-F29 PolarHBondContact O-N 2.81Å
28	L	30.8	Very low	37.3	Very low	149 Å²	149	130.7 Å²	130.7	78%	0.78	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-14.4	176.1	-95.3	145.7	0	0	0	114	S24 E26	S24-L28 PolarHBondContact O-N 2.83Å; E26-L28 VanDerWaalsContact C-N 3.33Å; E26-L28 PolarHBondContact O-N 2.89Å
29	F	30.6	Very low	35.2	Very low	174 Å²	174	133.1 Å²	133.1	76%	0.763	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.8	11.1	-179.4	-80.7	-72.1	0	0	0	115.3	S25 E26 E27 K31	S25-F29 WeakPolarHBondContact O-CD2 3.44Å; E26-F29 PolarHBondContact O-N 2.77Å; E27-F29 VanDerWaalsContact C-N 3.26Å; E27-F29 PolarHBondContact O-N 2.81Å; F29-K31 PolarHBondContact O-N 2.8Å
30	K	29.8	Very low	33	Very low	169 Å²	169	134.7 Å²	134.7	74%	0.735	71%	0.705	S	S	*	*			trans	-72.8	84.9	166.9	-75.8	-175.9	-179.9	172.2	0	110
31	K	27.5	Very low	31.4	Very low	190 Å²	190	136.6 Å²	136.6	83%	0.826	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-49.4	130.8	162.7	-83	-178.6	175	177.5	0	108.6	F29 A33	F29-K31 PolarHBondContact O-N 2.8Å; K31-A33 PolarHBondContact O-N 3.18Å
32	P	26.9	Very low	30.3	Very low	123 Å²	123	137.2 Å²	137.2	80%	0.799	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-61.7	135.3	178.9	25.2	-31.2	0	0	0	109.1	A34	P32-A34 PolarHBondContact O-N 3.05Å; P32-A34 VanDerWaalsContact O-N 3.16Å
33	A	26.5	Very low	29.2	Very low	100 Å²	100	135.1 Å²	135.1	83%	0.826	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-48.7	121.2	178.6	0	0	0	0	0	109.9	K31 F35	K31-A33 PolarHBondContact O-N 3.18Å; A33-F35 PolarHBondContact O-N 3.13Å
34	A	25.6	Very low	28.3	Very low	94 Å²	94	132.8 Å²	132.8	78%	0.777	75%	0.745	S	S	*	*			trans	-58	111.2	177.8	0	0	0	0	0	109.3	P32 V36	P32-A34 PolarHBondContact O-N 3.05Å; P32-A34 VanDerWaalsContact O-N 3.16Å; A34-V36 PolarHBondContact O-N 2.65Å
35	F	25.6	Very low	27.4	Very low	193 Å²	193	136.9 Å²	136.9	85%	0.846	77%	0.768	S	S	*	*			trans	-67.5	112.3	169.8	-155.7	-94.9	0	0	0	107.8	A33 R37	A33-F35 PolarHBondContact O-N 3.13Å; F35-R37 PolarHBondContact O-N 3.14Å; F35-R37 VanDerWaalsContact O-N 3.13Å
36	V	23.4	Very low	26.9	Very low	130 Å²	130	142 Å²	142	79%	0.788	79%	0.79	S	S	*	*			trans	-60.6	110.1	179.7	177.1	0	0	0	0	108.7	A34	A34-V36 PolarHBondContact O-N 2.65Å
37	R	24.6	Very low	26.1	Very low	227 Å²	227	141.1 Å²	141.1	86%	0.857	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-89	137.4	163.4	-86.6	-173.7	175.5	-178.3	-0.9	109.4	F35	F35-R37 PolarHBondContact O-N 3.14Å; F35-R37 VanDerWaalsContact O-N 3.13Å
38	P	22.2	Very low	25.5	Very low	118 Å²	118	139.7 Å²	139.7	77%	0.766	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-67.9	146.5	-177.9	-12	26.9	0	0	0	112.2
39	S	21.2	Very low	25.2	Very low	118 Å²	118	144 Å²	144	83%	0.825	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-53.8	128.4	173.9	48.1	0	0	0	0	114.9
40	S	26.5	Very low	24.8	Very low	109 Å²	109	142.7 Å²	142.7	76%	0.762	81%	0.81	S	S	*	*			trans	-151.1	98	149	62.7	0	0	0	0	110.8
41	Q	24.7	Very low	24.5	Very low	185 Å²	185	139.1 Å²	139.1	86%	0.864	81%	0.807	S	S	*	*			trans	40.7	129.2	138.9	-63.5	-179.7	-8.7	0	0	122
42	S	24.1	Very low	24.4	Very low	122 Å²	122	135.5 Å²	135.5	85%	0.853	81%	0.805	S	S	*	*			trans	69.1	107.7	146.7	62.3	0	0	0	0	119.7
43	G	26.2	Very low	24.5	Very low	74 Å²	74	135.9 Å²	135.9	76%	0.763	81%	0.805	S	S	*	*			trans	175.3	77.7	166.9	0	0	0	0	0	114
44	V	26.4	Very low	24.5	Very low	134 Å²	134	140 Å²	140	81%	0.812	80%	0.804	S	S	*	*			trans	28.2	108.2	156.5	-171.5	0	0	0	0	118.6	L46	V44-L46 PolarHBondContact O-N 3.05Å
45	T	21.3	Very low	24.6	Very low	127 Å²	127	141 Å²	141	78%	0.779	81%	0.805	S	S	*	*			trans	-62.3	109.3	170.3	-45.7	0	0	0	0	112.6	T47	T45-T47 HydrophobicContact CG2-CG2 4.19Å
46	L	25.1	Very low	25.1	Very low	162 Å²	162	136.2 Å²	136.2	85%	0.848	80%	0.796	S	S	*	*			trans	-102.8	109	158.5	-76.7	168.2	0	0	0	108.3	V44 P48	V44-L46 PolarHBondContact O-N 3.05Å; L46-P48 WeakPolarHBondContact O-CD 3.41Å
47	T	22.7	Very low	26.2	Very low	117 Å²	117	137.5 Å²	137.5	72%	0.718	79%	0.787	S	S	*	*			trans	-68.8	124	178.5	43.8	0	0	0	0	110.7	T45 R49	T45-T47 HydrophobicContact CG2-CG2 4.19Å; T47-R49 PolarHBondContact O-N 2.58Å
48	P	24.6	Very low	27.7	Very low	118 Å²	118	133.8 Å²	133.8	77%	0.766	78%	0.784	S	S	*	*			trans	-74.7	115.8	174	-8.1	24	0	0	0	109.2	L46 T50	L46-P48 WeakPolarHBondContact O-CD 3.41Å; P48-T50 PolarHBondContact O-N 3.28Å
49	R	23.6	Very low	30.2	Very low	240 Å²	240	132.6 Å²	132.6	91%	0.906	77%	0.771	S	S	*	*			trans	-61.3	117.8	170.1	-78.1	-178.7	173.3	176.2	-2.1	109.4	T47 S51	T47-R49 PolarHBondContact O-N 2.58Å; R49-S51 PolarHBondContact O-N 3.09Å
50	T	21.9	Very low	33.1	Very low	146 Å²	146	130.9 Å²	130.9	90%	0.896	75%	0.75	S	S	*	*			trans	-69.5	88.1	173.2	49.9	0	0	0	0	110.2	P48	P48-T50 PolarHBondContact O-N 3.28Å
51	S	25	Very low	36	Very low	95 Å²	95	128.6 Å²	128.6	66%	0.664	73%	0.729	S	S	*	*			trans	-91.8	113.8	163.5	58.2	0	0	0	0	109.1	R49 V53	R49-S51 PolarHBondContact O-N 3.09Å; S51-V53 PolarHBondContact O-N 3.26Å
52	S	23.8	Very low	39.1	Very low	114 Å²	114	122.9 Å²	122.9	80%	0.797	71%	0.713	S	S	*	*			trans	-47.5	102.7	170	53	0	0	0	0	111.8	K54	S52-K54 PolarHBondContact O-N 3.17Å
53	V	28.7	Very low	42.3	Very low	131 Å²	131	117.1 Å²	117.1	79%	0.794	67%	0.673	S	S	*	*			trans	-79.6	106.7	175.1	-179.5	0	0	0	0	108.2	S51	S51-V53 PolarHBondContact O-N 3.26Å
54	K	26.5	Very low	45.5	Very low	186 Å²	186	115.1 Å²	115.1	81%	0.809	65%	0.647	S	S	*	*			trans	-60.7	133.8	169.6	-69.1	178.1	176.7	179	0	109.6	S52 S56	S52-K54 PolarHBondContact O-N 3.17Å; K54-S56 PolarHBondContact O-N 2.85Å
55	S	28.5	Very low	48.9	Very low	114 Å²	114	108.7 Å²	108.7	80%	0.797	61%	0.608	S	S	*	*			trans	-3.2	103.3	169.7	61.9	0	0	0	0	115.7	R57	S55-R57 PolarHBondContact O-N 2.87Å
56	S	36	Very low	52.5	Low	94 Å²	94	102.7 Å²	102.7	66%	0.657	57%	0.571	S	S	*	*			trans	-55.8	133.7	170.4	50.6	0	0	0	0	110.7	K54 N58	K54-S56 PolarHBondContact O-N 2.85Å; S56-N58 PolarHBondContact O-N 2.8Å
57	R	46.3	Very low	55.9	Low	157 Å²	157	95 Å²	95	59%	0.592	53%	0.53	S	S	*	.			trans	-63	112.3	169.5	-70.1	174.7	173.8	168.1	-2.5	108	S55 D59 E60	S55-R57 PolarHBondContact O-N 2.87Å; R57-D59 PolarHBondContact O-N 3.26Å; R57-E60 PolarHBondContact O-N 2.85Å
58	N	57.5	Low	59.4	Low	148 Å²	148	89.5 Å²	89.5	79%	0.791	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-9	-173.1	-83.2	-6.8	0	0	0	115.9	S56	S56-N58 PolarHBondContact O-N 2.8Å
59	D	73.5	Confident	62.8	Low	93 Å²	93	84 Å²	84	50%	0.497	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-10.6	-172	-57.2	-13.1	0	0	0	113.7	R57 R418 V419	R57-D59 PolarHBondContact O-N 3.26Å; D59-R418 CarbonylContact O-C 3.57Å; D59-R418 WeakPolarHBondContact O-CA 3.25Å; D59-V419 WeakPolarHBondContact CB-O 3.19Å; D59-V419 PolarHBondContact O-N 3.29Å
60	E	83.3	Confident	66	Low	82 Å²	82	73.7 Å²	73.7	38%	0.383	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	114.7	-177.9	-76.1	179.1	176.5	0	0	111	R57 I416 N417 R418	R57-E60 PolarHBondContact O-N 2.85Å; E60-I416 HydrophobicContact CB-CG2 3.79Å; E60-I416 HydrophobicContact CG-CG2 4.16Å; E60-N417 WeakPolarHBondContact CA-O 3.19Å; E60-R418 HydrophobicContact CG-CG 3.84Å; E60-R418 IonicContact OE1-CZ 3.76Å; E60-R418 IonicContact OE1-NE 3.49Å; E60-R418 PolarHBondContact OE1-NE 2.8Å; E60-R418 IonicContact OE1-NH2 3.5Å; E60-R418 PolarHBondContact OE1-NH2 3.11Å
61	I	87.2	Confident	69.1	Low	61 Å²	61	71.4 Å²	71.4	31%	0.313	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	127.8	-176.1	-55.6	-176	0	0	0	109.4	K385 N417 V419	I61-K385 HydrophobicContact CD1-CD 4.45Å; I61-K385 VanDerWaalsContact CD1-CE 3.49Å; I61-K385 HydrophobicContact CD1-CG 4.23Å; I61-N417 PolarHBondContact N-O 3.43Å; I61-N417 PolarHBondContact O-N 2.91Å; I61-V419 HydrophobicContact CB-CG2 4.2Å; I61-V419 HydrophobicContact CD1-CB 3.84Å; I61-V419 HydrophobicContact CD1-CG1 4.34Å; I61-V419 HydrophobicContact CD1-CG2 3.93Å; I61-V419 HydrophobicContact CG1-CB 4.37Å; I61-V419 HydrophobicContact CG1-CG2 4.23Å
62	A	88.7	Confident	71.9	Confident	65 Å²	65	70.9 Å²	70.9	54%	0.537	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	148	174.2	0	0	0	0	0	111.3	C64 M415	A62-C64 PolarHBondContact O-N 2.71Å; A62-M415 WeakPolarHBondContact CA-O 3.31Å
63	I	91.1	Very high	74.7	Confident	2 Å²	2	68.8 Å²	68.8	1%	0.01	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-69.1	130.3	177.7	-69.3	-169.3	0	0	0	110.4	V65 L380 T386 V388 M415	I63-V65 HydrophobicContact CG2-CG2 4.39Å; I63-L380 HydrophobicContact CD1-CD2 4.22Å; I63-T386 HydrophobicContact CD1-CG2 3.86Å; I63-T386 HydrophobicContact CG1-CG2 4.37Å; I63-T386 HydrophobicContact CG2-CG2 4.2Å; I63-T386 WeakPolarHBondContact CG2-O 3.36Å; I63-V388 HydrophobicContact CG2-CG2 4.04Å; I63-M415 HydrophobicContact CD1-CB 3.68Å; I63-M415 HydrophobicContact CD1-CE 3.51Å; I63-M415 HydrophobicContact CD1-SD 4.25Å; I63-M415 HydrophobicContact CG1-CB 4.07Å; I63-M415 PolarHBondContact N-O 3.48Å
64	C	94.6	Very high	77.1	Confident	31 Å²	31	67.3 Å²	67.3	21%	0.209	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	133.7	174.7	179.9	0	0	0	0	109.9	A62 D110 T386 T387 V388	A62-C64 PolarHBondContact O-N 2.71Å; C64-D110 WeakPolarHBondContact CA-OD2 3.29Å; C64-T386 PolarHBondContact N-O 3.45Å; C64-T387 HydrophobicContact CB-CG2 4.22Å; C64-T387 CarbonylContact O-C 3.55Å; C64-T387 VanDerWaalsContact O-CA 3.22Å; C64-T387 WeakPolarHBondContact O-CA 3.24Å; C64-V388 PolarHBondContact O-N 2.86Å
65	V	96.4	Very high	79.5	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	120.7	178.9	-178	0	0	0	0	109.7	I63 F109 D110 H111 V388 A409 A412 K413	I63-V65 HydrophobicContact CG2-CG2 4.39Å; V65-F109 HydrophobicContact CB-CD1 4.14Å; V65-F109 HydrophobicContact CG1-CD1 3.48Å; V65-F109 VanDerWaalsContact CG1-CD1 3.48Å; V65-F109 HydrophobicContact CG1-CE1 3.97Å; V65-F109 HydrophobicContact CG1-CG 4.33Å; V65-D110 PolarHBondContact N-OD2 3.41Å; V65-D110 PolarHBondContact O-N 3.35Å; V65-H111 PolarHBondContact O-N 2.92Å; V65-V388 WeakPolarHBondContact CA-O 3.32Å; V65-V388 HydrophobicContact CG2-CB 4.42Å; V65-A409 HydrophobicContact CG1-CB 3.72Å; V65-A412 HydrophobicContact CG2-CB 4.48Å; V65-K413 HydrophobicContact CB-CB 4.42Å; V65-K413 HydrophobicContact CG2-CB 3.75Å; V65-K413 HydrophobicContact CG2-CG 4.18Å
66	A	97.3	Very high	81.9	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	140	174.9	0	0	0	0	0	110.2	H111 L134 V388 L389 A390	A66-H111 CarbonylContact C-O 3.48Å; A66-H111 VanDerWaalsContact CA-O 3.25Å; A66-H111 WeakPolarHBondContact CA-O 3.47Å; A66-H111 HydrophobicContact CB-CB 3.98Å; A66-L134 HydrophobicContact CB-CD1 3.72Å; A66-L134 HydrophobicContact CB-CD2 3.83Å; A66-L134 HydrophobicContact CB-CG 4.37Å; A66-V388 PolarHBondContact N-O 2.8Å; A66-L389 HydrophobicContact CB-CD1 4.13Å; A66-L389 CarbonylContact O-C 3.48Å; A66-L389 WeakPolarHBondContact O-CA 3.42Å; A66-A390 PolarHBondContact O-N 2.91Å
67	V	97.7	Very high	83.6	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	128	174.5	-173.2	0	0	0	0	109.8	I96 F109 H111 C112 I113 A390 I392 L406	V67-I96 HydrophobicContact CB-CD1 3.64Å; V67-I96 HydrophobicContact CG1-CD1 3.41Å; V67-I96 VanDerWaalsContact CG1-CD1 3.41Å; V67-I96 HydrophobicContact CG2-CD1 4.18Å; V67-F109 HydrophobicContact CB-CD2 4.26Å; V67-F109 HydrophobicContact CG2-CB 4.24Å; V67-F109 HydrophobicContact CG2-CD1 4.04Å; V67-F109 HydrophobicContact CG2-CD2 3.31Å; V67-F109 HydrophobicContact CG2-CE1 4.21Å; V67-F109 HydrophobicContact CG2-CE2 3.5Å; V67-F109 HydrophobicContact CG2-CG 3.59Å; V67-F109 HydrophobicContact CG2-CZ 3.94Å; V67-H111 PolarHBondContact N-O 2.83Å; V67-C112 CarbonylContact O-C 3.4Å; V67-C112 WeakPolarHBondContact O-CA 3.14Å; V67-I113 PolarHBondContact O-N 3.14Å; V67-A390 CarbonylContact C-O 3.59Å; V67-A390 VanDerWaalsContact CA-O 3.28Å; V67-A390 WeakPolarHBondContact CA-O 3.41Å; V67-A390 HydrophobicContact CG2-CB 4.18Å; V67-I392 HydrophobicContact CG1-CD1 3.83Å; V67-I392 HydrophobicContact CG1-CG1 3.93Å; V67-L406 HydrophobicContact CG1-CD2 4.08Å; V67-L406 HydrophobicContact CG2-CD2 4.42Å
68	R	95.9	Very high	84.2	Confident	3 Å²	3	60 Å²	60	1%	0.011	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	118.6	173	-173.3	-177.9	-177.5	161.2	11.3	110	I113 D115 S163 L389 A390 T391 I392	R68-I113 CarbonylContact C-O 3.52Å; R68-I113 WeakPolarHBondContact CA-O 3.42Å; R68-D115 IonicContact CZ-OD2 2.79Å; R68-D115 VanDerWaalsContact CZ-OD2 3.29Å; R68-D115 IonicContact NE-OD1 3.16Å; R68-D115 IonicContact NE-OD2 3.51Å; R68-D115 PolarHBondContact NE-OD2 3.49Å; R68-D115 IonicContact NH2-OD1 3.82Å; R68-D115 IonicContact NH2-OD2 2.72Å; R68-D115 PolarHBondContact NH2-OD2 3.4Å; R68-S163 WeakPolarHBondContact CD-OG 3.43Å; R68-S163 PolarHBondContact NH1-OG 3.2Å; R68-L389 HydrophobicContact CB-CD1 4.15Å; R68-A390 PolarHBondContact N-O 2.98Å; R68-T391 WeakPolarHBondContact O-CA 3.38Å; R68-I392 PolarHBondContact O-N 2.94Å
69	V	94.6	Very high	84.2	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.006	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	112.4	172.6	-169.8	0	0	0	0	107.7	V89 I96 I113 R114 D115 I392 P394	V69-V89 HydrophobicContact CB-CG2 4.41Å; V69-V89 HydrophobicContact CG2-CG2 3.65Å; V69-I96 HydrophobicContact CG2-CD1 4.31Å; V69-I113 PolarHBondContact N-O 3.34Å; V69-R114 HydrophobicContact CB-CG 4.27Å; V69-D115 PolarHBondContact O-N 3.05Å; V69-I392 HydrophobicContact CB-CG1 4.26Å; V69-I392 HydrophobicContact CG1-CG1 4.39Å; V69-I392 HydrophobicContact CG2-CD1 3.71Å; V69-I392 HydrophobicContact CG2-CG1 3.77Å; V69-P394 HydrophobicContact CG1-CB 4.11Å; V69-P394 HydrophobicContact CG1-CG 4.13Å
70	R	92.5	Very high	83.2	Confident	24 Å²	24	57.3 Å²	57.3	9%	0.091	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-72.5	163.4	176.9	66.5	159.2	177.4	76.2	-6.1	111.5	E76 G157 I392 S393 P394	R70-E76 IonicContact CZ-OE1 3.88Å; R70-E76 IonicContact CZ-OE2 2.87Å; R70-E76 IonicContact NH1-OE1 3.65Å; R70-E76 IonicContact NH1-OE2 3.36Å; R70-E76 PolarHBondContact NH1-OE2 3.19Å; R70-E76 VanDerWaalsContact NH2-CD 3.31Å; R70-E76 IonicContact NH2-OE1 3.15Å; R70-E76 PolarHBondContact NH2-OE1 3.26Å; R70-E76 IonicContact NH2-OE2 2.99Å; R70-E76 PolarHBondContact NH2-OE2 2.86Å; R70-E76 VanDerWaalsContact NH2-OE2 3.13Å; R70-G157 WeakPolarHBondContact CD-O 3.32Å; R70-G157 PolarHBondContact NE-O 3.38Å; R70-I392 PolarHBondContact N-O 2.93Å; R70-I392 VanDerWaalsContact N-O 3.11Å; R70-S393 PolarHBondContact NH2-OG 3.41Å; R70-P394 WeakPolarHBondContact O-CD 3.35Å; R70-P394 WeakPolarHBondContact O-CG 3.43Å
71	Q	87	Confident	82.1	Confident	98 Å²	98	58.4 Å²	58.4	46%	0.458	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-63.1	154.3	170.8	67.3	-174.8	7.4	0	0	112.1	D115	Q71-D115 WeakPolarHBondContact CA-O 3.23Å; Q71-D115 PolarHBondContact N-O 3.21Å
72	I	83.6	Confident	81.2	Confident	85 Å²	85	58.5 Å²	58.5	44%	0.436	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-67.4	129.2	169	-63	172.8	0	0	0	107.8	E76 I77 P394	I72-E76 HydrophobicContact CG2-CB 3.67Å; I72-I77 HydrophobicContact CG2-CG1 3.68Å; I72-P394 HydrophobicContact CD1-CG 4.46Å; I72-P394 HydrophobicContact CG1-CB 4.11Å; I72-P394 HydrophobicContact CG1-CG 3.52Å
73	L	83.1	Confident	80.1	Confident	69 Å²	69	61.3 Å²	61.3	36%	0.361	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-78.6	155	176.9	-62.2	173	0	0	0	110.5	N75 E76 I77	L73-N75 WeakPolarHBondContact CB-OD1 3.49Å; L73-N75 PolarHBondContact O-N 2.87Å; L73-E76 HydrophobicContact CB-CG 4.18Å; L73-E76 PolarHBondContact N-OE2 3.41Å; L73-E76 WeakPolarHBondContact O-CA 3.44Å; L73-E76 VanDerWaalsContact O-CB 3.31Å; L73-E76 WeakPolarHBondContact O-CB 3.39Å; L73-E76 PolarHBondContact O-N 3.25Å; L73-I77 PolarHBondContact O-N 2.92Å
74	S	78.4	Confident	79.1	Confident	101 Å²	101	64.2 Å²	64.2	71%	0.706	36%	0.364	S	S	*	.	H	α-helix	trans	-53.5	-40.9	179.3	47.3	0	0	0	0	112.9	E76 I77	S74-E76 PolarHBondContact O-N 3.38Å; S74-E76 VanDerWaalsContact O-N 3.16Å; S74-I77 PolarHBondContact O-N 3.04Å
75	N	77.1	Confident	78.3	Confident	93 Å²	93	64 Å²	64	50%	0.497	36%	0.36	S	S	.	.	H	α-helix	trans	-73.7	4.1	176.3	72.2	-19.3	0	0	0	115.2	L73 R397	L73-N75 WeakPolarHBondContact CB-OD1 3.49Å; L73-N75 PolarHBondContact O-N 2.87Å; N75-R397 PolarHBondContact O-NH1 2.93Å
76	E	79.2	Confident	77.5	Confident	9 Å²	9	66.7 Å²	66.7	4%	0.042	38%	0.38	C	S	.	.	H	α-helix	trans	-110.9	-15.6	178	-71	174.7	158.3	0	0	113	R70 I72 L73 S74 E78 T79 A395 R397 N398	R70-E76 IonicContact CZ-OE1 3.88Å; R70-E76 IonicContact CZ-OE2 2.87Å; R70-E76 IonicContact NH1-OE1 3.65Å; R70-E76 IonicContact NH1-OE2 3.36Å; R70-E76 PolarHBondContact NH1-OE2 3.19Å; R70-E76 VanDerWaalsContact NH2-CD 3.31Å; R70-E76 IonicContact NH2-OE1 3.15Å; R70-E76 PolarHBondContact NH2-OE1 3.26Å; R70-E76 IonicContact NH2-OE2 2.99Å; R70-E76 PolarHBondContact NH2-OE2 2.86Å; R70-E76 VanDerWaalsContact NH2-OE2 3.13Å; I72-E76 HydrophobicContact CG2-CB 3.67Å; L73-E76 HydrophobicContact CB-CG 4.18Å; L73-E76 PolarHBondContact N-OE2 3.41Å; L73-E76 WeakPolarHBondContact O-CA 3.44Å; L73-E76 VanDerWaalsContact O-CB 3.31Å; L73-E76 WeakPolarHBondContact O-CB 3.39Å; L73-E76 PolarHBondContact O-N 3.25Å; S74-E76 PolarHBondContact O-N 3.38Å; S74-E76 VanDerWaalsContact O-N 3.16Å; E76-E78 VanDerWaalsContact C-N 3.35Å; E76-T79 PolarHBondContact O-OG1 3.1Å; E76-T79 VanDerWaalsContact O-OG1 3.07Å; E76-A395 HydrophobicContact CB-CB 3.83Å; E76-A395 VanDerWaalsContact CD-CB 3.44Å; E76-A395 HydrophobicContact CG-CB 3.82Å; E76-R397 IonicContact OE1-CZ 3.38Å; E76-R397 IonicContact OE1-NE 2.87Å; E76-R397 PolarHBondContact OE1-NE 3.38Å; E76-R397 IonicContact OE1-NH2 2.69Å; E76-R397 PolarHBondContact OE1-NH2 3.09Å; E76-N398 PolarHBondContact OE1-ND2 2.93Å
77	I	72	Confident	77	Confident	118 Å²	118	67.3 Å²	67.3	61%	0.605	38%	0.382	S	S	*	.	H	α-helix	trans	-70.8	-34.5	-179.4	-59.3	173.2	0	0	0	110.5	I72 L73 S74 T79	I72-I77 HydrophobicContact CG2-CG1 3.68Å; L73-I77 PolarHBondContact O-N 2.92Å; S74-I77 PolarHBondContact O-N 3.04Å; I77-T79 PolarHBondContact O-N 3.33Å
78	E	58.5	Low	76.5	Confident	177 Å²	177	71.8 Å²	71.8	83%	0.827	41%	0.406	S	S	*	.	S	Bend	trans	-77.7	-17	-172.3	-66.7	179.2	173.3	0	0	114.5	E76 T80	E76-E78 VanDerWaalsContact C-N 3.35Å; E78-T80 PolarHBondContact O-N 3.16Å; E78-T80 VanDerWaalsContact O-N 3.15Å
79	T	57	Low	76.3	Confident	56 Å²	56	72.4 Å²	72.4	34%	0.344	41%	0.411	S	S	.	.	S	Bend	trans	-79.8	99.4	178.8	32.1	0	0	0	0	111.1	E76 I77 S81	E76-T79 PolarHBondContact O-OG1 3.1Å; E76-T79 VanDerWaalsContact O-OG1 3.07Å; I77-T79 PolarHBondContact O-N 3.33Å; T79-S81 PolarHBondContact O-N 3.12Å
80	T	52	Low	76	Confident	129 Å²	129	75 Å²	75	79%	0.791	43%	0.425	S	S	*	.			trans	17.7	81.2	158.4	30.2	0	0	0	0	113.7	E78 D82	E78-T80 PolarHBondContact O-N 3.16Å; E78-T80 VanDerWaalsContact O-N 3.15Å; T80-D82 PolarHBondContact O-N 3.23Å
81	S	60.6	Low	75.7	Confident	104 Å²	104	76 Å²	76	73%	0.727	44%	0.435	S	S	*	.			trans	-65.6	97.7	176.1	51.5	0	0	0	0	109.3	T79 P83	T79-S81 PolarHBondContact O-N 3.12Å; S81-P83 VanDerWaalsContact O-CD 3.27Å; S81-P83 WeakPolarHBondContact O-CD 3.49Å
82	D	67.5	Low	75.6	Confident	64 Å²	64	80.3 Å²	80.3	34%	0.342	46%	0.455	S	S	.	.			trans	-64.6	111.6	166.1	-179	-8.5	0	0	0	107.8	T80 T84 I85	T80-D82 PolarHBondContact O-N 3.23Å; D82-T84 PolarHBondContact O-N 2.64Å; D82-T84 VanDerWaalsContact OD1-CB 3.3Å; D82-T84 WeakPolarHBondContact OD1-CB 3.44Å; D82-T84 WeakPolarHBondContact OD1-CG2 3.42Å; D82-T84 PolarHBondContact OD1-N 3.4Å; D82-T84 PolarHBondContact OD1-OG1 3.41Å; D82-T84 PolarHBondContact OD2-OG1 3.03Å; D82-T84 VanDerWaalsContact OD2-OG1 3.12Å; D82-I85 HydrophobicContact CB-CG1 4.36Å; D82-I85 PolarHBondContact O-N 2.94Å; D82-I85 VanDerWaalsContact O-N 3.15Å
83	P	66.7	Low	75.6	Confident	124 Å²	124	82.3 Å²	82.3	81%	0.805	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-12.2	-176.6	28.8	-35.1	0	0	0	112.5	S81 I85	S81-P83 VanDerWaalsContact O-CD 3.27Å; S81-P83 WeakPolarHBondContact O-CD 3.49Å; P83-I85 PolarHBondContact O-N 3.36Å
84	T	70.5	Confident	75.9	Confident	63 Å²	63	79.3 Å²	79.3	39%	0.387	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-4.8	177.4	73.7	0	0	0	0	113.6	D82 K100 G101	D82-T84 PolarHBondContact O-N 2.64Å; D82-T84 VanDerWaalsContact OD1-CB 3.3Å; D82-T84 WeakPolarHBondContact OD1-CB 3.44Å; D82-T84 WeakPolarHBondContact OD1-CG2 3.42Å; D82-T84 PolarHBondContact OD1-N 3.4Å; D82-T84 PolarHBondContact OD1-OG1 3.41Å; D82-T84 PolarHBondContact OD2-OG1 3.03Å; D82-T84 VanDerWaalsContact OD2-OG1 3.12Å; T84-K100 WeakPolarHBondContact O-CA 3.48Å; T84-G101 PolarHBondContact O-N 3.37Å; T84-G101 VanDerWaalsContact O-N 3.09Å; T84-G101 PolarHBondContact OG1-N 2.81Å
85	I	76.2	Confident	76.6	Confident	25 Å²	25	75.6 Å²	75.6	13%	0.128	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	121.2	177.9	-55.2	-143.9	0	0	0	110.4	D82 P83 G99 K100 Q396 I399	D82-I85 HydrophobicContact CB-CG1 4.36Å; D82-I85 PolarHBondContact O-N 2.94Å; D82-I85 VanDerWaalsContact O-N 3.15Å; P83-I85 PolarHBondContact O-N 3.36Å; I85-G99 WeakPolarHBondContact CA-O 3.44Å; I85-K100 HydrophobicContact CD1-CB 4.35Å; I85-K100 HydrophobicContact CD1-CD 4.09Å; I85-K100 HydrophobicContact CD1-CG 3.75Å; I85-K100 HydrophobicContact CG1-CG 4.29Å; I85-Q396 VanDerWaalsContact CD1-CD 3.49Å; I85-Q396 VanDerWaalsContact CG1-OE1 3.24Å; I85-Q396 VanDerWaalsContact CG2-OE1 3.29Å; I85-I399 HydrophobicContact CD1-CB 4.3Å; I85-I399 HydrophobicContact CD1-CG1 3.96Å; I85-I399 HydrophobicContact CD1-CG2 3.86Å; I85-I399 HydrophobicContact CG2-CB 4.39Å; I85-I399 HydrophobicContact CG2-CD1 3.38Å; I85-I399 HydrophobicContact CG2-CG1 3.55Å
86	S	81	Confident	77.3	Confident	58 Å²	58	71.1 Å²	71.1	41%	0.406	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	140.5	177.9	63.1	0	0	0	0	110.6	G99	S86-G99 PolarHBondContact N-O 3.37Å; S86-G99 VanDerWaalsContact N-O 3.1Å; S86-G99 PolarHBondContact O-N 2.66Å
87	I	86.6	Confident	77.9	Confident	12 Å²	12	72 Å²	72	6%	0.062	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	106.5	164.1	-56.1	-171.4	0	0	0	105.9	V89 I96 C97 F98 R114 I399 T402	I87-V89 HydrophobicContact CG2-CG2 4.25Å; I87-I96 HydrophobicContact CG2-CG2 3.88Å; I87-C97 WeakPolarHBondContact CA-O 3.49Å; I87-F98 HydrophobicContact CD1-CD2 4.36Å; I87-F98 HydrophobicContact CG1-CD2 4.23Å; I87-R114 VanDerWaalsContact O-CZ 3.3Å; I87-R114 PolarHBondContact O-NH1 2.82Å; I87-R114 VanDerWaalsContact O-NH1 3.15Å; I87-R114 PolarHBondContact O-NH2 2.83Å; I87-I399 HydrophobicContact CD1-CD1 3.81Å; I87-I399 HydrophobicContact CG1-CD1 4.02Å; I87-T402 HydrophobicContact CD1-CG2 3.59Å
88	D	87.7	Confident	78.8	Confident	94 Å²	94	66.5 Å²	66.5	50%	0.503	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	142.1	172.7	-166.1	32.6	0	0	0	110.8	I96 C97 R114	D88-I96 CarbonylContact O-C 3.54Å; D88-I96 VanDerWaalsContact O-CA 3.31Å; D88-I96 WeakPolarHBondContact O-CA 3.44Å; D88-C97 HydrophobicContact CB-CB 4.28Å; D88-C97 PolarHBondContact N-O 3.47Å; D88-C97 PolarHBondContact O-N 3.39Å; D88-R114 IonicContact OD1-NH1 2.7Å; D88-R114 PolarHBondContact OD1-NH1 2.74Å
89	V	89.8	Confident	80	Confident	17 Å²	17	58.3 Å²	58.3	10%	0.103	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	115.4	-171.2	-175.4	0	0	0	0	108.6	V69 I87 I96 C112 R114	V69-V89 HydrophobicContact CB-CG2 4.41Å; V69-V89 HydrophobicContact CG2-CG2 3.65Å; I87-V89 HydrophobicContact CG2-CG2 4.25Å; V89-I96 HydrophobicContact CG1-CG1 4.24Å; V89-I96 HydrophobicContact CG2-CG1 4.24Å; V89-C112 HydrophobicContact CG1-CB 3.7Å; V89-R114 HydrophobicContact CB-CB 4.01Å; V89-R114 HydrophobicContact CB-CG 4.48Å; V89-R114 HydrophobicContact CG1-CB 4.15Å; V89-R114 HydrophobicContact CG2-CB 4.15Å; V89-R114 HydrophobicContact CG2-CG 4.26Å
90	D	89.4	Confident	81.2	Confident	56 Å²	56	59.6 Å²	59.6	30%	0.299	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	101.1	167.2	-169.7	-32.9	0	0	0	109	Q92 L93 G94 T95	D90-Q92 PolarHBondContact O-N 2.72Å; D90-Q92 WeakPolarHBondContact OD1-CA 3.3Å; D90-Q92 WeakPolarHBondContact OD1-CB 3.43Å; D90-Q92 PolarHBondContact OD1-N 3.32Å; D90-L93 HydrophobicContact CB-CB 4.18Å; D90-L93 PolarHBondContact OD1-N 3.05Å; D90-L93 VanDerWaalsContact OD2-CD1 3.24Å; D90-L93 WeakPolarHBondContact OD2-CD1 3.39Å; D90-L93 VanDerWaalsContact OD2-CG 3.31Å; D90-L93 WeakPolarHBondContact OD2-CG 3.35Å; D90-G94 WeakPolarHBondContact O-CA 3.35Å; D90-G94 PolarHBondContact O-N 2.83Å; D90-T95 WeakPolarHBondContact CB-OG1 3.22Å; D90-T95 PolarHBondContact N-O 2.83Å; D90-T95 PolarHBondContact O-N 3.45Å
91	S	85.4	Confident	82.5	Confident	43 Å²	43	55.3 Å²	55.3	30%	0.301	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-17.1	179.2	-72	0	0	0	0	114.4	C112	S91-C112 VanDerWaalsContact CA-O 3.3Å; S91-C112 WeakPolarHBondContact CA-O 3.35Å; S91-C112 WeakPolarHBondContact CB-O 3.18Å; S91-C112 PolarHBondContact OG-O 2.91Å
92	Q	85.3	Confident	83.2	Confident	190 Å²	190	58.8 Å²	58.8	89%	0.888	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-44.5	177.5	-64.7	-174.1	-1.2	0	0	110.8	D90 G94	D90-Q92 PolarHBondContact O-N 2.72Å; D90-Q92 WeakPolarHBondContact OD1-CA 3.3Å; D90-Q92 WeakPolarHBondContact OD1-CB 3.43Å; D90-Q92 PolarHBondContact OD1-N 3.32Å; Q92-G94 VanDerWaalsContact C-N 3.3Å
93	L	83.8	Confident	83.7	Confident	127 Å²	127	61.2 Å²	61.2	67%	0.665	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-12.8	176.3	-62.8	-178	0	0	0	113.1	D90 T95	D90-L93 HydrophobicContact CB-CB 4.18Å; D90-L93 PolarHBondContact OD1-N 3.05Å; D90-L93 VanDerWaalsContact OD2-CD1 3.24Å; D90-L93 WeakPolarHBondContact OD2-CD1 3.39Å; D90-L93 VanDerWaalsContact OD2-CG 3.31Å; D90-L93 WeakPolarHBondContact OD2-CG 3.35Å; L93-T95 VanDerWaalsContact C-N 3.33Å; L93-T95 HydrophobicContact CB-CG2 3.88Å
94	G	89.5	Confident	84.5	Confident	5 Å²	5	62 Å²	62	5%	0.052	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	68	35	-176.2	0	0	0	0	0	112	D90 Q92 F109 C112	D90-G94 WeakPolarHBondContact O-CA 3.35Å; D90-G94 PolarHBondContact O-N 2.83Å; Q92-G94 VanDerWaalsContact C-N 3.3Å; G94-F109 PolarHBondContact O-N 3.08Å; G94-C112 PolarHBondContact O-SG 2.74Å
95	T	92	Very high	85.5	Confident	23 Å²	23	63.4 Å²	63.4	14%	0.141	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	148.6	-175.5	70	0	0	0	0	112.2	D90 L93 F107 N108	D90-T95 WeakPolarHBondContact CB-OG1 3.22Å; D90-T95 PolarHBondContact N-O 2.83Å; D90-T95 PolarHBondContact O-N 3.45Å; L93-T95 VanDerWaalsContact C-N 3.33Å; L93-T95 HydrophobicContact CB-CG2 3.88Å; T95-F107 CarbonylContact C-O 3.23Å; T95-F107 VanDerWaalsContact CA-O 3.27Å; T95-F107 WeakPolarHBondContact CA-O 3.27Å; T95-N108 WeakPolarHBondContact CG2-OD1 3.33Å
96	I	93.3	Very high	86.2	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	117.4	172.4	-63.5	179.7	0	0	0	108.1	V67 V69 I87 D88 V89 V106 F107 F109 C112 I392 L406	V67-I96 HydrophobicContact CB-CD1 3.64Å; V67-I96 HydrophobicContact CG1-CD1 3.41Å; V67-I96 VanDerWaalsContact CG1-CD1 3.41Å; V67-I96 HydrophobicContact CG2-CD1 4.18Å; V69-I96 HydrophobicContact CG2-CD1 4.31Å; I87-I96 HydrophobicContact CG2-CG2 3.88Å; D88-I96 CarbonylContact O-C 3.54Å; D88-I96 VanDerWaalsContact O-CA 3.31Å; D88-I96 WeakPolarHBondContact O-CA 3.44Å; V89-I96 HydrophobicContact CG1-CG1 4.24Å; V89-I96 HydrophobicContact CG2-CG1 4.24Å; I96-V106 WeakPolarHBondContact O-CA 3.24Å; I96-F107 PolarHBondContact N-O 3.4Å; I96-F107 PolarHBondContact O-N 3.44Å; I96-F109 HydrophobicContact CD1-CD2 4.29Å; I96-F109 HydrophobicContact CD1-CE2 4.3Å; I96-C112 HydrophobicContact CD1-CB 4.46Å; I96-C112 HydrophobicContact CG1-CB 4.21Å; I96-I392 HydrophobicContact CD1-CD1 4.47Å; I96-L406 HydrophobicContact CD1-CD2 4.01Å; I96-L406 HydrophobicContact CG2-CD1 4.36Å; I96-L406 HydrophobicContact CG2-CD2 4.48Å
97	C	90.8	Very high	86.8	Confident	27 Å²	27	64.1 Å²	64.1	18%	0.182	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	115.7	171.6	-63.2	0	0	0	0	108.5	I87 D88	I87-C97 WeakPolarHBondContact CA-O 3.49Å; D88-C97 HydrophobicContact CB-CB 4.28Å; D88-C97 PolarHBondContact N-O 3.47Å; D88-C97 PolarHBondContact O-N 3.39Å
98	F	91.2	Very high	87.2	Confident	3 Å²	3	67.8 Å²	67.8	1%	0.013	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	112.2	177.7	178.4	-80.5	0	0	0	108.9	I87 K100 E104 R105 F107 I399 T402 L403 L406	I87-F98 HydrophobicContact CD1-CD2 4.36Å; I87-F98 HydrophobicContact CG1-CD2 4.23Å; F98-K100 HydrophobicContact CE1-CB 3.73Å; F98-K100 HydrophobicContact CZ-CB 4.32Å; F98-E104 CarbonylContact O-C 3.57Å; F98-E104 WeakPolarHBondContact O-CA 3.43Å; F98-R105 PolarHBondContact N-O 3.42Å; F98-R105 PolarHBondContact O-N 2.73Å; F98-F107 HydrophobicContact CB-CE2 4.17Å; F98-I399 HydrophobicContact CD2-CD1 4.12Å; F98-I399 HydrophobicContact CE2-CD1 3.28Å; F98-I399 HydrophobicContact CE2-CG1 3.59Å; F98-I399 HydrophobicContact CZ-CD1 3.77Å; F98-I399 HydrophobicContact CZ-CG1 3.53Å; F98-T402 HydrophobicContact CE2-CG2 4.43Å; F98-L403 HydrophobicContact CD1-CD1 3.98Å; F98-L403 HydrophobicContact CD2-CD1 4.5Å; F98-L403 HydrophobicContact CE1-CB 4.31Å; F98-L403 HydrophobicContact CE1-CD1 3.88Å; F98-L403 HydrophobicContact CE1-CD2 3.95Å; F98-L403 HydrophobicContact CE1-CG 4.26Å; F98-L403 HydrophobicContact CE2-CB 3.9Å; F98-L403 HydrophobicContact CE2-CD1 4.36Å; F98-L403 HydrophobicContact CG-CD1 4.3Å; F98-L403 HydrophobicContact CZ-CB 3.68Å; F98-L403 HydrophobicContact CZ-CD1 4.06Å; F98-L403 HydrophobicContact CZ-CD2 4.04Å; F98-L403 HydrophobicContact CZ-CG 4.13Å; F98-L406 HydrophobicContact CB-CD1 4.43Å; F98-L406 HydrophobicContact CD2-CD1 3.98Å
99	G	83.6	Confident	87.6	Confident	5 Å²	5	63.7 Å²	63.7	5%	0.052	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	134.8	172	0	0	0	0	0	111.2	I85 S86	I85-G99 WeakPolarHBondContact CA-O 3.44Å; S86-G99 PolarHBondContact N-O 3.37Å; S86-G99 VanDerWaalsContact N-O 3.1Å; S86-G99 PolarHBondContact O-N 2.66Å
100	K	82.6	Confident	87.9	Confident	83 Å²	83	66 Å²	66	36%	0.361	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	108	167.9	179.5	174.4	-174.7	-167.9	0	109.8	T84 I85 F98 Q103 N400	T84-K100 WeakPolarHBondContact O-CA 3.48Å; I85-K100 HydrophobicContact CD1-CB 4.35Å; I85-K100 HydrophobicContact CD1-CD 4.09Å; I85-K100 HydrophobicContact CD1-CG 3.75Å; I85-K100 HydrophobicContact CG1-CG 4.29Å; F98-K100 HydrophobicContact CE1-CB 3.73Å; F98-K100 HydrophobicContact CZ-CB 4.32Å; K100-Q103 PolarHBondContact N-O 2.57Å; K100-Q103 PolarHBondContact O-N 3.46Å; K100-N400 PolarHBondContact NZ-OD1 2.87Å
101	G	79.9	Confident	88.1	Confident	39 Å²	39	65.8 Å²	65.8	40%	0.402	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.9	-137.4	-169.8	0	0	0	0	0	110.1	T84 Q103	T84-G101 PolarHBondContact O-N 3.37Å; T84-G101 VanDerWaalsContact O-N 3.09Å; T84-G101 PolarHBondContact OG1-N 2.81Å; G101-Q103 PolarHBondContact O-N 3.47Å
102	D	75	Confident	88.5	Confident	177 Å²	177	63.8 Å²	63.8	95%	0.947	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	1	176.8	-58.7	-30.9	0	0	0	113.9
103	Q	78.3	Confident	88.8	Confident	115 Å²	115	54.9 Å²	54.9	54%	0.537	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	109.1	179.6	-65.4	-170.2	9.6	0	0	111.2	K100 G101	K100-Q103 PolarHBondContact N-O 2.57Å; K100-Q103 PolarHBondContact O-N 3.46Å; G101-Q103 PolarHBondContact O-N 3.47Å
104	E	83.5	Confident	89.1	Confident	141 Å²	141	52.2 Å²	52.2	66%	0.659	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.5	134.1	166.7	-165.9	175.6	-167.2	0	0	110.5	F98	F98-E104 CarbonylContact O-C 3.57Å; F98-E104 WeakPolarHBondContact O-CA 3.43Å
105	R	90.1	Very high	89	Confident	91 Å²	91	52.7 Å²	52.7	34%	0.343	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	125.3	178.7	-62.2	-176.7	-171.5	-133	-0.9	110.1	F98 F107	F98-R105 PolarHBondContact N-O 3.42Å; F98-R105 PolarHBondContact O-N 2.73Å; R105-F107 HydrophobicContact CB-CE2 3.96Å; R105-F107 HydrophobicContact CB-CZ 4.47Å
106	V	91.4	Very high	88.5	Confident	84 Å²	84	55.3 Å²	55.3	51%	0.509	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	129.5	175.7	-172.4	0	0	0	0	109.7	I96	I96-V106 WeakPolarHBondContact O-CA 3.24Å
107	F	94.1	Very high	87.5	Confident	14 Å²	14	58.5 Å²	58.5	6%	0.061	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	138.6	173.8	-63.3	-92	0	0	0	110.3	T95 I96 F98 R105 F109 L403 L406 R407 N410	T95-F107 CarbonylContact C-O 3.23Å; T95-F107 VanDerWaalsContact CA-O 3.27Å; T95-F107 WeakPolarHBondContact CA-O 3.27Å; I96-F107 PolarHBondContact N-O 3.4Å; I96-F107 PolarHBondContact O-N 3.44Å; F98-F107 HydrophobicContact CB-CE2 4.17Å; R105-F107 HydrophobicContact CB-CE2 3.96Å; R105-F107 HydrophobicContact CB-CZ 4.47Å; F107-F109 HydrophobicContact CB-CD2 4.19Å; F107-F109 HydrophobicContact CB-CE2 3.35Å; F107-F109 HydrophobicContact CB-CZ 3.67Å; F107-F109 HydrophobicContact CD1-CZ 4.18Å; F107-F109 HydrophobicContact CG-CE2 4.21Å; F107-F109 HydrophobicContact CG-CZ 4.2Å; F107-L403 HydrophobicContact CE2-CD1 4.19Å; F107-L403 HydrophobicContact CZ-CD1 3.94Å; F107-L406 HydrophobicContact CD1-CB 4.36Å; F107-L406 HydrophobicContact CD2-CB 4.31Å; F107-L406 HydrophobicContact CD2-CD1 4.1Å; F107-L406 HydrophobicContact CE1-CB 4.13Å; F107-L406 HydrophobicContact CE2-CB 4.09Å; F107-L406 HydrophobicContact CE2-CD1 4Å; F107-L406 HydrophobicContact CG-CB 4.44Å; F107-L406 HydrophobicContact CZ-CB 3.99Å; F107-R407 HydrophobicContact CE1-CG 4.34Å; F107-R407 HydrophobicContact CZ-CG 4.38Å; F107-N410 HydrophobicContact CD1-CB 4.13Å; F107-N410 HydrophobicContact CE1-CB 4.45Å
108	N	94.4	Very high	86.5	Confident	89 Å²	89	65.3 Å²	65.3	48%	0.476	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	116.6	-178.2	-59.2	-22	0	0	0	110.1	T95 K413	T95-N108 WeakPolarHBondContact CG2-OD1 3.33Å; N108-K413 WeakPolarHBondContact O-CD 3.48Å; N108-K413 PolarHBondContact O-NZ 2.89Å
109	F	96.1	Very high	85.9	Confident	9 Å²	9	68.4 Å²	68.4	4%	0.039	36%	0.361	C	S	.	.			trans	-119.2	172.6	-179.5	-58.7	-68.4	0	0	0	110.7	V65 V67 G94 I96 F107 L406 A409 N410	V65-F109 HydrophobicContact CB-CD1 4.14Å; V65-F109 HydrophobicContact CG1-CD1 3.48Å; V65-F109 VanDerWaalsContact CG1-CD1 3.48Å; V65-F109 HydrophobicContact CG1-CE1 3.97Å; V65-F109 HydrophobicContact CG1-CG 4.33Å; V67-F109 HydrophobicContact CB-CD2 4.26Å; V67-F109 HydrophobicContact CG2-CB 4.24Å; V67-F109 HydrophobicContact CG2-CD1 4.04Å; V67-F109 HydrophobicContact CG2-CD2 3.31Å; V67-F109 HydrophobicContact CG2-CE1 4.21Å; V67-F109 HydrophobicContact CG2-CE2 3.5Å; V67-F109 HydrophobicContact CG2-CG 3.59Å; V67-F109 HydrophobicContact CG2-CZ 3.94Å; G94-F109 PolarHBondContact O-N 3.08Å; I96-F109 HydrophobicContact CD1-CD2 4.29Å; I96-F109 HydrophobicContact CD1-CE2 4.3Å; F107-F109 HydrophobicContact CB-CD2 4.19Å; F107-F109 HydrophobicContact CB-CE2 3.35Å; F107-F109 HydrophobicContact CB-CZ 3.67Å; F107-F109 HydrophobicContact CD1-CZ 4.18Å; F107-F109 HydrophobicContact CG-CE2 4.21Å; F107-F109 HydrophobicContact CG-CZ 4.2Å; F109-L406 HydrophobicContact CE2-CD2 3.75Å; F109-L406 HydrophobicContact CZ-CD2 4.04Å; F109-A409 HydrophobicContact CD1-CB 4.38Å; F109-A409 HydrophobicContact CE1-CB 3.57Å; F109-A409 HydrophobicContact CZ-CB 3.96Å; F109-N410 HydrophobicContact CE1-CB 4.27Å
110	D	95.5	Very high	85.7	Confident	66 Å²	66	71.9 Å²	71.9	35%	0.353	40%	0.397	S	S	.	.	S	Bend	trans	-77.8	-34.2	-179.5	-51.9	-48.1	0	0	0	110.2	C64 V65 K413	C64-D110 WeakPolarHBondContact CA-OD2 3.29Å; V65-D110 PolarHBondContact N-OD2 3.41Å; V65-D110 PolarHBondContact O-N 3.35Å; D110-K413 WeakPolarHBondContact OD1-CE 3.07Å; D110-K413 IonicContact OD1-NZ 3.49Å; D110-K413 PolarHBondContact OD1-NZ 3.03Å
111	H	95	Very high	85.8	Confident	51 Å²	51	73.5 Å²	73.5	24%	0.236	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	134	172.4	-55.3	-62.1	0	0	0	111.4	V65 A66 V67 L134	V65-H111 PolarHBondContact O-N 2.92Å; A66-H111 CarbonylContact C-O 3.48Å; A66-H111 VanDerWaalsContact CA-O 3.25Å; A66-H111 WeakPolarHBondContact CA-O 3.47Å; A66-H111 HydrophobicContact CB-CB 3.98Å; V67-H111 PolarHBondContact N-O 2.83Å; H111-L134 VanDerWaalsContact CD2-CD2 3.45Å; H111-L134 WeakPolarHBondContact CD2-CD2 3.45Å
112	C	93.7	Very high	86.1	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	122.3	171.4	-67.1	0	0	0	0	109.2	V67 V89 S91 G94 I96	V67-C112 CarbonylContact O-C 3.4Å; V67-C112 WeakPolarHBondContact O-CA 3.14Å; V89-C112 HydrophobicContact CG1-CB 3.7Å; S91-C112 VanDerWaalsContact CA-O 3.3Å; S91-C112 WeakPolarHBondContact CA-O 3.35Å; S91-C112 WeakPolarHBondContact CB-O 3.18Å; S91-C112 PolarHBondContact OG-O 2.91Å; G94-C112 PolarHBondContact O-SG 2.74Å; I96-C112 HydrophobicContact CD1-CB 4.46Å; I96-C112 HydrophobicContact CG1-CB 4.21Å
113	I	91	Very high	86.5	Confident	4 Å²	4	68.5 Å²	68.5	2%	0.021	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	127.6	-176.6	-60.6	162.1	0	0	0	107.9	V67 R68 V69 L130	V67-I113 PolarHBondContact O-N 3.14Å; R68-I113 CarbonylContact C-O 3.52Å; R68-I113 WeakPolarHBondContact CA-O 3.42Å; V69-I113 PolarHBondContact N-O 3.34Å; I113-L130 HydrophobicContact CD1-CB 4.19Å; I113-L130 HydrophobicContact CD1-CD1 3.36Å; I113-L130 HydrophobicContact CD1-CG 4.38Å
114	R	90.1	Very high	87.1	Confident	71 Å²	71	65.9 Å²	65.9	27%	0.268	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	122.9	175.7	-171	178	-170.4	158.9	8.8	110	V69 I87 D88 V89 L116 R126	V69-R114 HydrophobicContact CB-CG 4.27Å; I87-R114 VanDerWaalsContact O-CZ 3.3Å; I87-R114 PolarHBondContact O-NH1 2.82Å; I87-R114 VanDerWaalsContact O-NH1 3.15Å; I87-R114 PolarHBondContact O-NH2 2.83Å; D88-R114 IonicContact OD1-NH1 2.7Å; D88-R114 PolarHBondContact OD1-NH1 2.74Å; V89-R114 HydrophobicContact CB-CB 4.01Å; V89-R114 HydrophobicContact CB-CG 4.48Å; V89-R114 HydrophobicContact CG1-CB 4.15Å; V89-R114 HydrophobicContact CG2-CB 4.15Å; V89-R114 HydrophobicContact CG2-CG 4.26Å; R114-L116 HydrophobicContact CG-CD2 4.02Å; R114-L116 HydrophobicContact CG-CG 4.07Å; R114-L116 PolarHBondContact O-N 3.41Å; R114-R126 PolarHBondContact O-NH1 2.92Å
115	D	87.7	Confident	87.3	Confident	14 Å²	14	62.4 Å²	62.4	8%	0.075	35%	0.351	C	S	.	.			trans	-81	101.5	170.6	-63.9	-17.5	0	0	0	108.6	R68 V69 Q71 R126	R68-D115 IonicContact CZ-OD2 2.79Å; R68-D115 VanDerWaalsContact CZ-OD2 3.29Å; R68-D115 IonicContact NE-OD1 3.16Å; R68-D115 IonicContact NE-OD2 3.51Å; R68-D115 PolarHBondContact NE-OD2 3.49Å; R68-D115 IonicContact NH2-OD1 3.82Å; R68-D115 IonicContact NH2-OD2 2.72Å; R68-D115 PolarHBondContact NH2-OD2 3.4Å; V69-D115 PolarHBondContact O-N 3.05Å; Q71-D115 WeakPolarHBondContact CA-O 3.23Å; Q71-D115 PolarHBondContact N-O 3.21Å; D115-R126 WeakPolarHBondContact OD1-CD 3.28Å; D115-R126 IonicContact OD1-NH1 3.37Å
116	L	81.1	Confident	87.3	Confident	79 Å²	79	59.1 Å²	59.1	41%	0.414	34%	0.339	S	S	.	.			trans	-95.8	142.4	177	-69	169.8	0	0	0	110.6	R114 D119 R126	R114-L116 HydrophobicContact CG-CD2 4.02Å; R114-L116 HydrophobicContact CG-CG 4.07Å; R114-L116 PolarHBondContact O-N 3.41Å; L116-D119 HydrophobicContact CB-CB 4.27Å; L116-R126 PolarHBondContact O-NH2 3.27Å
117	A	72.3	Confident	87.4	Confident	67 Å²	67	55.1 Å²	55.1	55%	0.554	32%	0.315	S	S	*	.	S	Bend	trans	-77.5	142.7	164.1	0	0	0	0	0	109.1	D119	A117-D119 PolarHBondContact O-N 2.82Å
118	N	70.7	Confident	87.4	Confident	170 Å²	170	58.9 Å²	58.9	91%	0.909	33%	0.331	S	S	*	.	S	Bend	trans	64.8	25.3	167.5	-50.9	-25	0	0	0	117.1	G120	N118-G120 VanDerWaalsContact C-N 3.29Å
119	D	77.5	Confident	87.3	Confident	67 Å²	67	56.6 Å²	56.6	36%	0.358	32%	0.319	S	S	.	.	S	Bend	trans	-89.3	9.7	172.9	72.7	-20.2	0	0	0	113.7	L116 A117 K121 R126	L116-D119 HydrophobicContact CB-CB 4.27Å; A117-D119 PolarHBondContact O-N 2.82Å; D119-K121 VanDerWaalsContact C-N 3.28Å; D119-K121 PolarHBondContact O-N 2.82Å; D119-K121 WeakPolarHBondContact OD1-CB 3.15Å; D119-K121 PolarHBondContact OD1-N 3.2Å; D119-R126 IonicContact OD1-CZ 2.71Å; D119-R126 IonicContact OD1-NH2 3.26Å; D119-R126 PolarHBondContact OD1-NH2 2.78Å; D119-R126 IonicContact OD2-CZ 3.9Å; D119-R126 IonicContact OD2-NH1 3.59Å; D119-R126 IonicContact OD2-NH2 2.83Å; D119-R126 PolarHBondContact OD2-NH2 2.9Å
120	G	79.8	Confident	87.3	Confident	79 Å²	79	56.1 Å²	56.1	81%	0.814	32%	0.317	S	S	*	.	S	Bend	trans	80.5	-3.7	-177.1	0	0	0	0	0	115.1	N118	N118-G120 VanDerWaalsContact C-N 3.29Å
121	K	83.6	Confident	87.4	Confident	117 Å²	117	54 Å²	54	51%	0.509	30%	0.304	S	S	.	.			trans	-92.4	135.6	175.2	-66.2	-175.8	177.6	-179.6	0	111.3	D119 D125	D119-K121 VanDerWaalsContact C-N 3.28Å; D119-K121 PolarHBondContact O-N 2.82Å; D119-K121 WeakPolarHBondContact OD1-CB 3.15Å; D119-K121 PolarHBondContact OD1-N 3.2Å; K121-D125 HydrophobicContact CB-CB 4.33Å
122	T	86.4	Confident	87.4	Confident	76 Å²	76	54.8 Å²	54.8	47%	0.466	31%	0.31	S	S	.	.			trans	-75.5	159.2	173.6	69.7	0	0	0	0	110.9	N124 D125 R126	T122-N124 PolarHBondContact O-N 2.69Å; T122-D125 WeakPolarHBondContact CB-OD2 3.44Å; T122-D125 PolarHBondContact N-OD2 2.89Å; T122-D125 WeakPolarHBondContact O-CB 3.18Å; T122-D125 PolarHBondContact O-N 3.28Å; T122-D125 PolarHBondContact OG1-N 3.03Å; T122-D125 VanDerWaalsContact OG1-N 3.14Å; T122-D125 PolarHBondContact OG1-OD2 3.42Å; T122-R126 WeakPolarHBondContact O-CG 3.39Å; T122-R126 PolarHBondContact O-N 2.96Å
123	A	84.9	Confident	87.4	Confident	35 Å²	35	58.3 Å²	58.3	29%	0.289	32%	0.324	S	S	.	.	H	α-helix	trans	-60.4	-31.6	174	0	0	0	0	0	112.5	R126 Q127 E170	A123-R126 WeakPolarHBondContact O-CB 3.48Å; A123-R126 PolarHBondContact O-N 3.07Å; A123-Q127 WeakPolarHBondContact O-CG 3.47Å; A123-Q127 PolarHBondContact O-N 3.38Å; A123-Q127 VanDerWaalsContact O-N 3.09Å; A123-E170 VanDerWaalsContact CB-CD 3.4Å; A123-E170 HydrophobicContact CB-CG 4.38Å; A123-E170 VanDerWaalsContact CB-OE1 3.23Å; A123-E170 WeakPolarHBondContact CB-OE1 3.42Å; A123-E170 WeakPolarHBondContact CB-OE2 3.36Å
124	N	89.2	Confident	87.7	Confident	59 Å²	59	58.3 Å²	58.3	32%	0.316	32%	0.324	S	S	.	.	H	α-helix	trans	-64.9	-39.4	172.1	-170.7	50.4	0	0	0	112.6	T122 R126 Q127 K128 E170 R176	T122-N124 PolarHBondContact O-N 2.69Å; N124-R126 VanDerWaalsContact C-N 3.26Å; N124-R126 PolarHBondContact O-N 3.27Å; N124-Q127 PolarHBondContact O-N 3.36Å; N124-K128 WeakPolarHBondContact O-CB 3.2Å; N124-K128 PolarHBondContact O-N 3.48Å; N124-E170 HydrophobicContact CB-CG 4.39Å; N124-R176 PolarHBondContact OD1-NH2 2.82Å
125	D	88.9	Confident	87.9	Confident	69 Å²	69	55 Å²	55	37%	0.369	31%	0.312	S	S	.	.	H	α-helix	trans	-62.7	-35	174.4	-61.1	-44	0	0	0	111.5	K121 T122 K128 D129	K121-D125 HydrophobicContact CB-CB 4.33Å; T122-D125 WeakPolarHBondContact CB-OD2 3.44Å; T122-D125 PolarHBondContact N-OD2 2.89Å; T122-D125 WeakPolarHBondContact O-CB 3.18Å; T122-D125 PolarHBondContact O-N 3.28Å; T122-D125 PolarHBondContact OG1-N 3.03Å; T122-D125 VanDerWaalsContact OG1-N 3.14Å; T122-D125 PolarHBondContact OG1-OD2 3.42Å; D125-K128 WeakPolarHBondContact O-CB 3.41Å; D125-K128 PolarHBondContact O-N 2.84Å; D125-D129 PolarHBondContact O-N 3.43Å
126	R	89	Confident	88.3	Confident	21 Å²	21	55.8 Å²	55.8	8%	0.079	32%	0.32	C	S	.	.	H	α-helix	trans	-68.5	-43.2	177	-62.4	179.1	172.6	-62.9	-7.6	112.3	R114 D115 L116 D119 T122 A123 N124 K128 D129 L130	R114-R126 PolarHBondContact O-NH1 2.92Å; D115-R126 WeakPolarHBondContact OD1-CD 3.28Å; D115-R126 IonicContact OD1-NH1 3.37Å; L116-R126 PolarHBondContact O-NH2 3.27Å; D119-R126 IonicContact OD1-CZ 2.71Å; D119-R126 IonicContact OD1-NH2 3.26Å; D119-R126 PolarHBondContact OD1-NH2 2.78Å; D119-R126 IonicContact OD2-CZ 3.9Å; D119-R126 IonicContact OD2-NH1 3.59Å; D119-R126 IonicContact OD2-NH2 2.83Å; D119-R126 PolarHBondContact OD2-NH2 2.9Å; T122-R126 WeakPolarHBondContact O-CG 3.39Å; T122-R126 PolarHBondContact O-N 2.96Å; A123-R126 WeakPolarHBondContact O-CB 3.48Å; A123-R126 PolarHBondContact O-N 3.07Å; N124-R126 VanDerWaalsContact C-N 3.26Å; N124-R126 PolarHBondContact O-N 3.27Å; R126-K128 VanDerWaalsContact C-N 3.26Å; R126-K128 PolarHBondContact O-N 3.1Å; R126-D129 PolarHBondContact O-N 2.77Å; R126-L130 PolarHBondContact O-N 3.5Å
127	Q	94.5	Very high	89	Confident	0 Å²	0	55 Å²	55	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-62.8	-37	172.7	-65.6	-76.5	52.6	0	0	111.3	A123 N124 F131 Y162 E170 P171	A123-Q127 WeakPolarHBondContact O-CG 3.47Å; A123-Q127 PolarHBondContact O-N 3.38Å; A123-Q127 VanDerWaalsContact O-N 3.09Å; N124-Q127 PolarHBondContact O-N 3.36Å; Q127-F131 WeakPolarHBondContact O-CB 3.47Å; Q127-F131 PolarHBondContact O-N 2.85Å; Q127-Y162 PolarHBondContact NE2-O 2.87Å; Q127-E170 HydrophobicContact CG-CB 4.35Å; Q127-E170 PolarHBondContact NE2-O 2.94Å; Q127-P171 WeakPolarHBondContact CB-O 3.39Å
128	K	94.5	Very high	90.1	Very high	93 Å²	93	52.1 Å²	52.1	40%	0.404	30%	0.295	S	S	.	.	H	α-helix	trans	-66.3	-46.4	175	-172.6	-174.7	175.3	-65.3	0	112.1	N124 D125 R126 L130 F131 D132	N124-K128 WeakPolarHBondContact O-CB 3.2Å; N124-K128 PolarHBondContact O-N 3.48Å; D125-K128 WeakPolarHBondContact O-CB 3.41Å; D125-K128 PolarHBondContact O-N 2.84Å; R126-K128 VanDerWaalsContact C-N 3.26Å; R126-K128 PolarHBondContact O-N 3.1Å; K128-L130 VanDerWaalsContact C-N 3.33Å; K128-L130 PolarHBondContact O-N 3.19Å; K128-F131 CarbonylContact O-C 3.52Å; K128-F131 WeakPolarHBondContact O-CA 3.4Å; K128-F131 WeakPolarHBondContact O-CB 3.49Å; K128-F131 PolarHBondContact O-N 3.09Å; K128-F131 VanDerWaalsContact O-N 3.1Å; K128-D132 IonicContact NZ-OD1 3.13Å; K128-D132 IonicContact NZ-OD2 3.82Å; K128-D132 PolarHBondContact NZ-OD2 3.16Å; K128-D132 VanDerWaalsContact O-CG 3.25Å; K128-D132 PolarHBondContact O-N 3.31Å
129	D	92.4	Very high	91.4	Very high	41 Å²	41	44.2 Å²	44.2	22%	0.219	25%	0.253	C	S	.	.	H	α-helix	trans	-59.6	-43.4	177	-177	32.4	0	0	0	111.2	D125 R126 F131 D132 R133	D125-D129 PolarHBondContact O-N 3.43Å; R126-D129 PolarHBondContact O-N 2.77Å; D129-F131 VanDerWaalsContact C-N 3.31Å; D129-F131 PolarHBondContact O-N 3.34Å; D129-D132 PolarHBondContact O-N 2.96Å; D129-R133 WeakPolarHBondContact O-CG 3.41Å; D129-R133 PolarHBondContact O-N 2.94Å; D129-R133 VanDerWaalsContact O-N 3.08Å; D129-R133 IonicContact OD1-CZ 3.83Å; D129-R133 IonicContact OD1-NE 2.93Å; D129-R133 PolarHBondContact OD1-NE 2.84Å; D129-R133 IonicContact OD1-NH2 3.45Å; D129-R133 PolarHBondContact OD1-NH2 3.37Å; D129-R133 IonicContact OD2-CZ 3.01Å; D129-R133 IonicContact OD2-NE 3.87Å; D129-R133 IonicContact OD2-NH2 2.76Å; D129-R133 PolarHBondContact OD2-NH2 3.49Å
130	L	95.2	Very high	92.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60	-42.5	173.8	-177.3	67.9	0	0	0	111.9	I113 R126 K128 L134 L173 L389	I113-L130 HydrophobicContact CD1-CB 4.19Å; I113-L130 HydrophobicContact CD1-CD1 3.36Å; I113-L130 HydrophobicContact CD1-CG 4.38Å; R126-L130 PolarHBondContact O-N 3.5Å; K128-L130 VanDerWaalsContact C-N 3.33Å; K128-L130 PolarHBondContact O-N 3.19Å; L130-L134 HydrophobicContact CD1-CD1 3.57Å; L130-L134 HydrophobicContact CD1-CG 4.19Å; L130-L134 HydrophobicContact CG-CD1 4.39Å; L130-L134 PolarHBondContact O-N 2.66Å; L130-L173 HydrophobicContact CD2-CD1 3.89Å; L130-L173 HydrophobicContact CD2-CG 4.02Å; L130-L173 HydrophobicContact CG-CD1 4.13Å; L130-L173 HydrophobicContact CG-CD2 4.14Å; L130-L173 HydrophobicContact CG-CG 4.17Å; L130-L389 HydrophobicContact CD1-CD1 4.03Å; L130-L389 HydrophobicContact CD2-CD2 4.23Å
131	F	97.2	Very high	93	Very high	20 Å²	20	42.4 Å²	42.4	9%	0.088	23%	0.23	C	C	.	.	I	π-helix	trans	-64.9	-45.1	176.2	165	-102.2	0	0	0	113	Q127 K128 D129 R133 L134 G135 A136 L173 R176 L180	Q127-F131 WeakPolarHBondContact O-CB 3.47Å; Q127-F131 PolarHBondContact O-N 2.85Å; K128-F131 CarbonylContact O-C 3.52Å; K128-F131 WeakPolarHBondContact O-CA 3.4Å; K128-F131 WeakPolarHBondContact O-CB 3.49Å; K128-F131 PolarHBondContact O-N 3.09Å; K128-F131 VanDerWaalsContact O-N 3.1Å; D129-F131 VanDerWaalsContact C-N 3.31Å; D129-F131 PolarHBondContact O-N 3.34Å; F131-R133 PolarHBondContact O-N 3.25Å; F131-L134 PolarHBondContact O-N 3.36Å; F131-G135 CarbonylContact O-C 3.54Å; F131-G135 VanDerWaalsContact O-CA 3.31Å; F131-G135 WeakPolarHBondContact O-CA 3.33Å; F131-G135 PolarHBondContact O-N 3.12Å; F131-A136 HydrophobicContact CE1-CB 4.46Å; F131-A136 HydrophobicContact CZ-CB 4.3Å; F131-A136 PolarHBondContact O-N 3.25Å; F131-L173 HydrophobicContact CB-CD2 4.24Å; F131-R176 HydrophobicContact CB-CB 4.26Å; F131-R176 HydrophobicContact CD1-CB 4.21Å; F131-R176 HydrophobicContact CD2-CB 3.42Å; F131-R176 VanDerWaalsContact CD2-CB 3.42Å; F131-R176 HydrophobicContact CE1-CB 4.45Å; F131-R176 HydrophobicContact CE2-CB 3.75Å; F131-R176 HydrophobicContact CG-CB 3.66Å; F131-R176 HydrophobicContact CG-CG 4.36Å; F131-R176 HydrophobicContact CZ-CB 4.23Å; F131-L180 HydrophobicContact CE1-CD2 4.42Å; F131-L180 HydrophobicContact CE2-CD2 4.49Å; F131-L180 HydrophobicContact CZ-CB 3.88Å; F131-L180 HydrophobicContact CZ-CD2 3.64Å; F131-L180 HydrophobicContact CZ-CG 4.38Å
132	D	96.2	Very high	93.7	Very high	68 Å²	68	36.9 Å²	36.9	36%	0.364	21%	0.206	S	C	.	.	I	π-helix	trans	-62.5	-35.3	-179.7	-67.7	-23.6	0	0	0	110.9	K128 D129	K128-D132 IonicContact NZ-OD1 3.13Å; K128-D132 IonicContact NZ-OD2 3.82Å; K128-D132 PolarHBondContact NZ-OD2 3.16Å; K128-D132 VanDerWaalsContact O-CG 3.25Å; K128-D132 PolarHBondContact O-N 3.31Å; D129-D132 PolarHBondContact O-N 2.96Å
133	R	93.9	Very high	94.2	Very high	74 Å²	74	35.4 Å²	35.4	28%	0.279	20%	0.195	S	C	.	.	I	π-helix	trans	-78.1	-41.8	178.1	-66.9	177.9	-168.8	-132.9	7.6	114.1	D129 F131 P137	D129-R133 WeakPolarHBondContact O-CG 3.41Å; D129-R133 PolarHBondContact O-N 2.94Å; D129-R133 VanDerWaalsContact O-N 3.08Å; D129-R133 IonicContact OD1-CZ 3.83Å; D129-R133 IonicContact OD1-NE 2.93Å; D129-R133 PolarHBondContact OD1-NE 2.84Å; D129-R133 IonicContact OD1-NH2 3.45Å; D129-R133 PolarHBondContact OD1-NH2 3.37Å; D129-R133 IonicContact OD2-CZ 3.01Å; D129-R133 IonicContact OD2-NE 3.87Å; D129-R133 IonicContact OD2-NH2 2.76Å; D129-R133 PolarHBondContact OD2-NH2 3.49Å; F131-R133 PolarHBondContact O-N 3.25Å; R133-P137 WeakPolarHBondContact O-CG 3.44Å
134	L	96.1	Very high	94.5	Very high	5 Å²	5	35.9 Å²	35.9	3%	0.026	20%	0.197	C	C	.	.	I	π-helix	trans	-109.4	-46.3	-171.7	-54.4	-175.3	0	0	0	113.5	A66 H111 L130 F131 M138 L150 L173 T387 L389	A66-L134 HydrophobicContact CB-CD1 3.72Å; A66-L134 HydrophobicContact CB-CD2 3.83Å; A66-L134 HydrophobicContact CB-CG 4.37Å; H111-L134 VanDerWaalsContact CD2-CD2 3.45Å; H111-L134 WeakPolarHBondContact CD2-CD2 3.45Å; L130-L134 HydrophobicContact CD1-CD1 3.57Å; L130-L134 HydrophobicContact CD1-CG 4.19Å; L130-L134 HydrophobicContact CG-CD1 4.39Å; L130-L134 PolarHBondContact O-N 2.66Å; F131-L134 PolarHBondContact O-N 3.36Å; L134-M138 VanDerWaalsContact O-CG 3.27Å; L134-M138 WeakPolarHBondContact O-CG 3.49Å; L134-L150 HydrophobicContact CB-CD1 4.47Å; L134-L150 HydrophobicContact CD1-CD1 4.42Å; L134-L173 HydrophobicContact CB-CD2 4.34Å; L134-T387 HydrophobicContact CD2-CG2 4.27Å; L134-L389 HydrophobicContact CD1-CD1 4.14Å
135	G	94.9	Very high	94.7	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.01	18%	0.182	C	C	.	.	I	π-helix	trans	-75.2	-47.4	-173.8	0	0	0	0	0	113	F131 M138 V139	F131-G135 CarbonylContact O-C 3.54Å; F131-G135 VanDerWaalsContact O-CA 3.31Å; F131-G135 WeakPolarHBondContact O-CA 3.33Å; F131-G135 PolarHBondContact O-N 3.12Å; G135-M138 WeakPolarHBondContact O-CB 3.32Å; G135-M138 PolarHBondContact O-N 2.8Å; G135-M138 VanDerWaalsContact O-N 3.16Å; G135-V139 PolarHBondContact O-N 3.1Å; G135-V139 VanDerWaalsContact O-N 3.12Å
136	A	95.6	Very high	95	Very high	30 Å²	30	30.7 Å²	30.7	25%	0.248	17%	0.169	C	C	.	.	H	α-helix	trans	-60.5	-43	-177.4	0	0	0	0	0	113.5	F131 M138 V139 S140 L180	F131-A136 HydrophobicContact CE1-CB 4.46Å; F131-A136 HydrophobicContact CZ-CB 4.3Å; F131-A136 PolarHBondContact O-N 3.25Å; A136-M138 PolarHBondContact O-N 3.43Å; A136-V139 PolarHBondContact O-N 3.01Å; A136-S140 PolarHBondContact O-N 2.92Å; A136-L180 HydrophobicContact CB-CD2 4.08Å
137	P	95.3	Very high	95.2	Very high	62 Å²	62	31.1 Å²	31.1	40%	0.403	17%	0.172	S	C	.	.	H	α-helix	trans	-61.1	-40.5	173.1	-26.1	36.8	0	0	0	113.4	R133 V139 S140 D141	R133-P137 WeakPolarHBondContact O-CG 3.44Å; P137-V139 VanDerWaalsContact C-N 3.28Å; P137-V139 PolarHBondContact O-N 3.1Å; P137-S140 WeakPolarHBondContact O-CB 3.47Å; P137-S140 PolarHBondContact O-N 3.48Å; P137-S140 VanDerWaalsContact O-N 3.14Å; P137-D141 PolarHBondContact O-N 2.7Å; P137-D141 VanDerWaalsContact O-N 3.15Å
138	M	96.8	Very high	95.3	Very high	8 Å²	8	31.1 Å²	31.1	4%	0.039	17%	0.173	C	C	.	.	H	α-helix	trans	-61.5	-35.8	177.4	-70.7	179.2	-171.5	0	0	112.4	L134 G135 A136 S140 D141 V142 C148 L150 L302 T387	L134-M138 VanDerWaalsContact O-CG 3.27Å; L134-M138 WeakPolarHBondContact O-CG 3.49Å; G135-M138 WeakPolarHBondContact O-CB 3.32Å; G135-M138 PolarHBondContact O-N 2.8Å; G135-M138 VanDerWaalsContact O-N 3.16Å; A136-M138 PolarHBondContact O-N 3.43Å; M138-S140 VanDerWaalsContact C-N 3.32Å; M138-S140 PolarHBondContact O-N 2.84Å; M138-D141 PolarHBondContact O-N 3.06Å; M138-V142 WeakPolarHBondContact O-CG2 3.5Å; M138-V142 PolarHBondContact O-N 3.04Å; M138-C148 HydrophobicContact CB-CB 4.46Å; M138-C148 HydrophobicContact CG-CB 4.34Å; M138-L150 HydrophobicContact CE-CB 4.04Å; M138-L150 HydrophobicContact CE-CD1 3.69Å; M138-L150 HydrophobicContact CE-CG 4.32Å; M138-L150 HydrophobicContact SD-CB 4.33Å; M138-L150 HydrophobicContact SD-CD1 4.23Å; M138-L302 HydrophobicContact CB-CD1 4.46Å; M138-L302 HydrophobicContact SD-CD1 4.13Å; M138-T387 HydrophobicContact CE-CG2 3.96Å; M138-T387 WeakPolarHBondContact CE-OG1 3.32Å
139	V	97.8	Very high	95.4	Very high	4 Å²	4	26.9 Å²	26.9	2%	0.024	16%	0.155	C	C	.	.	H	α-helix	trans	-59.8	-45.1	175.5	175.1	0	0	0	0	110.9	G135 A136 P137 D141 V142 L143 T177 L180 L181 K184	G135-V139 PolarHBondContact O-N 3.1Å; G135-V139 VanDerWaalsContact O-N 3.12Å; A136-V139 PolarHBondContact O-N 3.01Å; P137-V139 VanDerWaalsContact C-N 3.28Å; P137-V139 PolarHBondContact O-N 3.1Å; V139-D141 VanDerWaalsContact C-N 3.29Å; V139-D141 PolarHBondContact O-N 3.36Å; V139-V142 PolarHBondContact O-N 2.77Å; V139-L143 HydrophobicContact CG1-CD1 3.82Å; V139-L143 HydrophobicContact CG1-CG 4.34Å; V139-L143 WeakPolarHBondContact O-CB 3.19Å; V139-L143 VanDerWaalsContact O-CG 3.26Å; V139-L143 WeakPolarHBondContact O-CG 3.27Å; V139-L143 PolarHBondContact O-N 2.91Å; V139-T177 HydrophobicContact CG2-CG2 3.62Å; V139-L180 HydrophobicContact CB-CD2 4.24Å; V139-L180 HydrophobicContact CB-CG 4.49Å; V139-L180 HydrophobicContact CG1-CD2 4.39Å; V139-L180 HydrophobicContact CG1-CG 4.18Å; V139-L180 HydrophobicContact CG2-CB 4.27Å; V139-L180 HydrophobicContact CG2-CD2 4.04Å; V139-L180 HydrophobicContact CG2-CG 4.22Å; V139-L181 HydrophobicContact CG1-CB 4.08Å; V139-L181 HydrophobicContact CG1-CD1 3.99Å; V139-L181 HydrophobicContact CG2-CB 4.21Å; V139-K184 HydrophobicContact CG1-CG 4.41Å
140	S	95.2	Very high	95.6	Very high	79 Å²	79	25 Å²	25	55%	0.552	15%	0.145	S	C	*	.	H	α-helix	trans	-60.7	-41.1	177.7	-171.1	0	0	0	0	111.7	A136 P137 M138 S144	A136-S140 PolarHBondContact O-N 2.92Å; P137-S140 WeakPolarHBondContact O-CB 3.47Å; P137-S140 PolarHBondContact O-N 3.48Å; P137-S140 VanDerWaalsContact O-N 3.14Å; M138-S140 VanDerWaalsContact C-N 3.32Å; M138-S140 PolarHBondContact O-N 2.84Å; S140-S144 PolarHBondContact O-N 2.9Å; S140-S144 VanDerWaalsContact O-N 3.15Å
141	D	96.3	Very high	95.5	Very high	29 Å²	29	25.2 Å²	25.2	16%	0.155	15%	0.145	C	C	.	.	H	α-helix	trans	-66.5	-46.1	178.7	-75.3	-34.7	0	0	0	112	P137 M138 V139 L143 S144 G145 I146 C148 K385	P137-D141 PolarHBondContact O-N 2.7Å; P137-D141 VanDerWaalsContact O-N 3.15Å; M138-D141 PolarHBondContact O-N 3.06Å; V139-D141 VanDerWaalsContact C-N 3.29Å; V139-D141 PolarHBondContact O-N 3.36Å; D141-L143 PolarHBondContact O-N 2.9Å; D141-S144 WeakPolarHBondContact O-CB 3.08Å; D141-S144 PolarHBondContact O-N 3.39Å; D141-S144 VanDerWaalsContact O-N 3.08Å; D141-S144 PolarHBondContact O-OG 2.77Å; D141-G145 PolarHBondContact O-N 3.4Å; D141-I146 HydrophobicContact CB-CB 4.18Å; D141-I146 HydrophobicContact CB-CG2 4.32Å; D141-I146 WeakPolarHBondContact O-CB 3.48Å; D141-I146 PolarHBondContact O-N 3.01Å; D141-C148 VanDerWaalsContact CB-SG 3.57Å; D141-K385 HydrophobicContact CB-CD 4.3Å; D141-K385 IonicContact OD1-NZ 3.76Å; D141-K385 PolarHBondContact OD1-NZ 3.16Å; D141-K385 WeakPolarHBondContact OD2-CD 3.49Å; D141-K385 IonicContact OD2-NZ 3.72Å; D141-K385 PolarHBondContact OD2-NZ 3.45Å
142	V	97.5	Very high	95.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-58.5	-47.5	176.3	172.8	0	0	0	0	110.6	M138 V139 S144 G145 C148 L181 V280 S300 L302	M138-V142 WeakPolarHBondContact O-CG2 3.5Å; M138-V142 PolarHBondContact O-N 3.04Å; V139-V142 PolarHBondContact O-N 2.77Å; V142-S144 PolarHBondContact O-N 3.03Å; V142-G145 PolarHBondContact O-N 2.99Å; V142-C148 HydrophobicContact CG2-CB 4.25Å; V142-L181 HydrophobicContact CB-CD1 4.37Å; V142-L181 HydrophobicContact CG1-CD1 3.9Å; V142-L181 HydrophobicContact CG1-CD2 4.11Å; V142-V280 HydrophobicContact CG1-CB 4.2Å; V142-V280 HydrophobicContact CG1-CG2 3.87Å; V142-S300 WeakPolarHBondContact CG1-OG 3.44Å; V142-S300 WeakPolarHBondContact O-CB 3.44Å; V142-S300 PolarHBondContact O-OG 3.33Å; V142-L302 HydrophobicContact CG2-CB 3.82Å; V142-L302 HydrophobicContact CG2-CD2 4.45Å; V142-L302 HydrophobicContact CG2-CG 4.5Å
143	L	95.9	Very high	95.4	Very high	45 Å²	45	22.3 Å²	22.3	24%	0.236	13%	0.129	C	C	.	.	H	α-helix	trans	-61.2	-27.8	177.6	-69.6	169.8	0	0	0	113.3	V139 D141 G145 L181 K184 L185 I282	V139-L143 HydrophobicContact CG1-CD1 3.82Å; V139-L143 HydrophobicContact CG1-CG 4.34Å; V139-L143 WeakPolarHBondContact O-CB 3.19Å; V139-L143 VanDerWaalsContact O-CG 3.26Å; V139-L143 WeakPolarHBondContact O-CG 3.27Å; V139-L143 PolarHBondContact O-N 2.91Å; D141-L143 PolarHBondContact O-N 2.9Å; L143-G145 VanDerWaalsContact C-N 3.26Å; L143-G145 PolarHBondContact O-N 2.81Å; L143-L181 HydrophobicContact CD2-CD1 3.8Å; L143-L181 HydrophobicContact CG-CD1 3.9Å; L143-K184 HydrophobicContact CD1-CB 3.55Å; L143-K184 HydrophobicContact CD1-CG 4.01Å; L143-K184 HydrophobicContact CD2-CB 4.44Å; L143-L185 HydrophobicContact CD2-CD2 3.49Å; L143-L185 VanDerWaalsContact CD2-CD2 3.49Å; L143-L185 HydrophobicContact CD2-CG 3.85Å; L143-I282 HydrophobicContact CD2-CD1 4.17Å
144	S	92.7	Very high	95.4	Very high	46 Å²	46	18.8 Å²	18.8	32%	0.322	12%	0.116	S	C	.	.	H	α-helix	trans	-77.6	-9.7	175.1	78.2	0	0	0	0	113.9	S140 D141 V142 I146 V421	S140-S144 PolarHBondContact O-N 2.9Å; S140-S144 VanDerWaalsContact O-N 3.15Å; D141-S144 WeakPolarHBondContact O-CB 3.08Å; D141-S144 PolarHBondContact O-N 3.39Å; D141-S144 VanDerWaalsContact O-N 3.08Å; D141-S144 PolarHBondContact O-OG 2.77Å; V142-S144 PolarHBondContact O-N 3.03Å; S144-I146 WeakPolarHBondContact OG-CD1 3.37Å; S144-I146 WeakPolarHBondContact OG-CG1 3.39Å; S144-V421 VanDerWaalsContact O-CG1 3.23Å; S144-V421 WeakPolarHBondContact O-CG1 3.45Å
145	G	93	Very high	95.1	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.9	20.1	-175	0	0	0	0	0	114.3	D141 V142 L143 N422	D141-G145 PolarHBondContact O-N 3.4Å; V142-G145 PolarHBondContact O-N 2.99Å; L143-G145 VanDerWaalsContact C-N 3.26Å; L143-G145 PolarHBondContact O-N 2.81Å; G145-N422 PolarHBondContact O-N 2.89Å; G145-N422 PolarHBondContact O-ND2 3.4Å
146	I	94.4	Very high	94.8	Very high	19 Å²	19	22 Å²	22	10%	0.097	13%	0.134	C	C	.	.			trans	-95.6	133.6	177	-65.9	171.5	0	0	0	109.8	D141 S144 S300 K385 V419 V421	D141-I146 HydrophobicContact CB-CB 4.18Å; D141-I146 HydrophobicContact CB-CG2 4.32Å; D141-I146 WeakPolarHBondContact O-CB 3.48Å; D141-I146 PolarHBondContact O-N 3.01Å; S144-I146 WeakPolarHBondContact OG-CD1 3.37Å; S144-I146 WeakPolarHBondContact OG-CG1 3.39Å; I146-S300 WeakPolarHBondContact O-CB 3.36Å; I146-K385 HydrophobicContact CG2-CB 4.39Å; I146-K385 HydrophobicContact CG2-CD 4.02Å; I146-K385 HydrophobicContact CG2-CG 4Å; I146-V419 HydrophobicContact CB-CG1 4.44Å; I146-V419 HydrophobicContact CD1-CG1 4.35Å; I146-V419 HydrophobicContact CG1-CG1 4.27Å; I146-V419 HydrophobicContact CG2-CG1 3.42Å; I146-V419 VanDerWaalsContact CG2-CG1 3.42Å; I146-V421 HydrophobicContact CD1-CG2 4.47Å; I146-V421 HydrophobicContact CG1-CG2 4.02Å
147	N	94.8	Very high	94.4	Very high	29 Å²	29	22.9 Å²	22.9	16%	0.155	15%	0.147	C	C	.	.			trans	-72.4	140.5	171.4	-60.7	-34.5	0	0	0	110.5	S300 S301 N383 A384 K385 N422	N147-S300 WeakPolarHBondContact OD1-CA 3.32Å; N147-S301 CarbonylContact C-O 3.55Å; N147-S301 VanDerWaalsContact CA-O 3.26Å; N147-S301 WeakPolarHBondContact CA-O 3.4Å; N147-S301 PolarHBondContact OD1-N 2.83Å; N147-N383 WeakPolarHBondContact CB-O 3.31Å; N147-N383 PolarHBondContact ND2-O 3.14Å; N147-A384 HydrophobicContact CB-CB 3.92Å; N147-A384 CarbonylContact O-C 3.56Å; N147-A384 VanDerWaalsContact O-CA 3.23Å; N147-A384 WeakPolarHBondContact O-CA 3.47Å; N147-K385 PolarHBondContact O-N 2.86Å; N147-N422 VanDerWaalsContact CG-ND2 3.3Å; N147-N422 PolarHBondContact ND2-ND2 3.22Å; N147-N422 VanDerWaalsContact ND2-ND2 3.14Å; N147-N422 PolarHBondContact OD1-ND2 3.31Å; N147-N422 VanDerWaalsContact OD1-ND2 3.09Å
148	C	96.3	Very high	94.2	Very high	1 Å²	1	20 Å²	20	1%	0.007	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	140.3	178.3	-67	0	0	0	0	110.6	M138 D141 V142 S301 L302 T303 K385	M138-C148 HydrophobicContact CB-CB 4.46Å; M138-C148 HydrophobicContact CG-CB 4.34Å; D141-C148 VanDerWaalsContact CB-SG 3.57Å; V142-C148 HydrophobicContact CG2-CB 4.25Å; C148-S301 PolarHBondContact N-O 3.38Å; C148-L302 HydrophobicContact CB-CD1 3.7Å; C148-L302 CarbonylContact O-C 3.58Å; C148-L302 VanDerWaalsContact O-CA 3.28Å; C148-L302 WeakPolarHBondContact O-CA 3.47Å; C148-T303 PolarHBondContact O-N 2.84Å; C148-K385 CarbonylContact C-O 3.6Å; C148-K385 VanDerWaalsContact CA-O 3.29Å; C148-K385 WeakPolarHBondContact CA-O 3.23Å
149	T	95.8	Very high	94	Very high	4 Å²	4	20.6 Å²	20.6	3%	0.025	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	134.3	174	-57.2	0	0	0	0	110.8	F151 T303 V305 S379 K385 T386 T387	T149-F151 HydrophobicContact CG2-CD1 4.39Å; T149-F151 HydrophobicContact CG2-CE1 3.71Å; T149-F151 HydrophobicContact CG2-CE2 3.97Å; T149-F151 HydrophobicContact CG2-CZ 3.49Å; T149-F151 VanDerWaalsContact CG2-CZ 3.49Å; T149-T303 CarbonylContact C-O 3.56Å; T149-T303 VanDerWaalsContact CA-O 3.25Å; T149-T303 WeakPolarHBondContact CA-O 3.46Å; T149-V305 HydrophobicContact CG2-CG2 4.38Å; T149-S379 WeakPolarHBondContact CB-OG 3.46Å; T149-S379 WeakPolarHBondContact CG2-OG 3.44Å; T149-S379 WeakPolarHBondContact OG1-CB 3.44Å; T149-S379 PolarHBondContact OG1-OG 3.48Å; T149-K385 PolarHBondContact N-O 2.75Å; T149-T386 CarbonylContact O-C 3.57Å; T149-T386 VanDerWaalsContact O-CA 3.31Å; T149-T386 WeakPolarHBondContact O-CA 3.27Å; T149-T387 PolarHBondContact O-N 2.9Å
150	L	97.2	Very high	93.9	Very high	1 Å²	1	21 Å²	21	1%	0.005	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	127.8	174	-173.8	149	0	0	0	111	L134 M138 L164 L173 T303 M304 V305 T387 L389	L134-L150 HydrophobicContact CB-CD1 4.47Å; L134-L150 HydrophobicContact CD1-CD1 4.42Å; M138-L150 HydrophobicContact CE-CB 4.04Å; M138-L150 HydrophobicContact CE-CD1 3.69Å; M138-L150 HydrophobicContact CE-CG 4.32Å; M138-L150 HydrophobicContact SD-CB 4.33Å; M138-L150 HydrophobicContact SD-CD1 4.23Å; L150-L164 HydrophobicContact CD2-CD2 3.44Å; L150-L164 VanDerWaalsContact CD2-CD2 3.44Å; L150-L173 HydrophobicContact CD1-CD1 3.96Å; L150-L173 HydrophobicContact CD2-CD1 4.44Å; L150-T303 PolarHBondContact N-O 2.64Å; L150-M304 HydrophobicContact CB-CG 4.29Å; L150-V305 PolarHBondContact O-N 2.8Å; L150-T387 CarbonylContact C-O 3.53Å; L150-T387 VanDerWaalsContact CA-O 3.3Å; L150-T387 WeakPolarHBondContact CA-O 3Å; L150-T387 HydrophobicContact CD1-CG2 4.26Å; L150-L389 HydrophobicContact CD2-CB 4.29Å
151	F	92.6	Very high	93.8	Very high	4 Å²	4	20.1 Å²	20.1	2%	0.018	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	121	175.7	-60	-63.6	0	0	0	111.1	T149 V305 L307 L376 L380 T386 T387 V388 L389	T149-F151 HydrophobicContact CG2-CD1 4.39Å; T149-F151 HydrophobicContact CG2-CE1 3.71Å; T149-F151 HydrophobicContact CG2-CE2 3.97Å; T149-F151 HydrophobicContact CG2-CZ 3.49Å; T149-F151 VanDerWaalsContact CG2-CZ 3.49Å; F151-V305 HydrophobicContact CD1-CB 3.81Å; F151-V305 HydrophobicContact CD1-CG1 4.28Å; F151-V305 HydrophobicContact CD1-CG2 3.9Å; F151-V305 HydrophobicContact CE1-CB 4.23Å; F151-V305 HydrophobicContact CE1-CG2 3.83Å; F151-L307 HydrophobicContact CB-CD1 4.44Å; F151-L376 HydrophobicContact CD1-CD1 4.21Å; F151-L376 HydrophobicContact CE1-CB 4.49Å; F151-L376 HydrophobicContact CE1-CD1 3.31Å; F151-L376 HydrophobicContact CE1-CD2 3.57Å; F151-L376 HydrophobicContact CE1-CG 3.92Å; F151-L376 HydrophobicContact CZ-CB 4.34Å; F151-L376 HydrophobicContact CZ-CD1 3.87Å; F151-L376 HydrophobicContact CZ-CD2 4Å; F151-L376 HydrophobicContact CZ-CG 4.27Å; F151-L380 HydrophobicContact CE2-CD2 3.82Å; F151-L380 HydrophobicContact CE2-CG 4.3Å; F151-L380 HydrophobicContact CZ-CD2 4.36Å; F151-L380 HydrophobicContact CZ-CG 4.36Å; F151-T386 HydrophobicContact CD2-CG2 3.76Å; F151-T386 HydrophobicContact CE2-CG2 3.37Å; F151-T386 HydrophobicContact CZ-CG2 4.46Å; F151-T387 PolarHBondContact N-O 3.15Å; F151-V388 HydrophobicContact CD2-CG2 4.08Å; F151-L389 WeakPolarHBondContact O-CA 3.43Å; F151-L389 PolarHBondContact O-N 3.12Å
152	A	96.4	Very high	93.7	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	118.2	163.7	0	0	0	0	0	109.7	K160 L164 V305 L307 L389	A152-K160 HydrophobicContact CB-CB 3.98Å; A152-K160 HydrophobicContact CB-CG 4.23Å; A152-L164 HydrophobicContact CB-CD1 3.54Å; A152-L164 HydrophobicContact CB-CD2 4.34Å; A152-L164 HydrophobicContact CB-CG 3.89Å; A152-V305 PolarHBondContact N-O 3.33Å; A152-L307 VanDerWaalsContact O-CB 3.31Å; A152-L307 WeakPolarHBondContact O-CB 3.5Å; A152-L307 PolarHBondContact O-N 3.41Å; A152-L389 CarbonylContact C-O 3.57Å; A152-L389 WeakPolarHBondContact CA-O 3.31Å
153	Y	94.8	Very high	93.6	Very high	28 Å²	28	22 Å²	22	11%	0.11	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	145.9	-178.1	-178	-97.9	0	0	0	111.1	L307 S310 L329 L389 A390 T391 T405 Y408	Y153-L307 HydrophobicContact CD2-CD1 3.91Å; Y153-S310 VanDerWaalsContact CZ-CB 3.42Å; Y153-S310 WeakPolarHBondContact OH-CB 3.41Å; Y153-L329 HydrophobicContact CE2-CD2 4.26Å; Y153-L389 PolarHBondContact N-O 2.72Å; Y153-A390 CarbonylContact O-C 3.58Å; Y153-A390 WeakPolarHBondContact O-CA 3.31Å; Y153-T391 PolarHBondContact O-N 2.9Å; Y153-T391 PolarHBondContact O-OG1 3.49Å; Y153-T391 VanDerWaalsContact O-OG1 3.14Å; Y153-T405 HydrophobicContact CD1-CG2 4.02Å; Y153-T405 HydrophobicContact CE1-CG2 4.3Å; Y153-Y408 AromaticContact CD1-CD1 3.56Å; Y153-Y408 HydrophobicContact CD1-CD1 3.56Å; Y153-Y408 AromaticContact CD1-CE1 3.78Å; Y153-Y408 HydrophobicContact CD1-CE1 3.78Å; Y153-Y408 HydrophobicContact CD1-CG 4.07Å; Y153-Y408 HydrophobicContact CD2-CE1 4.2Å; Y153-Y408 AromaticContact CE1-CD1 3.63Å; Y153-Y408 HydrophobicContact CE1-CD1 3.63Å; Y153-Y408 HydrophobicContact CE1-CD2 4.08Å; Y153-Y408 HydrophobicContact CE1-CE1 4.07Å; Y153-Y408 HydrophobicContact CE1-CE2 4.47Å; Y153-Y408 AromaticContact CE1-CG 3.62Å; Y153-Y408 HydrophobicContact CE1-CG 3.62Å; Y153-Y408 HydrophobicContact CE2-CE1 4.45Å; Y153-Y408 HydrophobicContact CE2-CE2 4.27Å; Y153-Y408 HydrophobicContact CG-CD1 4.13Å; Y153-Y408 AromaticContact CG-CE1 3.85Å; Y153-Y408 HydrophobicContact CG-CE1 3.85Å; Y153-Y408 AromaticContact CZ-CD2 3.98Å
154	G	93	Very high	93.7	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.123	C	C	.	.	S	Bend	trans	149	168.8	-178.4	0	0	0	0	0	112.2	K160 S310 T391	G154-K160 WeakPolarHBondContact O-CE 3.25Å; G154-K160 PolarHBondContact O-NZ 2.75Å; G154-S310 PolarHBondContact O-N 3.16Å; G154-S310 PolarHBondContact O-OG 2.75Å; G154-T391 WeakPolarHBondContact CA-O 3.43Å
155	Q	90.7	Very high	93.9	Very high	17 Å²	17	18.5 Å²	18.5	8%	0.079	11%	0.111	C	C	.	.	S	Bend	trans	-65.6	163.8	179	68.7	173.7	94.1	0	0	111.7	G157 T158 K160 S310 E311 N398 E401	Q155-G157 PolarHBondContact O-N 3.27Å; Q155-T158 HydrophobicContact CB-CG2 4.49Å; Q155-T158 HydrophobicContact CG-CG2 3.3Å; Q155-T158 PolarHBondContact O-N 3.08Å; Q155-T158 PolarHBondContact O-OG1 3.38Å; Q155-K160 VanDerWaalsContact C-NZ 3.31Å; Q155-K160 PolarHBondContact O-NZ 2.93Å; Q155-S310 PolarHBondContact N-OG 2.94Å; Q155-E311 WeakPolarHBondContact CA-OE2 3.36Å; Q155-E311 HydrophobicContact CB-CB 4.23Å; Q155-N398 PolarHBondContact NE2-OD1 3.02Å; Q155-N398 VanDerWaalsContact OE1-CB 3.27Å; Q155-N398 PolarHBondContact OE1-O 3.14Å; Q155-E401 HydrophobicContact CB-CB 4.29Å; Q155-E401 VanDerWaalsContact OE1-CB 3.24Å
156	T	88.6	Confident	93.9	Very high	55 Å²	55	19.5 Å²	19.5	34%	0.337	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	138.2	173	-62.9	0	0	0	0	110.9	S270 E311	T156-S270 WeakPolarHBondContact OG1-CB 3.5Å; T156-E311 WeakPolarHBondContact CB-OE1 2.97Å; T156-E311 PolarHBondContact N-OE2 3.38Å; T156-E311 PolarHBondContact OG1-OE1 3.31Å; T156-E311 PolarHBondContact OG1-OE2 3.01Å
157	G	87.1	Confident	93.7	Very high	50 Å²	50	22 Å²	22	52%	0.515	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	5.5	-180	0	0	0	0	0	115.9	R70 Q155 G159	R70-G157 WeakPolarHBondContact CD-O 3.32Å; R70-G157 PolarHBondContact NE-O 3.38Å; Q155-G157 PolarHBondContact O-N 3.27Å; G157-G159 VanDerWaalsContact C-N 3.32Å
158	T	91.6	Very high	93.1	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.006	17%	0.17	C	C	.	.	S	Bend	trans	-81.3	-8.2	173.3	50.8	0	0	0	0	114.6	Q155 T391	Q155-T158 HydrophobicContact CB-CG2 4.49Å; Q155-T158 HydrophobicContact CG-CG2 3.3Å; Q155-T158 PolarHBondContact O-N 3.08Å; Q155-T158 PolarHBondContact O-OG1 3.38Å; T158-T391 WeakPolarHBondContact CB-O 3.46Å; T158-T391 WeakPolarHBondContact OG1-CB 3.48Å; T158-T391 PolarHBondContact OG1-O 3.35Å; T158-T391 PolarHBondContact OG1-OG1 2.94Å
159	G	92	Very high	92.6	Very high	20 Å²	20	29 Å²	29	21%	0.206	20%	0.199	C	C	.	.	S	Bend	trans	98.3	26.7	178.1	0	0	0	0	0	115.4	G157 S163	G157-G159 VanDerWaalsContact C-N 3.32Å; G159-S163 VanDerWaalsContact O-CB 3.29Å; G159-S163 WeakPolarHBondContact O-CB 3.44Å; G159-S163 PolarHBondContact O-N 3.28Å; G159-S163 PolarHBondContact O-OG 3.3Å
160	K	95.1	Very high	92.5	Very high	13 Å²	13	31.6 Å²	31.6	6%	0.057	21%	0.21	C	C	.	.	H	α-helix	trans	-54.3	-63.5	171	-64.4	-175.4	-65.5	-71.3	0	112	A152 G154 Q155 Y162 S163 L164 D306 L307 T391	A152-K160 HydrophobicContact CB-CB 3.98Å; A152-K160 HydrophobicContact CB-CG 4.23Å; G154-K160 WeakPolarHBondContact O-CE 3.25Å; G154-K160 PolarHBondContact O-NZ 2.75Å; Q155-K160 VanDerWaalsContact C-NZ 3.31Å; Q155-K160 PolarHBondContact O-NZ 2.93Å; K160-Y162 VanDerWaalsContact C-N 3.3Å; K160-Y162 PolarHBondContact O-N 3.31Å; K160-S163 PolarHBondContact O-N 3.47Å; K160-S163 VanDerWaalsContact O-N 3.1Å; K160-L164 PolarHBondContact O-N 3.18Å; K160-D306 VanDerWaalsContact CB-OD1 3.31Å; K160-D306 WeakPolarHBondContact CB-OD1 3.49Å; K160-L307 WeakPolarHBondContact CD-O 3.45Å; K160-L307 WeakPolarHBondContact CE-O 3.39Å; K160-T391 HydrophobicContact CG-CG2 4.36Å; K160-T391 WeakPolarHBondContact CG-OG1 3.28Å
161	T	93	Very high	92.4	Very high	61 Å²	61	33.4 Å²	33.4	37%	0.374	22%	0.222	S	C	.	.	H	α-helix	trans	-60.8	-39.5	179.4	-45.2	0	0	0	0	111.6	S163 L164 F165 D306	T161-S163 PolarHBondContact O-N 2.84Å; T161-L164 PolarHBondContact O-N 3.07Å; T161-F165 HydrophobicContact CG2-CD2 3.74Å; T161-F165 HydrophobicContact CG2-CE2 4.39Å; T161-F165 PolarHBondContact O-N 3.18Å; T161-D306 PolarHBondContact OG1-OD2 3.35Å
162	Y	94.4	Very high	92.6	Very high	68 Å²	68	33.2 Å²	33.2	27%	0.267	22%	0.221	S	C	.	.	H	α-helix	trans	-62	-41.3	174.3	174.3	-104.1	0	0	0	112.4	Q127 K160 G166 T167 E170	Q127-Y162 PolarHBondContact NE2-O 2.87Å; K160-Y162 VanDerWaalsContact C-N 3.3Å; K160-Y162 PolarHBondContact O-N 3.31Å; Y162-G166 WeakPolarHBondContact O-CA 3.45Å; Y162-G166 PolarHBondContact O-N 2.8Å; Y162-T167 HydrophobicContact CD2-CG2 4.34Å; Y162-T167 HydrophobicContact CE2-CG2 4.3Å; Y162-E170 WeakPolarHBondContact CE2-OE2 3.16Å; Y162-E170 PolarHBondContact OH-OE2 2.9Å
163	S	96.9	Very high	92.6	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-69.6	-36	178.3	-59	0	0	0	0	112.5	R68 G159 K160 T161 L173	R68-S163 WeakPolarHBondContact CD-OG 3.43Å; R68-S163 PolarHBondContact NH1-OG 3.2Å; G159-S163 VanDerWaalsContact O-CB 3.29Å; G159-S163 WeakPolarHBondContact O-CB 3.44Å; G159-S163 PolarHBondContact O-N 3.28Å; G159-S163 PolarHBondContact O-OG 3.3Å; K160-S163 PolarHBondContact O-N 3.47Å; K160-S163 VanDerWaalsContact O-N 3.1Å; T161-S163 PolarHBondContact O-N 2.84Å; S163-L173 PolarHBondContact O-N 3.48Å
164	L	97.5	Very high	92.8	Very high	1 Å²	1	32 Å²	32	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-79.1	-55.9	-178.6	-71	179.1	0	0	0	112.6	L150 A152 K160 T161 G172 L173 I174 M304 D306	L150-L164 HydrophobicContact CD2-CD2 3.44Å; L150-L164 VanDerWaalsContact CD2-CD2 3.44Å; A152-L164 HydrophobicContact CB-CD1 3.54Å; A152-L164 HydrophobicContact CB-CD2 4.34Å; A152-L164 HydrophobicContact CB-CG 3.89Å; K160-L164 PolarHBondContact O-N 3.18Å; T161-L164 PolarHBondContact O-N 3.07Å; L164-G172 CarbonylContact O-C 3.53Å; L164-L173 HydrophobicContact CD2-CD1 4.34Å; L164-L173 PolarHBondContact O-N 3.49Å; L164-I174 HydrophobicContact CB-CD1 3.97Å; L164-I174 HydrophobicContact CB-CG1 4.41Å; L164-I174 WeakPolarHBondContact O-CB 3.42Å; L164-I174 WeakPolarHBondContact O-CG1 3.22Å; L164-I174 PolarHBondContact O-N 2.93Å; L164-M304 HydrophobicContact CD2-CB 4.46Å; L164-D306 HydrophobicContact CD1-CB 3.51Å
165	F	96	Very high	93	Very high	16 Å²	16	32.6 Å²	32.6	7%	0.07	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-41.5	-175.1	-64.1	-82.4	0	0	0	111.8	T161 G172 I174 F200 I251 V274 D306	T161-F165 HydrophobicContact CG2-CD2 3.74Å; T161-F165 HydrophobicContact CG2-CE2 4.39Å; T161-F165 PolarHBondContact O-N 3.18Å; F165-G172 PolarHBondContact O-N 3.39Å; F165-I174 HydrophobicContact CD1-CD1 3.78Å; F165-I174 HydrophobicContact CD2-CD1 4.3Å; F165-I174 HydrophobicContact CE1-CD1 3.42Å; F165-I174 VanDerWaalsContact CE1-CD1 3.42Å; F165-I174 HydrophobicContact CE2-CD1 3.99Å; F165-I174 HydrophobicContact CG-CD1 4.21Å; F165-I174 HydrophobicContact CZ-CD1 3.53Å; F165-F200 HydrophobicContact CE1-CE1 4.39Å; F165-F200 HydrophobicContact CE1-CE2 4.03Å; F165-F200 AromaticContact CE1-CZ 3.48Å; F165-F200 HydrophobicContact CE1-CZ 3.48Å; F165-F200 VanDerWaalsContact CE1-CZ 3.48Å; F165-F200 AromaticContact CZ-CE2 3.8Å; F165-F200 HydrophobicContact CZ-CE2 3.8Å; F165-F200 AromaticContact CZ-CZ 3.61Å; F165-F200 HydrophobicContact CZ-CZ 3.61Å; F165-I251 HydrophobicContact CD1-CG2 3.91Å; F165-I251 HydrophobicContact CE1-CG2 4.47Å; F165-V274 HydrophobicContact CZ-CG1 4.35Å; F165-D306 HydrophobicContact CE2-CB 4.33Å
166	G	93.2	Very high	93.4	Very high	21 Å²	21	33.9 Å²	33.9	22%	0.216	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	74.7	-159.4	-173.1	0	0	0	0	0	112.8	Y162 E170	Y162-G166 WeakPolarHBondContact O-CA 3.45Å; Y162-G166 PolarHBondContact O-N 2.8Å; G166-E170 VanDerWaalsContact CA-O 3.24Å; G166-E170 WeakPolarHBondContact CA-O 3.39Å
167	T	90.4	Very high	93.8	Very high	71 Å²	71	31.2 Å²	31.2	44%	0.436	21%	0.209	S	C	.	.			trans	-116.3	171.4	172	68.6	0	0	0	0	109.3	Y162 G169 E170	Y162-T167 HydrophobicContact CD2-CG2 4.34Å; Y162-T167 HydrophobicContact CE2-CG2 4.3Å; T167-G169 PolarHBondContact O-N 2.79Å; T167-E170 PolarHBondContact N-O 3.42Å; T167-E170 CarbonylContact O-C 3.54Å; T167-E170 VanDerWaalsContact O-C 3.23Å; T167-E170 PolarHBondContact O-N 2.89Å; T167-E170 VanDerWaalsContact O-N 3.12Å; T167-E170 WeakPolarHBondContact OG1-CB 3.47Å; T167-E170 PolarHBondContact OG1-N 3.41Å; T167-E170 VanDerWaalsContact OG1-N 3.1Å
168	S	82.6	Confident	94.3	Very high	121 Å²	121	28.9 Å²	28.9	85%	0.846	18%	0.184	S	C	*	.	S	Bend	trans	-58.4	-31.9	177.3	-49.9	0	0	0	0	113
169	G	86.6	Confident	94.6	Very high	58 Å²	58	33.7 Å²	33.7	60%	0.598	21%	0.205	S	C	*	.	S	Bend	trans	-88.4	-22.8	175.5	0	0	0	0	0	114.3	T167	T167-G169 PolarHBondContact O-N 2.79Å
170	E	91.8	Very high	94.9	Very high	57 Å²	57	35 Å²	35	27%	0.266	21%	0.207	S	C	.	.	S	Bend	trans	-130.5	70.1	-174.6	-59.3	170.5	-174	0	0	110.2	A123 N124 Q127 Y162 G166 T167 G172	A123-E170 VanDerWaalsContact CB-CD 3.4Å; A123-E170 HydrophobicContact CB-CG 4.38Å; A123-E170 VanDerWaalsContact CB-OE1 3.23Å; A123-E170 WeakPolarHBondContact CB-OE1 3.42Å; A123-E170 WeakPolarHBondContact CB-OE2 3.36Å; N124-E170 HydrophobicContact CB-CG 4.39Å; Q127-E170 HydrophobicContact CG-CB 4.35Å; Q127-E170 PolarHBondContact NE2-O 2.94Å; Y162-E170 WeakPolarHBondContact CE2-OE2 3.16Å; Y162-E170 PolarHBondContact OH-OE2 2.9Å; G166-E170 VanDerWaalsContact CA-O 3.24Å; G166-E170 WeakPolarHBondContact CA-O 3.39Å; T167-E170 PolarHBondContact N-O 3.42Å; T167-E170 CarbonylContact O-C 3.54Å; T167-E170 VanDerWaalsContact O-C 3.23Å; T167-E170 PolarHBondContact O-N 2.89Å; T167-E170 VanDerWaalsContact O-N 3.12Å; T167-E170 WeakPolarHBondContact OG1-CB 3.47Å; T167-E170 PolarHBondContact OG1-N 3.41Å; T167-E170 VanDerWaalsContact OG1-N 3.1Å; E170-G172 PolarHBondContact O-N 3.33Å
171	P	95.5	Very high	95	Very high	40 Å²	40	34.4 Å²	34.4	26%	0.26	21%	0.205	S	C	.	.	B	Isolated β-bridge	trans	-60.3	136.2	-174.4	22	-32.1	0	0	0	110.9	Q127 P175 R176	Q127-P171 WeakPolarHBondContact CB-O 3.39Å; P171-P175 HydrophobicContact CB-CB 4.19Å; P171-P175 HydrophobicContact CB-CG 3.65Å; P171-R176 HydrophobicContact CB-CG 4.39Å; P171-R176 HydrophobicContact CG-CG 4.48Å; P171-R176 PolarHBondContact O-NE 2.97Å
172	G	96.6	Very high	95.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	19%	0.187	C	C	.	.			trans	-83.4	-161.6	-179.6	0	0	0	0	0	113.5	L164 F165 E170 P175 R176	L164-G172 CarbonylContact O-C 3.53Å; F165-G172 PolarHBondContact O-N 3.39Å; E170-G172 PolarHBondContact O-N 3.33Å; G172-P175 WeakPolarHBondContact O-CD 3.37Å; G172-P175 WeakPolarHBondContact O-CG 3.18Å; G172-R176 WeakPolarHBondContact O-CB 3.49Å; G172-R176 VanDerWaalsContact O-CG 3.27Å; G172-R176 WeakPolarHBondContact O-CG 3.45Å; G172-R176 PolarHBondContact O-N 3.48Å
173	L	98	Very high	95.3	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-59.7	-47.4	-179.3	-77.1	169	0	0	0	113.6	L130 F131 L134 L150 S163 L164 T177 M304 L389	L130-L173 HydrophobicContact CD2-CD1 3.89Å; L130-L173 HydrophobicContact CD2-CG 4.02Å; L130-L173 HydrophobicContact CG-CD1 4.13Å; L130-L173 HydrophobicContact CG-CD2 4.14Å; L130-L173 HydrophobicContact CG-CG 4.17Å; F131-L173 HydrophobicContact CB-CD2 4.24Å; L134-L173 HydrophobicContact CB-CD2 4.34Å; L150-L173 HydrophobicContact CD1-CD1 3.96Å; L150-L173 HydrophobicContact CD2-CD1 4.44Å; S163-L173 PolarHBondContact O-N 3.48Å; L164-L173 HydrophobicContact CD2-CD1 4.34Å; L164-L173 PolarHBondContact O-N 3.49Å; L173-T177 WeakPolarHBondContact O-CB 3.42Å; L173-T177 PolarHBondContact O-N 3.28Å; L173-T177 PolarHBondContact O-OG1 3.02Å; L173-M304 HydrophobicContact CB-SD 4.35Å; L173-L389 HydrophobicContact CD1-CD2 3.91Å
174	I	98.1	Very high	95.3	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-57.7	-60.2	-176.1	-67.6	169.1	0	0	0	111.1	L164 F165 R176 T177 C178 I251 F276 M304	L164-I174 HydrophobicContact CB-CD1 3.97Å; L164-I174 HydrophobicContact CB-CG1 4.41Å; L164-I174 WeakPolarHBondContact O-CB 3.42Å; L164-I174 WeakPolarHBondContact O-CG1 3.22Å; L164-I174 PolarHBondContact O-N 2.93Å; F165-I174 HydrophobicContact CD1-CD1 3.78Å; F165-I174 HydrophobicContact CD2-CD1 4.3Å; F165-I174 HydrophobicContact CE1-CD1 3.42Å; F165-I174 VanDerWaalsContact CE1-CD1 3.42Å; F165-I174 HydrophobicContact CE2-CD1 3.99Å; F165-I174 HydrophobicContact CG-CD1 4.21Å; F165-I174 HydrophobicContact CZ-CD1 3.53Å; I174-R176 PolarHBondContact O-N 3.47Å; I174-T177 PolarHBondContact O-N 3.43Å; I174-C178 WeakPolarHBondContact O-CB 3.3Å; I174-C178 PolarHBondContact O-N 3.15Å; I174-C178 PolarHBondContact O-SG 2.85Å; I174-I251 HydrophobicContact CG2-CD1 3.86Å; I174-I251 HydrophobicContact CG2-CG1 4.43Å; I174-F276 HydrophobicContact CD1-CB 4.1Å; I174-F276 HydrophobicContact CD1-CG 4.34Å; I174-F276 HydrophobicContact CG2-CD1 3.69Å; I174-F276 HydrophobicContact CG2-CD2 4.48Å; I174-F276 HydrophobicContact CG2-CE1 3.59Å; I174-F276 HydrophobicContact CG2-CE2 4.4Å; I174-F276 HydrophobicContact CG2-CG 4.14Å; I174-F276 HydrophobicContact CG2-CZ 3.95Å; I174-M304 HydrophobicContact CB-SD 4.3Å; I174-M304 HydrophobicContact CD1-CB 4.26Å; I174-M304 HydrophobicContact CG1-CB 4.04Å; I174-M304 HydrophobicContact CG1-CE 4.33Å; I174-M304 HydrophobicContact CG1-CG 4.29Å; I174-M304 HydrophobicContact CG1-SD 3.4Å; I174-M304 WeakPolarHBondContact CG1-SD 3.43Å
175	P	97.7	Very high	95.2	Very high	13 Å²	13	37.1 Å²	37.1	8%	0.084	22%	0.216	C	C	.	.	H	α-helix	trans	-62.6	-40.9	-178	22.7	-33.4	0	0	0	112.4	P171 G172 C178 K179 F244 I251	P171-P175 HydrophobicContact CB-CB 4.19Å; P171-P175 HydrophobicContact CB-CG 3.65Å; G172-P175 WeakPolarHBondContact O-CD 3.37Å; G172-P175 WeakPolarHBondContact O-CG 3.18Å; P175-C178 PolarHBondContact O-N 2.89Å; P175-K179 VanDerWaalsContact O-CB 3.32Å; P175-K179 WeakPolarHBondContact O-CB 3.33Å; P175-K179 PolarHBondContact O-N 3.21Å; P175-F244 HydrophobicContact CB-CE2 4.45Å; P175-F244 HydrophobicContact CB-CZ 4.26Å; P175-F244 VanDerWaalsContact O-CE2 3.3Å; P175-F244 WeakPolarHBondContact O-CE2 3.33Å; P175-I251 HydrophobicContact CB-CD1 4.31Å
176	R	97.8	Very high	95	Very high	43 Å²	43	41 Å²	41	16%	0.162	23%	0.234	C	C	.	.	H	α-helix	trans	-64.9	-42.2	179.2	-69	177.2	-178.9	-85.6	-2.6	112.8	N124 F131 P171 G172 I174 K179 L180	N124-R176 PolarHBondContact OD1-NH2 2.82Å; F131-R176 HydrophobicContact CB-CB 4.26Å; F131-R176 HydrophobicContact CD1-CB 4.21Å; F131-R176 HydrophobicContact CD2-CB 3.42Å; F131-R176 VanDerWaalsContact CD2-CB 3.42Å; F131-R176 HydrophobicContact CE1-CB 4.45Å; F131-R176 HydrophobicContact CE2-CB 3.75Å; F131-R176 HydrophobicContact CG-CB 3.66Å; F131-R176 HydrophobicContact CG-CG 4.36Å; F131-R176 HydrophobicContact CZ-CB 4.23Å; P171-R176 HydrophobicContact CB-CG 4.39Å; P171-R176 HydrophobicContact CG-CG 4.48Å; P171-R176 PolarHBondContact O-NE 2.97Å; G172-R176 WeakPolarHBondContact O-CB 3.49Å; G172-R176 VanDerWaalsContact O-CG 3.27Å; G172-R176 WeakPolarHBondContact O-CG 3.45Å; G172-R176 PolarHBondContact O-N 3.48Å; I174-R176 PolarHBondContact O-N 3.47Å; R176-K179 PolarHBondContact O-N 3.3Å; R176-L180 PolarHBondContact O-N 3.47Å
177	T	98.2	Very high	95	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-67.5	-44.2	178.6	-53.5	0	0	0	0	111	V139 L173 I174 K179 L180 L181 L302 M304	V139-T177 HydrophobicContact CG2-CG2 3.62Å; L173-T177 WeakPolarHBondContact O-CB 3.42Å; L173-T177 PolarHBondContact O-N 3.28Å; L173-T177 PolarHBondContact O-OG1 3.02Å; I174-T177 PolarHBondContact O-N 3.43Å; T177-K179 VanDerWaalsContact C-N 3.34Å; T177-K179 PolarHBondContact O-N 2.99Å; T177-L180 PolarHBondContact O-N 3.41Å; T177-L181 WeakPolarHBondContact O-CB 3.3Å; T177-L181 PolarHBondContact O-N 2.91Å; T177-L302 HydrophobicContact CG2-CD2 3.68Å; T177-M304 HydrophobicContact CG2-CE 3.78Å
178	C	98	Very high	95	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-61.6	-42.9	175.2	-65.7	0	0	0	0	111.6	I174 P175 L181 L182 M196 I247	I174-C178 WeakPolarHBondContact O-CB 3.3Å; I174-C178 PolarHBondContact O-N 3.15Å; I174-C178 PolarHBondContact O-SG 2.85Å; P175-C178 PolarHBondContact O-N 2.89Å; C178-L181 PolarHBondContact O-N 3.42Å; C178-L182 VanDerWaalsContact O-CB 3.29Å; C178-L182 WeakPolarHBondContact O-CB 3.46Å; C178-L182 PolarHBondContact O-N 3.48Å; C178-M196 HydrophobicContact CB-CE 4.39Å; C178-I247 HydrophobicContact CB-CD1 3.99Å; C178-I247 HydrophobicContact CB-CG2 3.92Å
179	K	97.2	Very high	95	Very high	103 Å²	103	38.5 Å²	38.5	45%	0.448	22%	0.219	S	C	.	.	H	α-helix	trans	-60.4	-49.4	177.1	-170.1	169.6	-177.5	168.5	0	112.2	P175 R176 T177 L182 N183 F244	P175-K179 VanDerWaalsContact O-CB 3.32Å; P175-K179 WeakPolarHBondContact O-CB 3.33Å; P175-K179 PolarHBondContact O-N 3.21Å; R176-K179 PolarHBondContact O-N 3.3Å; T177-K179 VanDerWaalsContact C-N 3.34Å; T177-K179 PolarHBondContact O-N 2.99Å; K179-L182 PolarHBondContact O-N 3.16Å; K179-N183 WeakPolarHBondContact O-CB 3.32Å; K179-N183 PolarHBondContact O-N 3.38Å; K179-N183 PolarHBondContact O-OD1 2.96Å; K179-F244 HydrophobicContact CB-CD2 3.66Å; K179-F244 HydrophobicContact CB-CE2 3.6Å; K179-F244 HydrophobicContact CB-CG 4.34Å; K179-F244 HydrophobicContact CB-CZ 4.21Å; K179-F244 HydrophobicContact CD-CD1 4.34Å; K179-F244 HydrophobicContact CD-CE1 4.21Å; K179-F244 HydrophobicContact CD-CE2 4.41Å; K179-F244 HydrophobicContact CD-CG 4.49Å; K179-F244 HydrophobicContact CD-CZ 4.24Å; K179-F244 HydrophobicContact CG-CD2 4.04Å; K179-F244 HydrophobicContact CG-CE2 4.24Å; K179-F244 HydrophobicContact CG-CG 4.21Å
180	L	98	Very high	94.8	Very high	48 Å²	48	42.4 Å²	42.4	25%	0.251	23%	0.234	S	C	.	.	H	α-helix	trans	-65.5	-42.3	179.1	179.5	63.3	0	0	0	111.7	F131 A136 V139 R176 T177 N183 K184	F131-L180 HydrophobicContact CE1-CD2 4.42Å; F131-L180 HydrophobicContact CE2-CD2 4.49Å; F131-L180 HydrophobicContact CZ-CB 3.88Å; F131-L180 HydrophobicContact CZ-CD2 3.64Å; F131-L180 HydrophobicContact CZ-CG 4.38Å; A136-L180 HydrophobicContact CB-CD2 4.08Å; V139-L180 HydrophobicContact CB-CD2 4.24Å; V139-L180 HydrophobicContact CB-CG 4.49Å; V139-L180 HydrophobicContact CG1-CD2 4.39Å; V139-L180 HydrophobicContact CG1-CG 4.18Å; V139-L180 HydrophobicContact CG2-CB 4.27Å; V139-L180 HydrophobicContact CG2-CD2 4.04Å; V139-L180 HydrophobicContact CG2-CG 4.22Å; R176-L180 PolarHBondContact O-N 3.47Å; T177-L180 PolarHBondContact O-N 3.41Å; L180-N183 PolarHBondContact O-N 2.78Å; L180-K184 HydrophobicContact CD1-CG 4.23Å; L180-K184 HydrophobicContact CG-CG 4.49Å; L180-K184 WeakPolarHBondContact O-CB 3.37Å; L180-K184 VanDerWaalsContact O-CG 3.29Å; L180-K184 WeakPolarHBondContact O-CG 3.16Å; L180-K184 PolarHBondContact O-N 2.94Å
181	L	97.9	Very high	94.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-60.2	-47.8	177.7	179	60.7	0	0	0	111.2	V139 V142 L143 T177 C178 K184 L185 M196 V278 V280	V139-L181 HydrophobicContact CG1-CB 4.08Å; V139-L181 HydrophobicContact CG1-CD1 3.99Å; V139-L181 HydrophobicContact CG2-CB 4.21Å; V142-L181 HydrophobicContact CB-CD1 4.37Å; V142-L181 HydrophobicContact CG1-CD1 3.9Å; V142-L181 HydrophobicContact CG1-CD2 4.11Å; L143-L181 HydrophobicContact CD2-CD1 3.8Å; L143-L181 HydrophobicContact CG-CD1 3.9Å; T177-L181 WeakPolarHBondContact O-CB 3.3Å; T177-L181 PolarHBondContact O-N 2.91Å; C178-L181 PolarHBondContact O-N 3.42Å; L181-K184 PolarHBondContact O-N 2.88Å; L181-L185 HydrophobicContact CD1-CD1 4.29Å; L181-L185 HydrophobicContact CD1-CG 4.42Å; L181-L185 HydrophobicContact CG-CD1 4.15Å; L181-L185 WeakPolarHBondContact O-CG 3.36Å; L181-L185 PolarHBondContact O-N 2.88Å; L181-M196 HydrophobicContact CD2-CE 4.16Å; L181-V278 HydrophobicContact CD2-CG1 3.98Å; L181-V280 HydrophobicContact CD2-CG2 3.94Å
182	L	96.3	Very high	94	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-63.1	-46.1	178.1	-167.6	73.6	0	0	0	111.5	C178 K179 K184 L185 Q186 W194 M196 R243 F244	C178-L182 VanDerWaalsContact O-CB 3.29Å; C178-L182 WeakPolarHBondContact O-CB 3.46Å; C178-L182 PolarHBondContact O-N 3.48Å; K179-L182 PolarHBondContact O-N 3.16Å; L182-K184 VanDerWaalsContact C-N 3.27Å; L182-K184 PolarHBondContact O-N 2.63Å; L182-L185 PolarHBondContact O-N 2.95Å; L182-Q186 HydrophobicContact CG-CG 4.37Å; L182-Q186 WeakPolarHBondContact O-CB 3.39Å; L182-Q186 VanDerWaalsContact O-CG 3.31Å; L182-Q186 WeakPolarHBondContact O-CG 3.28Å; L182-Q186 PolarHBondContact O-N 2.85Å; L182-W194 HydrophobicContact CD1-CH2 3.98Å; L182-W194 HydrophobicContact CD1-CZ3 4.14Å; L182-M196 HydrophobicContact CD1-SD 3.94Å; L182-R243 VanDerWaalsContact CD2-C 3.41Å; L182-F244 HydrophobicContact CD2-CB 4.04Å
183	N	96.6	Very high	93.8	Very high	79 Å²	79	47 Å²	47	42%	0.422	25%	0.253	S	S	.	.	H	α-helix	trans	-57.2	-42.2	176	-72.4	-4.1	0	0	0	111.7	K179 L180 S187	K179-N183 WeakPolarHBondContact O-CB 3.32Å; K179-N183 PolarHBondContact O-N 3.38Å; K179-N183 PolarHBondContact O-OD1 2.96Å; L180-N183 PolarHBondContact O-N 2.78Å; N183-S187 WeakPolarHBondContact O-CB 3.42Å; N183-S187 PolarHBondContact O-N 2.74Å; N183-S187 PolarHBondContact O-OG 3.4Å
184	K	96.6	Very high	93.6	Very high	106 Å²	106	49.8 Å²	49.8	46%	0.461	26%	0.263	S	S	.	.	H	α-helix	trans	-67.2	-42.6	178.1	-73.1	-70.8	-176.1	-178.2	0	111.9	V139 L143 L180 L181 L182 S187 T188	V139-K184 HydrophobicContact CG1-CG 4.41Å; L143-K184 HydrophobicContact CD1-CB 3.55Å; L143-K184 HydrophobicContact CD1-CG 4.01Å; L143-K184 HydrophobicContact CD2-CB 4.44Å; L180-K184 HydrophobicContact CD1-CG 4.23Å; L180-K184 HydrophobicContact CG-CG 4.49Å; L180-K184 WeakPolarHBondContact O-CB 3.37Å; L180-K184 VanDerWaalsContact O-CG 3.29Å; L180-K184 WeakPolarHBondContact O-CG 3.16Å; L180-K184 PolarHBondContact O-N 2.94Å; L181-K184 PolarHBondContact O-N 2.88Å; L182-K184 VanDerWaalsContact C-N 3.27Å; L182-K184 PolarHBondContact O-N 2.63Å; K184-S187 WeakPolarHBondContact CA-OG 3.45Å; K184-S187 PolarHBondContact O-N 2.85Å; K184-S187 PolarHBondContact O-OG 3.15Å; K184-T188 WeakPolarHBondContact O-CG2 3.48Å; K184-T188 PolarHBondContact O-N 3.3Å
185	L	95.6	Very high	93.5	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-62.5	-46.2	175	-72.1	171.3	0	0	0	111.7	L143 L181 L182 S187 T188 W194 M196 V280 I282	L143-L185 HydrophobicContact CD2-CD2 3.49Å; L143-L185 VanDerWaalsContact CD2-CD2 3.49Å; L143-L185 HydrophobicContact CD2-CG 3.85Å; L181-L185 HydrophobicContact CD1-CD1 4.29Å; L181-L185 HydrophobicContact CD1-CG 4.42Å; L181-L185 HydrophobicContact CG-CD1 4.15Å; L181-L185 WeakPolarHBondContact O-CG 3.36Å; L181-L185 PolarHBondContact O-N 2.88Å; L182-L185 PolarHBondContact O-N 2.95Å; L185-S187 VanDerWaalsContact C-N 3.27Å; L185-S187 PolarHBondContact O-N 2.87Å; L185-T188 WeakPolarHBondContact O-CB 3.4Å; L185-T188 WeakPolarHBondContact O-CG2 3.49Å; L185-T188 PolarHBondContact O-N 3.24Å; L185-T188 VanDerWaalsContact O-N 3.11Å; L185-T188 PolarHBondContact O-OG1 2.79Å; L185-W194 HydrophobicContact CB-CD2 3.85Å; L185-W194 HydrophobicContact CB-CE3 4.24Å; L185-W194 HydrophobicContact CB-CG 4.06Å; L185-W194 HydrophobicContact CB-CZ2 4.48Å; L185-W194 HydrophobicContact CD1-CD2 4.44Å; L185-W194 HydrophobicContact CD1-CE3 4.11Å; L185-W194 HydrophobicContact CD2-CB 3.93Å; L185-W194 HydrophobicContact CD2-CG 4.1Å; L185-W194 PolarHBondContact O-NE1 3.05Å; L185-W194 VanDerWaalsContact O-NE1 3.12Å; L185-M196 HydrophobicContact CD1-CB 4.49Å; L185-M196 HydrophobicContact CD1-SD 4.34Å; L185-V280 HydrophobicContact CD1-CG1 4.01Å; L185-V280 HydrophobicContact CD1-CG2 4.42Å; L185-V280 HydrophobicContact CD2-CG1 4.01Å; L185-I282 HydrophobicContact CD2-CD1 3.82Å; L185-I282 HydrophobicContact CD2-CG1 4.08Å
186	Q	93.3	Very high	93.5	Very high	97 Å²	97	51.3 Å²	51.3	45%	0.453	27%	0.274	S	S	.	.	H	α-helix	trans	-64.5	-30.1	177	-71.6	173.7	-15.6	0	0	112.8	L182 T188 W194 E242	L182-Q186 HydrophobicContact CG-CG 4.37Å; L182-Q186 WeakPolarHBondContact O-CB 3.39Å; L182-Q186 VanDerWaalsContact O-CG 3.31Å; L182-Q186 WeakPolarHBondContact O-CG 3.28Å; L182-Q186 PolarHBondContact O-N 2.85Å; Q186-T188 PolarHBondContact O-N 3.08Å; Q186-W194 HydrophobicContact CG-CH2 4.3Å; Q186-W194 HydrophobicContact CG-CZ2 3.81Å; Q186-E242 PolarHBondContact NE2-O 3.31Å
187	S	92.3	Very high	93.5	Very high	89 Å²	89	52.8 Å²	52.8	62%	0.622	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	1.6	175.3	70.1	0	0	0	0	114.7	N183 K184 L185	N183-S187 WeakPolarHBondContact O-CB 3.42Å; N183-S187 PolarHBondContact O-N 2.74Å; N183-S187 PolarHBondContact O-OG 3.4Å; K184-S187 WeakPolarHBondContact CA-OG 3.45Å; K184-S187 PolarHBondContact O-N 2.85Å; K184-S187 PolarHBondContact O-OG 3.15Å; L185-S187 VanDerWaalsContact C-N 3.27Å; L185-S187 PolarHBondContact O-N 2.87Å
188	T	89.3	Confident	93.5	Very high	47 Å²	47	52.8 Å²	52.8	29%	0.288	28%	0.283	S	S	.	.	S	Bend	trans	-71.8	150	177.2	58.7	0	0	0	0	111.6	K184 L185 Q186 T192	K184-T188 WeakPolarHBondContact O-CG2 3.48Å; K184-T188 PolarHBondContact O-N 3.3Å; L185-T188 WeakPolarHBondContact O-CB 3.4Å; L185-T188 WeakPolarHBondContact O-CG2 3.49Å; L185-T188 PolarHBondContact O-N 3.24Å; L185-T188 VanDerWaalsContact O-N 3.11Å; L185-T188 PolarHBondContact O-OG1 2.79Å; Q186-T188 PolarHBondContact O-N 3.08Å; T188-T192 HydrophobicContact CG2-CG2 4.18Å
189	G	84.3	Confident	93.4	Very high	26 Å²	26	53.2 Å²	53.2	27%	0.268	29%	0.286	S	S	.	.			trans	-71.1	169	-179.2	0	0	0	0	0	113.1	E191 T192	G189-E191 WeakPolarHBondContact CA-OE2 3.27Å; G189-E191 PolarHBondContact O-N 3.46Å; G189-E191 VanDerWaalsContact O-N 3.09Å; G189-T192 WeakPolarHBondContact O-CB 3.3Å; G189-T192 PolarHBondContact O-N 3.28Å
190	P	81.6	Confident	93.4	Very high	139 Å²	139	48.4 Å²	48.4	90%	0.903	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-18.7	-176.8	27.7	-35.8	0	0	0	113.5	T192	P190-T192 PolarHBondContact O-N 3.46Å
191	E	80.8	Confident	93.3	Very high	84 Å²	84	46.3 Å²	46.3	39%	0.393	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-2.9	172.6	81.4	-64.2	156.3	0	0	113.3	G189 K284 K285	G189-E191 WeakPolarHBondContact CA-OE2 3.27Å; G189-E191 PolarHBondContact O-N 3.46Å; G189-E191 VanDerWaalsContact O-N 3.09Å; E191-K284 HydrophobicContact CG-CD 4.44Å; E191-K284 WeakPolarHBondContact O-CA 3.42Å; E191-K284 IonicContact OE1-NZ 3.11Å; E191-K284 PolarHBondContact OE1-NZ 3.16Å; E191-K284 VanDerWaalsContact OE1-NZ 3.15Å; E191-K285 WeakPolarHBondContact CB-O 3.31Å; E191-K285 PolarHBondContact O-N 3.12Å
192	T	89.6	Confident	93	Very high	13 Å²	13	46.4 Å²	46.4	8%	0.08	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	118	-176.2	-47.3	0	0	0	0	110.5	T188 G189 P190 I282 K284	T188-T192 HydrophobicContact CG2-CG2 4.18Å; G189-T192 WeakPolarHBondContact O-CB 3.3Å; G189-T192 PolarHBondContact O-N 3.28Å; P190-T192 PolarHBondContact O-N 3.46Å; T192-I282 HydrophobicContact CG2-CG2 3.4Å; T192-K284 HydrophobicContact CG2-CD 4.32Å; T192-K284 WeakPolarHBondContact OG1-CE 3.39Å; T192-K284 PolarHBondContact OG1-NZ 2.8Å
193	Q	91.8	Very high	92.7	Very high	97 Å²	97	46.6 Å²	46.6	45%	0.453	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	142.9	163.4	-177.1	178.6	4.1	0	0	108.9	I282 D283 K285	Q193-I282 CarbonylContact O-C 3.5Å; Q193-I282 WeakPolarHBondContact O-CA 3.36Å; Q193-D283 HydrophobicContact CB-CB 4.32Å; Q193-D283 PolarHBondContact N-O 2.59Å; Q193-D283 PolarHBondContact O-N 2.82Å; Q193-K285 HydrophobicContact CB-CD 4.43Å
194	W	95.4	Very high	92.2	Very high	59 Å²	59	44.2 Å²	44.2	22%	0.223	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	159.2	176.3	56.2	-91.9	0	0	0	111.2	L182 L185 Q186 M196 K281 I282	L182-W194 HydrophobicContact CD1-CH2 3.98Å; L182-W194 HydrophobicContact CD1-CZ3 4.14Å; L185-W194 HydrophobicContact CB-CD2 3.85Å; L185-W194 HydrophobicContact CB-CE3 4.24Å; L185-W194 HydrophobicContact CB-CG 4.06Å; L185-W194 HydrophobicContact CB-CZ2 4.48Å; L185-W194 HydrophobicContact CD1-CD2 4.44Å; L185-W194 HydrophobicContact CD1-CE3 4.11Å; L185-W194 HydrophobicContact CD2-CB 3.93Å; L185-W194 HydrophobicContact CD2-CG 4.1Å; L185-W194 PolarHBondContact O-NE1 3.05Å; L185-W194 VanDerWaalsContact O-NE1 3.12Å; Q186-W194 HydrophobicContact CG-CH2 4.3Å; Q186-W194 HydrophobicContact CG-CZ2 3.81Å; W194-M196 HydrophobicContact CE3-CB 4.39Å; W194-M196 HydrophobicContact CZ3-CB 4.25Å; W194-K281 CarbonylContact C-O 3.55Å; W194-K281 WeakPolarHBondContact CA-O 3.42Å; W194-I282 HydrophobicContact CB-CG1 4.4Å
195	S	95.7	Very high	91.3	Very high	45 Å²	45	42.7 Å²	42.7	32%	0.315	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	139.9	165.5	71.5	0	0	0	0	109.4	V280 K281	S195-V280 WeakPolarHBondContact O-CA 3.48Å; S195-K281 PolarHBondContact N-O 3.26Å; S195-K281 PolarHBondContact O-N 3.03Å; S195-K281 WeakPolarHBondContact OG-CB 3.36Å
196	M	97.3	Very high	90.5	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.01	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	131.3	178.1	-176	177.1	172.1	0	0	108.9	C178 L181 L182 L185 W194 I198 P240 V241 I247 V278 K279 V280	C178-M196 HydrophobicContact CB-CE 4.39Å; L181-M196 HydrophobicContact CD2-CE 4.16Å; L182-M196 HydrophobicContact CD1-SD 3.94Å; L185-M196 HydrophobicContact CD1-CB 4.49Å; L185-M196 HydrophobicContact CD1-SD 4.34Å; W194-M196 HydrophobicContact CE3-CB 4.39Å; W194-M196 HydrophobicContact CZ3-CB 4.25Å; M196-I198 HydrophobicContact CE-CD1 4.3Å; M196-P240 WeakPolarHBondContact O-CA 3.3Å; M196-V241 HydrophobicContact CB-CG2 4.05Å; M196-V241 HydrophobicContact CE-CG2 4.29Å; M196-V241 HydrophobicContact CG-CG2 3.69Å; M196-V241 PolarHBondContact O-N 3.36Å; M196-V241 HydrophobicContact SD-CG2 3.98Å; M196-I247 HydrophobicContact CE-CD1 3.66Å; M196-I247 HydrophobicContact SD-CD1 4.33Å; M196-V278 HydrophobicContact CE-CB 4.47Å; M196-V278 HydrophobicContact CE-CG1 3.37Å; M196-V278 HydrophobicContact CE-CG2 4.27Å; M196-V278 HydrophobicContact CG-CG1 3.88Å; M196-V278 HydrophobicContact SD-CG1 4.29Å; M196-K279 CarbonylContact C-O 3.59Å; M196-K279 WeakPolarHBondContact CA-O 3.3Å; M196-V280 HydrophobicContact CG-CG2 4.3Å
197	E	97.6	Very high	90	Very high	73 Å²	73	47.5 Å²	47.5	34%	0.341	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	136.3	-173.3	-78.8	174.3	-172.7	0	0	109.5	V238 V239 V278 K279	E197-V238 HydrophobicContact CB-CG1 3.56Å; E197-V238 HydrophobicContact CG-CG1 3.83Å; E197-V238 WeakPolarHBondContact OE2-CG1 3.43Å; E197-V239 CarbonylContact C-O 3.56Å; E197-V239 WeakPolarHBondContact CA-O 3.32Å; E197-V278 CarbonylContact O-C 3.55Å; E197-V278 WeakPolarHBondContact O-CA 3.08Å; E197-K279 HydrophobicContact CB-CB 4.23Å; E197-K279 PolarHBondContact N-O 2.86Å; E197-K279 PolarHBondContact O-N 3.36Å
198	I	97.9	Very high	89.9	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	138.8	-178.1	-62	-173.3	0	0	0	110.7	M196 V238 V239 V241 I247 L250 F276 T277 V278	M196-I198 HydrophobicContact CE-CD1 4.3Å; I198-V238 WeakPolarHBondContact O-CA 3.17Å; I198-V239 PolarHBondContact N-O 2.95Å; I198-V239 PolarHBondContact O-N 3.47Å; I198-V241 HydrophobicContact CD1-CG1 4.13Å; I198-V241 HydrophobicContact CD1-CG2 3.81Å; I198-V241 HydrophobicContact CG1-CG1 4.35Å; I198-V241 HydrophobicContact CG1-CG2 3.88Å; I198-I247 HydrophobicContact CD1-CB 4.2Å; I198-I247 HydrophobicContact CD1-CD1 4.08Å; I198-I247 HydrophobicContact CD1-CG1 3.71Å; I198-I247 HydrophobicContact CD1-CG2 3.74Å; I198-L250 HydrophobicContact CB-CD1 4.29Å; I198-L250 HydrophobicContact CG2-CD1 4.39Å; I198-F276 HydrophobicContact CD1-CE1 4.38Å; I198-F276 HydrophobicContact CD1-CZ 3.95Å; I198-F276 HydrophobicContact CG2-CD2 4.5Å; I198-F276 HydrophobicContact CG2-CE1 4.16Å; I198-F276 HydrophobicContact CG2-CE2 3.75Å; I198-F276 HydrophobicContact CG2-CZ 3.57Å; I198-T277 WeakPolarHBondContact CA-O 3.22Å; I198-V278 HydrophobicContact CD1-CG2 4.44Å; I198-V278 HydrophobicContact CG1-CG2 4.25Å
199	S	96.5	Very high	89.9	Confident	10 Å²	10	45.6 Å²	45.6	7%	0.07	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	148.9	165.9	68.1	0	0	0	0	110.9	S237 T277	S199-S237 WeakPolarHBondContact CB-O 3.44Å; S199-T277 PolarHBondContact N-O 2.95Å; S199-T277 PolarHBondContact O-N 2.67Å; S199-T277 WeakPolarHBondContact OG-CB 3.26Å
200	F	96.8	Very high	90.4	Very high	1 Å²	1	44.7 Å²	44.7	0%	0.004	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	106.7	-175.4	-156.4	178.9	0	0	0	110.5	F165 L211 L212 V274 F276	F165-F200 HydrophobicContact CE1-CE1 4.39Å; F165-F200 HydrophobicContact CE1-CE2 4.03Å; F165-F200 AromaticContact CE1-CZ 3.48Å; F165-F200 HydrophobicContact CE1-CZ 3.48Å; F165-F200 VanDerWaalsContact CE1-CZ 3.48Å; F165-F200 AromaticContact CZ-CE2 3.8Å; F165-F200 HydrophobicContact CZ-CE2 3.8Å; F165-F200 AromaticContact CZ-CZ 3.61Å; F165-F200 HydrophobicContact CZ-CZ 3.61Å; F200-L211 HydrophobicContact CB-CB 4.19Å; F200-L211 HydrophobicContact CD1-CB 4.17Å; F200-L211 HydrophobicContact CD1-CD1 4.38Å; F200-L211 HydrophobicContact CD2-CD1 3.81Å; F200-L211 HydrophobicContact CE1-CD1 4.41Å; F200-L211 HydrophobicContact CE2-CD1 3.91Å; F200-L211 HydrophobicContact CG-CB 4.04Å; F200-L211 HydrophobicContact CG-CD1 4.08Å; F200-L211 HydrophobicContact CZ-CD1 4.17Å; F200-L211 WeakPolarHBondContact O-CB 3.28Å; F200-L211 PolarHBondContact O-N 2.82Å; F200-L212 HydrophobicContact CB-CD1 4.18Å; F200-L212 HydrophobicContact CB-CD2 3.65Å; F200-L212 HydrophobicContact CB-CG 3.71Å; F200-L212 HydrophobicContact CD1-CD2 4.01Å; F200-L212 HydrophobicContact CG-CD2 4.37Å; F200-V274 HydrophobicContact CD2-CG1 3.84Å; F200-V274 HydrophobicContact CE2-CG1 3.2Å; F200-V274 HydrophobicContact CZ-CG1 4.13Å; F200-F276 HydrophobicContact CB-CD2 4.45Å; F200-F276 HydrophobicContact CD1-CD2 4.09Å; F200-F276 HydrophobicContact CD1-CE2 4.36Å; F200-F276 HydrophobicContact CD2-CB 4.2Å; F200-F276 AromaticContact CD2-CD2 3.77Å; F200-F276 HydrophobicContact CD2-CD2 3.77Å; F200-F276 HydrophobicContact CD2-CG 4.48Å; F200-F276 HydrophobicContact CE1-CD2 4.24Å; F200-F276 HydrophobicContact CE2-CB 4.16Å; F200-F276 AromaticContact CE2-CD2 3.86Å; F200-F276 HydrophobicContact CE2-CD2 3.86Å; F200-F276 AromaticContact CG-CD2 3.87Å; F200-F276 HydrophobicContact CG-CD2 3.87Å; F200-F276 HydrophobicContact CG-CE2 4.46Å; F200-F276 HydrophobicContact CZ-CD2 4.15Å
201	L	95.6	Very high	90.9	Very high	4 Å²	4	38.5 Å²	38.5	2%	0.021	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	132.4	-169.6	-179.4	77.8	0	0	0	110.9	M203 L208 R209 L221 V233 L236 V274 L275 L375	L201-M203 HydrophobicContact CD2-CG 4.35Å; L201-L208 HydrophobicContact CD1-CB 4.2Å; L201-L208 HydrophobicContact CD2-CD2 4.37Å; L201-R209 WeakPolarHBondContact CD1-O 2.91Å; L201-L221 HydrophobicContact CD1-CD1 3.69Å; L201-V233 HydrophobicContact CD2-CG2 4.14Å; L201-L236 HydrophobicContact CB-CD1 4.24Å; L201-L236 HydrophobicContact CB-CD2 4.35Å; L201-L236 HydrophobicContact CD1-CD1 3.8Å; L201-L236 HydrophobicContact CD1-CD2 4.43Å; L201-V274 CarbonylContact O-C 3.5Å; L201-V274 WeakPolarHBondContact O-CA 3.43Å; L201-L275 HydrophobicContact CB-CB 4.33Å; L201-L275 PolarHBondContact N-O 3.15Å; L201-L275 PolarHBondContact O-N 3.28Å; L201-L375 HydrophobicContact CD2-CD1 3.49Å; L201-L375 VanDerWaalsContact CD2-CD1 3.49Å
202	E	93	Very high	91.5	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.009	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	137.7	165.8	-174.9	-176	-131.5	0	0	110.2	R209 L211 R268 S272 H273 V274	E202-R209 HydrophobicContact CB-CB 4.47Å; E202-R209 PolarHBondContact N-O 3.24Å; E202-R209 PolarHBondContact O-N 2.7Å; E202-L211 HydrophobicContact CB-CD1 4.03Å; E202-L211 HydrophobicContact CB-CD2 3.93Å; E202-L211 HydrophobicContact CB-CG 3.89Å; E202-R268 IonicContact OE1-NE 3.19Å; E202-R268 IonicContact OE2-CZ 3.88Å; E202-R268 IonicContact OE2-NE 3.59Å; E202-R268 PolarHBondContact OE2-NE 3.45Å; E202-R268 IonicContact OE2-NH2 3.42Å; E202-R268 PolarHBondContact OE2-NH2 3Å; E202-S272 VanDerWaalsContact OE1-CB 3.23Å; E202-S272 WeakPolarHBondContact OE1-CB 3.49Å; E202-S272 PolarHBondContact OE1-OG 2.66Å; E202-H273 CarbonylContact C-O 3.45Å; E202-V274 HydrophobicContact CB-CG2 4.49Å; E202-V274 HydrophobicContact CG-CG2 4.3Å
203	M	89	Confident	91.4	Very high	6 Å²	6	37 Å²	37	3%	0.03	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	119.1	166.5	-58.7	-163.3	-72	0	0	110.4	L201 K207 L208 S272 H273 L275 C371 L372 L375	L201-M203 HydrophobicContact CD2-CG 4.35Å; M203-K207 WeakPolarHBondContact CA-O 3.04Å; M203-L208 HydrophobicContact CB-CD2 4.32Å; M203-L208 HydrophobicContact CG-CD2 3.36Å; M203-L208 HydrophobicContact SD-CD2 3.52Å; M203-L208 VanDerWaalsContact SD-CD2 3.52Å; M203-S272 CarbonylContact O-C 3.57Å; M203-S272 VanDerWaalsContact O-CA 3.28Å; M203-S272 WeakPolarHBondContact O-CA 3.24Å; M203-S272 WeakPolarHBondContact O-CB 3.48Å; M203-H273 HydrophobicContact CB-CB 4.33Å; M203-H273 HydrophobicContact CE-CB 4.06Å; M203-H273 PolarHBondContact N-O 2.89Å; M203-H273 PolarHBondContact O-N 2.88Å; M203-L275 HydrophobicContact CE-CD1 3.5Å; M203-C371 HydrophobicContact SD-CB 3.82Å; M203-L372 HydrophobicContact CE-CB 3.68Å; M203-L372 HydrophobicContact CE-CD1 3.32Å; M203-L372 HydrophobicContact CE-CG 4.08Å; M203-L375 HydrophobicContact CE-CD1 4.05Å; M203-L375 HydrophobicContact CG-CD1 4.43Å; M203-L375 HydrophobicContact SD-CD1 3.41Å; M203-L375 WeakPolarHBondContact SD-CD1 3.17Å; M203-L375 HydrophobicContact SD-CG 4.44Å
204	Y	85.5	Confident	90.9	Very high	29 Å²	29	34.8 Å²	34.8	11%	0.114	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	124	177.3	177.5	-107.3	0	0	0	109.3	E206 K207 R268 R271 E321	Y204-E206 VanDerWaalsContact C-N 3.33Å; Y204-E206 PolarHBondContact O-N 3.02Å; Y204-K207 PolarHBondContact N-O 3.27Å; Y204-K207 WeakPolarHBondContact O-CB 3.44Å; Y204-K207 PolarHBondContact O-N 2.8Å; Y204-R268 HydrophobicContact CD2-CG 4.14Å; Y204-R268 HydrophobicContact CE2-CG 4.15Å; Y204-R268 HydrophobicContact CG-CG 4.47Å; Y204-R271 HydrophobicContact CD2-CB 4.36Å; Y204-R271 HydrophobicContact CE2-CB 3.92Å; Y204-E321 PolarHBondContact OH-OE1 3.32Å
205	N	79	Confident	90	Very high	73 Å²	73	37.6 Å²	37.6	39%	0.39	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	48.8	-179.7	-171.3	16.6	0	0	0	112.9	K207 S324	N205-K207 PolarHBondContact O-N 3.14Å; N205-S324 WeakPolarHBondContact OD1-CB 3.07Å; N205-S324 PolarHBondContact OD1-OG 3.19Å
206	E	78.1	Confident	89	Confident	44 Å²	44	44.3 Å²	44.3	21%	0.206	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	57	13	-177.1	-59.4	-60	146	0	0	115.4	Y204 K369 C371	Y204-E206 VanDerWaalsContact C-N 3.33Å; Y204-E206 PolarHBondContact O-N 3.02Å; E206-K369 WeakPolarHBondContact CG-O 3.46Å; E206-C371 VanDerWaalsContact OE2-CB 3.31Å; E206-C371 WeakPolarHBondContact OE2-CB 3.4Å; E206-C371 PolarHBondContact OE2-N 2.61Å; E206-C371 PolarHBondContact OE2-SG 2.91Å
207	K	83.7	Confident	88.1	Confident	154 Å²	154	49.9 Å²	49.9	67%	0.67	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	140.2	170.1	-64.5	-174.9	180	-176.7	0	109.8	M203 Y204 N205	M203-K207 WeakPolarHBondContact CA-O 3.04Å; Y204-K207 PolarHBondContact N-O 3.27Å; Y204-K207 WeakPolarHBondContact O-CB 3.44Å; Y204-K207 PolarHBondContact O-N 2.8Å; N205-K207 PolarHBondContact O-N 3.14Å
208	L	89.7	Confident	87.1	Confident	25 Å²	25	48.3 Å²	48.3	13%	0.131	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	138.6	179.1	-60	-171.2	0	0	0	109.7	L201 M203 L221 I223 V233 C371 L375	L201-L208 HydrophobicContact CD1-CB 4.2Å; L201-L208 HydrophobicContact CD2-CD2 4.37Å; M203-L208 HydrophobicContact CB-CD2 4.32Å; M203-L208 HydrophobicContact CG-CD2 3.36Å; M203-L208 HydrophobicContact SD-CD2 3.52Å; M203-L208 VanDerWaalsContact SD-CD2 3.52Å; L208-L221 HydrophobicContact CB-CB 3.73Å; L208-L221 HydrophobicContact CB-CD1 3.88Å; L208-L221 HydrophobicContact CB-CG 4.42Å; L208-L221 HydrophobicContact CD1-CB 4.16Å; L208-I223 HydrophobicContact CD1-CD1 4.22Å; L208-I223 HydrophobicContact CD1-CG1 3.65Å; L208-V233 HydrophobicContact CD1-CG1 3.83Å; L208-V233 HydrophobicContact CD1-CG2 4.25Å; L208-C371 HydrophobicContact CD2-CB 4.23Å; L208-L375 HydrophobicContact CD2-CD1 4.46Å
209	R	89.5	Confident	86.3	Confident	72 Å²	72	51.1 Å²	51.1	27%	0.272	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	143.1	167.7	-73.5	-153.5	-134.7	-96.1	25.5	111.4	L201 E202 E215	L201-R209 WeakPolarHBondContact CD1-O 2.91Å; E202-R209 HydrophobicContact CB-CB 4.47Å; E202-R209 PolarHBondContact N-O 3.24Å; E202-R209 PolarHBondContact O-N 2.7Å; R209-E215 IonicContact CZ-OE1 3.63Å; R209-E215 IonicContact CZ-OE2 3.34Å; R209-E215 VanDerWaalsContact CZ-OE2 3.27Å; R209-E215 IonicContact NE-OE2 3.87Å; R209-E215 VanDerWaalsContact NH1-CD 3.28Å; R209-E215 IonicContact NH1-OE1 3.44Å; R209-E215 PolarHBondContact NH1-OE1 3.21Å; R209-E215 IonicContact NH1-OE2 3.94Å; R209-E215 IonicContact NH2-OE1 3.61Å; R209-E215 PolarHBondContact NH2-OE1 2.64Å; R209-E215 IonicContact NH2-OE2 2.97Å; R209-E215 PolarHBondContact NH2-OE2 2.88Å
210	D	93.6	Very high	85.6	Confident	7 Å²	7	54.8 Å²	54.8	4%	0.037	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	120.3	169.6	-167.5	-26.7	0	0	0	109.3	L212 I213 L221 L236 S237	D210-L212 VanDerWaalsContact C-N 3.29Å; D210-L212 WeakPolarHBondContact OD1-CA 3.4Å; D210-L212 WeakPolarHBondContact OD1-CB 3.29Å; D210-L212 PolarHBondContact OD1-N 2.87Å; D210-I213 HydrophobicContact CB-CB 4.41Å; D210-L221 HydrophobicContact CB-CD1 4.23Å; D210-L236 HydrophobicContact CB-CD1 4.06Å; D210-S237 PolarHBondContact OD1-OG 3.48Å; D210-S237 VanDerWaalsContact OD1-OG 3.07Å; D210-S237 WeakPolarHBondContact OD2-CA 3.3Å; D210-S237 WeakPolarHBondContact OD2-CB 3.38Å; D210-S237 PolarHBondContact OD2-N 3.04Å; D210-S237 PolarHBondContact OD2-OG 3.41Å
211	L	93.7	Very high	85.2	Confident	8 Å²	8	55.9 Å²	55.9	4%	0.042	30%	0.296	C	S	.	.	S	Bend	trans	-79.6	-12.7	177.9	-69.4	174.9	0	0	0	112.4	F200 E202 R257 R258 V274	F200-L211 HydrophobicContact CB-CB 4.19Å; F200-L211 HydrophobicContact CD1-CB 4.17Å; F200-L211 HydrophobicContact CD1-CD1 4.38Å; F200-L211 HydrophobicContact CD2-CD1 3.81Å; F200-L211 HydrophobicContact CE1-CD1 4.41Å; F200-L211 HydrophobicContact CE2-CD1 3.91Å; F200-L211 HydrophobicContact CG-CB 4.04Å; F200-L211 HydrophobicContact CG-CD1 4.08Å; F200-L211 HydrophobicContact CZ-CD1 4.17Å; F200-L211 WeakPolarHBondContact O-CB 3.28Å; F200-L211 PolarHBondContact O-N 2.82Å; E202-L211 HydrophobicContact CB-CD1 4.03Å; E202-L211 HydrophobicContact CB-CD2 3.93Å; E202-L211 HydrophobicContact CB-CG 3.89Å; L211-R257 WeakPolarHBondContact O-CD 3.49Å; L211-R257 PolarHBondContact O-NH1 2.96Å; L211-R258 HydrophobicContact CD2-CB 4.37Å; L211-V274 HydrophobicContact CD1-CG1 4.13Å; L211-V274 HydrophobicContact CD1-CG2 4.44Å
212	L	92.7	Very high	84.7	Confident	22 Å²	22	61.9 Å²	61.9	12%	0.115	32%	0.321	C	S	.	.	S	Bend	trans	-92.1	-9.3	178.3	-51.7	-177.6	0	0	0	113.2	F200 D210 S237 V239 L250 R257	F200-L212 HydrophobicContact CB-CD1 4.18Å; F200-L212 HydrophobicContact CB-CD2 3.65Å; F200-L212 HydrophobicContact CB-CG 3.71Å; F200-L212 HydrophobicContact CD1-CD2 4.01Å; F200-L212 HydrophobicContact CG-CD2 4.37Å; D210-L212 VanDerWaalsContact C-N 3.29Å; D210-L212 WeakPolarHBondContact OD1-CA 3.4Å; D210-L212 WeakPolarHBondContact OD1-CB 3.29Å; D210-L212 PolarHBondContact OD1-N 2.87Å; L212-S237 WeakPolarHBondContact CB-OG 3.1Å; L212-V239 HydrophobicContact CD1-CG2 3.76Å; L212-L250 HydrophobicContact CD1-CD2 4.34Å; L212-L250 HydrophobicContact CD2-CB 4.25Å; L212-L250 HydrophobicContact CD2-CD2 3.95Å; L212-R257 PolarHBondContact O-NH1 2.96Å
213	I	87.6	Confident	84.2	Confident	43 Å²	43	63 Å²	63	22%	0.221	33%	0.327	C	S	.	.	S	Bend	trans	-112.8	138.9	171.6	-56.2	176.7	0	0	0	111.4	D210 N217 R257	D210-I213 HydrophobicContact CB-CB 4.41Å; I213-N217 HydrophobicContact CG2-CB 4.04Å; I213-R257 VanDerWaalsContact CA-NH1 3.31Å; I213-R257 PolarHBondContact O-NH1 2.78Å
214	P	81.1	Confident	83.8	Confident	51 Å²	51	68.6 Å²	68.6	33%	0.331	35%	0.348	S	S	.	.			trans	-59.1	145.3	171.5	-20.8	31.1	0	0	0	112.5	E216 N217 A218	P214-E216 PolarHBondContact O-N 2.8Å; P214-N217 PolarHBondContact O-N 2.76Å; P214-A218 PolarHBondContact O-N 3.33Å
215	E	75.9	Confident	83	Confident	119 Å²	119	71.5 Å²	71.5	56%	0.556	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-58.8	-34	-175.3	-172.6	165.3	175.2	0	0	113.1	R209 N217 A218	R209-E215 IonicContact CZ-OE1 3.63Å; R209-E215 IonicContact CZ-OE2 3.34Å; R209-E215 VanDerWaalsContact CZ-OE2 3.27Å; R209-E215 IonicContact NE-OE2 3.87Å; R209-E215 VanDerWaalsContact NH1-CD 3.28Å; R209-E215 IonicContact NH1-OE1 3.44Å; R209-E215 PolarHBondContact NH1-OE1 3.21Å; R209-E215 IonicContact NH1-OE2 3.94Å; R209-E215 IonicContact NH2-OE1 3.61Å; R209-E215 PolarHBondContact NH2-OE1 2.64Å; R209-E215 IonicContact NH2-OE2 2.97Å; R209-E215 PolarHBondContact NH2-OE2 2.88Å; E215-N217 PolarHBondContact O-N 2.87Å; E215-A218 WeakPolarHBondContact O-CB 3.41Å; E215-A218 PolarHBondContact O-N 2.64Å
216	E	75.8	Confident	82.2	Confident	186 Å²	186	74.7 Å²	74.7	87%	0.869	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-60.7	-31.1	177.4	-65	163.2	-158.5	0	0	113.2	P214	P214-E216 PolarHBondContact O-N 2.8Å
217	N	77.5	Confident	81.3	Confident	118 Å²	118	78 Å²	78	63%	0.631	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-107.2	7	-178.2	-63.7	-35.6	0	0	0	112.2	I213 P214 E215 P219	I213-N217 HydrophobicContact CG2-CB 4.04Å; P214-N217 PolarHBondContact O-N 2.76Å; E215-N217 PolarHBondContact O-N 2.87Å; N217-P219 WeakPolarHBondContact O-CD 3.36Å
218	A	77.9	Confident	80.1	Confident	40 Å²	40	74.7 Å²	74.7	33%	0.331	41%	0.408	S	S	.	.			trans	-74.7	122.2	-169.7	0	0	0	0	0	111.4	P214 E215	P214-A218 PolarHBondContact O-N 3.33Å; E215-A218 WeakPolarHBondContact O-CB 3.41Å; E215-A218 PolarHBondContact O-N 2.64Å
219	P	80.7	Confident	78.7	Confident	59 Å²	59	80 Å²	80	38%	0.383	44%	0.436	S	S	.	.			trans	-70.1	156.9	175.1	29.5	-34.4	0	0	0	111.6	N217 L221 G235	N217-P219 WeakPolarHBondContact O-CD 3.36Å; P219-L221 HydrophobicContact CG-CD2 4.27Å; P219-L221 PolarHBondContact O-N 3.06Å; P219-L221 VanDerWaalsContact O-N 3.08Å; P219-G235 WeakPolarHBondContact CG-O 3.43Å
220	A	80.6	Confident	77.7	Confident	88 Å²	88	77.4 Å²	77.4	73%	0.727	43%	0.432	S	S	*	.			trans	-70.6	104.1	173	0	0	0	0	0	110.9
221	L	89.4	Confident	76.8	Confident	24 Å²	24	78.6 Å²	78.6	13%	0.126	44%	0.44	C	S	.	.			trans	-75.7	136.4	-178.9	-59.8	-176	0	0	0	112.4	L201 L208 D210 P219 V233 G235 L236	L201-L221 HydrophobicContact CD1-CD1 3.69Å; L208-L221 HydrophobicContact CB-CB 3.73Å; L208-L221 HydrophobicContact CB-CD1 3.88Å; L208-L221 HydrophobicContact CB-CG 4.42Å; L208-L221 HydrophobicContact CD1-CB 4.16Å; D210-L221 HydrophobicContact CB-CD1 4.23Å; P219-L221 HydrophobicContact CG-CD2 4.27Å; P219-L221 PolarHBondContact O-N 3.06Å; P219-L221 VanDerWaalsContact O-N 3.08Å; L221-V233 HydrophobicContact CB-CG1 3.84Å; L221-V233 HydrophobicContact CD1-CG1 4.27Å; L221-V233 HydrophobicContact CD2-CG1 4.25Å; L221-V233 HydrophobicContact CG-CG1 4.36Å; L221-G235 VanDerWaalsContact CD2-O 3.28Å; L221-G235 WeakPolarHBondContact CD2-O 3.38Å; L221-L236 HydrophobicContact CD1-CD1 4.39Å; L221-L236 HydrophobicContact CD2-CB 4.36Å
222	K	84.7	Confident	76.3	Confident	129 Å²	129	81.9 Å²	81.9	56%	0.561	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.7	133.8	177.3	-68	-178.7	-178.2	175.7	0	111.6	R224 Q234	K222-R224 PolarHBondContact O-N 3.46Å; K222-Q234 PolarHBondContact N-O 3.27Å; K222-Q234 PolarHBondContact O-N 3.1Å
223	I	82.2	Confident	76.1	Confident	26 Å²	26	81.8 Å²	81.8	13%	0.133	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	123.1	172.9	-52.3	-179.4	0	0	0	109	L208 V231 F232 C371 R374 L375	L208-I223 HydrophobicContact CD1-CD1 4.22Å; L208-I223 HydrophobicContact CD1-CG1 3.65Å; I223-V231 HydrophobicContact CG2-CG1 3.3Å; I223-F232 WeakPolarHBondContact CA-O 3.48Å; I223-C371 HydrophobicContact CD1-CB 3.65Å; I223-R374 HydrophobicContact CD1-CB 4.35Å; I223-R374 HydrophobicContact CG2-CB 4.4Å; I223-R374 PolarHBondContact O-NH2 3.43Å; I223-L375 HydrophobicContact CD1-CD1 4.45Å; I223-L375 HydrophobicContact CD1-CD2 3.87Å; I223-L375 HydrophobicContact CD1-CG 3.88Å; I223-L375 HydrophobicContact CG1-CD2 4.03Å; I223-L375 HydrophobicContact CG2-CD2 4.14Å
224	R	80.1	Confident	76	Confident	123 Å²	123	83.3 Å²	83.3	46%	0.464	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	155.8	174.5	-67	-167.2	-179.6	-158	-0.4	109.9	K222 V231 F232 Q234	K222-R224 PolarHBondContact O-N 3.46Å; R224-V231 WeakPolarHBondContact O-CA 3.47Å; R224-F232 HydrophobicContact CB-CD1 4.26Å; R224-F232 HydrophobicContact CB-CE1 3.58Å; R224-F232 HydrophobicContact CB-CE2 4.3Å; R224-F232 HydrophobicContact CB-CZ 3.64Å; R224-F232 HydrophobicContact CG-CZ 4.45Å; R224-F232 PolarHBondContact N-O 3.03Å; R224-F232 WeakPolarHBondContact O-CD1 3.48Å; R224-F232 PolarHBondContact O-N 3.05Å; R224-F232 VanDerWaalsContact O-O 3.13Å; R224-Q234 HydrophobicContact CG-CB 4.35Å; R224-Q234 VanDerWaalsContact CZ-CD 3.4Å; R224-Q234 VanDerWaalsContact NE-CD 3.33Å
225	D	69.5	Low	76.3	Confident	90 Å²	90	82.8 Å²	82.8	48%	0.481	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	126.2	174.9	-51.9	-21.7	0	0	0	106.7	V231 R374	D225-V231 WeakPolarHBondContact OD1-CG2 3.41Å; D225-R374 IonicContact OD1-CZ 3.76Å; D225-R374 IonicContact OD1-NH2 2.69Å; D225-R374 PolarHBondContact OD1-NH2 2.76Å; D225-R374 IonicContact OD2-NH2 3.67Å; D225-R374 PolarHBondContact OD2-NH2 2.91Å
226	Y	62.9	Low	77.1	Confident	141 Å²	141	78.5 Å²	78.5	55%	0.553	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.4	136.1	174.9	-162.2	-104.1	0	0	0	110.5	G228 D229 G230	Y226-G228 PolarHBondContact O-N 3.22Å; Y226-G228 VanDerWaalsContact O-N 3.17Å; Y226-D229 HydrophobicContact CD1-CB 4.26Å; Y226-D229 PolarHBondContact O-N 2.86Å; Y226-G230 PolarHBondContact N-O 3.07Å; Y226-G230 PolarHBondContact O-N 3.23Å
227	P	57.7	Low	77.9	Confident	114 Å²	114	70.8 Å²	70.8	74%	0.74	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	119.4	173.6	-21.2	32.6	0	0	0	110.8
228	G	58.7	Low	78.6	Confident	83 Å²	83	68.4 Å²	68.4	86%	0.856	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.9	-48.1	179.5	0	0	0	0	0	114.6	Y226	Y226-G228 PolarHBondContact O-N 3.22Å; Y226-G228 VanDerWaalsContact O-N 3.17Å
229	D	60.6	Low	79.5	Confident	136 Å²	136	68.7 Å²	68.7	73%	0.727	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-10.3	-176.6	-70	-29.6	0	0	0	114.2	Y226	Y226-D229 HydrophobicContact CD1-CB 4.26Å; Y226-D229 PolarHBondContact O-N 2.86Å
230	G	68.5	Low	80.3	Confident	19 Å²	19	70.5 Å²	70.5	20%	0.196	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	80	-152.3	178.3	0	0	0	0	0	113.1	Y226	Y226-G230 PolarHBondContact N-O 3.07Å; Y226-G230 PolarHBondContact O-N 3.23Å
231	V	75.5	Confident	80.9	Confident	31 Å²	31	66.4 Å²	66.4	19%	0.188	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	130.7	-177.2	-174.8	0	0	0	0	109.9	I223 R224 D225 R374 L375 K377	I223-V231 HydrophobicContact CG2-CG1 3.3Å; R224-V231 WeakPolarHBondContact O-CA 3.47Å; D225-V231 WeakPolarHBondContact OD1-CG2 3.41Å; V231-R374 WeakPolarHBondContact CG1-O 3.2Å; V231-L375 HydrophobicContact CG1-CD2 4.36Å; V231-K377 HydrophobicContact CG2-CB 4.23Å; V231-K377 HydrophobicContact CG2-CD 3.85Å
232	F	83	Confident	81	Confident	78 Å²	78	72 Å²	72	34%	0.342	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	163.7	178.1	72.3	-75.6	0	0	0	111.8	I223 R224 Q234	I223-F232 WeakPolarHBondContact CA-O 3.48Å; R224-F232 HydrophobicContact CB-CD1 4.26Å; R224-F232 HydrophobicContact CB-CE1 3.58Å; R224-F232 HydrophobicContact CB-CE2 4.3Å; R224-F232 HydrophobicContact CB-CZ 3.64Å; R224-F232 HydrophobicContact CG-CZ 4.45Å; R224-F232 PolarHBondContact N-O 3.03Å; R224-F232 WeakPolarHBondContact O-CD1 3.48Å; R224-F232 PolarHBondContact O-N 3.05Å; R224-F232 VanDerWaalsContact O-O 3.13Å; F232-Q234 HydrophobicContact CE2-CB 4.4Å
233	V	87.9	Confident	81.4	Confident	19 Å²	19	73.6 Å²	73.6	12%	0.115	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	111	178.3	-175.2	0	0	0	0	109	L201 L208 L221 G235 L236 L375	L201-V233 HydrophobicContact CD2-CG2 4.14Å; L208-V233 HydrophobicContact CD1-CG1 3.83Å; L208-V233 HydrophobicContact CD1-CG2 4.25Å; L221-V233 HydrophobicContact CB-CG1 3.84Å; L221-V233 HydrophobicContact CD1-CG1 4.27Å; L221-V233 HydrophobicContact CD2-CG1 4.25Å; L221-V233 HydrophobicContact CG-CG1 4.36Å; V233-G235 PolarHBondContact O-N 2.81Å; V233-L236 HydrophobicContact CB-CB 3.85Å; V233-L236 HydrophobicContact CB-CD2 4.06Å; V233-L236 HydrophobicContact CG1-CB 3.88Å; V233-L236 HydrophobicContact CG2-CD2 4.43Å; V233-L236 PolarHBondContact O-N 3.13Å; V233-L375 HydrophobicContact CG2-CD1 4.49Å; V233-L375 HydrophobicContact CG2-CD2 3.53Å
234	Q	86.6	Confident	82	Confident	75 Å²	75	73.7 Å²	73.7	35%	0.35	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	130.6	174.1	-172.8	-171.3	25.5	0	0	109.9	K222 R224 F232 L236	K222-Q234 PolarHBondContact N-O 3.27Å; K222-Q234 PolarHBondContact O-N 3.1Å; R224-Q234 HydrophobicContact CG-CB 4.35Å; R224-Q234 VanDerWaalsContact CZ-CD 3.4Å; R224-Q234 VanDerWaalsContact NE-CD 3.33Å; F232-Q234 HydrophobicContact CE2-CB 4.4Å; Q234-L236 VanDerWaalsContact C-N 3.32Å
235	G	86.6	Confident	82.7	Confident	41 Å²	41	74 Å²	74	42%	0.423	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	-1.9	178.4	0	0	0	0	0	114.5	P219 L221 V233	P219-G235 WeakPolarHBondContact CG-O 3.43Å; L221-G235 VanDerWaalsContact CD2-O 3.28Å; L221-G235 WeakPolarHBondContact CD2-O 3.38Å; V233-G235 PolarHBondContact O-N 2.81Å
236	L	92.4	Very high	83.8	Confident	29 Å²	29	73.2 Å²	73.2	15%	0.152	41%	0.406	C	S	.	.			trans	-71.4	129.9	173.6	-179	63.2	0	0	0	109	L201 D210 L221 V233 Q234	L201-L236 HydrophobicContact CB-CD1 4.24Å; L201-L236 HydrophobicContact CB-CD2 4.35Å; L201-L236 HydrophobicContact CD1-CD1 3.8Å; L201-L236 HydrophobicContact CD1-CD2 4.43Å; D210-L236 HydrophobicContact CB-CD1 4.06Å; L221-L236 HydrophobicContact CD1-CD1 4.39Å; L221-L236 HydrophobicContact CD2-CB 4.36Å; V233-L236 HydrophobicContact CB-CB 3.85Å; V233-L236 HydrophobicContact CB-CD2 4.06Å; V233-L236 HydrophobicContact CG1-CB 3.88Å; V233-L236 HydrophobicContact CG2-CD2 4.43Å; V233-L236 PolarHBondContact O-N 3.13Å; Q234-L236 VanDerWaalsContact C-N 3.32Å
237	S	92.4	Very high	85.3	Confident	24 Å²	24	66.5 Å²	66.5	17%	0.168	38%	0.38	C	S	.	.			trans	-64.2	144.5	175	65.1	0	0	0	0	111.3	S199 D210 L212	S199-S237 WeakPolarHBondContact CB-O 3.44Å; D210-S237 PolarHBondContact OD1-OG 3.48Å; D210-S237 VanDerWaalsContact OD1-OG 3.07Å; D210-S237 WeakPolarHBondContact OD2-CA 3.3Å; D210-S237 WeakPolarHBondContact OD2-CB 3.38Å; D210-S237 PolarHBondContact OD2-N 3.04Å; D210-S237 PolarHBondContact OD2-OG 3.41Å; L212-S237 WeakPolarHBondContact CB-OG 3.1Å
238	V	93.4	Very high	87	Confident	67 Å²	67	64.9 Å²	64.9	41%	0.406	36%	0.363	S	S	.	.			trans	-132.7	112	177.6	-177.8	0	0	0	0	105.9	E197 I198	E197-V238 HydrophobicContact CB-CG1 3.56Å; E197-V238 HydrophobicContact CG-CG1 3.83Å; E197-V238 WeakPolarHBondContact OE2-CG1 3.43Å; I198-V238 WeakPolarHBondContact O-CA 3.17Å
239	V	95.8	Very high	88.6	Confident	46 Å²	46	62.9 Å²	62.9	28%	0.279	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	116.9	-174	-177.8	0	0	0	0	108.8	E197 I198 L212 V241 L250	E197-V239 CarbonylContact C-O 3.56Å; E197-V239 WeakPolarHBondContact CA-O 3.32Å; I198-V239 PolarHBondContact N-O 2.95Å; I198-V239 PolarHBondContact O-N 3.47Å; L212-V239 HydrophobicContact CD1-CG2 3.76Å; V239-V241 HydrophobicContact CG1-CG1 4.47Å; V239-L250 HydrophobicContact CB-CD1 4.11Å; V239-L250 HydrophobicContact CB-CD2 4.49Å; V239-L250 HydrophobicContact CG1-CD1 3.97Å; V239-L250 HydrophobicContact CG1-CD2 4.27Å; V239-L250 HydrophobicContact CG2-CD2 4.32Å
240	P	96.9	Very high	90.3	Very high	97 Å²	97	57.3 Å²	57.3	63%	0.63	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.6	139.4	171.9	29.2	-33.1	0	0	0	109.8	M196	M196-P240 WeakPolarHBondContact O-CA 3.3Å
241	V	93.6	Very high	91.5	Very high	3 Å²	3	57.3 Å²	57.3	2%	0.018	30%	0.303	C	S	.	.			trans	-131.9	136.9	-178.5	-66.3	0	0	0	0	110.8	M196 I198 V239 D246 I247 L250	M196-V241 HydrophobicContact CB-CG2 4.05Å; M196-V241 HydrophobicContact CE-CG2 4.29Å; M196-V241 HydrophobicContact CG-CG2 3.69Å; M196-V241 PolarHBondContact O-N 3.36Å; M196-V241 HydrophobicContact SD-CG2 3.98Å; I198-V241 HydrophobicContact CD1-CG1 4.13Å; I198-V241 HydrophobicContact CD1-CG2 3.81Å; I198-V241 HydrophobicContact CG1-CG1 4.35Å; I198-V241 HydrophobicContact CG1-CG2 3.88Å; V239-V241 HydrophobicContact CG1-CG1 4.47Å; V241-D246 HydrophobicContact CG1-CB 4.28Å; V241-I247 HydrophobicContact CB-CG1 3.98Å; V241-I247 HydrophobicContact CG1-CG1 4.12Å; V241-I247 HydrophobicContact CG2-CD1 4.04Å; V241-I247 HydrophobicContact CG2-CG1 3.94Å; V241-L250 HydrophobicContact CG1-CD1 3.71Å
242	E	91.7	Very high	92.2	Very high	140 Å²	140	61 Å²	61	65%	0.654	32%	0.318	S	S	*	.			trans	-121.7	-20.7	178.9	-64.5	-176.2	177.8	0	0	112.4	Q186	Q186-E242 PolarHBondContact NE2-O 3.31Å
243	R	93.5	Very high	92.6	Very high	164 Å²	164	60.8 Å²	60.8	62%	0.619	32%	0.32	S	S	*	.	S	Bend	trans	-123.8	152.3	-177.3	-57.9	-177.9	178.1	177.5	-0.5	111.3	L182 E245 D246	L182-R243 VanDerWaalsContact CD2-C 3.41Å; R243-E245 VanDerWaalsContact C-N 3.3Å; R243-E245 WeakPolarHBondContact CB-OE2 3.4Å; R243-E245 PolarHBondContact O-N 3.05Å; R243-D246 WeakPolarHBondContact CB-OD2 3.23Å; R243-D246 PolarHBondContact N-OD2 3.39Å; R243-D246 PolarHBondContact O-N 3.44Å
244	F	94.8	Very high	92.7	Very high	28 Å²	28	59.9 Å²	59.9	12%	0.123	32%	0.315	C	S	.	.	H	α-helix	trans	-70.7	-32.1	-178.5	175.9	-106.9	0	0	0	111.5	P175 K179 L182 D246 I247 Q248	P175-F244 HydrophobicContact CB-CE2 4.45Å; P175-F244 HydrophobicContact CB-CZ 4.26Å; P175-F244 VanDerWaalsContact O-CE2 3.3Å; P175-F244 WeakPolarHBondContact O-CE2 3.33Å; K179-F244 HydrophobicContact CB-CD2 3.66Å; K179-F244 HydrophobicContact CB-CE2 3.6Å; K179-F244 HydrophobicContact CB-CG 4.34Å; K179-F244 HydrophobicContact CB-CZ 4.21Å; K179-F244 HydrophobicContact CD-CD1 4.34Å; K179-F244 HydrophobicContact CD-CE1 4.21Å; K179-F244 HydrophobicContact CD-CE2 4.41Å; K179-F244 HydrophobicContact CD-CG 4.49Å; K179-F244 HydrophobicContact CD-CZ 4.24Å; K179-F244 HydrophobicContact CG-CD2 4.04Å; K179-F244 HydrophobicContact CG-CE2 4.24Å; K179-F244 HydrophobicContact CG-CG 4.21Å; L182-F244 HydrophobicContact CD2-CB 4.04Å; F244-D246 VanDerWaalsContact C-N 3.27Å; F244-D246 PolarHBondContact O-N 2.96Å; F244-I247 WeakPolarHBondContact O-CB 3.48Å; F244-I247 PolarHBondContact O-N 3Å; F244-I247 VanDerWaalsContact O-N 3.14Å; F244-Q248 PolarHBondContact O-N 3.27Å
245	E	94	Very high	92.8	Very high	129 Å²	129	57.8 Å²	57.8	60%	0.603	31%	0.308	S	S	*	.	H	α-helix	trans	-59.6	-38.6	177	-63.8	70	-152.3	0	0	111.3	R243 Q248 A249	R243-E245 VanDerWaalsContact C-N 3.3Å; R243-E245 WeakPolarHBondContact CB-OE2 3.4Å; R243-E245 PolarHBondContact O-N 3.05Å; E245-Q248 PolarHBondContact O-N 3.42Å; E245-A249 PolarHBondContact O-N 3.41Å
246	D	92.8	Very high	92.7	Very high	73 Å²	73	57.3 Å²	57.3	39%	0.39	30%	0.303	S	S	.	.	H	α-helix	trans	-63.3	-43.9	176	-54.8	-31	0	0	0	110.7	V241 R243 F244 Q248 A249 L250	V241-D246 HydrophobicContact CG1-CB 4.28Å; R243-D246 WeakPolarHBondContact CB-OD2 3.23Å; R243-D246 PolarHBondContact N-OD2 3.39Å; R243-D246 PolarHBondContact O-N 3.44Å; F244-D246 VanDerWaalsContact C-N 3.27Å; F244-D246 PolarHBondContact O-N 2.96Å; D246-Q248 VanDerWaalsContact C-N 3.33Å; D246-Q248 PolarHBondContact O-N 2.75Å; D246-A249 PolarHBondContact O-N 3.38Å; D246-L250 VanDerWaalsContact O-CG 3.3Å; D246-L250 WeakPolarHBondContact O-CG 3.29Å; D246-L250 PolarHBondContact O-N 3.44Å
247	I	94.7	Very high	92.4	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-63.3	-43	178.4	-56.3	178.8	0	0	0	110.3	C178 M196 I198 V241 F244 L250 I251 F276	C178-I247 HydrophobicContact CB-CD1 3.99Å; C178-I247 HydrophobicContact CB-CG2 3.92Å; M196-I247 HydrophobicContact CE-CD1 3.66Å; M196-I247 HydrophobicContact SD-CD1 4.33Å; I198-I247 HydrophobicContact CD1-CB 4.2Å; I198-I247 HydrophobicContact CD1-CD1 4.08Å; I198-I247 HydrophobicContact CD1-CG1 3.71Å; I198-I247 HydrophobicContact CD1-CG2 3.74Å; V241-I247 HydrophobicContact CB-CG1 3.98Å; V241-I247 HydrophobicContact CG1-CG1 4.12Å; V241-I247 HydrophobicContact CG2-CD1 4.04Å; V241-I247 HydrophobicContact CG2-CG1 3.94Å; F244-I247 WeakPolarHBondContact O-CB 3.48Å; F244-I247 PolarHBondContact O-N 3Å; F244-I247 VanDerWaalsContact O-N 3.14Å; I247-L250 PolarHBondContact O-N 3.44Å; I247-I251 HydrophobicContact CG2-CD1 4.07Å; I247-I251 WeakPolarHBondContact O-CG1 3.29Å; I247-I251 PolarHBondContact O-N 2.97Å; I247-F276 HydrophobicContact CG2-CZ 4.37Å
248	Q	93.1	Very high	92.1	Very high	81 Å²	81	59 Å²	59	38%	0.379	30%	0.304	S	S	.	.	H	α-helix	trans	-63.3	-43.4	177.9	-170.8	173	-36.5	0	0	111.3	F244 E245 D246 L250 I251 E252	F244-Q248 PolarHBondContact O-N 3.27Å; E245-Q248 PolarHBondContact O-N 3.42Å; D246-Q248 VanDerWaalsContact C-N 3.33Å; D246-Q248 PolarHBondContact O-N 2.75Å; Q248-L250 PolarHBondContact O-N 3.26Å; Q248-I251 PolarHBondContact O-N 3.03Å; Q248-E252 PolarHBondContact NE2-OE1 2.95Å; Q248-E252 WeakPolarHBondContact O-CG 3.28Å; Q248-E252 PolarHBondContact O-N 3.29Å
249	A	93.1	Very high	91.1	Very high	40 Å²	40	61 Å²	61	33%	0.331	31%	0.311	S	S	.	.	H	α-helix	trans	-60.7	-41.9	174.4	0	0	0	0	0	112.2	E245 D246 I251 E252 I253	E245-A249 PolarHBondContact O-N 3.41Å; D246-A249 PolarHBondContact O-N 3.38Å; A249-I251 VanDerWaalsContact C-N 3.35Å; A249-I251 PolarHBondContact O-N 3.49Å; A249-E252 PolarHBondContact O-N 2.93Å; A249-I253 WeakPolarHBondContact O-CB 3.46Å; A249-I253 WeakPolarHBondContact O-CD1 3.46Å; A249-I253 WeakPolarHBondContact O-CG1 3.09Å; A249-I253 PolarHBondContact O-N 3.14Å
250	L	95.7	Very high	89.2	Confident	20 Å²	20	63 Å²	63	11%	0.105	32%	0.323	C	S	.	.	H	α-helix	trans	-63.6	-39.1	176.1	-68.2	173	0	0	0	112.4	I198 L212 V239 V241 D246 I247 Q248 G254	I198-L250 HydrophobicContact CB-CD1 4.29Å; I198-L250 HydrophobicContact CG2-CD1 4.39Å; L212-L250 HydrophobicContact CD1-CD2 4.34Å; L212-L250 HydrophobicContact CD2-CB 4.25Å; L212-L250 HydrophobicContact CD2-CD2 3.95Å; V239-L250 HydrophobicContact CB-CD1 4.11Å; V239-L250 HydrophobicContact CB-CD2 4.49Å; V239-L250 HydrophobicContact CG1-CD1 3.97Å; V239-L250 HydrophobicContact CG1-CD2 4.27Å; V239-L250 HydrophobicContact CG2-CD2 4.32Å; V241-L250 HydrophobicContact CG1-CD1 3.71Å; D246-L250 VanDerWaalsContact O-CG 3.3Å; D246-L250 WeakPolarHBondContact O-CG 3.29Å; D246-L250 PolarHBondContact O-N 3.44Å; I247-L250 PolarHBondContact O-N 3.44Å; Q248-L250 PolarHBondContact O-N 3.26Å; L250-G254 PolarHBondContact O-N 3.31Å
251	I	94.2	Very high	87.2	Confident	18 Å²	18	59.1 Å²	59.1	9%	0.092	30%	0.3	C	S	.	.	H	α-helix	trans	-63	-47.6	174.2	-69	166.2	0	0	0	110.1	F165 I174 P175 I247 Q248 A249 G254 C255 F276	F165-I251 HydrophobicContact CD1-CG2 3.91Å; F165-I251 HydrophobicContact CE1-CG2 4.47Å; I174-I251 HydrophobicContact CG2-CD1 3.86Å; I174-I251 HydrophobicContact CG2-CG1 4.43Å; P175-I251 HydrophobicContact CB-CD1 4.31Å; I247-I251 HydrophobicContact CG2-CD1 4.07Å; I247-I251 WeakPolarHBondContact O-CG1 3.29Å; I247-I251 PolarHBondContact O-N 2.97Å; Q248-I251 PolarHBondContact O-N 3.03Å; A249-I251 VanDerWaalsContact C-N 3.35Å; A249-I251 PolarHBondContact O-N 3.49Å; I251-G254 PolarHBondContact O-N 3.32Å; I251-C255 WeakPolarHBondContact O-CB 3.2Å; I251-C255 PolarHBondContact O-N 2.85Å; I251-C255 PolarHBondContact O-SG 3.47Å; I251-F276 HydrophobicContact CD1-CZ 4.48Å; I251-F276 HydrophobicContact CG1-CE2 3.86Å; I251-F276 HydrophobicContact CG1-CZ 4.11Å
252	E	90.9	Very high	85.3	Confident	108 Å²	108	60 Å²	60	51%	0.505	31%	0.306	S	S	.	.	H	α-helix	trans	-61.9	-45.8	179.2	-72.6	172.3	-167.2	0	0	111.7	Q248 A249 G256	Q248-E252 PolarHBondContact NE2-OE1 2.95Å; Q248-E252 WeakPolarHBondContact O-CG 3.28Å; Q248-E252 PolarHBondContact O-N 3.29Å; A249-E252 PolarHBondContact O-N 2.93Å; E252-G256 PolarHBondContact O-N 3.38Å
253	I	91.1	Very high	83	Confident	74 Å²	74	58.7 Å²	58.7	38%	0.379	31%	0.307	S	S	.	.	H	α-helix	trans	-59.6	-51.9	176	-70.6	164.6	0	0	0	110.6	A249 G256 R257	A249-I253 WeakPolarHBondContact O-CB 3.46Å; A249-I253 WeakPolarHBondContact O-CD1 3.46Å; A249-I253 WeakPolarHBondContact O-CG1 3.09Å; A249-I253 PolarHBondContact O-N 3.14Å; I253-G256 PolarHBondContact O-N 3.23Å; I253-R257 WeakPolarHBondContact O-CB 3.36Å; I253-R257 WeakPolarHBondContact O-CG 3.39Å; I253-R257 PolarHBondContact O-N 3.3Å
254	G	89.6	Confident	80.9	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-68.6	-38.2	-176.2	0	0	0	0	0	112.9	L250 I251 R258	L250-G254 PolarHBondContact O-N 3.31Å; I251-G254 PolarHBondContact O-N 3.32Å; G254-R258 WeakPolarHBondContact O-CB 3.21Å; G254-R258 PolarHBondContact O-N 3.31Å
255	C	88.6	Confident	78.8	Confident	32 Å²	32	59.8 Å²	59.8	22%	0.216	33%	0.331	C	S	.	.	H	α-helix	trans	-67.2	-43.2	173.3	-67.9	0	0	0	0	111.6	I251 R257 R258 I259	I251-C255 WeakPolarHBondContact O-CB 3.2Å; I251-C255 PolarHBondContact O-N 2.85Å; I251-C255 PolarHBondContact O-SG 3.47Å; C255-R257 VanDerWaalsContact C-N 3.32Å; C255-R257 PolarHBondContact O-N 2.95Å; C255-R258 WeakPolarHBondContact O-CB 3.26Å; C255-R258 PolarHBondContact O-N 3.45Å; C255-I259 VanDerWaalsContact O-CG1 3.32Å; C255-I259 WeakPolarHBondContact O-CG1 3.25Å; C255-I259 PolarHBondContact O-N 3.47Å
256	G	85.5	Confident	76.7	Confident	31 Å²	31	60.5 Å²	60.5	32%	0.32	34%	0.339	S	S	.	.	H	α-helix	trans	-59.6	-41.7	176.4	0	0	0	0	0	112.2	E252 I253 I259 T260	E252-G256 PolarHBondContact O-N 3.38Å; I253-G256 PolarHBondContact O-N 3.23Å; G256-I259 PolarHBondContact O-N 2.98Å; G256-T260 WeakPolarHBondContact O-CB 3.49Å; G256-T260 PolarHBondContact O-N 3.33Å; G256-T260 PolarHBondContact O-OG1 3.42Å
257	R	86.3	Confident	75.1	Confident	78 Å²	78	59.6 Å²	59.6	29%	0.294	34%	0.338	S	S	.	.	H	α-helix	trans	-69.2	-37.8	175	-73.8	172.3	-179.6	171.5	6	112.9	L211 L212 I213 I253 C255 I259 T260 A261	L211-R257 WeakPolarHBondContact O-CD 3.49Å; L211-R257 PolarHBondContact O-NH1 2.96Å; L212-R257 PolarHBondContact O-NH1 2.96Å; I213-R257 VanDerWaalsContact CA-NH1 3.31Å; I213-R257 PolarHBondContact O-NH1 2.78Å; I253-R257 WeakPolarHBondContact O-CB 3.36Å; I253-R257 WeakPolarHBondContact O-CG 3.39Å; I253-R257 PolarHBondContact O-N 3.3Å; C255-R257 VanDerWaalsContact C-N 3.32Å; C255-R257 PolarHBondContact O-N 2.95Å; R257-I259 VanDerWaalsContact C-N 3.33Å; R257-I259 PolarHBondContact O-N 3.2Å; R257-T260 PolarHBondContact O-N 2.97Å; R257-A261 WeakPolarHBondContact O-CB 3.42Å; R257-A261 PolarHBondContact O-N 3.47Å
258	R	85.5	Confident	73.9	Confident	11 Å²	11	60.5 Å²	60.5	4%	0.042	34%	0.342	C	S	.	.	H	α-helix	trans	-59.8	-42.9	171.5	-171.7	-176.9	-179.7	-172.3	-2.3	111.3	L211 G254 C255 A261 C262 S269 V274 D306	L211-R258 HydrophobicContact CD2-CB 4.37Å; G254-R258 WeakPolarHBondContact O-CB 3.21Å; G254-R258 PolarHBondContact O-N 3.31Å; C255-R258 WeakPolarHBondContact O-CB 3.26Å; C255-R258 PolarHBondContact O-N 3.45Å; R258-A261 PolarHBondContact O-N 3.28Å; R258-C262 PolarHBondContact O-N 2.96Å; R258-C262 PolarHBondContact O-SG 3.25Å; R258-S269 PolarHBondContact NH2-O 3.39Å; R258-V274 VanDerWaalsContact CZ-CG2 3.5Å; R258-D306 IonicContact CZ-OD2 3.7Å; R258-D306 IonicContact NH1-OD2 2.66Å; R258-D306 PolarHBondContact NH1-OD2 2.98Å; R258-D306 IonicContact NH2-OD2 3.02Å; R258-D306 PolarHBondContact NH2-OD2 3.47Å
259	I	71.2	Confident	72.9	Confident	108 Å²	108	59.2 Å²	59.2	55%	0.554	34%	0.342	S	S	*	.	H	α-helix	trans	-67.2	-45.4	177.4	-67.4	165.1	0	0	0	111.4	C255 G256 R257 A261 C262 T263	C255-I259 VanDerWaalsContact O-CG1 3.32Å; C255-I259 WeakPolarHBondContact O-CG1 3.25Å; C255-I259 PolarHBondContact O-N 3.47Å; G256-I259 PolarHBondContact O-N 2.98Å; R257-I259 VanDerWaalsContact C-N 3.33Å; R257-I259 PolarHBondContact O-N 3.2Å; I259-A261 PolarHBondContact O-N 3.43Å; I259-C262 WeakPolarHBondContact O-CA 3.29Å; I259-C262 WeakPolarHBondContact O-CB 3.31Å; I259-C262 PolarHBondContact O-N 2.84Å; I259-T263 PolarHBondContact O-N 2.89Å; I259-T263 VanDerWaalsContact O-N 3.1Å
260	T	56.3	Low	72.2	Confident	88 Å²	88	58.5 Å²	58.5	54%	0.54	33%	0.334	S	S	.	.	H	α-helix	trans	-59.8	-35.7	178.3	-53	0	0	0	0	111.1	G256 R257 C262 T263 V264	G256-T260 WeakPolarHBondContact O-CB 3.49Å; G256-T260 PolarHBondContact O-N 3.33Å; G256-T260 PolarHBondContact O-OG1 3.42Å; R257-T260 PolarHBondContact O-N 2.97Å; T260-C262 VanDerWaalsContact C-N 3.26Å; T260-C262 PolarHBondContact O-N 3.43Å; T260-T263 PolarHBondContact O-N 3.5Å; T260-T263 PolarHBondContact O-OG1 2.86Å; T260-V264 WeakPolarHBondContact O-CG2 3.4Å; T260-V264 PolarHBondContact O-N 2.9Å
261	A	55.6	Low	71.5	Confident	16 Å²	16	58.7 Å²	58.7	13%	0.132	33%	0.333	C	S	.	.	H	α-helix	trans	-70	-20.4	172.7	0	0	0	0	0	113.6	R257 R258 I259 R268	R257-A261 WeakPolarHBondContact O-CB 3.42Å; R257-A261 PolarHBondContact O-N 3.47Å; R258-A261 PolarHBondContact O-N 3.28Å; I259-A261 PolarHBondContact O-N 3.43Å; A261-R268 VanDerWaalsContact O-CD 3.3Å; A261-R268 WeakPolarHBondContact O-CD 3.01Å
262	C	53	Low	71.2	Confident	22 Å²	22	57.9 Å²	57.9	15%	0.149	33%	0.329	C	S	.	.	H	α-helix	trans	-81	-35.3	174.6	-60.9	0	0	0	0	113.1	R258 I259 T260 V264 N265 R268 S269	R258-C262 PolarHBondContact O-N 2.96Å; R258-C262 PolarHBondContact O-SG 3.25Å; I259-C262 WeakPolarHBondContact O-CA 3.29Å; I259-C262 WeakPolarHBondContact O-CB 3.31Å; I259-C262 PolarHBondContact O-N 2.84Å; T260-C262 VanDerWaalsContact C-N 3.26Å; T260-C262 PolarHBondContact O-N 3.43Å; C262-V264 VanDerWaalsContact C-N 3.27Å; C262-V264 PolarHBondContact O-N 2.82Å; C262-N265 CarbonylContact O-C 3.55Å; C262-N265 VanDerWaalsContact O-C 3.25Å; C262-N265 PolarHBondContact O-N 2.77Å; C262-R268 HydrophobicContact CB-CB 4.43Å; C262-S269 WeakPolarHBondContact SG-CB 3.44Å; C262-S269 PolarHBondContact SG-N 2.9Å
263	T	44.8	Very low	71.3	Confident	111 Å²	111	53 Å²	53	68%	0.681	31%	0.306	S	S	*	.	H	α-helix	trans	-68.8	-31.1	177.8	50.8	0	0	0	0	111.6	I259 T260 N265	I259-T263 PolarHBondContact O-N 2.89Å; I259-T263 VanDerWaalsContact O-N 3.1Å; T260-T263 PolarHBondContact O-N 3.5Å; T260-T263 PolarHBondContact O-OG1 2.86Å; T263-N265 VanDerWaalsContact C-N 3.34Å
264	V	49.2	Very low	71.4	Confident	121 Å²	121	49.5 Å²	49.5	73%	0.733	29%	0.288	S	S	*	.	S	Bend	trans	-72.5	-25.6	176	177.2	0	0	0	0	112.2	T260 C262	T260-V264 WeakPolarHBondContact O-CG2 3.4Å; T260-V264 PolarHBondContact O-N 2.9Å; C262-V264 VanDerWaalsContact C-N 3.27Å; C262-V264 PolarHBondContact O-N 2.82Å
265	N	49.5	Very low	71.7	Confident	94 Å²	94	49.9 Å²	49.9	50%	0.503	29%	0.29	S	S	.	.	S	Bend	trans	-152.9	112.6	-176.5	-145.3	-1.5	0	0	0	110.6	C262 T263 S267	C262-N265 CarbonylContact O-C 3.55Å; C262-N265 VanDerWaalsContact O-C 3.25Å; C262-N265 PolarHBondContact O-N 2.77Å; T263-N265 VanDerWaalsContact C-N 3.34Å; N265-S267 PolarHBondContact O-N 2.76Å
266	N	49.9	Very low	72.1	Confident	145 Å²	145	48.4 Å²	48.4	78%	0.775	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-37.7	130.8	-173.9	-82.1	-25.7	0	0	0	114.3	R268	N266-R268 VanDerWaalsContact C-N 3.35Å; N266-R268 PolarHBondContact O-N 2.99Å
267	S	60.1	Low	72.7	Confident	53 Å²	53	47.8 Å²	47.8	37%	0.371	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	62	17.6	168.6	70.7	0	0	0	0	118.5	N265 S269 S270 R271	N265-S267 PolarHBondContact O-N 2.76Å; S267-S269 VanDerWaalsContact C-N 3.32Å; S267-S269 PolarHBondContact O-N 3.41Å; S267-S269 VanDerWaalsContact O-N 3.16Å; S267-S270 PolarHBondContact O-N 2.89Å; S267-S270 VanDerWaalsContact O-N 3.12Å; S267-S270 PolarHBondContact O-OG 2.98Å; S267-R271 PolarHBondContact OG-NE 3.34Å
268	R	68.4	Low	73.2	Confident	20 Å²	20	44 Å²	44	8%	0.075	26%	0.256	C	S	.	.	H	α-helix	trans	-51.2	-40.2	-177.4	-175	-179.8	176.3	137.5	5	115.1	E202 Y204 A261 C262 N266 S270 R271 S272	E202-R268 IonicContact OE1-NE 3.19Å; E202-R268 IonicContact OE2-CZ 3.88Å; E202-R268 IonicContact OE2-NE 3.59Å; E202-R268 PolarHBondContact OE2-NE 3.45Å; E202-R268 IonicContact OE2-NH2 3.42Å; E202-R268 PolarHBondContact OE2-NH2 3Å; Y204-R268 HydrophobicContact CD2-CG 4.14Å; Y204-R268 HydrophobicContact CE2-CG 4.15Å; Y204-R268 HydrophobicContact CG-CG 4.47Å; A261-R268 VanDerWaalsContact O-CD 3.3Å; A261-R268 WeakPolarHBondContact O-CD 3.01Å; C262-R268 HydrophobicContact CB-CB 4.43Å; N266-R268 VanDerWaalsContact C-N 3.35Å; N266-R268 PolarHBondContact O-N 2.99Å; R268-S270 VanDerWaalsContact C-N 3.25Å; R268-S270 PolarHBondContact O-N 3.24Å; R268-R271 CarbonylContact O-C 3.23Å; R268-R271 WeakPolarHBondContact O-CA 3.47Å; R268-R271 PolarHBondContact O-N 3.01Å; R268-S272 PolarHBondContact O-N 3.14Å; R268-S272 PolarHBondContact O-OG 3.15Å
269	S	73.5	Confident	73.7	Confident	54 Å²	54	48 Å²	48	38%	0.378	27%	0.274	S	S	.	.	H	α-helix	trans	-61.6	-31.1	-178.2	57	0	0	0	0	113.7	R258 C262 S267 R271	R258-S269 PolarHBondContact NH2-O 3.39Å; C262-S269 WeakPolarHBondContact SG-CB 3.44Å; C262-S269 PolarHBondContact SG-N 2.9Å; S267-S269 VanDerWaalsContact C-N 3.32Å; S267-S269 PolarHBondContact O-N 3.41Å; S267-S269 VanDerWaalsContact O-N 3.16Å; S269-R271 PolarHBondContact O-N 3.34Å
270	S	77.5	Confident	75	Confident	24 Å²	24	43.1 Å²	43.1	17%	0.168	25%	0.249	C	C	.	.	H	α-helix	trans	-74.5	-16.2	175.4	67.9	0	0	0	0	113.2	T156 S267 R268 A308 G309	T156-S270 WeakPolarHBondContact OG1-CB 3.5Å; S267-S270 PolarHBondContact O-N 2.89Å; S267-S270 VanDerWaalsContact O-N 3.12Å; S267-S270 PolarHBondContact O-OG 2.98Å; R268-S270 VanDerWaalsContact C-N 3.25Å; R268-S270 PolarHBondContact O-N 3.24Å; S270-A308 WeakPolarHBondContact O-CA 3.24Å; S270-A308 WeakPolarHBondContact O-CB 3.45Å; S270-G309 PolarHBondContact O-N 2.87Å
271	R	81.5	Confident	76.8	Confident	25 Å²	25	41.5 Å²	41.5	9%	0.094	23%	0.234	C	C	.	.	H	α-helix	trans	-113.9	-13.7	-169.9	-68.1	-173	-174.5	-177.7	-1.2	113.8	Y204 S267 R268 S269 E321 I325	Y204-R271 HydrophobicContact CD2-CB 4.36Å; Y204-R271 HydrophobicContact CE2-CB 3.92Å; S267-R271 PolarHBondContact OG-NE 3.34Å; R268-R271 CarbonylContact O-C 3.23Å; R268-R271 WeakPolarHBondContact O-CA 3.47Å; R268-R271 PolarHBondContact O-N 3.01Å; S269-R271 PolarHBondContact O-N 3.34Å; R271-E321 WeakPolarHBondContact CD-OE1 3.01Å; R271-E321 IonicContact CZ-OE1 2.89Å; R271-E321 IonicContact NE-OE1 3.59Å; R271-E321 VanDerWaalsContact NH1-CD 3.26Å; R271-E321 IonicContact NH1-OE1 2.72Å; R271-E321 PolarHBondContact NH1-OE1 3.25Å; R271-E321 IonicContact NH1-OE2 3.71Å; R271-E321 PolarHBondContact NH1-OE2 3.11Å; R271-I325 HydrophobicContact CB-CD1 3.48Å; R271-I325 VanDerWaalsContact CB-CD1 3.48Å; R271-I325 HydrophobicContact CB-CG1 4.28Å; R271-I325 HydrophobicContact CG-CD1 3.63Å
272	S	87.9	Confident	78.7	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.231	C	C	.	.			trans	-96.3	149.1	174	63.1	0	0	0	0	111.7	E202 M203 R268	E202-S272 VanDerWaalsContact OE1-CB 3.23Å; E202-S272 WeakPolarHBondContact OE1-CB 3.49Å; E202-S272 PolarHBondContact OE1-OG 2.66Å; M203-S272 CarbonylContact O-C 3.57Å; M203-S272 VanDerWaalsContact O-CA 3.28Å; M203-S272 WeakPolarHBondContact O-CA 3.24Å; M203-S272 WeakPolarHBondContact O-CB 3.48Å; R268-S272 PolarHBondContact O-N 3.14Å; R268-S272 PolarHBondContact O-OG 3.15Å
273	H	91.8	Very high	80.5	Confident	6 Å²	6	41.1 Å²	41.1	3%	0.028	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	141	166.4	-53.5	-75.5	0	0	0	108.5	E202 M203 D306 L307 A308 S328 L372	E202-H273 CarbonylContact C-O 3.45Å; M203-H273 HydrophobicContact CB-CB 4.33Å; M203-H273 HydrophobicContact CE-CB 4.06Å; M203-H273 PolarHBondContact N-O 2.89Å; M203-H273 PolarHBondContact O-N 2.88Å; H273-D306 CarbonylContact C-O 3.25Å; H273-D306 WeakPolarHBondContact CA-O 3.39Å; H273-L307 WeakPolarHBondContact ND1-CA 3.33Å; H273-L307 WeakPolarHBondContact ND1-CD2 3.28Å; H273-A308 VanDerWaalsContact CE1-CB 3.42Å; H273-A308 WeakPolarHBondContact CE1-CB 3.34Å; H273-A308 PolarHBondContact CE1-N 2.94Å; H273-A308 PolarHBondContact ND1-N 2.97Å; H273-S328 PolarHBondContact NE2-OG 3.43Å; H273-L372 HydrophobicContact CB-CD1 4.34Å
274	V	94.3	Very high	82.5	Confident	1 Å²	1	39 Å²	39	1%	0.006	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	132.2	-180	172.2	0	0	0	0	109.7	F165 F200 L201 E202 L211 R258 V305 D306	F165-V274 HydrophobicContact CZ-CG1 4.35Å; F200-V274 HydrophobicContact CD2-CG1 3.84Å; F200-V274 HydrophobicContact CE2-CG1 3.2Å; F200-V274 HydrophobicContact CZ-CG1 4.13Å; L201-V274 CarbonylContact O-C 3.5Å; L201-V274 WeakPolarHBondContact O-CA 3.43Å; E202-V274 HydrophobicContact CB-CG2 4.49Å; E202-V274 HydrophobicContact CG-CG2 4.3Å; L211-V274 HydrophobicContact CD1-CG1 4.13Å; L211-V274 HydrophobicContact CD1-CG2 4.44Å; R258-V274 VanDerWaalsContact CZ-CG2 3.5Å; V274-V305 CarbonylContact O-C 3.56Å; V274-V305 VanDerWaalsContact O-CA 3.28Å; V274-V305 WeakPolarHBondContact O-CA 3.42Å; V274-D306 HydrophobicContact CB-CB 4.22Å; V274-D306 PolarHBondContact N-O 2.96Å; V274-D306 PolarHBondContact O-N 3.26Å
275	L	95.5	Very high	84.1	Confident	7 Å²	7	36.2 Å²	36.2	4%	0.037	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	115.2	178.5	-74.6	73.8	0	0	0	108.4	L201 M203 T303 V305 L375 L376	L201-L275 HydrophobicContact CB-CB 4.33Å; L201-L275 PolarHBondContact N-O 3.15Å; L201-L275 PolarHBondContact O-N 3.28Å; M203-L275 HydrophobicContact CE-CD1 3.5Å; L275-T303 HydrophobicContact CD2-CG2 4.48Å; L275-V305 HydrophobicContact CD1-CG1 4.06Å; L275-V305 HydrophobicContact CG-CG1 4.14Å; L275-V305 HydrophobicContact CG-CG2 4.15Å; L275-L375 HydrophobicContact CD2-CB 4.03Å; L275-L375 HydrophobicContact CD2-CD1 3.91Å; L275-L376 HydrophobicContact CD2-CD2 4.38Å
276	F	97.5	Very high	85.3	Confident	1 Å²	1	35.2 Å²	35.2	0%	0.004	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	115.1	170	-171.5	-89.2	0	0	0	108	I174 I198 F200 I247 I251 V278 M304	I174-F276 HydrophobicContact CD1-CB 4.1Å; I174-F276 HydrophobicContact CD1-CG 4.34Å; I174-F276 HydrophobicContact CG2-CD1 3.69Å; I174-F276 HydrophobicContact CG2-CD2 4.48Å; I174-F276 HydrophobicContact CG2-CE1 3.59Å; I174-F276 HydrophobicContact CG2-CE2 4.4Å; I174-F276 HydrophobicContact CG2-CG 4.14Å; I174-F276 HydrophobicContact CG2-CZ 3.95Å; I198-F276 HydrophobicContact CD1-CE1 4.38Å; I198-F276 HydrophobicContact CD1-CZ 3.95Å; I198-F276 HydrophobicContact CG2-CD2 4.5Å; I198-F276 HydrophobicContact CG2-CE1 4.16Å; I198-F276 HydrophobicContact CG2-CE2 3.75Å; I198-F276 HydrophobicContact CG2-CZ 3.57Å; F200-F276 HydrophobicContact CB-CD2 4.45Å; F200-F276 HydrophobicContact CD1-CD2 4.09Å; F200-F276 HydrophobicContact CD1-CE2 4.36Å; F200-F276 HydrophobicContact CD2-CB 4.2Å; F200-F276 AromaticContact CD2-CD2 3.77Å; F200-F276 HydrophobicContact CD2-CD2 3.77Å; F200-F276 HydrophobicContact CD2-CG 4.48Å; F200-F276 HydrophobicContact CE1-CD2 4.24Å; F200-F276 HydrophobicContact CE2-CB 4.16Å; F200-F276 AromaticContact CE2-CD2 3.86Å; F200-F276 HydrophobicContact CE2-CD2 3.86Å; F200-F276 AromaticContact CG-CD2 3.87Å; F200-F276 HydrophobicContact CG-CD2 3.87Å; F200-F276 HydrophobicContact CG-CE2 4.46Å; F200-F276 HydrophobicContact CZ-CD2 4.15Å; I247-F276 HydrophobicContact CG2-CZ 4.37Å; I251-F276 HydrophobicContact CD1-CZ 4.48Å; I251-F276 HydrophobicContact CG1-CE2 3.86Å; I251-F276 HydrophobicContact CG1-CZ 4.11Å; F276-V278 HydrophobicContact CD1-CG2 4.11Å; F276-V278 HydrophobicContact CE1-CG2 3.63Å; F276-M304 PolarHBondContact N-O 2.83Å; F276-M304 PolarHBondContact O-N 3.14Å
277	T	96.9	Very high	86.3	Confident	18 Å²	18	32.8 Å²	32.8	11%	0.11	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	129.1	-174.4	-50.9	0	0	0	0	109.8	I198 S199 K279 S301 L302	I198-T277 WeakPolarHBondContact CA-O 3.22Å; S199-T277 PolarHBondContact N-O 2.95Å; S199-T277 PolarHBondContact O-N 2.67Å; S199-T277 WeakPolarHBondContact OG-CB 3.26Å; T277-K279 HydrophobicContact CG2-CG 4.3Å; T277-S301 WeakPolarHBondContact CG2-OG 3.21Å; T277-L302 WeakPolarHBondContact CA-O 3.33Å
278	V	97.5	Very high	86.5	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	118.6	171.8	177.6	0	0	0	0	107.6	L181 M196 E197 I198 F276 V280 S301 L302	L181-V278 HydrophobicContact CD2-CG1 3.98Å; M196-V278 HydrophobicContact CE-CB 4.47Å; M196-V278 HydrophobicContact CE-CG1 3.37Å; M196-V278 HydrophobicContact CE-CG2 4.27Å; M196-V278 HydrophobicContact CG-CG1 3.88Å; M196-V278 HydrophobicContact SD-CG1 4.29Å; E197-V278 CarbonylContact O-C 3.55Å; E197-V278 WeakPolarHBondContact O-CA 3.08Å; I198-V278 HydrophobicContact CD1-CG2 4.44Å; I198-V278 HydrophobicContact CG1-CG2 4.25Å; F276-V278 HydrophobicContact CD1-CG2 4.11Å; F276-V278 HydrophobicContact CE1-CG2 3.63Å; V278-V280 HydrophobicContact CG1-CG2 4.06Å; V278-S301 CarbonylContact O-C 3.5Å; V278-S301 WeakPolarHBondContact O-CA 3.28Å; V278-L302 HydrophobicContact CB-CB 4.25Å; V278-L302 PolarHBondContact N-O 3.15Å; V278-L302 PolarHBondContact O-N 3Å
279	K	96.1	Very high	86.1	Confident	95 Å²	95	39.1 Å²	39.1	41%	0.413	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	134.4	171.2	-68.4	-176.7	177.1	-177.7	0	109.2	M196 E197 T277	M196-K279 CarbonylContact C-O 3.59Å; M196-K279 WeakPolarHBondContact CA-O 3.3Å; E197-K279 HydrophobicContact CB-CB 4.23Å; E197-K279 PolarHBondContact N-O 2.86Å; E197-K279 PolarHBondContact O-N 3.36Å; T277-K279 HydrophobicContact CG2-CG 4.3Å
280	V	97.4	Very high	85.8	Confident	4 Å²	4	44.5 Å²	44.5	2%	0.024	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	131.9	177.5	-178.1	0	0	0	0	108.7	V142 L181 L185 S195 M196 V278 I282 R299 S300	V142-V280 HydrophobicContact CG1-CB 4.2Å; V142-V280 HydrophobicContact CG1-CG2 3.87Å; L181-V280 HydrophobicContact CD2-CG2 3.94Å; L185-V280 HydrophobicContact CD1-CG1 4.01Å; L185-V280 HydrophobicContact CD1-CG2 4.42Å; L185-V280 HydrophobicContact CD2-CG1 4.01Å; S195-V280 WeakPolarHBondContact O-CA 3.48Å; M196-V280 HydrophobicContact CG-CG2 4.3Å; V278-V280 HydrophobicContact CG1-CG2 4.06Å; V280-I282 HydrophobicContact CG1-CD1 4.19Å; V280-I282 HydrophobicContact CG1-CG1 3.81Å; V280-R299 WeakPolarHBondContact O-CA 3.32Å; V280-S300 PolarHBondContact N-O 3.4Å; V280-S300 PolarHBondContact O-N 2.76Å
281	K	95.5	Very high	84.9	Confident	55 Å²	55	46.9 Å²	46.9	24%	0.239	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	134.1	167.7	-174.3	-171.7	-177.5	-129.4	0	108.1	W194 S195 D283 T297 T298 R299	W194-K281 CarbonylContact C-O 3.55Å; W194-K281 WeakPolarHBondContact CA-O 3.42Å; S195-K281 PolarHBondContact N-O 3.26Å; S195-K281 PolarHBondContact O-N 3.03Å; S195-K281 WeakPolarHBondContact OG-CB 3.36Å; K281-D283 WeakPolarHBondContact CE-OD1 3.21Å; K281-D283 IonicContact NZ-OD1 3.7Å; K281-D283 PolarHBondContact NZ-OD1 3.08Å; K281-D283 VanDerWaalsContact NZ-OD1 3.16Å; K281-D283 IonicContact NZ-OD2 3.6Å; K281-D283 PolarHBondContact NZ-OD2 2.95Å; K281-T297 HydrophobicContact CG-CG2 4.09Å; K281-T298 WeakPolarHBondContact CA-O 3.4Å; K281-R299 HydrophobicContact CG-CG 4.28Å
282	I	95.2	Very high	84.2	Confident	12 Å²	12	49.5 Å²	49.5	6%	0.062	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	120.6	176.8	-53.5	177.5	0	0	0	108.1	L143 L185 T192 Q193 W194 V280 T297 T298	L143-I282 HydrophobicContact CD2-CD1 4.17Å; L185-I282 HydrophobicContact CD2-CD1 3.82Å; L185-I282 HydrophobicContact CD2-CG1 4.08Å; T192-I282 HydrophobicContact CG2-CG2 3.4Å; Q193-I282 CarbonylContact O-C 3.5Å; Q193-I282 WeakPolarHBondContact O-CA 3.36Å; W194-I282 HydrophobicContact CB-CG1 4.4Å; V280-I282 HydrophobicContact CG1-CD1 4.19Å; V280-I282 HydrophobicContact CG1-CG1 3.81Å; I282-T297 CarbonylContact O-C 3.58Å; I282-T297 WeakPolarHBondContact O-CA 3.44Å; I282-T298 PolarHBondContact N-O 2.94Å; I282-T298 PolarHBondContact O-N 3.5Å; I282-T298 PolarHBondContact O-OG1 3.4Å
283	D	91.5	Very high	83.3	Confident	18 Å²	18	54.7 Å²	54.7	10%	0.096	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	115.5	177.8	-66.2	-14.5	0	0	0	108.4	Q193 K281 T297	Q193-D283 HydrophobicContact CB-CB 4.32Å; Q193-D283 PolarHBondContact N-O 2.59Å; Q193-D283 PolarHBondContact O-N 2.82Å; K281-D283 WeakPolarHBondContact CE-OD1 3.21Å; K281-D283 IonicContact NZ-OD1 3.7Å; K281-D283 PolarHBondContact NZ-OD1 3.08Å; K281-D283 VanDerWaalsContact NZ-OD1 3.16Å; K281-D283 IonicContact NZ-OD2 3.6Å; K281-D283 PolarHBondContact NZ-OD2 2.95Å; D283-T297 WeakPolarHBondContact OD1-CG2 3.36Å; D283-T297 PolarHBondContact OD1-OG1 3.39Å
284	K	86.9	Confident	82.4	Confident	66 Å²	66	57 Å²	57	29%	0.287	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	124.2	171.2	-73.1	-71	-170.6	177.5	0	109.5	E191 T192 C294 F295 R296	E191-K284 HydrophobicContact CG-CD 4.44Å; E191-K284 WeakPolarHBondContact O-CA 3.42Å; E191-K284 IonicContact OE1-NZ 3.11Å; E191-K284 PolarHBondContact OE1-NZ 3.16Å; E191-K284 VanDerWaalsContact OE1-NZ 3.15Å; T192-K284 HydrophobicContact CG2-CD 4.32Å; T192-K284 WeakPolarHBondContact OG1-CE 3.39Å; T192-K284 PolarHBondContact OG1-NZ 2.8Å; K284-C294 WeakPolarHBondContact O-CA 3.38Å; K284-F295 HydrophobicContact CB-CD1 4.38Å; K284-F295 HydrophobicContact CB-CE1 3.72Å; K284-F295 HydrophobicContact CB-CE2 4.14Å; K284-F295 HydrophobicContact CB-CZ 3.59Å; K284-F295 HydrophobicContact CG-CZ 4.45Å; K284-F295 VanDerWaalsContact O-CD1 3.25Å; K284-F295 WeakPolarHBondContact O-CD1 3.4Å; K284-F295 PolarHBondContact O-N 2.88Å; K284-R296 HydrophobicContact CB-CB 4.23Å; K284-R296 PolarHBondContact N-O 3.32Å
285	K	82.4	Confident	81.5	Confident	63 Å²	63	60.1 Å²	60.1	27%	0.274	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	147.8	-175.2	-65.5	-179.6	176.8	-171.2	0	110.9	E191 Q193 T292 Y293 C294	E191-K285 WeakPolarHBondContact CB-O 3.31Å; E191-K285 PolarHBondContact O-N 3.12Å; Q193-K285 HydrophobicContact CB-CD 4.43Å; K285-T292 HydrophobicContact CB-CG2 3.75Å; K285-T292 HydrophobicContact CD-CG2 3.76Å; K285-T292 HydrophobicContact CG-CG2 4.18Å; K285-Y293 CarbonylContact C-O 3.58Å; K285-Y293 WeakPolarHBondContact CA-O 3.27Å; K285-C294 HydrophobicContact CG-CB 4.35Å
286	I	74.3	Confident	80.9	Confident	72 Å²	72	64.9 Å²	64.9	37%	0.369	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	133.2	170.1	-170.2	166	0	0	0	108.1	T292 Y293 F295	I286-T292 WeakPolarHBondContact O-CA 3.32Å; I286-Y293 PolarHBondContact N-O 2.81Å; I286-Y293 PolarHBondContact O-N 3.48Å; I286-F295 HydrophobicContact CB-CD1 4.12Å; I286-F295 HydrophobicContact CB-CE1 4.26Å; I286-F295 HydrophobicContact CG2-CD1 4.05Å
287	T	71.6	Confident	80.6	Confident	94 Å²	94	65.6 Å²	65.6	58%	0.577	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101	117.8	175.1	-54.6	0	0	0	0	108.3	E291 T292	T287-E291 CarbonylContact C-O 3.52Å; T287-E291 VanDerWaalsContact CA-O 3.27Å; T287-E291 WeakPolarHBondContact CA-O 3.37Å; T287-T292 PolarHBondContact OG1-OG1 2.71Å; T287-T292 VanDerWaalsContact OG1-OG1 3.07Å
288	A	63.1	Low	80.3	Confident	46 Å²	46	65.3 Å²	65.3	38%	0.38	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	133.8	175.7	0	0	0	0	0	108.1	N290 E291	A288-N290 VanDerWaalsContact C-N 3.32Å; A288-N290 PolarHBondContact O-N 3.47Å; A288-E291 PolarHBondContact N-O 2.85Å; A288-E291 PolarHBondContact O-N 2.87Å
289	N	61.2	Low	80.1	Confident	161 Å²	161	71.1 Å²	71.1	86%	0.861	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	45.1	-180	-61.6	-7.4	0	0	0	114	E291	N289-E291 PolarHBondContact O-N 3.35Å
290	N	66.7	Low	80	Confident	167 Å²	167	66.9 Å²	66.9	89%	0.893	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.2	-0.5	-174.9	-65.5	-15.9	0	0	0	116.2	A288	A288-N290 VanDerWaalsContact C-N 3.32Å; A288-N290 PolarHBondContact O-N 3.47Å
291	E	58.5	Low	79.9	Confident	74 Å²	74	67.9 Å²	67.9	35%	0.346	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	140.8	172.6	-70.6	-171.3	-160.5	0	0	111	T287 A288 N289 Y293	T287-E291 CarbonylContact C-O 3.52Å; T287-E291 VanDerWaalsContact CA-O 3.27Å; T287-E291 WeakPolarHBondContact CA-O 3.37Å; A288-E291 PolarHBondContact N-O 2.85Å; A288-E291 PolarHBondContact O-N 2.87Å; N289-E291 PolarHBondContact O-N 3.35Å; E291-Y293 HydrophobicContact CB-CE1 4.42Å; E291-Y293 HydrophobicContact CB-CE2 3.67Å; E291-Y293 PolarHBondContact OE2-OH 2.86Å
292	T	66.3	Low	79.9	Confident	80 Å²	80	65.3 Å²	65.3	49%	0.491	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	117.9	-179.1	-57.5	0	0	0	0	110.6	K285 I286 T287	K285-T292 HydrophobicContact CB-CG2 3.75Å; K285-T292 HydrophobicContact CD-CG2 3.76Å; K285-T292 HydrophobicContact CG-CG2 4.18Å; I286-T292 WeakPolarHBondContact O-CA 3.32Å; T287-T292 PolarHBondContact OG1-OG1 2.71Å; T287-T292 VanDerWaalsContact OG1-OG1 3.07Å
293	Y	68.3	Low	80	Confident	108 Å²	108	65.6 Å²	65.6	42%	0.424	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	133.4	-177.8	-55	-82.8	0	0	0	110.9	K285 I286 E291	K285-Y293 CarbonylContact C-O 3.58Å; K285-Y293 WeakPolarHBondContact CA-O 3.27Å; I286-Y293 PolarHBondContact N-O 2.81Å; I286-Y293 PolarHBondContact O-N 3.48Å; E291-Y293 HydrophobicContact CB-CE1 4.42Å; E291-Y293 HydrophobicContact CB-CE2 3.67Å; E291-Y293 PolarHBondContact OE2-OH 2.86Å
294	C	73.4	Confident	80.3	Confident	55 Å²	55	64.9 Å²	64.9	37%	0.372	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	116.9	168.2	-177	0	0	0	0	109.3	K284 K285	K284-C294 WeakPolarHBondContact O-CA 3.38Å; K285-C294 HydrophobicContact CG-CB 4.35Å
295	F	76.6	Confident	80.7	Confident	66 Å²	66	61.8 Å²	61.8	29%	0.289	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	-14.9	-178.5	68.7	-90.4	0	0	0	113.1	K284 I286 S428 V431	K284-F295 HydrophobicContact CB-CD1 4.38Å; K284-F295 HydrophobicContact CB-CE1 3.72Å; K284-F295 HydrophobicContact CB-CE2 4.14Å; K284-F295 HydrophobicContact CB-CZ 3.59Å; K284-F295 HydrophobicContact CG-CZ 4.45Å; K284-F295 VanDerWaalsContact O-CD1 3.25Å; K284-F295 WeakPolarHBondContact O-CD1 3.4Å; K284-F295 PolarHBondContact O-N 2.88Å; I286-F295 HydrophobicContact CB-CD1 4.12Å; I286-F295 HydrophobicContact CB-CE1 4.26Å; I286-F295 HydrophobicContact CG2-CD1 4.05Å; F295-S428 VanDerWaalsContact O-CA 3.24Å; F295-S428 WeakPolarHBondContact O-CA 3.46Å; F295-S428 VanDerWaalsContact O-CB 3.28Å; F295-S428 WeakPolarHBondContact O-CB 3.31Å; F295-S428 PolarHBondContact O-OG 3.4Å; F295-V431 HydrophobicContact CB-CB 4.13Å; F295-V431 HydrophobicContact CB-CG1 3.38Å
296	R	83	Confident	81.3	Confident	107 Å²	107	58.8 Å²	58.8	40%	0.404	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	123	177.7	177.8	177.9	176.2	167.6	-0.7	110.8	K284 T298	K284-R296 HydrophobicContact CB-CB 4.23Å; K284-R296 PolarHBondContact N-O 3.32Å; R296-T298 HydrophobicContact CG-CG2 4.38Å
297	T	89.4	Confident	82.2	Confident	17 Å²	17	55.4 Å²	55.4	10%	0.104	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	128.3	170.4	-56.6	0	0	0	0	108.5	K281 I282 D283 R299 S423 D424	K281-T297 HydrophobicContact CG-CG2 4.09Å; I282-T297 CarbonylContact O-C 3.58Å; I282-T297 WeakPolarHBondContact O-CA 3.44Å; D283-T297 WeakPolarHBondContact OD1-CG2 3.36Å; D283-T297 PolarHBondContact OD1-OG1 3.39Å; T297-R299 HydrophobicContact CG2-CG 4.35Å; T297-S423 VanDerWaalsContact O-CA 3.22Å; T297-S423 WeakPolarHBondContact O-CA 3.39Å; T297-D424 VanDerWaalsContact CB-OD2 3.27Å; T297-D424 WeakPolarHBondContact CB-OD2 3.46Å; T297-D424 PolarHBondContact O-N 2.89Å; T297-D424 VanDerWaalsContact O-N 3.08Å
298	T	91.6	Very high	83	Confident	11 Å²	11	51 Å²	51	7%	0.067	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	142.8	169.2	50.7	0	0	0	0	110.7	K281 I282 R296 V421 N422	K281-T298 WeakPolarHBondContact CA-O 3.4Å; I282-T298 PolarHBondContact N-O 2.94Å; I282-T298 PolarHBondContact O-N 3.5Å; I282-T298 PolarHBondContact O-OG1 3.4Å; R296-T298 HydrophobicContact CG-CG2 4.38Å; T298-V421 HydrophobicContact CG2-CG1 4.37Å; T298-N422 CarbonylContact C-O 3.56Å; T298-N422 VanDerWaalsContact CA-O 3.27Å; T298-N422 WeakPolarHBondContact CA-O 3.43Å
299	R	92.8	Very high	84.2	Confident	123 Å²	123	49 Å²	49	46%	0.464	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	138.8	179.2	-63.5	176.3	-174.1	-98.4	6.6	109.9	V280 K281 T297 N422	V280-R299 WeakPolarHBondContact O-CA 3.32Å; K281-R299 HydrophobicContact CG-CG 4.28Å; T297-R299 HydrophobicContact CG2-CG 4.35Å; R299-N422 PolarHBondContact N-O 3.01Å; R299-N422 VanDerWaalsContact O-CB 3.27Å; R299-N422 WeakPolarHBondContact O-CB 3.38Å; R299-N422 PolarHBondContact O-ND2 3.49Å; R299-N422 VanDerWaalsContact O-ND2 3.1Å
300	S	94.8	Very high	85.3	Confident	6 Å²	6	41.9 Å²	41.9	4%	0.042	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	144.6	178.6	47.9	0	0	0	0	110.2	V142 I146 N147 V280	V142-S300 WeakPolarHBondContact CG1-OG 3.44Å; V142-S300 WeakPolarHBondContact O-CB 3.44Å; V142-S300 PolarHBondContact O-OG 3.33Å; I146-S300 WeakPolarHBondContact O-CB 3.36Å; N147-S300 WeakPolarHBondContact OD1-CA 3.32Å; V280-S300 PolarHBondContact N-O 3.4Å; V280-S300 PolarHBondContact O-N 2.76Å
301	S	94	Very high	85.9	Confident	25 Å²	25	35.9 Å²	35.9	18%	0.175	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	128.5	173	-169.9	0	0	0	0	109.5	N147 C148 T277 V278	N147-S301 CarbonylContact C-O 3.55Å; N147-S301 VanDerWaalsContact CA-O 3.26Å; N147-S301 WeakPolarHBondContact CA-O 3.4Å; N147-S301 PolarHBondContact OD1-N 2.83Å; C148-S301 PolarHBondContact N-O 3.38Å; T277-S301 WeakPolarHBondContact CG2-OG 3.21Å; V278-S301 CarbonylContact O-C 3.5Å; V278-S301 WeakPolarHBondContact O-CA 3.28Å
302	L	97	Very high	86.2	Confident	1 Å²	1	41 Å²	41	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	112.3	169.6	171	63.5	0	0	0	108.7	M138 V142 C148 T177 T277 V278 M304	M138-L302 HydrophobicContact CB-CD1 4.46Å; M138-L302 HydrophobicContact SD-CD1 4.13Å; V142-L302 HydrophobicContact CG2-CB 3.82Å; V142-L302 HydrophobicContact CG2-CD2 4.45Å; V142-L302 HydrophobicContact CG2-CG 4.5Å; C148-L302 HydrophobicContact CB-CD1 3.7Å; C148-L302 CarbonylContact O-C 3.58Å; C148-L302 VanDerWaalsContact O-CA 3.28Å; C148-L302 WeakPolarHBondContact O-CA 3.47Å; T177-L302 HydrophobicContact CG2-CD2 3.68Å; T277-L302 WeakPolarHBondContact CA-O 3.33Å; V278-L302 HydrophobicContact CB-CB 4.25Å; V278-L302 PolarHBondContact N-O 3.15Å; V278-L302 PolarHBondContact O-N 3Å; L302-M304 HydrophobicContact CD1-CE 4.24Å; L302-M304 HydrophobicContact CD1-CG 4.5Å; L302-M304 HydrophobicContact CD2-CE 3.74Å; L302-M304 HydrophobicContact CG-CE 4.1Å
303	T	96	Very high	85.8	Confident	17 Å²	17	40 Å²	40	10%	0.104	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	117.1	-178.3	-54.6	0	0	0	0	109.9	C148 T149 L150 L275 V305	C148-T303 PolarHBondContact O-N 2.84Å; T149-T303 CarbonylContact C-O 3.56Å; T149-T303 VanDerWaalsContact CA-O 3.25Å; T149-T303 WeakPolarHBondContact CA-O 3.46Å; L150-T303 PolarHBondContact N-O 2.64Å; L275-T303 HydrophobicContact CD2-CG2 4.48Å; T303-V305 HydrophobicContact CG2-CG2 3.93Å
304	M	97.8	Very high	85	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.02	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	128.2	173.5	-60.4	-165.2	-145.5	0	0	110.2	L150 L164 L173 I174 T177 F276 L302	L150-M304 HydrophobicContact CB-CG 4.29Å; L164-M304 HydrophobicContact CD2-CB 4.46Å; L173-M304 HydrophobicContact CB-SD 4.35Å; I174-M304 HydrophobicContact CB-SD 4.3Å; I174-M304 HydrophobicContact CD1-CB 4.26Å; I174-M304 HydrophobicContact CG1-CB 4.04Å; I174-M304 HydrophobicContact CG1-CE 4.33Å; I174-M304 HydrophobicContact CG1-CG 4.29Å; I174-M304 HydrophobicContact CG1-SD 3.4Å; I174-M304 WeakPolarHBondContact CG1-SD 3.43Å; T177-M304 HydrophobicContact CG2-CE 3.78Å; F276-M304 PolarHBondContact N-O 2.83Å; F276-M304 PolarHBondContact O-N 3.14Å; L302-M304 HydrophobicContact CD1-CE 4.24Å; L302-M304 HydrophobicContact CD1-CG 4.5Å; L302-M304 HydrophobicContact CD2-CE 3.74Å; L302-M304 HydrophobicContact CG-CE 4.1Å
305	V	95.7	Very high	83.7	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	115.9	-168.5	-169.4	0	0	0	0	109.9	T149 L150 F151 A152 V274 L275 T303 L307 L376	T149-V305 HydrophobicContact CG2-CG2 4.38Å; L150-V305 PolarHBondContact O-N 2.8Å; F151-V305 HydrophobicContact CD1-CB 3.81Å; F151-V305 HydrophobicContact CD1-CG1 4.28Å; F151-V305 HydrophobicContact CD1-CG2 3.9Å; F151-V305 HydrophobicContact CE1-CB 4.23Å; F151-V305 HydrophobicContact CE1-CG2 3.83Å; A152-V305 PolarHBondContact N-O 3.33Å; V274-V305 CarbonylContact O-C 3.56Å; V274-V305 VanDerWaalsContact O-CA 3.28Å; V274-V305 WeakPolarHBondContact O-CA 3.42Å; L275-V305 HydrophobicContact CD1-CG1 4.06Å; L275-V305 HydrophobicContact CG-CG1 4.14Å; L275-V305 HydrophobicContact CG-CG2 4.15Å; T303-V305 HydrophobicContact CG2-CG2 3.93Å; V305-L307 HydrophobicContact CG1-CD2 3.65Å; V305-L307 HydrophobicContact CG1-CG 4.13Å; V305-L376 HydrophobicContact CG2-CD2 3.99Å
306	D	95.2	Very high	82.4	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	101.3	168.7	-171.3	20.5	0	0	0	108.1	K160 T161 L164 F165 R258 H273 V274	K160-D306 VanDerWaalsContact CB-OD1 3.31Å; K160-D306 WeakPolarHBondContact CB-OD1 3.49Å; T161-D306 PolarHBondContact OG1-OD2 3.35Å; L164-D306 HydrophobicContact CD1-CB 3.51Å; F165-D306 HydrophobicContact CE2-CB 4.33Å; R258-D306 IonicContact CZ-OD2 3.7Å; R258-D306 IonicContact NH1-OD2 2.66Å; R258-D306 PolarHBondContact NH1-OD2 2.98Å; R258-D306 IonicContact NH2-OD2 3.02Å; R258-D306 PolarHBondContact NH2-OD2 3.47Å; H273-D306 CarbonylContact C-O 3.25Å; H273-D306 WeakPolarHBondContact CA-O 3.39Å; V274-D306 HydrophobicContact CB-CB 4.22Å; V274-D306 PolarHBondContact N-O 2.96Å; V274-D306 PolarHBondContact O-N 3.26Å
307	L	92.8	Very high	80.8	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.005	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-77.4	153.6	180	-62.5	171.8	0	0	0	110.9	F151 A152 Y153 K160 H273 V305 L329 L332 L372	F151-L307 HydrophobicContact CB-CD1 4.44Å; A152-L307 VanDerWaalsContact O-CB 3.31Å; A152-L307 WeakPolarHBondContact O-CB 3.5Å; A152-L307 PolarHBondContact O-N 3.41Å; Y153-L307 HydrophobicContact CD2-CD1 3.91Å; K160-L307 WeakPolarHBondContact CD-O 3.45Å; K160-L307 WeakPolarHBondContact CE-O 3.39Å; H273-L307 WeakPolarHBondContact ND1-CA 3.33Å; H273-L307 WeakPolarHBondContact ND1-CD2 3.28Å; V305-L307 HydrophobicContact CG1-CD2 3.65Å; V305-L307 HydrophobicContact CG1-CG 4.13Å; L307-L329 HydrophobicContact CB-CD2 4.34Å; L307-L329 HydrophobicContact CD1-CD2 4.46Å; L307-L332 HydrophobicContact CD1-CD2 3.86Å; L307-L332 HydrophobicContact CD2-CD2 4.45Å; L307-L372 HydrophobicContact CD2-CD1 3.92Å; L307-L372 HydrophobicContact CD2-CD2 3.9Å
308	A	89.7	Confident	79	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-55.8	159.5	168.2	0	0	0	0	0	111.5	S270 H273 S310 I325 L329	S270-A308 WeakPolarHBondContact O-CA 3.24Å; S270-A308 WeakPolarHBondContact O-CB 3.45Å; H273-A308 VanDerWaalsContact CE1-CB 3.42Å; H273-A308 WeakPolarHBondContact CE1-CB 3.34Å; H273-A308 PolarHBondContact CE1-N 2.94Å; H273-A308 PolarHBondContact ND1-N 2.97Å; A308-S310 PolarHBondContact O-N 3.45Å; A308-I325 HydrophobicContact CB-CG2 3.91Å; A308-L329 HydrophobicContact CB-CD1 4.35Å
309	G	87	Confident	77.2	Confident	4 Å²	4	51.2 Å²	51.2	4%	0.041	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-51.7	132.1	174.6	0	0	0	0	0	112.2	S270 E311 L329	S270-G309 PolarHBondContact O-N 2.87Å; G309-E311 VanDerWaalsContact C-N 3.27Å; G309-E311 WeakPolarHBondContact CA-OE2 3.36Å; G309-E311 PolarHBondContact O-N 3.01Å; G309-L329 WeakPolarHBondContact O-CD1 3.26Å
310	S	83.9	Confident	75.4	Confident	13 Å²	13	53.9 Å²	53.9	9%	0.091	30%	0.298	C	S	.	.			trans	-79.7	-6.6	179.5	67.2	0	0	0	0	114.2	Y153 G154 Q155 A308	Y153-S310 VanDerWaalsContact CZ-CB 3.42Å; Y153-S310 WeakPolarHBondContact OH-CB 3.41Å; G154-S310 PolarHBondContact O-N 3.16Å; G154-S310 PolarHBondContact O-OG 2.75Å; Q155-S310 PolarHBondContact N-OG 2.94Å; A308-S310 PolarHBondContact O-N 3.45Å
311	E	79.7	Confident	73.6	Confident	40 Å²	40	55 Å²	55	19%	0.187	30%	0.303	C	S	.	.	S	Bend	trans	-65.3	144.8	-179.7	67.7	-78.8	-171.9	0	0	112	Q155 T156 G309 L313 E401	Q155-E311 WeakPolarHBondContact CA-OE2 3.36Å; Q155-E311 HydrophobicContact CB-CB 4.23Å; T156-E311 WeakPolarHBondContact CB-OE1 2.97Å; T156-E311 PolarHBondContact N-OE2 3.38Å; T156-E311 PolarHBondContact OG1-OE1 3.31Å; T156-E311 PolarHBondContact OG1-OE2 3.01Å; G309-E311 VanDerWaalsContact C-N 3.27Å; G309-E311 WeakPolarHBondContact CA-OE2 3.36Å; G309-E311 PolarHBondContact O-N 3.01Å; E311-L313 PolarHBondContact O-N 2.75Å; E311-E401 HydrophobicContact CB-CG 4.45Å
312	R	66.3	Low	71.6	Confident	182 Å²	182	55 Å²	55	69%	0.687	30%	0.301	S	S	*	.			trans	-82.8	111.3	169.5	-64.9	-178.2	-179.5	175.2	-1.5	108.1	S314	R312-S314 PolarHBondContact O-N 3.4Å
313	L	56.1	Low	69.9	Low	59 Å²	59	59 Å²	59	31%	0.309	33%	0.326	S	S	.	.			trans	-58.9	132.2	176.4	-68.1	170.1	0	0	0	110.7	E311 T322	E311-L313 PolarHBondContact O-N 2.75Å; L313-T322 HydrophobicContact CB-CG2 3.92Å; L313-T322 HydrophobicContact CD1-CG2 4.03Å
314	S	51.8	Low	68.2	Low	91 Å²	91	58.8 Å²	58.8	64%	0.636	33%	0.325	S	S	*	.			trans	-66.7	151.6	161.9	59.3	0	0	0	0	109.3	R312 T316	R312-S314 PolarHBondContact O-N 3.4Å; S314-T316 PolarHBondContact O-N 3.05Å; S314-T316 PolarHBondContact O-OG1 3.35Å
315	S	46.9	Very low	66.3	Low	121 Å²	121	59.1 Å²	59.1	85%	0.846	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	14.6	-163.8	51	0	0	0	0	119.2	T317	S315-T317 PolarHBondContact O-N 3.17Å
316	T	48	Very low	65	Low	126 Å²	126	61 Å²	61	77%	0.773	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-7.9	-171.3	-0.6	0	0	0	0	115	S314	S314-T316 PolarHBondContact O-N 3.05Å; S314-T316 PolarHBondContact O-OG1 3.35Å
317	T	49.6	Very low	63.8	Low	45 Å²	45	64.1 Å²	64.1	28%	0.276	35%	0.35	S	S	.	.	S	Bend	trans	-117.2	154.5	179.3	51.1	0	0	0	0	113.6	S315 L319 T322	S315-T317 PolarHBondContact O-N 3.17Å; T317-L319 PolarHBondContact O-N 3.02Å; T317-L319 VanDerWaalsContact O-N 3.16Å; T317-T322 PolarHBondContact OG1-OG1 3.18Å
318	S	52.4	Low	63	Low	79 Å²	79	64.2 Å²	64.2	55%	0.552	35%	0.351	S	S	*	.			trans	-39.4	119.9	179	178.3	0	0	0	0	112	K320 E321 T322	S318-K320 PolarHBondContact O-N 2.93Å; S318-K320 VanDerWaalsContact O-N 3.08Å; S318-E321 PolarHBondContact O-N 2.85Å; S318-E321 VanDerWaalsContact O-N 3.15Å; S318-T322 PolarHBondContact O-N 2.8Å; S318-T322 PolarHBondContact O-OG1 3.07Å
319	L	54.1	Low	62.6	Low	137 Å²	137	64.8 Å²	64.8	72%	0.717	35%	0.354	S	S	*	.	H	α-helix	trans	-53.7	-35.8	-172.4	-137.4	89.8	0	0	0	112.1	T317 T323	T317-L319 PolarHBondContact O-N 3.02Å; T317-L319 VanDerWaalsContact O-N 3.16Å; L319-T323 VanDerWaalsContact O-CB 3.3Å; L319-T323 WeakPolarHBondContact O-CB 3.48Å; L319-T323 PolarHBondContact O-N 3.11Å; L319-T323 PolarHBondContact O-OG1 3.35Å
320	K	54.2	Low	62	Low	179 Å²	179	67.8 Å²	67.8	78%	0.778	38%	0.375	S	S	*	.	H	α-helix	trans	-65	-45	-177.6	-68.8	-175.9	178.8	177.8	0	112.6	S318 T323 S324	S318-K320 PolarHBondContact O-N 2.93Å; S318-K320 VanDerWaalsContact O-N 3.08Å; K320-T323 PolarHBondContact O-N 3.45Å; K320-S324 PolarHBondContact O-N 3.33Å; K320-S324 VanDerWaalsContact O-N 3.14Å
321	E	57	Low	61.5	Low	31 Å²	31	68 Å²	68	15%	0.145	38%	0.376	C	S	.	.	H	α-helix	trans	-68.9	-50	-178.3	-170.4	-167.6	148.8	0	0	110.6	Y204 R271 S318 T323 S324 I325	Y204-E321 PolarHBondContact OH-OE1 3.32Å; R271-E321 WeakPolarHBondContact CD-OE1 3.01Å; R271-E321 IonicContact CZ-OE1 2.89Å; R271-E321 IonicContact NE-OE1 3.59Å; R271-E321 VanDerWaalsContact NH1-CD 3.26Å; R271-E321 IonicContact NH1-OE1 2.72Å; R271-E321 PolarHBondContact NH1-OE1 3.25Å; R271-E321 IonicContact NH1-OE2 3.71Å; R271-E321 PolarHBondContact NH1-OE2 3.11Å; S318-E321 PolarHBondContact O-N 2.85Å; S318-E321 VanDerWaalsContact O-N 3.15Å; E321-T323 PolarHBondContact O-N 2.67Å; E321-S324 PolarHBondContact O-N 2.83Å; E321-S324 PolarHBondContact O-OG 3.4Å; E321-I325 HydrophobicContact CG-CD1 4Å; E321-I325 PolarHBondContact O-N 3.19Å
322	T	53.1	Low	61.6	Low	24 Å²	24	66.1 Å²	66.1	15%	0.147	37%	0.367	C	S	.	.	H	α-helix	trans	-55.3	-38.1	176.8	-50.6	0	0	0	0	111.7	L313 T317 S318 N326	L313-T322 HydrophobicContact CB-CG2 3.92Å; L313-T322 HydrophobicContact CD1-CG2 4.03Å; T317-T322 PolarHBondContact OG1-OG1 3.18Å; S318-T322 PolarHBondContact O-N 2.8Å; S318-T322 PolarHBondContact O-OG1 3.07Å; T322-N326 WeakPolarHBondContact O-CB 3.31Å; T322-N326 PolarHBondContact O-N 2.78Å; T322-N326 PolarHBondContact O-ND2 2.81Å
323	T	60	Low	62.2	Low	84 Å²	84	58 Å²	58	52%	0.515	34%	0.34	S	S	.	.	H	α-helix	trans	-69	-40.8	177.4	-57.1	0	0	0	0	111.8	L319 K320 E321 K327	L319-T323 VanDerWaalsContact O-CB 3.3Å; L319-T323 WeakPolarHBondContact O-CB 3.48Å; L319-T323 PolarHBondContact O-N 3.11Å; L319-T323 PolarHBondContact O-OG1 3.35Å; K320-T323 PolarHBondContact O-N 3.45Å; E321-T323 PolarHBondContact O-N 2.67Å; T323-K327 WeakPolarHBondContact O-CB 3.42Å; T323-K327 PolarHBondContact O-N 2.78Å
324	S	60.8	Low	63.1	Low	14 Å²	14	60 Å²	60	10%	0.098	35%	0.349	C	S	.	.	H	α-helix	trans	-66.4	-44.6	-178.2	70.3	0	0	0	0	113.7	N205 K320 E321 K327 S328	N205-S324 WeakPolarHBondContact OD1-CB 3.07Å; N205-S324 PolarHBondContact OD1-OG 3.19Å; K320-S324 PolarHBondContact O-N 3.33Å; K320-S324 VanDerWaalsContact O-N 3.14Å; E321-S324 PolarHBondContact O-N 2.83Å; E321-S324 PolarHBondContact O-OG 3.4Å; S324-K327 WeakPolarHBondContact O-CB 3.44Å; S324-K327 PolarHBondContact O-N 2.63Å; S324-S328 PolarHBondContact O-N 3.12Å; S324-S328 VanDerWaalsContact O-N 3.11Å
325	I	59.1	Low	64.2	Low	11 Å²	11	55.9 Å²	55.9	6%	0.056	32%	0.32	C	S	.	.	H	α-helix	trans	-66.6	-50.4	-179.1	-60	154.6	0	0	0	109.1	R271 A308 E321 K327 S328 L329	R271-I325 HydrophobicContact CB-CD1 3.48Å; R271-I325 VanDerWaalsContact CB-CD1 3.48Å; R271-I325 HydrophobicContact CB-CG1 4.28Å; R271-I325 HydrophobicContact CG-CD1 3.63Å; A308-I325 HydrophobicContact CB-CG2 3.91Å; E321-I325 HydrophobicContact CG-CD1 4Å; E321-I325 PolarHBondContact O-N 3.19Å; I325-K327 PolarHBondContact O-N 2.92Å; I325-S328 PolarHBondContact O-N 2.93Å; I325-S328 VanDerWaalsContact O-N 3.15Å; I325-S328 PolarHBondContact O-OG 2.89Å; I325-L329 PolarHBondContact O-N 2.84Å
326	N	67.2	Low	65.8	Low	38 Å²	38	50.2 Å²	50.2	20%	0.203	28%	0.28	C	S	.	.	H	α-helix	trans	-63.3	-29.1	177.1	-75.3	-53.8	0	0	0	112	T322 S330	T322-N326 WeakPolarHBondContact O-CB 3.31Å; T322-N326 PolarHBondContact O-N 2.78Å; T322-N326 PolarHBondContact O-ND2 2.81Å; N326-S330 WeakPolarHBondContact O-CA 3.49Å; N326-S330 WeakPolarHBondContact O-CB 3.38Å; N326-S330 PolarHBondContact O-N 2.92Å; N326-S330 PolarHBondContact O-OG 2.93Å
327	K	71.1	Confident	67.2	Low	67 Å²	67	46 Å²	46	29%	0.291	25%	0.252	S	S	.	.	H	α-helix	trans	-65.4	-43.8	174.3	178.7	174.7	176.6	177.7	0	111.9	T323 S324 I325 C331 E368	T323-K327 WeakPolarHBondContact O-CB 3.42Å; T323-K327 PolarHBondContact O-N 2.78Å; S324-K327 WeakPolarHBondContact O-CB 3.44Å; S324-K327 PolarHBondContact O-N 2.63Å; I325-K327 PolarHBondContact O-N 2.92Å; K327-C331 VanDerWaalsContact O-CB 3.24Å; K327-C331 WeakPolarHBondContact O-CB 3.23Å; K327-C331 PolarHBondContact O-N 2.97Å; K327-E368 WeakPolarHBondContact CE-OE2 3.36Å; K327-E368 IonicContact NZ-OE1 2.81Å; K327-E368 PolarHBondContact NZ-OE1 3.21Å; K327-E368 IonicContact NZ-OE2 2.89Å; K327-E368 PolarHBondContact NZ-OE2 3.15Å
328	S	75.4	Confident	68.2	Low	3 Å²	3	47.2 Å²	47.2	2%	0.021	26%	0.255	C	S	.	.	H	α-helix	trans	-60.5	-48.1	177.3	69	0	0	0	0	112	H273 S324 I325 L332 N370	H273-S328 PolarHBondContact NE2-OG 3.43Å; S324-S328 PolarHBondContact O-N 3.12Å; S324-S328 VanDerWaalsContact O-N 3.11Å; I325-S328 PolarHBondContact O-N 2.93Å; I325-S328 VanDerWaalsContact O-N 3.15Å; I325-S328 PolarHBondContact O-OG 2.89Å; S328-L332 PolarHBondContact O-N 3.08Å; S328-L332 VanDerWaalsContact O-N 3.14Å; S328-N370 WeakPolarHBondContact CA-ND2 3.41Å; S328-N370 PolarHBondContact O-ND2 2.84Å
329	L	81.3	Confident	69.3	Low	12 Å²	12	45 Å²	45	6%	0.063	24%	0.237	C	C	.	.	H	α-helix	trans	-72	-37.3	178.4	-73.4	177.4	0	0	0	113.7	Y153 L307 A308 G309 I325 L332 G333	Y153-L329 HydrophobicContact CE2-CD2 4.26Å; L307-L329 HydrophobicContact CB-CD2 4.34Å; L307-L329 HydrophobicContact CD1-CD2 4.46Å; A308-L329 HydrophobicContact CB-CD1 4.35Å; G309-L329 WeakPolarHBondContact O-CD1 3.26Å; I325-L329 PolarHBondContact O-N 2.84Å; L329-L332 WeakPolarHBondContact O-CB 3.46Å; L329-L332 PolarHBondContact O-N 3.19Å; L329-G333 PolarHBondContact O-N 3.43Å
330	S	73.4	Confident	70.4	Confident	68 Å²	68	39 Å²	39	48%	0.476	21%	0.206	S	C	.	.	H	α-helix	trans	-65.5	-42.1	177.7	-64.1	0	0	0	0	110.7	N326 G333 M334	N326-S330 WeakPolarHBondContact O-CA 3.49Å; N326-S330 WeakPolarHBondContact O-CB 3.38Å; N326-S330 PolarHBondContact O-N 2.92Å; N326-S330 PolarHBondContact O-OG 2.93Å; S330-G333 PolarHBondContact O-N 3.14Å; S330-M334 VanDerWaalsContact O-CG 3.28Å; S330-M334 WeakPolarHBondContact O-CG 3.31Å; S330-M334 PolarHBondContact O-N 3.17Å
331	C	75.1	Confident	71.2	Confident	17 Å²	17	36.4 Å²	36.4	12%	0.115	20%	0.197	C	C	.	.	H	α-helix	trans	-64.1	-41.9	174.9	179.1	0	0	0	0	111.6	K327 G333 M334 V335 N370	K327-C331 VanDerWaalsContact O-CB 3.24Å; K327-C331 WeakPolarHBondContact O-CB 3.23Å; K327-C331 PolarHBondContact O-N 2.97Å; C331-G333 VanDerWaalsContact C-N 3.31Å; C331-G333 PolarHBondContact O-N 2.97Å; C331-M334 PolarHBondContact O-N 2.79Å; C331-V335 VanDerWaalsContact O-CG2 3.26Å; C331-V335 WeakPolarHBondContact O-CG2 3.46Å; C331-V335 PolarHBondContact O-N 2.92Å; C331-N370 WeakPolarHBondContact CB-ND2 3.35Å; C331-N370 PolarHBondContact SG-ND2 2.85Å
332	L	81.3	Confident	71.1	Confident	1 Å²	1	38 Å²	38	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-58.3	-44	172.1	-177.8	66.9	0	0	0	111.4	L307 S328 L329 V335 I336 L372 L380 Y408	L307-L332 HydrophobicContact CD1-CD2 3.86Å; L307-L332 HydrophobicContact CD2-CD2 4.45Å; S328-L332 PolarHBondContact O-N 3.08Å; S328-L332 VanDerWaalsContact O-N 3.14Å; L329-L332 WeakPolarHBondContact O-CB 3.46Å; L329-L332 PolarHBondContact O-N 3.19Å; L332-V335 PolarHBondContact O-N 2.82Å; L332-I336 HydrophobicContact CD1-CD1 4.43Å; L332-I336 HydrophobicContact CG-CD1 4.2Å; L332-I336 VanDerWaalsContact O-CG1 3.3Å; L332-I336 WeakPolarHBondContact O-CG1 3.4Å; L332-I336 PolarHBondContact O-N 2.87Å; L332-I336 VanDerWaalsContact O-N 3.08Å; L332-L372 HydrophobicContact CD2-CD2 4.35Å; L332-L380 HydrophobicContact CD1-CD1 3.45Å; L332-L380 VanDerWaalsContact CD1-CD1 3.45Å; L332-Y408 WeakPolarHBondContact CD2-OH 3.43Å
333	G	78.2	Confident	71.1	Confident	11 Å²	11	38.9 Å²	38.9	11%	0.113	22%	0.216	C	C	.	.	H	α-helix	trans	-60.4	-43.9	174.9	0	0	0	0	0	113.2	L329 S330 C331 I336 D337	L329-G333 PolarHBondContact O-N 3.43Å; S330-G333 PolarHBondContact O-N 3.14Å; C331-G333 VanDerWaalsContact C-N 3.31Å; C331-G333 PolarHBondContact O-N 2.97Å; G333-I336 PolarHBondContact O-N 3.26Å; G333-D337 PolarHBondContact O-N 3.36Å
334	M	74.8	Confident	70.3	Confident	102 Å²	102	43.4 Å²	43.4	50%	0.502	22%	0.224	S	C	.	.	H	α-helix	trans	-62.8	-42	176.8	-70.3	169.6	64.9	0	0	112.4	S330 C331 I336 D337 Q338	S330-M334 VanDerWaalsContact O-CG 3.28Å; S330-M334 WeakPolarHBondContact O-CG 3.31Å; S330-M334 PolarHBondContact O-N 3.17Å; C331-M334 PolarHBondContact O-N 2.79Å; M334-I336 VanDerWaalsContact C-N 3.32Å; M334-I336 PolarHBondContact O-N 2.64Å; M334-D337 PolarHBondContact O-N 2.91Å; M334-Q338 WeakPolarHBondContact O-CG 3.46Å; M334-Q338 PolarHBondContact O-N 2.98Å
335	V	75.5	Confident	69.2	Low	3 Å²	3	50.4 Å²	50.4	2%	0.018	25%	0.253	C	S	.	.	H	α-helix	trans	-59.9	-46.1	176.1	169.3	0	0	0	0	110.4	C331 L332 D337 Q338 L339 F361 F373 L380	C331-V335 VanDerWaalsContact O-CG2 3.26Å; C331-V335 WeakPolarHBondContact O-CG2 3.46Å; C331-V335 PolarHBondContact O-N 2.92Å; L332-V335 PolarHBondContact O-N 2.82Å; V335-D337 VanDerWaalsContact C-N 3.35Å; V335-Q338 PolarHBondContact O-N 3.31Å; V335-L339 HydrophobicContact CG1-CD1 3.76Å; V335-L339 HydrophobicContact CG1-CG 4.29Å; V335-L339 WeakPolarHBondContact O-CB 3.2Å; V335-L339 VanDerWaalsContact O-CG 3.32Å; V335-L339 WeakPolarHBondContact O-CG 3.49Å; V335-L339 PolarHBondContact O-N 3.4Å; V335-F361 HydrophobicContact CG2-CE1 4.09Å; V335-F361 HydrophobicContact CG2-CE2 4.02Å; V335-F361 HydrophobicContact CG2-CZ 3.34Å; V335-F373 HydrophobicContact CB-CD2 4.36Å; V335-F373 HydrophobicContact CB-CE2 4.31Å; V335-F373 HydrophobicContact CG1-CD2 4.1Å; V335-F373 HydrophobicContact CG1-CE2 3.69Å; V335-F373 HydrophobicContact CG2-CD2 3.58Å; V335-F373 HydrophobicContact CG2-CE2 3.62Å; V335-F373 HydrophobicContact CG2-CG 4.27Å; V335-F373 HydrophobicContact CG2-CZ 4.34Å; V335-L380 HydrophobicContact CG1-CD1 4.37Å
336	I	80.3	Confident	68.1	Low	2 Å²	2	53 Å²	53	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-64	-43.6	179.9	-69.7	172.6	0	0	0	110.8	L332 G333 M334 Q338 L339 S340 Y408 R411 A412 M415	L332-I336 HydrophobicContact CD1-CD1 4.43Å; L332-I336 HydrophobicContact CG-CD1 4.2Å; L332-I336 VanDerWaalsContact O-CG1 3.3Å; L332-I336 WeakPolarHBondContact O-CG1 3.4Å; L332-I336 PolarHBondContact O-N 2.87Å; L332-I336 VanDerWaalsContact O-N 3.08Å; G333-I336 PolarHBondContact O-N 3.26Å; M334-I336 VanDerWaalsContact C-N 3.32Å; M334-I336 PolarHBondContact O-N 2.64Å; I336-Q338 PolarHBondContact O-N 3Å; I336-L339 PolarHBondContact O-N 3.36Å; I336-S340 WeakPolarHBondContact O-CB 3.49Å; I336-S340 PolarHBondContact O-N 2.81Å; I336-S340 PolarHBondContact O-OG 2.75Å; I336-S340 VanDerWaalsContact O-OG 3.13Å; I336-Y408 HydrophobicContact CD1-CE1 4.03Å; I336-Y408 HydrophobicContact CD1-CE2 3.64Å; I336-Y408 WeakPolarHBondContact CD1-OH 3.23Å; I336-R411 HydrophobicContact CG2-CB 4.4Å; I336-A412 HydrophobicContact CG2-CB 4.1Å; I336-M415 HydrophobicContact CB-CE 4.2Å; I336-M415 HydrophobicContact CB-SD 4.02Å; I336-M415 HydrophobicContact CD1-CE 4.12Å; I336-M415 HydrophobicContact CG1-CE 3.64Å; I336-M415 HydrophobicContact CG1-SD 3.78Å; I336-M415 HydrophobicContact CG2-CE 3.82Å; I336-M415 HydrophobicContact CG2-SD 3.94Å
337	D	77	Confident	66.4	Low	37 Å²	37	57.3 Å²	57.3	20%	0.198	29%	0.292	C	S	.	.	H	α-helix	trans	-58.5	-49.9	177.9	-70.3	-14.2	0	0	0	110.4	G333 M334 V335 L339 S340 E341 R411	G333-D337 PolarHBondContact O-N 3.36Å; M334-D337 PolarHBondContact O-N 2.91Å; V335-D337 VanDerWaalsContact C-N 3.35Å; D337-L339 PolarHBondContact O-N 3.11Å; D337-S340 PolarHBondContact O-N 3.41Å; D337-S340 PolarHBondContact O-OG 3.43Å; D337-E341 WeakPolarHBondContact O-CG 3.49Å; D337-E341 PolarHBondContact O-N 3.31Å; D337-R411 VanDerWaalsContact CG-CZ 3.5Å; D337-R411 WeakPolarHBondContact OD1-CD 3.36Å; D337-R411 IonicContact OD1-CZ 3.34Å; D337-R411 IonicContact OD1-NE 3.75Å; D337-R411 PolarHBondContact OD1-NE 3.44Å; D337-R411 IonicContact OD1-NH1 3.77Å; D337-R411 PolarHBondContact OD1-NH1 3.32Å; D337-R411 IonicContact OD1-NH2 3.29Å; D337-R411 PolarHBondContact OD1-NH2 3.17Å; D337-R411 IonicContact OD2-CZ 3.91Å; D337-R411 IonicContact OD2-NH1 2.87Å; D337-R411 PolarHBondContact OD2-NH1 3.21Å; D337-R411 IonicContact OD2-NH2 2.85Å
338	Q	70.6	Confident	64.7	Low	72 Å²	72	62.6 Å²	62.6	34%	0.336	32%	0.317	S	S	.	.	H	α-helix	trans	-63.3	-44.9	178.6	-71.2	-179.2	-12.1	0	0	113.4	M334 V335 I336 S340 E341 N342	M334-Q338 WeakPolarHBondContact O-CG 3.46Å; M334-Q338 PolarHBondContact O-N 2.98Å; V335-Q338 PolarHBondContact O-N 3.31Å; I336-Q338 PolarHBondContact O-N 3Å; Q338-S340 VanDerWaalsContact C-N 3.3Å; Q338-S340 PolarHBondContact O-N 3.11Å; Q338-E341 PolarHBondContact O-N 3.4Å; Q338-N342 VanDerWaalsContact O-CB 3.27Å; Q338-N342 WeakPolarHBondContact O-CB 3.3Å; Q338-N342 VanDerWaalsContact O-CG 3.27Å; Q338-N342 PolarHBondContact O-N 3.33Å; Q338-N342 PolarHBondContact O-ND2 3.24Å
339	L	75.5	Confident	62.9	Low	32 Å²	32	73.7 Å²	73.7	17%	0.168	36%	0.359	C	S	.	.	H	α-helix	trans	-67.3	-33.4	177.9	-70.1	178.4	0	0	0	111.7	V335 I336 D337 A343 L380 M415	V335-L339 HydrophobicContact CG1-CD1 3.76Å; V335-L339 HydrophobicContact CG1-CG 4.29Å; V335-L339 WeakPolarHBondContact O-CB 3.2Å; V335-L339 VanDerWaalsContact O-CG 3.32Å; V335-L339 WeakPolarHBondContact O-CG 3.49Å; V335-L339 PolarHBondContact O-N 3.4Å; I336-L339 PolarHBondContact O-N 3.36Å; D337-L339 PolarHBondContact O-N 3.11Å; L339-A343 PolarHBondContact O-N 2.91Å; L339-L380 HydrophobicContact CD1-CB 4.09Å; L339-M415 HydrophobicContact CB-CG 3.96Å; L339-M415 HydrophobicContact CB-SD 3.87Å; L339-M415 HydrophobicContact CD1-SD 4.16Å
340	S	77.9	Confident	60.6	Low	10 Å²	10	78.2 Å²	78.2	7%	0.07	38%	0.383	C	S	.	.	H	α-helix	trans	-72.5	-32.7	177.8	76.8	0	0	0	0	113.3	I336 D337 Q338 R411	I336-S340 WeakPolarHBondContact O-CB 3.49Å; I336-S340 PolarHBondContact O-N 2.81Å; I336-S340 PolarHBondContact O-OG 2.75Å; I336-S340 VanDerWaalsContact O-OG 3.13Å; D337-S340 PolarHBondContact O-N 3.41Å; D337-S340 PolarHBondContact O-OG 3.43Å; Q338-S340 VanDerWaalsContact C-N 3.3Å; Q338-S340 PolarHBondContact O-N 3.11Å; S340-R411 VanDerWaalsContact CB-O 3.29Å; S340-R411 WeakPolarHBondContact CB-O 3.45Å
341	E	69.9	Low	58.8	Low	125 Å²	125	76.5 Å²	76.5	58%	0.584	37%	0.371	S	S	*	.	H	α-helix	trans	-77.9	-43.7	176.1	-73.6	175.4	-176.3	0	0	111.3	D337 Q338 A343 R344	D337-E341 WeakPolarHBondContact O-CG 3.49Å; D337-E341 PolarHBondContact O-N 3.31Å; Q338-E341 PolarHBondContact O-N 3.4Å; E341-A343 PolarHBondContact O-N 2.71Å; E341-R344 PolarHBondContact O-N 3.26Å; E341-R344 VanDerWaalsContact O-N 3.16Å
342	N	56.5	Low	57.2	Low	65 Å²	65	77.8 Å²	77.8	35%	0.348	38%	0.383	S	S	.	.	H	α-helix	trans	-64.8	-25.4	-178.9	-77.8	-17.3	0	0	0	113.2	Q338 R344 F345 V346	Q338-N342 VanDerWaalsContact O-CB 3.27Å; Q338-N342 WeakPolarHBondContact O-CB 3.3Å; Q338-N342 VanDerWaalsContact O-CG 3.27Å; Q338-N342 PolarHBondContact O-N 3.33Å; Q338-N342 PolarHBondContact O-ND2 3.24Å; N342-R344 PolarHBondContact O-N 3.34Å; N342-F345 PolarHBondContact O-N 3.02Å; N342-V346 WeakPolarHBondContact O-CG2 3.28Å; N342-V346 PolarHBondContact O-N 2.9Å
343	A	51.7	Low	55.1	Low	42 Å²	42	81.7 Å²	81.7	35%	0.347	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-19.5	173.5	0	0	0	0	0	113.6	L339 E341 R414 I416	L339-A343 PolarHBondContact O-N 2.91Å; E341-A343 PolarHBondContact O-N 2.71Å; A343-R414 WeakPolarHBondContact CB-O 3.42Å; A343-I416 HydrophobicContact CB-CD1 4.33Å
344	R	44.4	Very low	53.2	Low	179 Å²	179	83.2 Å²	83.2	68%	0.675	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-23.4	176.3	-65.2	178.9	173.2	-169.5	-8	115.1	E341 N342	E341-R344 PolarHBondContact O-N 3.26Å; E341-R344 VanDerWaalsContact O-N 3.16Å; N342-R344 PolarHBondContact O-N 3.34Å
345	F	38	Very low	51.4	Low	162 Å²	162	85.3 Å²	85.3	71%	0.711	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.6	12.3	-166	-72.8	-76	0	0	0	114.7	N342 N347	N342-F345 PolarHBondContact O-N 3.02Å; F345-N347 VanDerWaalsContact C-N 3.27Å; F345-N347 PolarHBondContact O-N 3.18Å
346	V	35.9	Very low	49.7	Very low	65 Å²	65	87.3 Å²	87.3	39%	0.394	42%	0.421	S	S	.	.			trans	-71.2	85.6	174.5	-174.2	0	0	0	0	110.1	N342 D350	N342-V346 WeakPolarHBondContact O-CG2 3.28Å; N342-V346 PolarHBondContact O-N 2.9Å; V346-D350 WeakPolarHBondContact CG1-O 3.33Å
347	N	30.1	Very low	47.8	Very low	128 Å²	128	91.2 Å²	91.2	68%	0.684	45%	0.453	S	S	*	.			trans	-60.9	143.7	163.8	-79.4	-36.9	0	0	0	109.9	F345 R349 D350	F345-N347 VanDerWaalsContact C-N 3.27Å; F345-N347 PolarHBondContact O-N 3.18Å; N347-R349 PolarHBondContact O-N 2.99Å; N347-D350 PolarHBondContact O-N 3.22Å
348	H	34.9	Very low	45.9	Very low	178 Å²	178	94.3 Å²	94.3	82%	0.824	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	14.6	-164.1	-69.6	-64.5	0	0	0	119
349	R	38.7	Very low	44.3	Very low	236 Å²	236	92.1 Å²	92.1	89%	0.891	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.7	-27.6	178.6	-75.2	-174.6	173	174.9	-2	115.2	N347	N347-R349 PolarHBondContact O-N 2.99Å
350	D	32.3	Very low	42.7	Very low	108 Å²	108	92.4 Å²	92.4	58%	0.578	47%	0.471	S	S	*	.	S	Bend	trans	-105.9	98.6	-176.9	-63.4	-35.3	0	0	0	109.8	V346 N347	V346-D350 WeakPolarHBondContact CG1-O 3.33Å; N347-D350 PolarHBondContact O-N 3.22Å
351	S	36.9	Very low	41	Very low	32 Å²	32	93.6 Å²	93.6	22%	0.224	48%	0.475	C	S	.	.			trans	-62.9	148.3	178.3	73.2	0	0	0	0	110.7	L353 T354 W355	S351-L353 PolarHBondContact O-N 3.42Å; S351-L353 VanDerWaalsContact O-N 3.09Å; S351-T354 PolarHBondContact N-OG1 2.96Å; S351-T354 WeakPolarHBondContact O-CA 3.39Å; S351-T354 VanDerWaalsContact O-CB 3.24Å; S351-T354 WeakPolarHBondContact O-CB 3.26Å; S351-T354 PolarHBondContact O-N 3.46Å; S351-T354 PolarHBondContact O-OG1 3.44Å; S351-T354 PolarHBondContact OG-N 2.85Å; S351-T354 PolarHBondContact OG-OG1 3.46Å; S351-W355 PolarHBondContact O-N 2.86Å
352	A	39.8	Very low	39.5	Very low	44 Å²	44	93 Å²	93	36%	0.364	48%	0.475	S	S	.	.	H	α-helix	trans	-53.5	-30.8	170.2	0	0	0	0	0	111.5	W355 Y356	A352-W355 WeakPolarHBondContact O-CB 3.38Å; A352-W355 PolarHBondContact O-N 3.35Å; A352-Y356 WeakPolarHBondContact O-CB 3.48Å; A352-Y356 PolarHBondContact O-N 3.46Å
353	L	38.5	Very low	38.4	Very low	82 Å²	82	98 Å²	98	43%	0.429	49%	0.489	S	S	.	.	H	α-helix	trans	-66	-31.5	170.4	-79.3	164.7	0	0	0	113.7	S351 W355 Y356 A357	S351-L353 PolarHBondContact O-N 3.42Å; S351-L353 VanDerWaalsContact O-N 3.09Å; L353-W355 VanDerWaalsContact C-N 3.33Å; L353-Y356 HydrophobicContact CD2-CD1 4.42Å; L353-Y356 CarbonylContact O-C 3.6Å; L353-Y356 WeakPolarHBondContact O-CA 3.4Å; L353-Y356 VanDerWaalsContact O-CB 3.31Å; L353-Y356 WeakPolarHBondContact O-CB 3.32Å; L353-Y356 PolarHBondContact O-N 2.93Å; L353-Y356 VanDerWaalsContact O-N 3.17Å; L353-A357 WeakPolarHBondContact O-CB 3.48Å; L353-A357 PolarHBondContact O-N 2.82Å
354	T	38.5	Very low	37.9	Very low	43 Å²	43	99.3 Å²	99.3	26%	0.264	49%	0.492	S	S	.	.	H	α-helix	trans	-65.3	-39.7	173.8	-44.8	0	0	0	0	110	S351 Y356 N358	S351-T354 PolarHBondContact N-OG1 2.96Å; S351-T354 WeakPolarHBondContact O-CA 3.39Å; S351-T354 VanDerWaalsContact O-CB 3.24Å; S351-T354 WeakPolarHBondContact O-CB 3.26Å; S351-T354 PolarHBondContact O-N 3.46Å; S351-T354 PolarHBondContact O-OG1 3.44Å; S351-T354 PolarHBondContact OG-N 2.85Å; S351-T354 PolarHBondContact OG-OG1 3.46Å; T354-Y356 VanDerWaalsContact C-N 3.33Å; T354-N358 WeakPolarHBondContact O-CB 3.42Å; T354-N358 PolarHBondContact O-N 2.85Å
355	W	37	Very low	37.5	Very low	146 Å²	146	99.2 Å²	99.2	55%	0.553	49%	0.492	S	S	*	.	H	α-helix	trans	-65.2	-36.9	169.9	-109.5	73.4	0	0	0	112.7	S351 A352 L353	S351-W355 PolarHBondContact O-N 2.86Å; A352-W355 WeakPolarHBondContact O-CB 3.38Å; A352-W355 PolarHBondContact O-N 3.35Å; L353-W355 VanDerWaalsContact C-N 3.33Å
356	Y	40	Very low	37.3	Very low	46 Å²	46	101.4 Å²	101.4	18%	0.18	50%	0.495	C	S	.	.	H	α-helix	trans	-70	-34.8	178.5	-142	-106	0	0	0	113.4	A352 L353 T354 F373 K377	A352-Y356 WeakPolarHBondContact O-CB 3.48Å; A352-Y356 PolarHBondContact O-N 3.46Å; L353-Y356 HydrophobicContact CD2-CD1 4.42Å; L353-Y356 CarbonylContact O-C 3.6Å; L353-Y356 WeakPolarHBondContact O-CA 3.4Å; L353-Y356 VanDerWaalsContact O-CB 3.31Å; L353-Y356 WeakPolarHBondContact O-CB 3.32Å; L353-Y356 PolarHBondContact O-N 2.93Å; L353-Y356 VanDerWaalsContact O-N 3.17Å; T354-Y356 VanDerWaalsContact C-N 3.33Å; Y356-F373 HydrophobicContact CE2-CZ 4.29Å; Y356-K377 HydrophobicContact CE1-CD 4.01Å; Y356-K377 HydrophobicContact CE1-CG 3.43Å; Y356-K377 VanDerWaalsContact CE1-CG 3.43Å; Y356-K377 WeakPolarHBondContact OH-CA 3.47Å; Y356-K377 WeakPolarHBondContact OH-CG 3.28Å; Y356-K377 PolarHBondContact OH-O 2.7Å
357	A	39.6	Very low	37.3	Very low	83 Å²	83	101.4 Å²	101.4	69%	0.686	51%	0.509	S	S	*	.	H	α-helix	trans	-93	-32	-178	0	0	0	0	0	112.6	L353 G359	L353-A357 WeakPolarHBondContact O-CB 3.48Å; L353-A357 PolarHBondContact O-N 2.82Å; A357-G359 PolarHBondContact O-N 2.69Å
358	N	37.4	Very low	38	Very low	103 Å²	103	99.5 Å²	99.5	55%	0.551	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	8.4	177	-73.7	-2.1	0	0	0	113.5	T354 S360	T354-N358 WeakPolarHBondContact O-CB 3.42Å; T354-N358 PolarHBondContact O-N 2.85Å; N358-S360 PolarHBondContact O-N 2.94Å
359	G	36.4	Very low	38.8	Very low	26 Å²	26	98.7 Å²	98.7	27%	0.268	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	6.1	170	0	0	0	0	0	114.9	A357 F361 L362 R363	A357-G359 PolarHBondContact O-N 2.69Å; G359-F361 PolarHBondContact O-N 2.91Å; G359-L362 WeakPolarHBondContact O-CA 3.39Å; G359-L362 WeakPolarHBondContact O-CB 3.36Å; G359-L362 PolarHBondContact O-N 2.87Å; G359-R363 PolarHBondContact O-N 3.41Å
360	S	41.6	Very low	40.3	Very low	37 Å²	37	88.2 Å²	88.2	26%	0.259	45%	0.451	S	S	.	.	S	Bend	trans	-61	-31.9	176	-56	0	0	0	0	111.6	N358	N358-S360 PolarHBondContact O-N 2.94Å
361	F	43.2	Very low	42.5	Very low	36 Å²	36	83.8 Å²	83.8	16%	0.158	43%	0.429	C	S	.	.	G	3₁₀ helix	trans	-77.5	-26.4	171.6	-165.9	-97.6	0	0	0	113.3	V335 G359 R363 V364 F373	V335-F361 HydrophobicContact CG2-CE1 4.09Å; V335-F361 HydrophobicContact CG2-CE2 4.02Å; V335-F361 HydrophobicContact CG2-CZ 3.34Å; G359-F361 PolarHBondContact O-N 2.91Å; F361-R363 PolarHBondContact O-N 3.17Å; F361-R363 VanDerWaalsContact O-N 3.13Å; F361-V364 HydrophobicContact CE2-CG2 4.3Å; F361-V364 HydrophobicContact CZ-CG2 4.27Å; F361-V364 WeakPolarHBondContact O-CB 3.42Å; F361-V364 WeakPolarHBondContact O-CG2 3.07Å; F361-V364 PolarHBondContact O-N 2.99Å; F361-F373 AromaticContact CD1-CE1 3.91Å; F361-F373 HydrophobicContact CD1-CE1 3.91Å; F361-F373 HydrophobicContact CD1-CZ 4.02Å; F361-F373 HydrophobicContact CE1-CD1 4.06Å; F361-F373 AromaticContact CE1-CE1 3.46Å; F361-F373 HydrophobicContact CE1-CE1 3.46Å; F361-F373 VanDerWaalsContact CE1-CE1 3.46Å; F361-F373 HydrophobicContact CE1-CE2 4.33Å; F361-F373 AromaticContact CE1-CZ 3.62Å; F361-F373 HydrophobicContact CE1-CZ 3.62Å; F361-F373 HydrophobicContact CZ-CZ 4.4Å
362	L	37.5	Very low	44.6	Very low	111 Å²	111	82.3 Å²	82.3	58%	0.581	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-69.8	-3.6	174.6	-106.1	95.5	0	0	0	113.7	G359 V364	G359-L362 WeakPolarHBondContact O-CA 3.39Å; G359-L362 WeakPolarHBondContact O-CB 3.36Å; G359-L362 PolarHBondContact O-N 2.87Å; L362-V364 PolarHBondContact O-N 3.47Å
363	R	33.9	Very low	46.3	Very low	172 Å²	172	81.5 Å²	81.5	65%	0.649	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-73.8	-6.5	163.9	-75.1	-166.2	-176.7	-144.4	2.7	113.4	G359 F361 R365	G359-R363 PolarHBondContact O-N 3.41Å; F361-R363 PolarHBondContact O-N 3.17Å; F361-R363 VanDerWaalsContact O-N 3.13Å; R363-R365 PolarHBondContact O-N 3.33Å
364	V	42.3	Very low	48.3	Very low	68 Å²	68	81.9 Å²	81.9	41%	0.412	40%	0.403	S	S	.	.	S	Bend	trans	-68.1	78.6	155.8	-175.4	0	0	0	0	107.4	F361 L362	F361-V364 HydrophobicContact CE2-CG2 4.3Å; F361-V364 HydrophobicContact CZ-CG2 4.27Å; F361-V364 WeakPolarHBondContact O-CB 3.42Å; F361-V364 WeakPolarHBondContact O-CG2 3.07Å; F361-V364 PolarHBondContact O-N 2.99Å; L362-V364 PolarHBondContact O-N 3.47Å
365	R	35.8	Very low	50.4	Low	178 Å²	178	81.3 Å²	81.3	67%	0.672	40%	0.398	S	S	*	.			trans	31.1	99.5	171.3	-68.9	-175.9	170.9	103.1	1.4	114.5	R363 G367 E368	R363-R365 PolarHBondContact O-N 3.33Å; R365-G367 PolarHBondContact O-N 3.27Å; R365-E368 HydrophobicContact CB-CB 4.16Å; R365-E368 HydrophobicContact CB-CG 4.02Å; R365-E368 PolarHBondContact O-N 2.8Å
366	R	33.9	Very low	52.6	Low	207 Å²	207	74.4 Å²	74.4	78%	0.781	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.1	-6	166.7	-135.1	177.2	-174.3	-179.7	1.8	115.9	Q1030	R366-Q1030 VanDerWaalsContact NH1-OE1 3.09Å
367	G	36	Very low	54.4	Low	66 Å²	66	75.7 Å²	75.7	68%	0.68	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.9	-11.1	173.4	0	0	0	0	0	115.6	R365 K369	R365-G367 PolarHBondContact O-N 3.27Å; G367-K369 PolarHBondContact O-N 3.29Å
368	E	43.9	Very low	56	Low	88 Å²	88	75 Å²	75	41%	0.411	36%	0.363	S	S	.	.			trans	-106.4	87.8	-171.6	-64.8	-160.6	130.5	0	0	111.5	K327 R365 N370	K327-E368 WeakPolarHBondContact CE-OE2 3.36Å; K327-E368 IonicContact NZ-OE1 2.81Å; K327-E368 PolarHBondContact NZ-OE1 3.21Å; K327-E368 IonicContact NZ-OE2 2.89Å; K327-E368 PolarHBondContact NZ-OE2 3.15Å; R365-E368 HydrophobicContact CB-CB 4.16Å; R365-E368 HydrophobicContact CB-CG 4.02Å; R365-E368 PolarHBondContact O-N 2.8Å; E368-N370 PolarHBondContact O-N 2.91Å
369	K	52.5	Low	58.1	Low	160 Å²	160	70.6 Å²	70.6	70%	0.696	34%	0.34	S	S	*	.			trans	-40.3	95.2	165.4	-54.5	167.9	-174.8	176.6	0	110.9	E206 G367	E206-K369 WeakPolarHBondContact CG-O 3.46Å; G367-K369 PolarHBondContact O-N 3.29Å
370	N	69.1	Low	60.2	Low	16 Å²	16	69.4 Å²	69.4	9%	0.086	33%	0.327	C	S	.	.			trans	-101.3	95.4	158.4	-170.1	-44.6	0	0	0	107.9	S328 C331 E368 L372 F373 R374	S328-N370 WeakPolarHBondContact CA-ND2 3.41Å; S328-N370 PolarHBondContact O-ND2 2.84Å; C331-N370 WeakPolarHBondContact CB-ND2 3.35Å; C331-N370 PolarHBondContact SG-ND2 2.85Å; E368-N370 PolarHBondContact O-N 2.91Å; N370-L372 VanDerWaalsContact C-N 3.33Å; N370-L372 WeakPolarHBondContact OD1-CB 3.38Å; N370-L372 PolarHBondContact OD1-N 2.77Å; N370-L372 VanDerWaalsContact OD1-N 3.14Å; N370-F373 HydrophobicContact CB-CB 4.44Å; N370-F373 PolarHBondContact OD1-N 2.84Å; N370-R374 WeakPolarHBondContact O-CG 3.44Å; N370-R374 PolarHBondContact O-N 3.08Å
371	C	78.5	Confident	61.6	Low	15 Å²	15	68.4 Å²	68.4	10%	0.101	32%	0.324	C	S	.	.	H	α-helix	trans	-64.7	-40.9	-178.5	-62	0	0	0	0	110.9	M203 E206 L208 I223 R374 L375	M203-C371 HydrophobicContact SD-CB 3.82Å; E206-C371 VanDerWaalsContact OE2-CB 3.31Å; E206-C371 WeakPolarHBondContact OE2-CB 3.4Å; E206-C371 PolarHBondContact OE2-N 2.61Å; E206-C371 PolarHBondContact OE2-SG 2.91Å; L208-C371 HydrophobicContact CD2-CB 4.23Å; I223-C371 HydrophobicContact CD1-CB 3.65Å; C371-R374 PolarHBondContact O-N 2.74Å; C371-L375 WeakPolarHBondContact O-CG 3.5Å; C371-L375 PolarHBondContact O-N 3.09Å
372	L	80.8	Confident	63.4	Low	2 Å²	2	67.2 Å²	67.2	1%	0.01	32%	0.321	C	S	.	.	H	α-helix	trans	-58.8	-52.9	-178.3	179.3	64.6	0	0	0	111.8	M203 H273 L307 L332 N370 R374 L375 L376	M203-L372 HydrophobicContact CE-CB 3.68Å; M203-L372 HydrophobicContact CE-CD1 3.32Å; M203-L372 HydrophobicContact CE-CG 4.08Å; H273-L372 HydrophobicContact CB-CD1 4.34Å; L307-L372 HydrophobicContact CD2-CD1 3.92Å; L307-L372 HydrophobicContact CD2-CD2 3.9Å; L332-L372 HydrophobicContact CD2-CD2 4.35Å; N370-L372 VanDerWaalsContact C-N 3.33Å; N370-L372 WeakPolarHBondContact OD1-CB 3.38Å; N370-L372 PolarHBondContact OD1-N 2.77Å; N370-L372 VanDerWaalsContact OD1-N 3.14Å; L372-R374 VanDerWaalsContact C-N 3.32Å; L372-R374 PolarHBondContact O-N 3.15Å; L372-L375 PolarHBondContact O-N 2.92Å; L372-L376 HydrophobicContact CD1-CD1 3.5Å; L372-L376 HydrophobicContact CD1-CG 4.24Å; L372-L376 HydrophobicContact CG-CD1 3.91Å; L372-L376 WeakPolarHBondContact O-CB 3.28Å; L372-L376 VanDerWaalsContact O-CG 3.24Å; L372-L376 WeakPolarHBondContact O-CG 3.18Å; L372-L376 PolarHBondContact O-N 3.47Å; L372-L376 VanDerWaalsContact O-N 3.11Å
373	F	75.6	Confident	65.8	Low	26 Å²	26	62.8 Å²	62.8	11%	0.114	30%	0.298	C	S	.	.	H	α-helix	trans	-60.7	-42.4	178.3	170.3	-106.5	0	0	0	111.8	V335 Y356 F361 N370 L375 L376 K377	V335-F373 HydrophobicContact CB-CD2 4.36Å; V335-F373 HydrophobicContact CB-CE2 4.31Å; V335-F373 HydrophobicContact CG1-CD2 4.1Å; V335-F373 HydrophobicContact CG1-CE2 3.69Å; V335-F373 HydrophobicContact CG2-CD2 3.58Å; V335-F373 HydrophobicContact CG2-CE2 3.62Å; V335-F373 HydrophobicContact CG2-CG 4.27Å; V335-F373 HydrophobicContact CG2-CZ 4.34Å; Y356-F373 HydrophobicContact CE2-CZ 4.29Å; F361-F373 AromaticContact CD1-CE1 3.91Å; F361-F373 HydrophobicContact CD1-CE1 3.91Å; F361-F373 HydrophobicContact CD1-CZ 4.02Å; F361-F373 HydrophobicContact CE1-CD1 4.06Å; F361-F373 AromaticContact CE1-CE1 3.46Å; F361-F373 HydrophobicContact CE1-CE1 3.46Å; F361-F373 VanDerWaalsContact CE1-CE1 3.46Å; F361-F373 HydrophobicContact CE1-CE2 4.33Å; F361-F373 AromaticContact CE1-CZ 3.62Å; F361-F373 HydrophobicContact CE1-CZ 3.62Å; F361-F373 HydrophobicContact CZ-CZ 4.4Å; N370-F373 HydrophobicContact CB-CB 4.44Å; N370-F373 PolarHBondContact OD1-N 2.84Å; F373-L375 PolarHBondContact O-N 2.84Å; F373-L376 CarbonylContact O-C 3.54Å; F373-L376 PolarHBondContact O-N 3.48Å; F373-L376 VanDerWaalsContact O-N 3.11Å; F373-K377 PolarHBondContact O-N 3.47Å
374	R	79.8	Confident	68.5	Low	91 Å²	91	54.7 Å²	54.7	34%	0.343	27%	0.268	S	S	.	.	H	α-helix	trans	-60.7	-42.8	178.6	-77.1	-171.5	62.5	176.2	-2.5	112.7	I223 D225 V231 N370 C371 L372 L376 K377	I223-R374 HydrophobicContact CD1-CB 4.35Å; I223-R374 HydrophobicContact CG2-CB 4.4Å; I223-R374 PolarHBondContact O-NH2 3.43Å; D225-R374 IonicContact OD1-CZ 3.76Å; D225-R374 IonicContact OD1-NH2 2.69Å; D225-R374 PolarHBondContact OD1-NH2 2.76Å; D225-R374 IonicContact OD2-NH2 3.67Å; D225-R374 PolarHBondContact OD2-NH2 2.91Å; V231-R374 WeakPolarHBondContact CG1-O 3.2Å; N370-R374 WeakPolarHBondContact O-CG 3.44Å; N370-R374 PolarHBondContact O-N 3.08Å; C371-R374 PolarHBondContact O-N 2.74Å; L372-R374 VanDerWaalsContact C-N 3.32Å; L372-R374 PolarHBondContact O-N 3.15Å; R374-L376 PolarHBondContact O-N 3.1Å; R374-K377 VanDerWaalsContact O-CB 3.27Å; R374-K377 WeakPolarHBondContact O-CB 3.43Å; R374-K377 PolarHBondContact O-N 3.3Å
375	L	83.4	Confident	70.9	Confident	31 Å²	31	54 Å²	54	16%	0.162	26%	0.26	C	S	.	.	H	α-helix	trans	-68	-25.8	177.1	-66.2	-178.2	0	0	0	112.7	L201 M203 L208 I223 V231 V233 L275 C371 L372 F373	L201-L375 HydrophobicContact CD2-CD1 3.49Å; L201-L375 VanDerWaalsContact CD2-CD1 3.49Å; M203-L375 HydrophobicContact CE-CD1 4.05Å; M203-L375 HydrophobicContact CG-CD1 4.43Å; M203-L375 HydrophobicContact SD-CD1 3.41Å; M203-L375 WeakPolarHBondContact SD-CD1 3.17Å; M203-L375 HydrophobicContact SD-CG 4.44Å; L208-L375 HydrophobicContact CD2-CD1 4.46Å; I223-L375 HydrophobicContact CD1-CD1 4.45Å; I223-L375 HydrophobicContact CD1-CD2 3.87Å; I223-L375 HydrophobicContact CD1-CG 3.88Å; I223-L375 HydrophobicContact CG1-CD2 4.03Å; I223-L375 HydrophobicContact CG2-CD2 4.14Å; V231-L375 HydrophobicContact CG1-CD2 4.36Å; V233-L375 HydrophobicContact CG2-CD1 4.49Å; V233-L375 HydrophobicContact CG2-CD2 3.53Å; L275-L375 HydrophobicContact CD2-CB 4.03Å; L275-L375 HydrophobicContact CD2-CD1 3.91Å; C371-L375 WeakPolarHBondContact O-CG 3.5Å; C371-L375 PolarHBondContact O-N 3.09Å; L372-L375 PolarHBondContact O-N 2.92Å; F373-L375 PolarHBondContact O-N 2.84Å
376	L	83	Confident	73.8	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	10.6	-178.5	-59.4	177.1	0	0	0	113.5	F151 L275 V305 L372 F373 R374 D378 S379 L380	F151-L376 HydrophobicContact CD1-CD1 4.21Å; F151-L376 HydrophobicContact CE1-CB 4.49Å; F151-L376 HydrophobicContact CE1-CD1 3.31Å; F151-L376 HydrophobicContact CE1-CD2 3.57Å; F151-L376 HydrophobicContact CE1-CG 3.92Å; F151-L376 HydrophobicContact CZ-CB 4.34Å; F151-L376 HydrophobicContact CZ-CD1 3.87Å; F151-L376 HydrophobicContact CZ-CD2 4Å; F151-L376 HydrophobicContact CZ-CG 4.27Å; L275-L376 HydrophobicContact CD2-CD2 4.38Å; V305-L376 HydrophobicContact CG2-CD2 3.99Å; L372-L376 HydrophobicContact CD1-CD1 3.5Å; L372-L376 HydrophobicContact CD1-CG 4.24Å; L372-L376 HydrophobicContact CG-CD1 3.91Å; L372-L376 WeakPolarHBondContact O-CB 3.28Å; L372-L376 VanDerWaalsContact O-CG 3.24Å; L372-L376 WeakPolarHBondContact O-CG 3.18Å; L372-L376 PolarHBondContact O-N 3.47Å; L372-L376 VanDerWaalsContact O-N 3.11Å; F373-L376 CarbonylContact O-C 3.54Å; F373-L376 PolarHBondContact O-N 3.48Å; F373-L376 VanDerWaalsContact O-N 3.11Å; R374-L376 PolarHBondContact O-N 3.1Å; L376-D378 VanDerWaalsContact C-N 3.33Å; L376-D378 PolarHBondContact O-N 2.86Å; L376-S379 WeakPolarHBondContact O-CA 3.36Å; L376-S379 VanDerWaalsContact O-CB 3.31Å; L376-S379 WeakPolarHBondContact O-CB 3.4Å; L376-S379 PolarHBondContact O-N 3.14Å; L376-L380 PolarHBondContact O-N 2.88Å
377	K	77.5	Confident	76.7	Confident	72 Å²	72	36.6 Å²	36.6	31%	0.313	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-52.1	-49.2	-176.8	-174.1	-175.9	-179.8	-178.7	0	112	V231 Y356 F373 R374 S379	V231-K377 HydrophobicContact CG2-CB 4.23Å; V231-K377 HydrophobicContact CG2-CD 3.85Å; Y356-K377 HydrophobicContact CE1-CD 4.01Å; Y356-K377 HydrophobicContact CE1-CG 3.43Å; Y356-K377 VanDerWaalsContact CE1-CG 3.43Å; Y356-K377 WeakPolarHBondContact OH-CA 3.47Å; Y356-K377 WeakPolarHBondContact OH-CG 3.28Å; Y356-K377 PolarHBondContact OH-O 2.7Å; F373-K377 PolarHBondContact O-N 3.47Å; R374-K377 VanDerWaalsContact O-CB 3.27Å; R374-K377 WeakPolarHBondContact O-CB 3.43Å; R374-K377 PolarHBondContact O-N 3.3Å; K377-S379 PolarHBondContact O-N 3.06Å
378	D	74.1	Confident	79.6	Confident	70 Å²	70	33.5 Å²	33.5	37%	0.374	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	-75.3	-15.3	179.3	-70.3	-14.7	0	0	0	113.3	L376 G382 N383	L376-D378 VanDerWaalsContact C-N 3.33Å; L376-D378 PolarHBondContact O-N 2.86Å; D378-G382 CarbonylContact O-C 3.53Å; D378-G382 VanDerWaalsContact O-C 3.23Å; D378-G382 VanDerWaalsContact O-CA 3.23Å; D378-G382 WeakPolarHBondContact O-CA 3.27Å; D378-N383 PolarHBondContact O-N 3.09Å
379	S	81.1	Confident	82.2	Confident	9 Å²	9	29.3 Å²	29.3	6%	0.063	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-84.3	-19.6	-180	-54.7	0	0	0	0	113.4	T149 L376 K377 T386 N417	T149-S379 WeakPolarHBondContact CB-OG 3.46Å; T149-S379 WeakPolarHBondContact CG2-OG 3.44Å; T149-S379 WeakPolarHBondContact OG1-CB 3.44Å; T149-S379 PolarHBondContact OG1-OG 3.48Å; L376-S379 WeakPolarHBondContact O-CA 3.36Å; L376-S379 VanDerWaalsContact O-CB 3.31Å; L376-S379 WeakPolarHBondContact O-CB 3.4Å; L376-S379 PolarHBondContact O-N 3.14Å; K377-S379 PolarHBondContact O-N 3.06Å; S379-T386 WeakPolarHBondContact O-CB 3.45Å; S379-T386 PolarHBondContact O-OG1 3.01Å; S379-N417 PolarHBondContact O-ND2 2.79Å
380	L	79.7	Confident	84.3	Confident	1 Å²	1	21.7 Å²	21.7	1%	0.005	11%	0.111	C	C	.	.	S	Bend	trans	-126	100	-176.2	-63.2	172.2	0	0	0	110.1	I63 F151 L332 V335 L339 L376 G382 T386 M415	I63-L380 HydrophobicContact CD1-CD2 4.22Å; F151-L380 HydrophobicContact CE2-CD2 3.82Å; F151-L380 HydrophobicContact CE2-CG 4.3Å; F151-L380 HydrophobicContact CZ-CD2 4.36Å; F151-L380 HydrophobicContact CZ-CG 4.36Å; L332-L380 HydrophobicContact CD1-CD1 3.45Å; L332-L380 VanDerWaalsContact CD1-CD1 3.45Å; V335-L380 HydrophobicContact CG1-CD1 4.37Å; L339-L380 HydrophobicContact CD1-CB 4.09Å; L376-L380 PolarHBondContact O-N 2.88Å; L380-G382 VanDerWaalsContact C-N 3.3Å; L380-T386 HydrophobicContact CD2-CG2 4.43Å; L380-M415 HydrophobicContact CD2-CE 3.96Å; L380-M415 HydrophobicContact CD2-SD 4.39Å
381	G	71.7	Confident	85.6	Confident	17 Å²	17	21 Å²	21	18%	0.175	11%	0.107	C	C	.	.	S	Bend	trans	83.5	-0.7	-173.2	0	0	0	0	0	114.6	N417	G381-N417 WeakPolarHBondContact CA-OD1 3.14Å; G381-N417 PolarHBondContact N-OD1 2.72Å
382	G	81.1	Confident	86.5	Confident	11 Å²	11	20.3 Å²	20.3	11%	0.113	10%	0.103	C	C	.	.	S	Bend	trans	-104.3	-155	-176.5	0	0	0	0	0	114.5	D378 L380 A384 R418	D378-G382 CarbonylContact O-C 3.53Å; D378-G382 VanDerWaalsContact O-C 3.23Å; D378-G382 VanDerWaalsContact O-CA 3.23Å; D378-G382 WeakPolarHBondContact O-CA 3.27Å; L380-G382 VanDerWaalsContact C-N 3.3Å; G382-A384 PolarHBondContact O-N 3.32Å; G382-R418 PolarHBondContact O-N 2.85Å
383	N	87.4	Confident	87	Confident	18 Å²	18	20.2 Å²	20.2	10%	0.096	10%	0.102	C	C	.	.	S	Bend	trans	-94.3	69	-177.2	179.5	29.9	0	0	0	112.2	N147 D378 R418 R420 N422	N147-N383 WeakPolarHBondContact CB-O 3.31Å; N147-N383 PolarHBondContact ND2-O 3.14Å; D378-N383 PolarHBondContact O-N 3.09Å; N383-R418 VanDerWaalsContact CA-O 3.32Å; N383-R418 WeakPolarHBondContact CA-O 3.27Å; N383-R420 HydrophobicContact CB-CG 4.42Å; N383-R420 VanDerWaalsContact CG-CG 3.4Å; N383-R420 VanDerWaalsContact ND2-CG 3.32Å; N383-R420 WeakPolarHBondContact ND2-CG 3.28Å; N383-R420 PolarHBondContact ND2-NE 2.82Å; N383-R420 VanDerWaalsContact OD1-CG 3.24Å; N383-R420 WeakPolarHBondContact OD1-CG 3.24Å; N383-R420 PolarHBondContact OD1-N 3.16Å; N383-R420 PolarHBondContact OD1-O 2.99Å; N383-N422 PolarHBondContact ND2-OD1 2.8Å
384	A	90.8	Very high	87.6	Confident	2 Å²	2	20 Å²	20	2%	0.017	10%	0.104	C	C	.	.	S	Bend	trans	-153.4	144.7	168.1	0	0	0	0	0	110.8	N147 G382 T386 N417	N147-A384 HydrophobicContact CB-CB 3.92Å; N147-A384 CarbonylContact O-C 3.56Å; N147-A384 VanDerWaalsContact O-CA 3.23Å; N147-A384 WeakPolarHBondContact O-CA 3.47Å; G382-A384 PolarHBondContact O-N 3.32Å; A384-T386 PolarHBondContact O-N 2.74Å; A384-N417 WeakPolarHBondContact O-CB 3.5Å; A384-N417 PolarHBondContact O-ND2 3.07Å
385	K	94	Very high	87.9	Confident	53 Å²	53	15.8 Å²	15.8	23%	0.23	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	115.2	163.1	-80.9	-178.3	172.1	-177.1	0	108.6	I61 D141 I146 N147 C148 T149 V419	I61-K385 HydrophobicContact CD1-CD 4.45Å; I61-K385 VanDerWaalsContact CD1-CE 3.49Å; I61-K385 HydrophobicContact CD1-CG 4.23Å; D141-K385 HydrophobicContact CB-CD 4.3Å; D141-K385 IonicContact OD1-NZ 3.76Å; D141-K385 PolarHBondContact OD1-NZ 3.16Å; D141-K385 WeakPolarHBondContact OD2-CD 3.49Å; D141-K385 IonicContact OD2-NZ 3.72Å; D141-K385 PolarHBondContact OD2-NZ 3.45Å; I146-K385 HydrophobicContact CG2-CB 4.39Å; I146-K385 HydrophobicContact CG2-CD 4.02Å; I146-K385 HydrophobicContact CG2-CG 4Å; N147-K385 PolarHBondContact O-N 2.86Å; C148-K385 CarbonylContact C-O 3.6Å; C148-K385 VanDerWaalsContact CA-O 3.29Å; C148-K385 WeakPolarHBondContact CA-O 3.23Å; T149-K385 PolarHBondContact N-O 2.75Å; K385-V419 HydrophobicContact CG-CB 4.44Å; K385-V419 HydrophobicContact CG-CG1 3.94Å; K385-V419 HydrophobicContact CG-CG2 3.83Å
386	T	95.3	Very high	87.9	Confident	6 Å²	6	16.7 Å²	16.7	4%	0.037	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	136.3	-173	-66.9	0	0	0	0	111	I63 C64 T149 F151 S379 L380 A384 N417	I63-T386 HydrophobicContact CD1-CG2 3.86Å; I63-T386 HydrophobicContact CG1-CG2 4.37Å; I63-T386 HydrophobicContact CG2-CG2 4.2Å; I63-T386 WeakPolarHBondContact CG2-O 3.36Å; C64-T386 PolarHBondContact N-O 3.45Å; T149-T386 CarbonylContact O-C 3.57Å; T149-T386 VanDerWaalsContact O-CA 3.31Å; T149-T386 WeakPolarHBondContact O-CA 3.27Å; F151-T386 HydrophobicContact CD2-CG2 3.76Å; F151-T386 HydrophobicContact CE2-CG2 3.37Å; F151-T386 HydrophobicContact CZ-CG2 4.46Å; S379-T386 WeakPolarHBondContact O-CB 3.45Å; S379-T386 PolarHBondContact O-OG1 3.01Å; L380-T386 HydrophobicContact CD2-CG2 4.43Å; A384-T386 PolarHBondContact O-N 2.74Å; T386-N417 WeakPolarHBondContact CB-ND2 3.19Å; T386-N417 PolarHBondContact OG1-ND2 2.86Å
387	T	96.2	Very high	88	Confident	13 Å²	13	22.7 Å²	22.7	8%	0.08	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	133.6	176.4	-59.4	0	0	0	0	110.2	C64 L134 M138 T149 L150 F151	C64-T387 HydrophobicContact CB-CG2 4.22Å; C64-T387 CarbonylContact O-C 3.55Å; C64-T387 VanDerWaalsContact O-CA 3.22Å; C64-T387 WeakPolarHBondContact O-CA 3.24Å; L134-T387 HydrophobicContact CD2-CG2 4.27Å; M138-T387 HydrophobicContact CE-CG2 3.96Å; M138-T387 WeakPolarHBondContact CE-OG1 3.32Å; T149-T387 PolarHBondContact O-N 2.9Å; L150-T387 CarbonylContact C-O 3.53Å; L150-T387 VanDerWaalsContact CA-O 3.3Å; L150-T387 WeakPolarHBondContact CA-O 3Å; L150-T387 HydrophobicContact CD1-CG2 4.26Å; F151-T387 PolarHBondContact N-O 3.15Å
388	V	96	Very high	88.4	Confident	2 Å²	2	20.3 Å²	20.3	1%	0.012	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	115.8	172.3	178.6	0	0	0	0	108.6	I63 C64 V65 A66 F151 Y408 A412	I63-V388 HydrophobicContact CG2-CG2 4.04Å; C64-V388 PolarHBondContact O-N 2.86Å; V65-V388 WeakPolarHBondContact CA-O 3.32Å; V65-V388 HydrophobicContact CG2-CB 4.42Å; A66-V388 PolarHBondContact N-O 2.8Å; F151-V388 HydrophobicContact CD2-CG2 4.08Å; V388-Y408 HydrophobicContact CG1-CE1 4.37Å; V388-A412 HydrophobicContact CG2-CB 4.15Å
389	L	97.8	Very high	89.1	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	98.4	168.6	178.2	60.7	0	0	0	109.4	A66 R68 L130 L134 L150 F151 A152 Y153 L173 T391	A66-L389 HydrophobicContact CB-CD1 4.13Å; A66-L389 CarbonylContact O-C 3.48Å; A66-L389 WeakPolarHBondContact O-CA 3.42Å; R68-L389 HydrophobicContact CB-CD1 4.15Å; L130-L389 HydrophobicContact CD1-CD1 4.03Å; L130-L389 HydrophobicContact CD2-CD2 4.23Å; L134-L389 HydrophobicContact CD1-CD1 4.14Å; L150-L389 HydrophobicContact CD2-CB 4.29Å; F151-L389 WeakPolarHBondContact O-CA 3.43Å; F151-L389 PolarHBondContact O-N 3.12Å; A152-L389 CarbonylContact C-O 3.57Å; A152-L389 WeakPolarHBondContact CA-O 3.31Å; Y153-L389 PolarHBondContact N-O 2.72Å; L173-L389 HydrophobicContact CD1-CD2 3.91Å; L389-T391 HydrophobicContact CG-CG2 4.23Å
390	A	97.5	Very high	89.4	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	121.6	172.8	0	0	0	0	0	110.1	A66 V67 R68 Y153 T405 A409	A66-A390 PolarHBondContact O-N 2.91Å; V67-A390 CarbonylContact C-O 3.59Å; V67-A390 VanDerWaalsContact CA-O 3.28Å; V67-A390 WeakPolarHBondContact CA-O 3.41Å; V67-A390 HydrophobicContact CG2-CB 4.18Å; R68-A390 PolarHBondContact N-O 2.98Å; Y153-A390 CarbonylContact O-C 3.58Å; Y153-A390 WeakPolarHBondContact O-CA 3.31Å; A390-T405 HydrophobicContact CB-CG2 3.83Å; A390-A409 HydrophobicContact CB-CB 3.99Å
391	T	97	Very high	89.9	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	127.6	178.4	57.4	0	0	0	0	109.4	R68 Y153 G154 T158 K160 L389	R68-T391 WeakPolarHBondContact O-CA 3.38Å; Y153-T391 PolarHBondContact O-N 2.9Å; Y153-T391 PolarHBondContact O-OG1 3.49Å; Y153-T391 VanDerWaalsContact O-OG1 3.14Å; G154-T391 WeakPolarHBondContact CA-O 3.43Å; T158-T391 WeakPolarHBondContact CB-O 3.46Å; T158-T391 WeakPolarHBondContact OG1-CB 3.48Å; T158-T391 PolarHBondContact OG1-O 3.35Å; T158-T391 PolarHBondContact OG1-OG1 2.94Å; K160-T391 HydrophobicContact CG-CG2 4.36Å; K160-T391 WeakPolarHBondContact CG-OG1 3.28Å; L389-T391 HydrophobicContact CG-CG2 4.23Å
392	I	96.2	Very high	90.9	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.005	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	159.5	-175.4	59.8	168.7	0	0	0	112.2	V67 R68 V69 R70 I96 T402 T405 L406	V67-I392 HydrophobicContact CG1-CD1 3.83Å; V67-I392 HydrophobicContact CG1-CG1 3.93Å; R68-I392 PolarHBondContact O-N 2.94Å; V69-I392 HydrophobicContact CB-CG1 4.26Å; V69-I392 HydrophobicContact CG1-CG1 4.39Å; V69-I392 HydrophobicContact CG2-CD1 3.71Å; V69-I392 HydrophobicContact CG2-CG1 3.77Å; R70-I392 PolarHBondContact N-O 2.93Å; R70-I392 VanDerWaalsContact N-O 3.11Å; I96-I392 HydrophobicContact CD1-CD1 4.47Å; I392-T402 HydrophobicContact CB-CG2 3.73Å; I392-T402 HydrophobicContact CD1-CG2 3.65Å; I392-T402 HydrophobicContact CG1-CG2 4.23Å; I392-T402 HydrophobicContact CG2-CG2 4.03Å; I392-T405 HydrophobicContact CG2-CG2 3.46Å; I392-T405 VanDerWaalsContact CG2-CG2 3.46Å; I392-L406 HydrophobicContact CD1-CD1 4.37Å; I392-L406 HydrophobicContact CD1-CD2 3.94Å; I392-L406 HydrophobicContact CD1-CG 4.22Å
393	S	91.7	Very high	91.4	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.105	C	C	.	.			trans	-111.4	130.1	-179.6	160.9	0	0	0	0	109.7	R70 A395 N398 T402	R70-S393 PolarHBondContact NH2-OG 3.41Å; S393-A395 PolarHBondContact O-N 2.7Å; S393-A395 WeakPolarHBondContact OG-CB 3.24Å; S393-A395 PolarHBondContact OG-N 2.97Å; S393-A395 VanDerWaalsContact OG-N 3.16Å; S393-N398 WeakPolarHBondContact CB-ND2 3.45Å; S393-N398 PolarHBondContact OG-ND2 3.49Å; S393-T402 PolarHBondContact N-OG1 3.13Å; S393-T402 PolarHBondContact O-OG1 3.27Å
394	P	88.3	Confident	91.6	Very high	22 Å²	22	26 Å²	26	14%	0.143	12%	0.119	C	C	.	.			trans	-74.1	-10.6	173.6	30.3	-34.8	0	0	0	114.1	V69 R70 I72	V69-P394 HydrophobicContact CG1-CB 4.11Å; V69-P394 HydrophobicContact CG1-CG 4.13Å; R70-P394 WeakPolarHBondContact O-CD 3.35Å; R70-P394 WeakPolarHBondContact O-CG 3.43Å; I72-P394 HydrophobicContact CD1-CG 4.46Å; I72-P394 HydrophobicContact CG1-CB 4.11Å; I72-P394 HydrophobicContact CG1-CG 3.52Å
395	A	86	Confident	91.8	Very high	3 Å²	3	25.9 Å²	25.9	3%	0.025	12%	0.119	C	C	.	.	S	Bend	trans	-62.8	138.1	-179	0	0	0	0	0	113.6	E76 S393 R397 N398 I399	E76-A395 HydrophobicContact CB-CB 3.83Å; E76-A395 VanDerWaalsContact CD-CB 3.44Å; E76-A395 HydrophobicContact CG-CB 3.82Å; S393-A395 PolarHBondContact O-N 2.7Å; S393-A395 WeakPolarHBondContact OG-CB 3.24Å; S393-A395 PolarHBondContact OG-N 2.97Å; S393-A395 VanDerWaalsContact OG-N 3.16Å; A395-R397 VanDerWaalsContact C-N 3.32Å; A395-R397 HydrophobicContact CB-CG 4.35Å; A395-R397 PolarHBondContact O-N 2.76Å; A395-N398 WeakPolarHBondContact O-CB 3.37Å; A395-N398 PolarHBondContact O-N 3Å; A395-I399 PolarHBondContact O-N 3.37Å
396	Q	83.6	Confident	91.8	Very high	50 Å²	50	23.4 Å²	23.4	23%	0.234	11%	0.108	C	C	.	.	G	3₁₀ helix	trans	-51.2	-46.7	-178.6	-178	63.4	3.3	0	0	113.4	I85 N398 I399	I85-Q396 VanDerWaalsContact CD1-CD 3.49Å; I85-Q396 VanDerWaalsContact CG1-OE1 3.24Å; I85-Q396 VanDerWaalsContact CG2-OE1 3.29Å; Q396-N398 PolarHBondContact O-N 3.32Å; Q396-N398 VanDerWaalsContact O-N 3.1Å; Q396-I399 WeakPolarHBondContact O-CB 3.4Å; Q396-I399 WeakPolarHBondContact O-CG2 3.18Å; Q396-I399 PolarHBondContact O-N 2.73Å; Q396-I399 VanDerWaalsContact O-N 3.16Å
397	R	84	Confident	91.7	Very high	126 Å²	126	28.1 Å²	28.1	48%	0.475	13%	0.125	S	C	.	.	G	3₁₀ helix	trans	-59.5	-23.7	179.1	66.6	-176.3	-175.5	-167.9	-0.3	114.1	N75 E76 A395	N75-R397 PolarHBondContact O-NH1 2.93Å; E76-R397 IonicContact OE1-CZ 3.38Å; E76-R397 IonicContact OE1-NE 2.87Å; E76-R397 PolarHBondContact OE1-NE 3.38Å; E76-R397 IonicContact OE1-NH2 2.69Å; E76-R397 PolarHBondContact OE1-NH2 3.09Å; A395-R397 VanDerWaalsContact C-N 3.32Å; A395-R397 HydrophobicContact CB-CG 4.35Å; A395-R397 PolarHBondContact O-N 2.76Å
398	N	87.7	Confident	91.5	Very high	22 Å²	22	27.9 Å²	27.9	12%	0.118	12%	0.122	C	C	.	.	G	3₁₀ helix	trans	-100.5	0.8	-175.4	-70.3	-25	0	0	0	113	E76 Q155 S393 A395 Q396 N400 E401 T402	E76-N398 PolarHBondContact OE1-ND2 2.93Å; Q155-N398 PolarHBondContact NE2-OD1 3.02Å; Q155-N398 VanDerWaalsContact OE1-CB 3.27Å; Q155-N398 PolarHBondContact OE1-O 3.14Å; S393-N398 WeakPolarHBondContact CB-ND2 3.45Å; S393-N398 PolarHBondContact OG-ND2 3.49Å; A395-N398 WeakPolarHBondContact O-CB 3.37Å; A395-N398 PolarHBondContact O-N 3Å; Q396-N398 PolarHBondContact O-N 3.32Å; Q396-N398 VanDerWaalsContact O-N 3.1Å; N398-N400 VanDerWaalsContact C-N 3.32Å; N398-N400 PolarHBondContact O-N 3.39Å; N398-E401 PolarHBondContact O-N 3.32Å; N398-T402 PolarHBondContact O-N 2.77Å; N398-T402 PolarHBondContact O-OG1 2.78Å
399	I	88.2	Confident	91.3	Very high	5 Å²	5	27.8 Å²	27.8	3%	0.026	12%	0.122	C	C	.	.	H	α-helix	trans	-62.8	-36.2	-166.8	-163.1	66.6	0	0	0	113.7	I85 I87 F98 A395 Q396 T402 L403	I85-I399 HydrophobicContact CD1-CB 4.3Å; I85-I399 HydrophobicContact CD1-CG1 3.96Å; I85-I399 HydrophobicContact CD1-CG2 3.86Å; I85-I399 HydrophobicContact CG2-CB 4.39Å; I85-I399 HydrophobicContact CG2-CD1 3.38Å; I85-I399 HydrophobicContact CG2-CG1 3.55Å; I87-I399 HydrophobicContact CD1-CD1 3.81Å; I87-I399 HydrophobicContact CG1-CD1 4.02Å; F98-I399 HydrophobicContact CD2-CD1 4.12Å; F98-I399 HydrophobicContact CE2-CD1 3.28Å; F98-I399 HydrophobicContact CE2-CG1 3.59Å; F98-I399 HydrophobicContact CZ-CD1 3.77Å; F98-I399 HydrophobicContact CZ-CG1 3.53Å; A395-I399 PolarHBondContact O-N 3.37Å; Q396-I399 WeakPolarHBondContact O-CB 3.4Å; Q396-I399 WeakPolarHBondContact O-CG2 3.18Å; Q396-I399 PolarHBondContact O-N 2.73Å; Q396-I399 VanDerWaalsContact O-N 3.16Å; I399-T402 PolarHBondContact O-N 2.75Å; I399-L403 PolarHBondContact O-N 2.8Å
400	N	88.2	Confident	91.1	Very high	85 Å²	85	30.2 Å²	30.2	46%	0.455	14%	0.135	S	C	.	.	H	α-helix	trans	-68.4	-40.1	-179.6	-68.5	-35.2	0	0	0	111.7	K100 N398 R404	K100-N400 PolarHBondContact NZ-OD1 2.87Å; N398-N400 VanDerWaalsContact C-N 3.32Å; N398-N400 PolarHBondContact O-N 3.39Å; N400-R404 WeakPolarHBondContact O-CG 3.47Å; N400-R404 PolarHBondContact O-N 3.25Å
401	E	89.8	Confident	90.7	Very high	31 Å²	31	34.7 Å²	34.7	15%	0.145	15%	0.152	C	C	.	.	H	α-helix	trans	-70.4	-40.4	175.4	-68.9	-52.9	142.4	0	0	110.7	Q155 E311 N398 L403 R404 T405	Q155-E401 HydrophobicContact CB-CB 4.29Å; Q155-E401 VanDerWaalsContact OE1-CB 3.24Å; E311-E401 HydrophobicContact CB-CG 4.45Å; N398-E401 PolarHBondContact O-N 3.32Å; E401-L403 VanDerWaalsContact C-N 3.35Å; E401-L403 PolarHBondContact O-N 3.42Å; E401-R404 WeakPolarHBondContact O-CB 3.49Å; E401-R404 PolarHBondContact O-N 3.45Å; E401-R404 VanDerWaalsContact O-N 3.07Å; E401-R404 IonicContact OE1-CZ 3.99Å; E401-R404 IonicContact OE1-NH1 3.23Å; E401-R404 PolarHBondContact OE1-NH1 2.85Å; E401-R404 IonicContact OE2-NH1 3.17Å; E401-T405 PolarHBondContact O-N 3.35Å; E401-T405 PolarHBondContact O-OG1 2.88Å
402	T	92.5	Very high	90.3	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.006	15%	0.152	C	C	.	.	H	α-helix	trans	-55.8	-46.7	172.7	-69	0	0	0	0	112.2	I87 F98 I392 S393 N398 I399 R404 T405 L406	I87-T402 HydrophobicContact CD1-CG2 3.59Å; F98-T402 HydrophobicContact CE2-CG2 4.43Å; I392-T402 HydrophobicContact CB-CG2 3.73Å; I392-T402 HydrophobicContact CD1-CG2 3.65Å; I392-T402 HydrophobicContact CG1-CG2 4.23Å; I392-T402 HydrophobicContact CG2-CG2 4.03Å; S393-T402 PolarHBondContact N-OG1 3.13Å; S393-T402 PolarHBondContact O-OG1 3.27Å; N398-T402 PolarHBondContact O-N 2.77Å; N398-T402 PolarHBondContact O-OG1 2.78Å; I399-T402 PolarHBondContact O-N 2.75Å; T402-R404 VanDerWaalsContact C-N 3.31Å; T402-R404 PolarHBondContact O-N 2.87Å; T402-T405 PolarHBondContact O-N 2.82Å; T402-L406 HydrophobicContact CG2-CD1 4.19Å; T402-L406 WeakPolarHBondContact O-CG 3.36Å; T402-L406 PolarHBondContact O-N 3.48Å
403	L	92.1	Very high	90.1	Very high	20 Å²	20	37.4 Å²	37.4	11%	0.105	16%	0.163	C	C	.	.	H	α-helix	trans	-62	-37.5	176	-177.1	58.6	0	0	0	112.7	F98 F107 I399 E401 L406 R407	F98-L403 HydrophobicContact CD1-CD1 3.98Å; F98-L403 HydrophobicContact CD2-CD1 4.5Å; F98-L403 HydrophobicContact CE1-CB 4.31Å; F98-L403 HydrophobicContact CE1-CD1 3.88Å; F98-L403 HydrophobicContact CE1-CD2 3.95Å; F98-L403 HydrophobicContact CE1-CG 4.26Å; F98-L403 HydrophobicContact CE2-CB 3.9Å; F98-L403 HydrophobicContact CE2-CD1 4.36Å; F98-L403 HydrophobicContact CG-CD1 4.3Å; F98-L403 HydrophobicContact CZ-CB 3.68Å; F98-L403 HydrophobicContact CZ-CD1 4.06Å; F98-L403 HydrophobicContact CZ-CD2 4.04Å; F98-L403 HydrophobicContact CZ-CG 4.13Å; F107-L403 HydrophobicContact CE2-CD1 4.19Å; F107-L403 HydrophobicContact CZ-CD1 3.94Å; I399-L403 PolarHBondContact O-N 2.8Å; E401-L403 VanDerWaalsContact C-N 3.35Å; E401-L403 PolarHBondContact O-N 3.42Å; L403-L406 PolarHBondContact O-N 3.49Å; L403-R407 WeakPolarHBondContact O-CG 3.46Å; L403-R407 PolarHBondContact O-N 2.97Å
404	R	91	Very high	89.9	Confident	103 Å²	103	43 Å²	43	39%	0.389	18%	0.184	S	C	.	.	H	α-helix	trans	-65.4	-44.8	175.8	-72.7	172.8	177.5	170.5	2.3	111.2	N400 E401 T402 R407 Y408	N400-R404 WeakPolarHBondContact O-CG 3.47Å; N400-R404 PolarHBondContact O-N 3.25Å; E401-R404 WeakPolarHBondContact O-CB 3.49Å; E401-R404 PolarHBondContact O-N 3.45Å; E401-R404 VanDerWaalsContact O-N 3.07Å; E401-R404 IonicContact OE1-CZ 3.99Å; E401-R404 IonicContact OE1-NH1 3.23Å; E401-R404 PolarHBondContact OE1-NH1 2.85Å; E401-R404 IonicContact OE2-NH1 3.17Å; T402-R404 VanDerWaalsContact C-N 3.31Å; T402-R404 PolarHBondContact O-N 2.87Å; R404-R407 PolarHBondContact O-N 3.38Å; R404-Y408 WeakPolarHBondContact O-CB 3.45Å; R404-Y408 PolarHBondContact O-N 3.08Å
405	T	94.2	Very high	89.7	Confident	1 Å²	1	42 Å²	42	1%	0.006	18%	0.178	C	C	.	.	H	α-helix	trans	-60.6	-43.5	175.8	-60.8	0	0	0	0	111.6	Y153 A390 I392 E401 T402 R407 Y408 A409	Y153-T405 HydrophobicContact CD1-CG2 4.02Å; Y153-T405 HydrophobicContact CE1-CG2 4.3Å; A390-T405 HydrophobicContact CB-CG2 3.83Å; I392-T405 HydrophobicContact CG2-CG2 3.46Å; I392-T405 VanDerWaalsContact CG2-CG2 3.46Å; E401-T405 PolarHBondContact O-N 3.35Å; E401-T405 PolarHBondContact O-OG1 2.88Å; T402-T405 PolarHBondContact O-N 2.82Å; T405-R407 PolarHBondContact O-N 2.87Å; T405-Y408 WeakPolarHBondContact O-CB 3.44Å; T405-Y408 PolarHBondContact O-N 2.86Å; T405-A409 WeakPolarHBondContact O-CB 3.27Å; T405-A409 PolarHBondContact O-N 2.91Å
406	L	95.1	Very high	89.7	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.9	-42.4	175.4	-71.2	172.8	0	0	0	112.4	V67 I96 F98 F107 F109 I392 T402 L403 A409 N410	V67-L406 HydrophobicContact CG1-CD2 4.08Å; V67-L406 HydrophobicContact CG2-CD2 4.42Å; I96-L406 HydrophobicContact CD1-CD2 4.01Å; I96-L406 HydrophobicContact CG2-CD1 4.36Å; I96-L406 HydrophobicContact CG2-CD2 4.48Å; F98-L406 HydrophobicContact CB-CD1 4.43Å; F98-L406 HydrophobicContact CD2-CD1 3.98Å; F107-L406 HydrophobicContact CD1-CB 4.36Å; F107-L406 HydrophobicContact CD2-CB 4.31Å; F107-L406 HydrophobicContact CD2-CD1 4.1Å; F107-L406 HydrophobicContact CE1-CB 4.13Å; F107-L406 HydrophobicContact CE2-CB 4.09Å; F107-L406 HydrophobicContact CE2-CD1 4Å; F107-L406 HydrophobicContact CG-CB 4.44Å; F107-L406 HydrophobicContact CZ-CB 3.99Å; F109-L406 HydrophobicContact CE2-CD2 3.75Å; F109-L406 HydrophobicContact CZ-CD2 4.04Å; I392-L406 HydrophobicContact CD1-CD1 4.37Å; I392-L406 HydrophobicContact CD1-CD2 3.94Å; I392-L406 HydrophobicContact CD1-CG 4.22Å; T402-L406 HydrophobicContact CG2-CD1 4.19Å; T402-L406 WeakPolarHBondContact O-CG 3.36Å; T402-L406 PolarHBondContact O-N 3.48Å; L403-L406 PolarHBondContact O-N 3.49Å; L406-A409 PolarHBondContact O-N 3.17Å; L406-N410 WeakPolarHBondContact O-CB 3.22Å; L406-N410 PolarHBondContact O-N 3.19Å
407	R	92.9	Very high	89.9	Confident	105 Å²	105	43.1 Å²	43.1	40%	0.396	18%	0.184	S	C	.	.	H	α-helix	trans	-64.8	-40.8	175.1	-73	175.1	-179.1	172.2	1.8	112.2	F107 L403 R404 T405 N410 R411	F107-R407 HydrophobicContact CE1-CG 4.34Å; F107-R407 HydrophobicContact CZ-CG 4.38Å; L403-R407 WeakPolarHBondContact O-CG 3.46Å; L403-R407 PolarHBondContact O-N 2.97Å; R404-R407 PolarHBondContact O-N 3.38Å; T405-R407 PolarHBondContact O-N 2.87Å; R407-N410 PolarHBondContact O-N 3.21Å; R407-R411 WeakPolarHBondContact O-CG 3.49Å; R407-R411 PolarHBondContact O-N 3.09Å; R407-R411 VanDerWaalsContact O-N 3.08Å
408	Y	91.5	Very high	90	Very high	8 Å²	8	40.2 Å²	40.2	3%	0.031	17%	0.173	C	C	.	.	H	α-helix	trans	-59.8	-49.5	174.8	177	-85.2	0	0	0	111.1	Y153 L332 I336 V388 R404 T405 N410 R411 A412	Y153-Y408 AromaticContact CD1-CD1 3.56Å; Y153-Y408 HydrophobicContact CD1-CD1 3.56Å; Y153-Y408 AromaticContact CD1-CE1 3.78Å; Y153-Y408 HydrophobicContact CD1-CE1 3.78Å; Y153-Y408 HydrophobicContact CD1-CG 4.07Å; Y153-Y408 HydrophobicContact CD2-CE1 4.2Å; Y153-Y408 AromaticContact CE1-CD1 3.63Å; Y153-Y408 HydrophobicContact CE1-CD1 3.63Å; Y153-Y408 HydrophobicContact CE1-CD2 4.08Å; Y153-Y408 HydrophobicContact CE1-CE1 4.07Å; Y153-Y408 HydrophobicContact CE1-CE2 4.47Å; Y153-Y408 AromaticContact CE1-CG 3.62Å; Y153-Y408 HydrophobicContact CE1-CG 3.62Å; Y153-Y408 HydrophobicContact CE2-CE1 4.45Å; Y153-Y408 HydrophobicContact CE2-CE2 4.27Å; Y153-Y408 HydrophobicContact CG-CD1 4.13Å; Y153-Y408 AromaticContact CG-CE1 3.85Å; Y153-Y408 HydrophobicContact CG-CE1 3.85Å; Y153-Y408 AromaticContact CZ-CD2 3.98Å; L332-Y408 WeakPolarHBondContact CD2-OH 3.43Å; I336-Y408 HydrophobicContact CD1-CE1 4.03Å; I336-Y408 HydrophobicContact CD1-CE2 3.64Å; I336-Y408 WeakPolarHBondContact CD1-OH 3.23Å; V388-Y408 HydrophobicContact CG1-CE1 4.37Å; R404-Y408 WeakPolarHBondContact O-CB 3.45Å; R404-Y408 PolarHBondContact O-N 3.08Å; T405-Y408 WeakPolarHBondContact O-CB 3.44Å; T405-Y408 PolarHBondContact O-N 2.86Å; Y408-N410 VanDerWaalsContact C-N 3.32Å; Y408-N410 PolarHBondContact O-N 3.34Å; Y408-R411 PolarHBondContact O-N 3.45Å; Y408-R411 VanDerWaalsContact O-N 3.14Å; Y408-A412 PolarHBondContact O-N 3.23Å
409	A	93	Very high	90	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-57.5	-43.6	177	0	0	0	0	0	111.9	V65 F109 A390 T405 L406 R411 A412 K413	V65-A409 HydrophobicContact CG1-CB 3.72Å; F109-A409 HydrophobicContact CD1-CB 4.38Å; F109-A409 HydrophobicContact CE1-CB 3.57Å; F109-A409 HydrophobicContact CZ-CB 3.96Å; A390-A409 HydrophobicContact CB-CB 3.99Å; T405-A409 WeakPolarHBondContact O-CB 3.27Å; T405-A409 PolarHBondContact O-N 2.91Å; L406-A409 PolarHBondContact O-N 3.17Å; A409-R411 VanDerWaalsContact C-N 3.31Å; A409-R411 PolarHBondContact O-N 3.1Å; A409-A412 PolarHBondContact O-N 3.5Å; A409-K413 PolarHBondContact O-N 3.29Å
410	N	92	Very high	90	Very high	51 Å²	51	46.9 Å²	46.9	27%	0.273	20%	0.198	S	C	.	.	H	α-helix	trans	-66.6	-30.4	179.2	-170.2	35.4	0	0	0	113.2	F107 F109 L406 R407 Y408	F107-N410 HydrophobicContact CD1-CB 4.13Å; F107-N410 HydrophobicContact CE1-CB 4.45Å; F109-N410 HydrophobicContact CE1-CB 4.27Å; L406-N410 WeakPolarHBondContact O-CB 3.22Å; L406-N410 PolarHBondContact O-N 3.19Å; R407-N410 PolarHBondContact O-N 3.21Å; Y408-N410 VanDerWaalsContact C-N 3.32Å; Y408-N410 PolarHBondContact O-N 3.34Å
411	R	89.8	Confident	90.1	Very high	94 Å²	94	45.7 Å²	45.7	36%	0.355	19%	0.193	S	C	.	.	H	α-helix	trans	-73.6	-45.2	172.5	-69	-176.8	-61.7	170.9	17.2	111.1	I336 D337 S340 R407 Y408 A409 K413 R414	I336-R411 HydrophobicContact CG2-CB 4.4Å; D337-R411 VanDerWaalsContact CG-CZ 3.5Å; D337-R411 WeakPolarHBondContact OD1-CD 3.36Å; D337-R411 IonicContact OD1-CZ 3.34Å; D337-R411 IonicContact OD1-NE 3.75Å; D337-R411 PolarHBondContact OD1-NE 3.44Å; D337-R411 IonicContact OD1-NH1 3.77Å; D337-R411 PolarHBondContact OD1-NH1 3.32Å; D337-R411 IonicContact OD1-NH2 3.29Å; D337-R411 PolarHBondContact OD1-NH2 3.17Å; D337-R411 IonicContact OD2-CZ 3.91Å; D337-R411 IonicContact OD2-NH1 2.87Å; D337-R411 PolarHBondContact OD2-NH1 3.21Å; D337-R411 IonicContact OD2-NH2 2.85Å; S340-R411 VanDerWaalsContact CB-O 3.29Å; S340-R411 WeakPolarHBondContact CB-O 3.45Å; R407-R411 WeakPolarHBondContact O-CG 3.49Å; R407-R411 PolarHBondContact O-N 3.09Å; R407-R411 VanDerWaalsContact O-N 3.08Å; Y408-R411 PolarHBondContact O-N 3.45Å; Y408-R411 VanDerWaalsContact O-N 3.14Å; A409-R411 VanDerWaalsContact C-N 3.31Å; A409-R411 PolarHBondContact O-N 3.1Å; R411-K413 VanDerWaalsContact C-N 3.25Å; R411-K413 PolarHBondContact O-N 2.71Å; R411-R414 PolarHBondContact O-N 3.22Å; R411-R414 VanDerWaalsContact O-N 3.1Å
412	A	89.2	Confident	90	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-58.6	-35.9	177.9	0	0	0	0	0	112.9	V65 I336 V388 Y408 A409 R414 M415	V65-A412 HydrophobicContact CG2-CB 4.48Å; I336-A412 HydrophobicContact CG2-CB 4.1Å; V388-A412 HydrophobicContact CG2-CB 4.15Å; Y408-A412 PolarHBondContact O-N 3.23Å; A409-A412 PolarHBondContact O-N 3.5Å; A412-R414 PolarHBondContact O-N 2.83Å; A412-M415 HydrophobicContact CB-CE 3.73Å; A412-M415 WeakPolarHBondContact O-CB 3.17Å; A412-M415 PolarHBondContact O-N 3Å
413	K	90.5	Very high	89.5	Confident	58 Å²	58	48.4 Å²	48.4	25%	0.252	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-23.4	176.9	-164.8	175.5	-171.8	177.1	0	114.1	V65 N108 D110 A409 R411	V65-K413 HydrophobicContact CB-CB 4.42Å; V65-K413 HydrophobicContact CG2-CB 3.75Å; V65-K413 HydrophobicContact CG2-CG 4.18Å; N108-K413 WeakPolarHBondContact O-CD 3.48Å; N108-K413 PolarHBondContact O-NZ 2.89Å; D110-K413 WeakPolarHBondContact OD1-CE 3.07Å; D110-K413 IonicContact OD1-NZ 3.49Å; D110-K413 PolarHBondContact OD1-NZ 3.03Å; A409-K413 PolarHBondContact O-N 3.29Å; R411-K413 VanDerWaalsContact C-N 3.25Å; R411-K413 PolarHBondContact O-N 2.71Å
414	R	87.7	Confident	88.5	Confident	117 Å²	117	50.7 Å²	50.7	44%	0.442	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-7.7	-177.4	-58	177	-176.4	-146.9	-5.4	113.6	A343 R411 A412	A343-R414 WeakPolarHBondContact CB-O 3.42Å; R411-R414 PolarHBondContact O-N 3.22Å; R411-R414 VanDerWaalsContact O-N 3.1Å; A412-R414 PolarHBondContact O-N 2.83Å
415	M	85.9	Confident	86.9	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	22%	0.224	C	C	.	.			trans	-75.2	149.2	177.8	-66	-169.6	-72	0	0	111	A62 I63 I336 L339 L380 A412	A62-M415 WeakPolarHBondContact CA-O 3.31Å; I63-M415 HydrophobicContact CD1-CB 3.68Å; I63-M415 HydrophobicContact CD1-CE 3.51Å; I63-M415 HydrophobicContact CD1-SD 4.25Å; I63-M415 HydrophobicContact CG1-CB 4.07Å; I63-M415 PolarHBondContact N-O 3.48Å; I336-M415 HydrophobicContact CB-CE 4.2Å; I336-M415 HydrophobicContact CB-SD 4.02Å; I336-M415 HydrophobicContact CD1-CE 4.12Å; I336-M415 HydrophobicContact CG1-CE 3.64Å; I336-M415 HydrophobicContact CG1-SD 3.78Å; I336-M415 HydrophobicContact CG2-CE 3.82Å; I336-M415 HydrophobicContact CG2-SD 3.94Å; L339-M415 HydrophobicContact CB-CG 3.96Å; L339-M415 HydrophobicContact CB-SD 3.87Å; L339-M415 HydrophobicContact CD1-SD 4.16Å; L380-M415 HydrophobicContact CD2-CE 3.96Å; L380-M415 HydrophobicContact CD2-SD 4.39Å; A412-M415 HydrophobicContact CB-CE 3.73Å; A412-M415 WeakPolarHBondContact O-CB 3.17Å; A412-M415 PolarHBondContact O-N 3Å
416	I	85.2	Confident	85.1	Confident	75 Å²	75	56.1 Å²	56.1	39%	0.385	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	128.6	-179	-58.7	174.1	0	0	0	108.4	E60 A343	E60-I416 HydrophobicContact CB-CG2 3.79Å; E60-I416 HydrophobicContact CG-CG2 4.16Å; A343-I416 HydrophobicContact CB-CD1 4.33Å
417	N	87.9	Confident	83.1	Confident	2 Å²	2	59.7 Å²	59.7	1%	0.011	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	158.5	172.7	-76.8	2.2	0	0	0	110.7	E60 I61 S379 G381 A384 T386 V419	E60-N417 WeakPolarHBondContact CA-O 3.19Å; I61-N417 PolarHBondContact N-O 3.43Å; I61-N417 PolarHBondContact O-N 2.91Å; S379-N417 PolarHBondContact O-ND2 2.79Å; G381-N417 WeakPolarHBondContact CA-OD1 3.14Å; G381-N417 PolarHBondContact N-OD1 2.72Å; A384-N417 WeakPolarHBondContact O-CB 3.5Å; A384-N417 PolarHBondContact O-ND2 3.07Å; T386-N417 WeakPolarHBondContact CB-ND2 3.19Å; T386-N417 PolarHBondContact OG1-ND2 2.86Å; N417-V419 HydrophobicContact CB-CG2 4.31Å
418	R	85.1	Confident	81.3	Confident	65 Å²	65	55.9 Å²	55.9	25%	0.245	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	93.5	178.3	-75.7	-178.4	174.9	169.2	3.3	110	D59 E60 G382 N383	D59-R418 CarbonylContact O-C 3.57Å; D59-R418 WeakPolarHBondContact O-CA 3.25Å; E60-R418 HydrophobicContact CG-CG 3.84Å; E60-R418 IonicContact OE1-CZ 3.76Å; E60-R418 IonicContact OE1-NE 3.49Å; E60-R418 PolarHBondContact OE1-NE 2.8Å; E60-R418 IonicContact OE1-NH2 3.5Å; E60-R418 PolarHBondContact OE1-NH2 3.11Å; G382-R418 PolarHBondContact O-N 2.85Å; N383-R418 VanDerWaalsContact CA-O 3.32Å; N383-R418 WeakPolarHBondContact CA-O 3.27Å
419	V	89	Confident	79.8	Confident	8 Å²	8	63 Å²	63	5%	0.048	31%	0.308	C	S	.	.			trans	-93.8	131	-169.4	-177	0	0	0	0	110.1	D59 I61 I146 K385 N417	D59-V419 WeakPolarHBondContact CB-O 3.19Å; D59-V419 PolarHBondContact O-N 3.29Å; I61-V419 HydrophobicContact CB-CG2 4.2Å; I61-V419 HydrophobicContact CD1-CB 3.84Å; I61-V419 HydrophobicContact CD1-CG1 4.34Å; I61-V419 HydrophobicContact CD1-CG2 3.93Å; I61-V419 HydrophobicContact CG1-CB 4.37Å; I61-V419 HydrophobicContact CG1-CG2 4.23Å; I146-V419 HydrophobicContact CB-CG1 4.44Å; I146-V419 HydrophobicContact CD1-CG1 4.35Å; I146-V419 HydrophobicContact CG1-CG1 4.27Å; I146-V419 HydrophobicContact CG2-CG1 3.42Å; I146-V419 VanDerWaalsContact CG2-CG1 3.42Å; K385-V419 HydrophobicContact CG-CB 4.44Å; K385-V419 HydrophobicContact CG-CG1 3.94Å; K385-V419 HydrophobicContact CG-CG2 3.83Å; N417-V419 HydrophobicContact CB-CG2 4.31Å
420	R	87.6	Confident	78.2	Confident	160 Å²	160	67.8 Å²	67.8	60%	0.604	33%	0.332	S	S	*	.			trans	-134.9	152.9	173.6	58.1	177.7	-175.4	-165.4	3.3	110.3	N383 N422	N383-R420 HydrophobicContact CB-CG 4.42Å; N383-R420 VanDerWaalsContact CG-CG 3.4Å; N383-R420 VanDerWaalsContact ND2-CG 3.32Å; N383-R420 WeakPolarHBondContact ND2-CG 3.28Å; N383-R420 PolarHBondContact ND2-NE 2.82Å; N383-R420 VanDerWaalsContact OD1-CG 3.24Å; N383-R420 WeakPolarHBondContact OD1-CG 3.24Å; N383-R420 PolarHBondContact OD1-N 3.16Å; N383-R420 PolarHBondContact OD1-O 2.99Å; R420-N422 PolarHBondContact O-N 2.87Å
421	V	89.5	Confident	76.8	Confident	60 Å²	60	67.2 Å²	67.2	36%	0.364	33%	0.33	S	S	.	.			trans	-72.2	124	171.3	175.7	0	0	0	0	108.8	S144 I146 T298 S423	S144-V421 VanDerWaalsContact O-CG1 3.23Å; S144-V421 WeakPolarHBondContact O-CG1 3.45Å; I146-V421 HydrophobicContact CD1-CG2 4.47Å; I146-V421 HydrophobicContact CG1-CG2 4.02Å; T298-V421 HydrophobicContact CG2-CG1 4.37Å; V421-S423 PolarHBondContact O-N 3.47Å; V421-S423 VanDerWaalsContact O-N 3.17Å
422	N	87.9	Confident	75.3	Confident	39 Å²	39	65.3 Å²	65.3	21%	0.209	33%	0.334	C	S	.	.			trans	-84.8	94.3	176	-40.7	-68.4	0	0	0	109.5	G145 N147 T298 R299 N383 R420	G145-N422 PolarHBondContact O-N 2.89Å; G145-N422 PolarHBondContact O-ND2 3.4Å; N147-N422 VanDerWaalsContact CG-ND2 3.3Å; N147-N422 PolarHBondContact ND2-ND2 3.22Å; N147-N422 VanDerWaalsContact ND2-ND2 3.14Å; N147-N422 PolarHBondContact OD1-ND2 3.31Å; N147-N422 VanDerWaalsContact OD1-ND2 3.09Å; T298-N422 CarbonylContact C-O 3.56Å; T298-N422 VanDerWaalsContact CA-O 3.27Å; T298-N422 WeakPolarHBondContact CA-O 3.43Å; R299-N422 PolarHBondContact N-O 3.01Å; R299-N422 VanDerWaalsContact O-CB 3.27Å; R299-N422 WeakPolarHBondContact O-CB 3.38Å; R299-N422 PolarHBondContact O-ND2 3.49Å; R299-N422 VanDerWaalsContact O-ND2 3.1Å; N383-N422 PolarHBondContact ND2-OD1 2.8Å; R420-N422 PolarHBondContact O-N 2.87Å
423	S	83.4	Confident	74.2	Confident	50 Å²	50	71.2 Å²	71.2	35%	0.35	36%	0.362	S	S	.	.	B	Isolated β-bridge	trans	-121.4	148.1	172.9	60	0	0	0	0	111.3	T297 V421 G425	T297-S423 VanDerWaalsContact O-CA 3.22Å; T297-S423 WeakPolarHBondContact O-CA 3.39Å; V421-S423 PolarHBondContact O-N 3.47Å; V421-S423 VanDerWaalsContact O-N 3.17Å; S423-G425 VanDerWaalsContact C-N 3.28Å; S423-G425 PolarHBondContact O-N 3.02Å
424	D	70.7	Confident	73.1	Confident	67 Å²	67	72.6 Å²	72.6	36%	0.358	37%	0.372	S	S	.	.			trans	-68.8	83.9	174.4	-68.9	-18.5	0	0	0	110.2	T297 K426 S428	T297-D424 VanDerWaalsContact CB-OD2 3.27Å; T297-D424 WeakPolarHBondContact CB-OD2 3.46Å; T297-D424 PolarHBondContact O-N 2.89Å; T297-D424 VanDerWaalsContact O-N 3.08Å; D424-K426 VanDerWaalsContact C-N 3.34Å; D424-K426 PolarHBondContact O-N 3.17Å; D424-S428 WeakPolarHBondContact O-CB 3.46Å; D424-S428 PolarHBondContact O-N 2.69Å
425	G	58	Low	72.2	Confident	37 Å²	37	69.1 Å²	69.1	38%	0.381	36%	0.364	S	S	.	.	H	α-helix	trans	-68.6	-24	-167.4	0	0	0	0	0	115.5	S423 K429	S423-G425 VanDerWaalsContact C-N 3.28Å; S423-G425 PolarHBondContact O-N 3.02Å; G425-K429 WeakPolarHBondContact O-CG 3.15Å
426	K	54.6	Low	71.4	Confident	181 Å²	181	73.8 Å²	73.8	79%	0.787	39%	0.388	S	S	*	.	H	α-helix	trans	-75.7	-50	179.6	-70.1	-175	-179.9	179.9	0	111.6	D424 I430	D424-K426 VanDerWaalsContact C-N 3.34Å; D424-K426 PolarHBondContact O-N 3.17Å; K426-I430 WeakPolarHBondContact O-CD1 3.26Å; K426-I430 WeakPolarHBondContact O-CG1 3.47Å
427	S	54.2	Low	70.6	Confident	75 Å²	75	75.5 Å²	75.5	52%	0.524	40%	0.395	S	S	.	.	H	α-helix	trans	-67.5	-38.7	179.9	-50.5	0	0	0	0	111.4	V431	S427-V431 WeakPolarHBondContact O-CB 3.41Å; S427-V431 WeakPolarHBondContact O-CG2 3.37Å; S427-V431 PolarHBondContact O-N 3.24Å
428	S	55.2	Low	69.7	Low	25 Å²	25	80.6 Å²	80.6	18%	0.175	42%	0.422	C	S	.	.	H	α-helix	trans	-69.7	-38.2	-175	-164	0	0	0	0	114	F295 D424 A432	F295-S428 VanDerWaalsContact O-CA 3.24Å; F295-S428 WeakPolarHBondContact O-CA 3.46Å; F295-S428 VanDerWaalsContact O-CB 3.28Å; F295-S428 WeakPolarHBondContact O-CB 3.31Å; F295-S428 PolarHBondContact O-OG 3.4Å; D424-S428 WeakPolarHBondContact O-CB 3.46Å; D424-S428 PolarHBondContact O-N 2.69Å; S428-A432 WeakPolarHBondContact O-CB 3.49Å; S428-A432 PolarHBondContact O-N 3.38Å
429	K	58.5	Low	69.3	Low	159 Å²	159	82.4 Å²	82.4	69%	0.691	43%	0.433	S	S	*	.	H	α-helix	trans	-65.6	-45.9	176.5	-74.9	-175.3	178.1	-172.8	0	112.1	G425 V431 A432 E433	G425-K429 WeakPolarHBondContact O-CG 3.15Å; K429-V431 VanDerWaalsContact C-N 3.35Å; K429-A432 PolarHBondContact O-N 3.4Å; K429-E433 VanDerWaalsContact O-CB 3.26Å; K429-E433 WeakPolarHBondContact O-CB 3.5Å; K429-E433 PolarHBondContact O-N 3.18Å
430	I	61	Low	68.5	Low	100 Å²	100	84.6 Å²	84.6	51%	0.513	45%	0.448	S	S	.	.	H	α-helix	trans	-62.5	-45.8	179.4	-63.3	169.2	0	0	0	109.8	K426 E433 L434	K426-I430 WeakPolarHBondContact O-CD1 3.26Å; K426-I430 WeakPolarHBondContact O-CG1 3.47Å; I430-E433 PolarHBondContact O-N 3.44Å; I430-L434 HydrophobicContact CG2-CD1 3.91Å; I430-L434 HydrophobicContact CG2-CG 4.48Å; I430-L434 WeakPolarHBondContact O-CB 3.43Å; I430-L434 WeakPolarHBondContact O-CG 3.44Å; I430-L434 PolarHBondContact O-N 2.82Å
431	V	61.1	Low	67.6	Low	38 Å²	38	85.3 Å²	85.3	23%	0.23	45%	0.451	C	S	.	.	H	α-helix	trans	-68.2	-40.6	179.6	179.5	0	0	0	0	111.5	F295 S427 K429 E433 L434 V435	F295-V431 HydrophobicContact CB-CB 4.13Å; F295-V431 HydrophobicContact CB-CG1 3.38Å; S427-V431 WeakPolarHBondContact O-CB 3.41Å; S427-V431 WeakPolarHBondContact O-CG2 3.37Å; S427-V431 PolarHBondContact O-N 3.24Å; K429-V431 VanDerWaalsContact C-N 3.35Å; V431-E433 VanDerWaalsContact C-N 3.35Å; V431-E433 PolarHBondContact O-N 2.69Å; V431-L434 PolarHBondContact O-N 3.02Å; V431-V435 HydrophobicContact CG1-CG2 4.31Å; V431-V435 VanDerWaalsContact O-CG2 3.28Å; V431-V435 WeakPolarHBondContact O-CG2 3.47Å; V431-V435 PolarHBondContact O-N 3.47Å
432	A	59.7	Low	66.9	Low	54 Å²	54	87 Å²	87	45%	0.446	46%	0.458	S	S	.	.	H	α-helix	trans	-62.9	-41.3	176	0	0	0	0	0	112.2	S428 K429 V435 D436	S428-A432 WeakPolarHBondContact O-CB 3.49Å; S428-A432 PolarHBondContact O-N 3.38Å; K429-A432 PolarHBondContact O-N 3.4Å; A432-V435 PolarHBondContact O-N 2.96Å; A432-D436 PolarHBondContact O-N 3.48Å
433	E	66.5	Low	66.3	Low	124 Å²	124	91 Å²	91	58%	0.579	47%	0.47	S	S	*	.	H	α-helix	trans	-66	-38.4	176.3	-167.4	170.3	-167.2	0	0	111.5	K429 I430 V431 Q437	K429-E433 VanDerWaalsContact O-CB 3.26Å; K429-E433 WeakPolarHBondContact O-CB 3.5Å; K429-E433 PolarHBondContact O-N 3.18Å; I430-E433 PolarHBondContact O-N 3.44Å; V431-E433 VanDerWaalsContact C-N 3.35Å; V431-E433 PolarHBondContact O-N 2.69Å; E433-Q437 WeakPolarHBondContact O-CB 3.45Å; E433-Q437 VanDerWaalsContact O-CG 3.22Å; E433-Q437 WeakPolarHBondContact O-CG 3.45Å; E433-Q437 PolarHBondContact O-N 3.39Å
434	L	66.2	Low	66.1	Low	87 Å²	87	93 Å²	93	46%	0.455	48%	0.477	S	S	.	.	H	α-helix	trans	-66.6	-40.7	173.5	-73.5	169.3	0	0	0	112.4	I430 V431 Q437 L438	I430-L434 HydrophobicContact CG2-CD1 3.91Å; I430-L434 HydrophobicContact CG2-CG 4.48Å; I430-L434 WeakPolarHBondContact O-CB 3.43Å; I430-L434 WeakPolarHBondContact O-CG 3.44Å; I430-L434 PolarHBondContact O-N 2.82Å; V431-L434 PolarHBondContact O-N 3.02Å; L434-Q437 PolarHBondContact O-N 2.87Å; L434-L438 WeakPolarHBondContact O-CG 3.28Å; L434-L438 PolarHBondContact O-N 3.24Å
435	V	68.1	Low	66.3	Low	45 Å²	45	94.7 Å²	94.7	27%	0.273	49%	0.485	S	S	.	.	H	α-helix	trans	-64.7	-44.3	176.8	170.9	0	0	0	0	110.9	V431 A432 Q437 L438 E439	V431-V435 HydrophobicContact CG1-CG2 4.31Å; V431-V435 VanDerWaalsContact O-CG2 3.28Å; V431-V435 WeakPolarHBondContact O-CG2 3.47Å; V431-V435 PolarHBondContact O-N 3.47Å; A432-V435 PolarHBondContact O-N 2.96Å; V435-Q437 VanDerWaalsContact C-N 3.34Å; V435-Q437 PolarHBondContact O-N 3.13Å; V435-L438 WeakPolarHBondContact O-CB 3.27Å; V435-L438 PolarHBondContact O-N 2.93Å; V435-E439 PolarHBondContact O-N 2.89Å
436	D	70	Confident	67.4	Low	99 Å²	99	99.1 Å²	99.1	53%	0.529	50%	0.497	S	S	.	.	H	α-helix	trans	-63.8	-38.6	176.9	-171.1	41.4	0	0	0	112	A432 L438 E439 S440	A432-D436 PolarHBondContact O-N 3.48Å; D436-L438 PolarHBondContact O-N 2.74Å; D436-E439 PolarHBondContact O-N 2.84Å; D436-S440 WeakPolarHBondContact O-CB 3.49Å; D436-S440 PolarHBondContact O-N 2.97Å
437	Q	69	Low	68.6	Low	110 Å²	110	96.5 Å²	96.5	51%	0.514	49%	0.488	S	S	.	.	H	α-helix	trans	-62.7	-40.5	172.5	-75.6	176.6	21.7	0	0	112.6	E433 L434 V435 R441	E433-Q437 WeakPolarHBondContact O-CB 3.45Å; E433-Q437 VanDerWaalsContact O-CG 3.22Å; E433-Q437 WeakPolarHBondContact O-CG 3.45Å; E433-Q437 PolarHBondContact O-N 3.39Å; L434-Q437 PolarHBondContact O-N 2.87Å; V435-Q437 VanDerWaalsContact C-N 3.34Å; V435-Q437 PolarHBondContact O-N 3.13Å; Q437-R441 VanDerWaalsContact O-CB 3.3Å; Q437-R441 WeakPolarHBondContact O-CB 3.45Å; Q437-R441 PolarHBondContact O-N 3.44Å
438	L	69.3	Low	69.6	Low	110 Å²	110	97 Å²	97	58%	0.576	49%	0.485	S	S	*	.	H	α-helix	trans	-65.7	-44.6	176.9	-75.4	171.4	0	0	0	111.6	L434 V435 D436 R441 N442	L434-L438 WeakPolarHBondContact O-CG 3.28Å; L434-L438 PolarHBondContact O-N 3.24Å; V435-L438 WeakPolarHBondContact O-CB 3.27Å; V435-L438 PolarHBondContact O-N 2.93Å; D436-L438 PolarHBondContact O-N 2.74Å; L438-R441 PolarHBondContact O-N 3.26Å; L438-N442 WeakPolarHBondContact O-CB 3.41Å; L438-N442 VanDerWaalsContact O-CG 3.28Å; L438-N442 PolarHBondContact O-N 2.88Å; L438-N442 PolarHBondContact O-ND2 3.3Å
439	E	75.3	Confident	70.8	Confident	103 Å²	103	101.3 Å²	101.3	48%	0.481	50%	0.502	S	S	.	.	H	α-helix	trans	-63.5	-43.3	176.7	-72.5	-174	-179.4	0	0	112.1	V435 D436 R441 N442 R443	V435-E439 PolarHBondContact O-N 2.89Å; D436-E439 PolarHBondContact O-N 2.84Å; E439-R441 VanDerWaalsContact C-N 3.34Å; E439-R441 PolarHBondContact O-N 3.31Å; E439-N442 PolarHBondContact O-N 3.49Å; E439-R443 WeakPolarHBondContact O-CG 3.2Å; E439-R443 PolarHBondContact O-N 3.03Å; E439-R443 IonicContact OE2-NH1 3.41Å
440	S	72.1	Confident	71.9	Confident	54 Å²	54	99.9 Å²	99.9	38%	0.378	50%	0.498	S	S	.	.	H	α-helix	trans	-63.2	-41.2	177	-162	0	0	0	0	111.8	D436 R443 L444	D436-S440 WeakPolarHBondContact O-CB 3.49Å; D436-S440 PolarHBondContact O-N 2.97Å; S440-R443 PolarHBondContact O-N 3.48Å; S440-L444 PolarHBondContact O-N 3.39Å; S440-L444 VanDerWaalsContact O-N 3.13Å
441	R	70.3	Confident	72.7	Confident	175 Å²	175	99 Å²	99	66%	0.66	49%	0.491	S	S	*	.	H	α-helix	trans	-63.1	-43.1	175.3	-169.8	73.5	70.4	121.8	5.1	111.7	Q437 L438 E439 L444 L445	Q437-R441 VanDerWaalsContact O-CB 3.3Å; Q437-R441 WeakPolarHBondContact O-CB 3.45Å; Q437-R441 PolarHBondContact O-N 3.44Å; L438-R441 PolarHBondContact O-N 3.26Å; E439-R441 VanDerWaalsContact C-N 3.34Å; E439-R441 PolarHBondContact O-N 3.31Å; R441-L444 PolarHBondContact O-N 3.17Å; R441-L445 HydrophobicContact CG-CD1 4.35Å; R441-L445 WeakPolarHBondContact O-CG 3.22Å; R441-L445 PolarHBondContact O-N 3.45Å
442	N	73.2	Confident	73.4	Confident	95 Å²	95	101.4 Å²	101.4	51%	0.508	50%	0.502	S	S	.	.	H	α-helix	trans	-64.3	-39.4	178.9	-74.3	-20.9	0	0	0	112.2	L438 E439 L445 M446	L438-N442 WeakPolarHBondContact O-CB 3.41Å; L438-N442 VanDerWaalsContact O-CG 3.28Å; L438-N442 PolarHBondContact O-N 2.88Å; L438-N442 PolarHBondContact O-ND2 3.3Å; E439-N442 PolarHBondContact O-N 3.49Å; N442-L445 PolarHBondContact O-N 3.36Å; N442-M446 PolarHBondContact O-N 2.93Å; N442-M446 VanDerWaalsContact O-N 3.12Å
443	R	77.2	Confident	74.5	Confident	123 Å²	123	103.1 Å²	103.1	46%	0.464	50%	0.501	S	S	.	.	H	α-helix	trans	-59.5	-47.2	172.8	-72.6	-174.3	-69.5	-100	3.4	111.7	E439 S440 L445 M446 E447	E439-R443 WeakPolarHBondContact O-CG 3.2Å; E439-R443 PolarHBondContact O-N 3.03Å; E439-R443 IonicContact OE2-NH1 3.41Å; S440-R443 PolarHBondContact O-N 3.48Å; R443-L445 VanDerWaalsContact C-N 3.32Å; R443-L445 PolarHBondContact O-N 2.99Å; R443-M446 PolarHBondContact O-N 3.43Å; R443-E447 PolarHBondContact O-N 2.98Å
444	L	77.8	Confident	75.3	Confident	93 Å²	93	102.4 Å²	102.4	49%	0.487	49%	0.493	S	S	.	.	H	α-helix	trans	-64.2	-36.4	180	-135.8	115.3	0	0	0	112.5	S440 R441 E447 N448	S440-L444 PolarHBondContact O-N 3.39Å; S440-L444 VanDerWaalsContact O-N 3.13Å; R441-L444 PolarHBondContact O-N 3.17Å; L444-E447 PolarHBondContact O-N 2.91Å; L444-N448 WeakPolarHBondContact O-CB 3.22Å; L444-N448 PolarHBondContact O-N 2.74Å
445	L	75.1	Confident	75.7	Confident	101 Å²	101	102.5 Å²	102.5	53%	0.529	49%	0.493	S	S	.	.	H	α-helix	trans	-65.4	-39	175.1	-75.1	171.5	0	0	0	112	R441 N442 R443 H449	R441-L445 HydrophobicContact CG-CD1 4.35Å; R441-L445 WeakPolarHBondContact O-CG 3.22Å; R441-L445 PolarHBondContact O-N 3.45Å; N442-L445 PolarHBondContact O-N 3.36Å; R443-L445 VanDerWaalsContact C-N 3.32Å; R443-L445 PolarHBondContact O-N 2.99Å; L445-H449 WeakPolarHBondContact O-CB 3.26Å; L445-H449 PolarHBondContact O-N 2.83Å
446	M	81.1	Confident	76.2	Confident	131 Å²	131	106.2 Å²	106.2	65%	0.645	51%	0.508	S	S	*	.	H	α-helix	trans	-65.8	-44.6	175	-70.7	-175.8	86.1	0	0	111.7	N442 R443 N448 H449 E450	N442-M446 PolarHBondContact O-N 2.93Å; N442-M446 VanDerWaalsContact O-N 3.12Å; R443-M446 PolarHBondContact O-N 3.43Å; M446-N448 VanDerWaalsContact C-N 3.35Å; M446-N448 PolarHBondContact O-N 2.94Å; M446-H449 WeakPolarHBondContact O-CB 3.32Å; M446-H449 PolarHBondContact O-N 3.01Å; M446-H449 VanDerWaalsContact O-N 3.15Å; M446-E450 PolarHBondContact O-N 3.44Å
447	E	79.8	Confident	76.6	Confident	125 Å²	125	108.5 Å²	108.5	58%	0.584	51%	0.509	S	S	*	.	H	α-helix	trans	-60.1	-43.8	176.1	-70.9	176.1	176.9	0	0	111.9	R443 L444 H449 E450 E451	R443-E447 PolarHBondContact O-N 2.98Å; L444-E447 PolarHBondContact O-N 2.91Å; E447-H449 VanDerWaalsContact C-N 3.31Å; E447-H449 PolarHBondContact O-N 3.08Å; E447-E450 PolarHBondContact O-N 2.92Å; E447-E451 PolarHBondContact O-N 3.25Å
448	N	75.9	Confident	77	Confident	86 Å²	86	107.4 Å²	107.4	46%	0.46	50%	0.504	S	S	.	.	H	α-helix	trans	-63.8	-37.2	175.6	-76.9	-16.8	0	0	0	112.2	L444 M446 E451 I452	L444-N448 WeakPolarHBondContact O-CB 3.22Å; L444-N448 PolarHBondContact O-N 2.74Å; M446-N448 VanDerWaalsContact C-N 3.35Å; M446-N448 PolarHBondContact O-N 2.94Å; N448-E451 PolarHBondContact O-N 2.82Å; N448-I452 WeakPolarHBondContact O-CB 3.46Å; N448-I452 WeakPolarHBondContact O-CD1 3.49Å; N448-I452 WeakPolarHBondContact O-CG1 3.43Å; N448-I452 PolarHBondContact O-N 3.16Å
449	H	79.7	Confident	77.1	Confident	116 Å²	116	107.2 Å²	107.2	54%	0.537	50%	0.503	S	S	.	.	H	α-helix	trans	-64.5	-44.5	177.1	-168.4	70	0	0	0	111.5	L445 M446 E447 E451 I452 E453	L445-H449 WeakPolarHBondContact O-CB 3.26Å; L445-H449 PolarHBondContact O-N 2.83Å; M446-H449 WeakPolarHBondContact O-CB 3.32Å; M446-H449 PolarHBondContact O-N 3.01Å; M446-H449 VanDerWaalsContact O-N 3.15Å; E447-H449 VanDerWaalsContact C-N 3.31Å; E447-H449 PolarHBondContact O-N 3.08Å; H449-E451 PolarHBondContact O-N 3.38Å; H449-I452 PolarHBondContact O-N 3.5Å; H449-E453 IonicContact NE2-OE1 3.33Å; H449-E453 PolarHBondContact O-N 2.83Å
450	E	82.3	Confident	77.1	Confident	129 Å²	129	105.3 Å²	105.3	60%	0.603	50%	0.501	S	S	*	.	H	α-helix	trans	-61.6	-40.5	176.1	-70.4	-177.3	176.7	0	0	112.4	M446 E447 E453 R454	M446-E450 PolarHBondContact O-N 3.44Å; E447-E450 PolarHBondContact O-N 2.92Å; E450-E453 PolarHBondContact O-N 3.14Å; E450-R454 WeakPolarHBondContact O-CB 3Å; E450-R454 PolarHBondContact O-N 3.43Å
451	E	77.7	Confident	77.1	Confident	81 Å²	81	109.3 Å²	109.3	38%	0.379	52%	0.515	S	S	.	.	H	α-helix	trans	-71.3	-37.8	178.3	-170.3	65.3	-177.7	0	0	112	E447 N448 H449 R454 L455	E447-E451 PolarHBondContact O-N 3.25Å; N448-E451 PolarHBondContact O-N 2.82Å; H449-E451 PolarHBondContact O-N 3.38Å; E451-R454 WeakPolarHBondContact O-CB 3.38Å; E451-R454 PolarHBondContact O-N 3.32Å; E451-R454 IonicContact OE1-CZ 3.38Å; E451-R454 IonicContact OE1-NH1 3.59Å; E451-R454 PolarHBondContact OE1-NH1 3Å; E451-R454 IonicContact OE2-NH1 2.79Å; E451-R454 PolarHBondContact OE2-NH1 2.95Å; E451-L455 HydrophobicContact CG-CD1 4.28Å; E451-L455 WeakPolarHBondContact O-CB 3.45Å; E451-L455 WeakPolarHBondContact O-CG 3.38Å; E451-L455 PolarHBondContact O-N 3.49Å
452	I	75.9	Confident	77	Confident	89 Å²	89	103.7 Å²	103.7	46%	0.456	51%	0.506	S	S	.	.	H	α-helix	trans	-60.6	-46.1	173.3	-71.4	165.2	0	0	0	110.3	N448 H449 R454 L455 Q456	N448-I452 WeakPolarHBondContact O-CB 3.46Å; N448-I452 WeakPolarHBondContact O-CD1 3.49Å; N448-I452 WeakPolarHBondContact O-CG1 3.43Å; N448-I452 PolarHBondContact O-N 3.16Å; H449-I452 PolarHBondContact O-N 3.5Å; I452-R454 VanDerWaalsContact C-N 3.29Å; I452-R454 PolarHBondContact O-N 2.86Å; I452-L455 PolarHBondContact O-N 2.87Å; I452-Q456 HydrophobicContact CG2-CG 4.37Å; I452-Q456 WeakPolarHBondContact O-CB 3.33Å; I452-Q456 VanDerWaalsContact O-CG 3.27Å; I452-Q456 WeakPolarHBondContact O-CG 3.48Å; I452-Q456 PolarHBondContact O-N 3.22Å
453	E	81.6	Confident	76.3	Confident	89 Å²	89	103.9 Å²	103.9	42%	0.416	51%	0.507	S	S	.	.	H	α-helix	trans	-62.3	-37.4	176.4	-76.1	-165.3	156.7	0	0	112.4	H449 E450 R457	H449-E453 IonicContact NE2-OE1 3.33Å; H449-E453 PolarHBondContact O-N 2.83Å; E450-E453 PolarHBondContact O-N 3.14Å; E453-R457 PolarHBondContact O-N 2.94Å; E453-R457 PolarHBondContact O-NE 3.01Å
454	R	83.4	Confident	75.3	Confident	109 Å²	109	101.7 Å²	101.7	41%	0.411	51%	0.511	S	S	.	.	H	α-helix	trans	-65	-48.3	176.1	-179	-176.5	159.3	-131.6	-12.8	111.4	E450 E451 I452 Q456 R457 E458	E450-R454 WeakPolarHBondContact O-CB 3Å; E450-R454 PolarHBondContact O-N 3.43Å; E451-R454 WeakPolarHBondContact O-CB 3.38Å; E451-R454 PolarHBondContact O-N 3.32Å; E451-R454 IonicContact OE1-CZ 3.38Å; E451-R454 IonicContact OE1-NH1 3.59Å; E451-R454 PolarHBondContact OE1-NH1 3Å; E451-R454 IonicContact OE2-NH1 2.79Å; E451-R454 PolarHBondContact OE2-NH1 2.95Å; I452-R454 VanDerWaalsContact C-N 3.29Å; I452-R454 PolarHBondContact O-N 2.86Å; R454-Q456 VanDerWaalsContact C-N 3.35Å; R454-R457 WeakPolarHBondContact O-CB 3.42Å; R454-R457 PolarHBondContact O-N 3.34Å; R454-E458 IonicContact CZ-OE1 2.7Å; R454-E458 IonicContact NE-OE1 3.98Å; R454-E458 PolarHBondContact NE-OE1 3.24Å; R454-E458 IonicContact NH2-OE1 3.44Å; R454-E458 PolarHBondContact NH2-OE1 3.47Å; R454-E458 PolarHBondContact O-N 2.97Å
455	L	76.2	Confident	74.2	Confident	89 Å²	89	100.2 Å²	100.2	47%	0.466	51%	0.512	S	S	.	.	H	α-helix	trans	-63.3	-40.7	178.2	-72.6	171.1	0	0	0	111.5	E451 I452 R457 E458 L459	E451-L455 HydrophobicContact CG-CD1 4.28Å; E451-L455 WeakPolarHBondContact O-CB 3.45Å; E451-L455 WeakPolarHBondContact O-CG 3.38Å; E451-L455 PolarHBondContact O-N 3.49Å; I452-L455 PolarHBondContact O-N 2.87Å; L455-R457 VanDerWaalsContact C-N 3.33Å; L455-R457 PolarHBondContact O-N 3.4Å; L455-E458 PolarHBondContact O-N 2.87Å; L455-L459 WeakPolarHBondContact O-CB 3.26Å; L455-L459 PolarHBondContact O-N 2.76Å
456	Q	77.6	Confident	73	Confident	123 Å²	123	99.4 Å²	99.4	58%	0.575	52%	0.515	S	S	*	.	H	α-helix	trans	-60.3	-41.3	174.2	-76.1	176.8	-9.7	0	0	112	I452 R454 L459 S460	I452-Q456 HydrophobicContact CG2-CG 4.37Å; I452-Q456 WeakPolarHBondContact O-CB 3.33Å; I452-Q456 VanDerWaalsContact O-CG 3.27Å; I452-Q456 WeakPolarHBondContact O-CG 3.48Å; I452-Q456 PolarHBondContact O-N 3.22Å; R454-Q456 VanDerWaalsContact C-N 3.35Å; Q456-L459 PolarHBondContact O-N 3.45Å; Q456-S460 WeakPolarHBondContact O-CB 3.42Å; Q456-S460 PolarHBondContact O-N 2.95Å
457	R	78.5	Confident	71.4	Confident	147 Å²	147	97.2 Å²	97.2	56%	0.555	51%	0.512	S	S	*	.	H	α-helix	trans	-62.4	-47.3	173.4	-83	-177.6	-81.4	126.3	-6.6	112	E453 R454 L455 L459 S460 M461	E453-R457 PolarHBondContact O-N 2.94Å; E453-R457 PolarHBondContact O-NE 3.01Å; R454-R457 WeakPolarHBondContact O-CB 3.42Å; R454-R457 PolarHBondContact O-N 3.34Å; L455-R457 VanDerWaalsContact C-N 3.33Å; L455-R457 PolarHBondContact O-N 3.4Å; R457-L459 VanDerWaalsContact C-N 3.33Å; R457-L459 PolarHBondContact O-N 3.49Å; R457-S460 PolarHBondContact O-N 3.37Å; R457-S460 PolarHBondContact O-OG 3.37Å; R457-M461 WeakPolarHBondContact O-CG 3.17Å; R457-M461 PolarHBondContact O-N 3.12Å; R457-M461 VanDerWaalsContact O-N 3.09Å
458	E	78	Confident	69.8	Low	88 Å²	88	100.1 Å²	100.1	41%	0.411	52%	0.523	S	S	.	.	H	α-helix	trans	-59.5	-42.6	177.3	-73.4	178.5	-170.8	0	0	111.8	R454 L455 S460 M461 A462	R454-E458 IonicContact CZ-OE1 2.7Å; R454-E458 IonicContact NE-OE1 3.98Å; R454-E458 PolarHBondContact NE-OE1 3.24Å; R454-E458 IonicContact NH2-OE1 3.44Å; R454-E458 PolarHBondContact NH2-OE1 3.47Å; R454-E458 PolarHBondContact O-N 2.97Å; L455-E458 PolarHBondContact O-N 2.87Å; E458-S460 PolarHBondContact O-N 3.46Å; E458-M461 PolarHBondContact O-N 3.12Å; E458-A462 PolarHBondContact O-N 3.49Å
459	L	70	Confident	68.4	Low	106 Å²	106	101.5 Å²	101.5	56%	0.555	53%	0.534	S	S	*	.	H	α-helix	trans	-64.9	-40.6	178.2	-142.1	161.1	0	0	0	111.7	L455 Q456 R457 M461 A462 N463	L455-L459 WeakPolarHBondContact O-CB 3.26Å; L455-L459 PolarHBondContact O-N 2.76Å; Q456-L459 PolarHBondContact O-N 3.45Å; R457-L459 VanDerWaalsContact C-N 3.33Å; R457-L459 PolarHBondContact O-N 3.49Å; L459-M461 VanDerWaalsContact C-N 3.33Å; L459-M461 PolarHBondContact O-N 3.24Å; L459-A462 PolarHBondContact O-N 3.47Å; L459-N463 WeakPolarHBondContact CD2-ND2 3.49Å; L459-N463 WeakPolarHBondContact O-CB 3.46Å; L459-N463 PolarHBondContact O-N 3.08Å
460	S	75.6	Confident	66.5	Low	63 Å²	63	99.3 Å²	99.3	44%	0.441	54%	0.536	S	S	.	.	H	α-helix	trans	-63.4	-36.9	175.1	76.3	0	0	0	0	112.8	Q456 R457 E458 S464	Q456-S460 WeakPolarHBondContact O-CB 3.42Å; Q456-S460 PolarHBondContact O-N 2.95Å; R457-S460 PolarHBondContact O-N 3.37Å; R457-S460 PolarHBondContact O-OG 3.37Å; E458-S460 PolarHBondContact O-N 3.46Å; S460-S464 WeakPolarHBondContact O-CB 3.39Å; S460-S464 PolarHBondContact O-N 3.5Å; S460-S464 VanDerWaalsContact O-N 3.14Å; S460-S464 PolarHBondContact O-OG 3.02Å
461	M	73.2	Confident	64.5	Low	138 Å²	138	100.3 Å²	100.3	68%	0.68	55%	0.546	S	S	*	.	H	α-helix	trans	-70.7	-40.9	175.8	-66.1	-143.1	-60.7	0	0	111.9	R457 E458 L459 S464 A465	R457-M461 WeakPolarHBondContact O-CG 3.17Å; R457-M461 PolarHBondContact O-N 3.12Å; R457-M461 VanDerWaalsContact O-N 3.09Å; E458-M461 PolarHBondContact O-N 3.12Å; L459-M461 VanDerWaalsContact C-N 3.33Å; L459-M461 PolarHBondContact O-N 3.24Å; M461-S464 PolarHBondContact O-N 3.21Å; M461-A465 PolarHBondContact O-N 3.07Å
462	A	66.6	Low	62.6	Low	57 Å²	57	107.9 Å²	107.9	47%	0.471	57%	0.571	S	S	.	*	H	α-helix	trans	-63	-43.7	176.6	0	0	0	0	0	112	E458 L459 S464 A465 S466	E458-A462 PolarHBondContact O-N 3.49Å; L459-A462 PolarHBondContact O-N 3.47Å; A462-S464 VanDerWaalsContact C-N 3.32Å; A462-S464 PolarHBondContact O-N 3.29Å; A462-A465 PolarHBondContact O-N 2.98Å; A462-S466 PolarHBondContact O-N 2.52Å
463	N	58.5	Low	60.7	Low	98 Å²	98	108.6 Å²	108.6	52%	0.524	58%	0.58	S	S	.	*	H	α-helix	trans	-64.1	-37.7	176.8	-74	-15.3	0	0	0	112.3	L459 S466 S467	L459-N463 WeakPolarHBondContact CD2-ND2 3.49Å; L459-N463 WeakPolarHBondContact O-CB 3.46Å; L459-N463 PolarHBondContact O-N 3.08Å; N463-S466 PolarHBondContact O-N 3.47Å; N463-S467 PolarHBondContact O-N 3.05Å
464	S	56	Low	58.8	Low	77 Å²	77	108.2 Å²	108.2	54%	0.538	59%	0.587	S	S	.	*	H	α-helix	trans	-67	-35.4	176.1	-58.3	0	0	0	0	112.5	S460 M461 A462	S460-S464 WeakPolarHBondContact O-CB 3.39Å; S460-S464 PolarHBondContact O-N 3.5Å; S460-S464 VanDerWaalsContact O-N 3.14Å; S460-S464 PolarHBondContact O-OG 3.02Å; M461-S464 PolarHBondContact O-N 3.21Å; A462-S464 VanDerWaalsContact C-N 3.32Å; A462-S464 PolarHBondContact O-N 3.29Å
465	A	54.7	Low	56.8	Low	62 Å²	62	109 Å²	109	51%	0.512	60%	0.603	S	S	.	*	H	α-helix	trans	-69.4	-41.1	174.3	0	0	0	0	0	111.9	M461 A462 K468	M461-A465 PolarHBondContact O-N 3.07Å; A462-A465 PolarHBondContact O-N 2.98Å; A465-K468 PolarHBondContact O-N 3.36Å
466	S	49.8	Very low	55.2	Low	84 Å²	84	107.8 Å²	107.8	59%	0.587	61%	0.606	S	S	*	*	H	α-helix	trans	-68.1	-36.1	179.6	-134.6	0	0	0	0	112.7	A462 N463 K468 V469 A470	A462-S466 PolarHBondContact O-N 2.52Å; N463-S466 PolarHBondContact O-N 3.47Å; S466-K468 PolarHBondContact O-N 3.01Å; S466-V469 PolarHBondContact O-N 3.15Å; S466-A470 PolarHBondContact O-N 3.45Å
467	S	48.4	Very low	53.6	Low	85 Å²	85	106.6 Å²	106.6	59%	0.594	60%	0.604	S	S	*	*	H	α-helix	trans	-63.3	-24	175.6	-92.7	0	0	0	0	114.3	N463	N463-S467 PolarHBondContact O-N 3.05Å
468	K	45.5	Very low	52.2	Low	187 Å²	187	103.1 Å²	103.1	81%	0.813	60%	0.599	S	S	*	*	H	α-helix	trans	-80	-21.9	176.8	-71.5	-173.1	179.1	-179	0	113.6	A465 S466	A465-K468 PolarHBondContact O-N 3.36Å; S466-K468 PolarHBondContact O-N 3.01Å
469	V	47.9	Very low	50.6	Low	115 Å²	115	104.2 Å²	104.2	70%	0.697	60%	0.604	S	S	*	*	H	α-helix	trans	-92.5	-29	-179	-177.7	0	0	0	0	111.7	S466 N471	S466-V469 PolarHBondContact O-N 3.15Å; V469-N471 VanDerWaalsContact C-N 3.26Å; V469-N471 PolarHBondContact O-N 3.12Å
470	A	40.1	Very low	49.5	Very low	70 Å²	70	104.3 Å²	104.3	58%	0.579	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-69.7	-13.8	-175.9	0	0	0	0	0	115.3	S466 R472	S466-A470 PolarHBondContact O-N 3.45Å; A470-R472 VanDerWaalsContact C-N 3.28Å; A470-R472 PolarHBondContact O-N 3.19Å
471	N	38.7	Very low	48.3	Very low	150 Å²	150	108 Å²	108	80%	0.802	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-80.5	10.5	-176.1	-90.9	-1.5	0	0	0	115.6	V469	V469-N471 VanDerWaalsContact C-N 3.26Å; V469-N471 PolarHBondContact O-N 3.12Å
472	R	37.6	Very low	46.7	Very low	240 Å²	240	109 Å²	109	91%	0.906	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-126.5	5.4	-174.7	-90.5	-172.6	172.7	178	-1.9	118.1	A470	A470-R472 VanDerWaalsContact C-N 3.28Å; A470-R472 PolarHBondContact O-N 3.19Å
473	T	36.9	Very low	45.5	Very low	104 Å²	104	110.3 Å²	110.3	64%	0.638	61%	0.611	S	S	*	*	S	Bend	trans	-133.8	108.1	178.4	21.9	0	0	0	0	109.8	V475	T473-V475 PolarHBondContact O-N 3.38Å
474	S	41.8	Very low	44.6	Very low	81 Å²	81	111 Å²	111	57%	0.566	62%	0.615	S	S	*	*			trans	-58.3	135.2	-179.9	48	0	0	0	0	111.1	A476 D477	S474-A476 PolarHBondContact O-N 3.4Å; S474-D477 PolarHBondContact O-N 3.38Å
475	V	41.7	Very low	44	Very low	124 Å²	124	114.7 Å²	114.7	75%	0.752	62%	0.623	S	S	*	*	H	α-helix	trans	-51.1	-18.1	-176.4	-179.3	0	0	0	0	114.3	T473	T473-V475 PolarHBondContact O-N 3.38Å
476	A	42	Very low	43	Very low	65 Å²	65	116.3 Å²	116.3	54%	0.537	63%	0.631	S	S	.	*	H	α-helix	trans	-67.7	-36.2	-179.9	0	0	0	0	0	114.1	S474	S474-A476 PolarHBondContact O-N 3.4Å
477	D	44.4	Very low	42.4	Very low	98 Å²	98	121 Å²	121	52%	0.524	64%	0.641	S	S	.	*	H	α-helix	trans	-79.9	-29.1	-174.1	-66.1	-30.8	0	0	0	112.4	S474 Q479 L480 Q481	S474-D477 PolarHBondContact O-N 3.38Å; D477-Q479 VanDerWaalsContact C-N 3.32Å; D477-Q479 PolarHBondContact O-N 3.36Å; D477-L480 PolarHBondContact O-N 3.06Å; D477-Q481 PolarHBondContact O-N 2.94Å
478	V	48.7	Very low	41.8	Very low	73 Å²	73	126.2 Å²	126.2	44%	0.442	65%	0.653	S	S	.	*	H	α-helix	trans	-68.1	-35.4	177.1	-179.2	0	0	0	0	110.5	Q481 Y482	V478-Q481 PolarHBondContact O-N 2.97Å; V478-Y482 HydrophobicContact CG1-CD2 3.88Å; V478-Y482 HydrophobicContact CG1-CE2 4.08Å; V478-Y482 WeakPolarHBondContact O-CD2 3.24Å; V478-Y482 PolarHBondContact O-N 3.29Å
479	Q	44.6	Very low	41	Very low	111 Å²	111	121.6 Å²	121.6	52%	0.519	64%	0.644	S	S	.	*	H	α-helix	trans	-67.9	-40.2	179.3	-165.6	61.6	38.7	0	0	112.1	D477 Q481 Y482 D483	D477-Q479 VanDerWaalsContact C-N 3.32Å; D477-Q479 PolarHBondContact O-N 3.36Å; Q479-Q481 PolarHBondContact O-N 3.5Å; Q479-Y482 PolarHBondContact O-N 2.97Å; Q479-D483 PolarHBondContact NE2-OD1 3.24Å; Q479-D483 PolarHBondContact O-N 3.41Å
480	L	46.3	Very low	39.8	Very low	109 Å²	109	119.9 Å²	119.9	57%	0.571	65%	0.649	S	S	*	*	H	α-helix	trans	-71.3	-29.3	179.1	-78	171.4	0	0	0	113.4	D477 N484	D477-L480 PolarHBondContact O-N 3.06Å; L480-N484 PolarHBondContact O-N 3.49Å; L480-N484 PolarHBondContact O-ND2 3.39Å
481	Q	50.6	Low	39.2	Very low	140 Å²	140	125.1 Å²	125.1	65%	0.654	66%	0.659	S	S	*	*	H	α-helix	trans	-73.4	-39.5	172.3	-79.5	-175.5	-27.8	0	0	111.8	D477 V478 Q479 D483 N484 E485	D477-Q481 PolarHBondContact O-N 2.94Å; V478-Q481 PolarHBondContact O-N 2.97Å; Q479-Q481 PolarHBondContact O-N 3.5Å; Q481-D483 PolarHBondContact O-N 3.07Å; Q481-N484 PolarHBondContact O-N 3.41Å; Q481-E485 PolarHBondContact O-N 3.13Å
482	Y	40.7	Very low	38.6	Very low	158 Å²	158	125.7 Å²	125.7	62%	0.62	66%	0.663	S	S	*	*	H	α-helix	trans	-61.2	-43.9	174.3	-100.5	-87.1	0	0	0	112.1	V478 Q479 N484 S486	V478-Y482 HydrophobicContact CG1-CD2 3.88Å; V478-Y482 HydrophobicContact CG1-CE2 4.08Å; V478-Y482 WeakPolarHBondContact O-CD2 3.24Å; V478-Y482 PolarHBondContact O-N 3.29Å; Q479-Y482 PolarHBondContact O-N 2.97Å; Y482-N484 VanDerWaalsContact C-N 3.3Å; Y482-N484 PolarHBondContact O-N 3.25Å; Y482-S486 WeakPolarHBondContact O-CB 3.41Å; Y482-S486 PolarHBondContact O-N 2.94Å; Y482-S486 VanDerWaalsContact O-N 3.09Å; Y482-S486 PolarHBondContact O-OG 2.93Å
483	D	39.7	Very low	38	Very low	86 Å²	86	121.7 Å²	121.7	46%	0.46	66%	0.657	S	S	.	*	H	α-helix	trans	-67.9	-29.3	-178.8	-69.4	-14.7	0	0	0	113	Q479 Q481	Q479-D483 PolarHBondContact NE2-OD1 3.24Å; Q479-D483 PolarHBondContact O-N 3.41Å; Q481-D483 PolarHBondContact O-N 3.07Å
484	N	41.5	Very low	37.5	Very low	112 Å²	112	121.2 Å²	121.2	60%	0.599	66%	0.658	S	S	*	*	H	α-helix	trans	-85.1	-33.3	180	-87	-31.7	0	0	0	113.7	L480 Q481 Y482	L480-N484 PolarHBondContact O-N 3.49Å; L480-N484 PolarHBondContact O-ND2 3.39Å; Q481-N484 PolarHBondContact O-N 3.41Å; Y482-N484 VanDerWaalsContact C-N 3.3Å; Y482-N484 PolarHBondContact O-N 3.25Å
485	E	42.3	Very low	36.8	Very low	154 Å²	154	122.6 Å²	122.6	72%	0.72	67%	0.668	S	S	*	*	H	α-helix	trans	-75.2	-30.6	174.4	-72.2	-169.4	163.2	0	0	111.9	Q481 K487 K488	Q481-E485 PolarHBondContact O-N 3.13Å; E485-K487 PolarHBondContact O-N 3.26Å; E485-K487 VanDerWaalsContact O-N 3.16Å; E485-K488 PolarHBondContact O-N 3.06Å; E485-K488 VanDerWaalsContact O-N 3.12Å
486	S	33.6	Very low	36.1	Very low	96 Å²	96	120.9 Å²	120.9	67%	0.671	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	-20.9	173.7	-77.4	0	0	0	0	114.1	Y482	Y482-S486 WeakPolarHBondContact O-CB 3.41Å; Y482-S486 PolarHBondContact O-N 2.94Å; Y482-S486 VanDerWaalsContact O-N 3.09Å; Y482-S486 PolarHBondContact O-OG 2.93Å
487	K	37.5	Very low	35.7	Very low	182 Å²	182	122 Å²	122	79%	0.791	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-8.2	176.2	-75.2	-175.7	179.8	174.4	0	114.9	E485	E485-K487 PolarHBondContact O-N 3.26Å; E485-K487 VanDerWaalsContact O-N 3.16Å
488	K	35.4	Very low	35.5	Very low	196 Å²	196	125.1 Å²	125.1	85%	0.852	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.8	-1.5	-174.4	-73.5	-171.6	177.9	178.6	0	116.2	E485	E485-K488 PolarHBondContact O-N 3.06Å; E485-K488 VanDerWaalsContact O-N 3.12Å
489	S	28.1	Very low	35.5	Very low	89 Å²	89	126.4 Å²	126.4	62%	0.622	68%	0.684	S	S	*	*			trans	-120	68.9	172.7	-176	0	0	0	0	112	K491	S489-K491 PolarHBondContact O-N 2.9Å
490	G	24.8	Very low	36.1	Very low	79 Å²	79	129.6 Å²	129.6	81%	0.814	70%	0.7	S	S	*	*			trans	-71.1	73.7	158.9	0	0	0	0	0	110.2
491	K	27	Very low	37	Very low	180 Å²	180	125.7 Å²	125.7	78%	0.783	68%	0.683	S	S	*	*			trans	-116.8	108	163.2	-95.4	-177.9	177.4	174.6	0	107.3	S489 I493	S489-K491 PolarHBondContact O-N 2.9Å; K491-I493 VanDerWaalsContact C-N 3.32Å; K491-I493 PolarHBondContact O-N 3.46Å
492	N	24.9	Very low	37.9	Very low	163 Å²	163	120.4 Å²	120.4	87%	0.872	66%	0.661	S	S	*	*			trans	-55.6	85.2	-179.9	-61.5	-24.6	0	0	0	111.5
493	I	26.4	Very low	39.5	Very low	155 Å²	155	118.3 Å²	118.3	80%	0.795	67%	0.669	S	S	*	*			trans	-92.3	103.6	147.8	-70	169.5	0	0	0	103.6	K491 S495	K491-I493 VanDerWaalsContact C-N 3.32Å; K491-I493 PolarHBondContact O-N 3.46Å; I493-S495 PolarHBondContact O-N 3.17Å
494	S	25.9	Very low	41.5	Very low	95 Å²	95	118.6 Å²	118.6	66%	0.664	67%	0.668	S	S	*	*			trans	-48.8	105.7	176.5	-60.3	0	0	0	0	109.7	S496	S494-S496 PolarHBondContact O-N 2.96Å
495	S	26.3	Very low	43.8	Very low	109 Å²	109	114 Å²	114	76%	0.762	64%	0.644	S	S	*	*			trans	-84.2	23.4	166.9	59.3	0	0	0	0	111.8	I493	I493-S495 PolarHBondContact O-N 3.17Å
496	S	26.9	Very low	46	Very low	89 Å²	89	106.8 Å²	106.8	62%	0.622	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	104.5	153.8	61.6	0	0	0	0	105.2	S494	S494-S496 PolarHBondContact O-N 2.96Å
497	S	34.9	Very low	48.7	Very low	88 Å²	88	102.2 Å²	102.2	62%	0.615	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn		-167.4	59.8	62.1	-61.2	0	0	0	0	109.6	I499	S497-I499 PolarHBondContact O-N 2.93Å
498	L	39	Very low	51.2	Low	164 Å²	164	93.8 Å²	93.8	86%	0.859	54%	0.542	S	S	*	.			trans	-67.4	92.1	165.6	-72.5	164.1	0	0	0	106.8	Q500	L498-Q500 PolarHBondContact O-N 3.34Å
499	I	48.3	Very low	53.8	Low	99 Å²	99	85.3 Å²	85.3	51%	0.508	51%	0.506	S	S	.	.			trans	-60.9	110	172.8	-63.9	168.6	0	0	0	105.7	S497 A501 E518	S497-I499 PolarHBondContact O-N 2.93Å; I499-A501 PolarHBondContact O-N 3.45Å; I499-A501 VanDerWaalsContact O-N 3.14Å; I499-E518 WeakPolarHBondContact CD1-O 3.34Å
500	Q	59.1	Low	56.7	Low	179 Å²	179	81.3 Å²	81.3	84%	0.836	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-61.5	117.2	175.2	-172.5	172.2	-3.3	0	0	106.9	L498	L498-Q500 PolarHBondContact O-N 3.34Å
501	A	64.5	Low	59.5	Low	27 Å²	27	78.7 Å²	78.7	22%	0.223	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-54.8	128.6	176.6	0	0	0	0	0	108.4	I499 F506	I499-A501 PolarHBondContact O-N 3.45Å; I499-A501 VanDerWaalsContact O-N 3.14Å; A501-F506 HydrophobicContact CB-CE1 4.19Å; A501-F506 HydrophobicContact CB-CZ 4.15Å
502	P	69.2	Low	62	Low	29 Å²	29	74.7 Å²	74.7	19%	0.188	44%	0.439	C	S	.	.	P	Polyproline II helix	trans	-61.5	152.6	179	23.5	-29.4	0	0	0	110.4	E504 F506 L521 S604	P502-E504 HydrophobicContact CB-CG 4.03Å; P502-E504 PolarHBondContact O-N 3.08Å; P502-F506 HydrophobicContact CG-CB 4.22Å; P502-F506 HydrophobicContact CG-CD1 3.67Å; P502-F506 HydrophobicContact CG-CE1 4.23Å; P502-F506 HydrophobicContact CG-CG 4.05Å; P502-L521 HydrophobicContact CG-CD1 4.33Å; P502-L521 HydrophobicContact CG-CD2 3.78Å; P502-S604 WeakPolarHBondContact O-CB 3.49Å
503	S	75.2	Confident	64.5	Low	114 Å²	114	70 Å²	70	80%	0.797	41%	0.414	S	S	*	.	S	Bend	trans	-71.6	-23.8	178.4	52.1	0	0	0	0	112.9
504	E	81.8	Confident	66.7	Low	91 Å²	91	64.3 Å²	64.3	43%	0.425	39%	0.387	S	S	.	.	S	Bend	trans	-84.1	154.9	175.9	56.5	-173.2	-179.2	0	0	111.8	P502 F506 S523	P502-E504 HydrophobicContact CB-CG 4.03Å; P502-E504 PolarHBondContact O-N 3.08Å; E504-F506 WeakPolarHBondContact O-CD1 3.38Å; E504-S523 WeakPolarHBondContact OE1-CB 3.38Å; E504-S523 PolarHBondContact OE1-OG 3.22Å
505	P	88.2	Confident	68.9	Low	17 Å²	17	67.1 Å²	67.1	11%	0.11	39%	0.39	C	S	.	.			trans	-54.6	143.8	173.6	-26.5	35.8	0	0	0	112.7	L524 L555 Y601 L602	P505-L524 WeakPolarHBondContact O-CB 3.45Å; P505-L524 PolarHBondContact O-N 3.47Å; P505-L555 HydrophobicContact CB-CD1 3.91Å; P505-L555 HydrophobicContact CB-CD2 4.31Å; P505-L555 HydrophobicContact CG-CD1 4.21Å; P505-Y601 CarbonylContact C-O 3.49Å; P505-Y601 VanDerWaalsContact CA-O 3.26Å; P505-Y601 WeakPolarHBondContact CA-O 3.14Å; P505-L602 HydrophobicContact CB-CD2 4.34Å
506	F	88.4	Confident	71.3	Confident	1 Å²	1	66 Å²	66	0%	0.004	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	160.5	-178.6	62.8	-87.7	0	0	0	111.9	A501 P502 E504 V508 L521 F522 Y601 P605	A501-F506 HydrophobicContact CB-CE1 4.19Å; A501-F506 HydrophobicContact CB-CZ 4.15Å; P502-F506 HydrophobicContact CG-CB 4.22Å; P502-F506 HydrophobicContact CG-CD1 3.67Å; P502-F506 HydrophobicContact CG-CE1 4.23Å; P502-F506 HydrophobicContact CG-CG 4.05Å; E504-F506 WeakPolarHBondContact O-CD1 3.38Å; F506-V508 HydrophobicContact CD2-CG2 3.64Å; F506-V508 HydrophobicContact CE2-CG2 3.51Å; F506-L521 HydrophobicContact CB-CD2 4.03Å; F506-L521 HydrophobicContact CB-CG 4.24Å; F506-L521 HydrophobicContact CD2-CD1 3.44Å; F506-L521 VanDerWaalsContact CD2-CD1 3.44Å; F506-L521 HydrophobicContact CD2-CD2 4.25Å; F506-L521 HydrophobicContact CD2-CG 3.61Å; F506-L521 HydrophobicContact CE2-CD1 3.52Å; F506-L521 HydrophobicContact CE2-CG 4.2Å; F506-L521 HydrophobicContact CG-CD1 4.03Å; F506-L521 HydrophobicContact CG-CD2 4.23Å; F506-L521 HydrophobicContact CG-CG 4.1Å; F506-L521 HydrophobicContact CZ-CD1 4.2Å; F506-F522 CarbonylContact C-O 3.32Å; F506-F522 VanDerWaalsContact CA-O 3.23Å; F506-F522 WeakPolarHBondContact CA-O 3.19Å; F506-F522 VanDerWaalsContact CB-O 3.31Å; F506-F522 WeakPolarHBondContact CB-O 3.46Å; F506-Y601 HydrophobicContact CD2-CD2 4.02Å; F506-Y601 HydrophobicContact CE1-CG 4.35Å; F506-Y601 AromaticContact CE2-CD2 3.32Å; F506-Y601 HydrophobicContact CE2-CD2 3.32Å; F506-Y601 HydrophobicContact CE2-CE2 4.11Å; F506-Y601 AromaticContact CE2-CG 3.83Å; F506-Y601 HydrophobicContact CE2-CG 3.83Å; F506-Y601 AromaticContact CZ-CD2 3.7Å; F506-Y601 HydrophobicContact CZ-CD2 3.7Å; F506-Y601 AromaticContact CZ-CG 3.72Å; F506-Y601 HydrophobicContact CZ-CG 3.72Å; F506-Y601 PolarHBondContact N-O 3.43Å; F506-Y601 PolarHBondContact O-N 2.87Å; F506-P605 HydrophobicContact CZ-CG 4.26Å
507	V	90.8	Very high	73.7	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	144.3	167.5	-70.2	0	0	0	0	109.8	F522 L524 V539 L553 F598 I599 L600	V507-F522 HydrophobicContact CG2-CB 3.9Å; V507-F522 HydrophobicContact CG2-CD2 4.4Å; V507-F522 PolarHBondContact N-O 3.09Å; V507-F522 PolarHBondContact O-N 3.33Å; V507-L524 HydrophobicContact CG1-CD1 3.99Å; V507-L524 HydrophobicContact CG1-CD2 4.38Å; V507-L524 HydrophobicContact CG1-CG 4.42Å; V507-L524 HydrophobicContact CG2-CD2 4.15Å; V507-V539 HydrophobicContact CG2-CG2 4.32Å; V507-L553 HydrophobicContact CG1-CD1 4.2Å; V507-F598 HydrophobicContact CB-CD1 4.42Å; V507-F598 HydrophobicContact CG2-CD1 4.44Å; V507-I599 WeakPolarHBondContact CA-O 3.3Å; V507-L600 HydrophobicContact CG1-CB 4.33Å; V507-L600 HydrophobicContact CG1-CD1 3.52Å
508	V	89.5	Confident	75.3	Confident	5 Å²	5	62 Å²	62	3%	0.03	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	126	174.2	-172.3	0	0	0	0	108.9	F506 S517 L520 L521 F598 I599 Y601 M610	F506-V508 HydrophobicContact CD2-CG2 3.64Å; F506-V508 HydrophobicContact CE2-CG2 3.51Å; V508-S517 WeakPolarHBondContact CG1-O 3.45Å; V508-L520 WeakPolarHBondContact CA-O 3.21Å; V508-L521 HydrophobicContact CG2-CD1 4.36Å; V508-L521 HydrophobicContact CG2-CG 4.39Å; V508-F598 CarbonylContact O-C 3.47Å; V508-F598 WeakPolarHBondContact O-CA 3.36Å; V508-I599 HydrophobicContact CB-CG2 3.89Å; V508-I599 HydrophobicContact CG2-CG2 4.45Å; V508-I599 PolarHBondContact N-O 3.44Å; V508-I599 PolarHBondContact O-N 3.11Å; V508-Y601 HydrophobicContact CG2-CD2 4.17Å; V508-Y601 HydrophobicContact CG2-CE2 4.16Å; V508-M610 HydrophobicContact CB-CE 4.08Å; V508-M610 HydrophobicContact CG1-CE 3.37Å
509	L	90.6	Very high	77	Confident	18 Å²	18	56.9 Å²	56.9	9%	0.094	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	120.1	172.8	179.5	68.4	0	0	0	109.3	L520 F522 V541 Q596 Y597 F598	L509-L520 HydrophobicContact CB-CB 3.9Å; L509-L520 HydrophobicContact CB-CD1 4.31Å; L509-L520 HydrophobicContact CD2-CD1 4.09Å; L509-L520 HydrophobicContact CG-CD1 4.25Å; L509-L520 PolarHBondContact N-O 2.81Å; L509-F522 HydrophobicContact CB-CE2 3.98Å; L509-V541 HydrophobicContact CD1-CG1 4.39Å; L509-V541 HydrophobicContact CD2-CG1 3.99Å; L509-Q596 HydrophobicContact CD1-CB 4.1Å; L509-Y597 WeakPolarHBondContact CD1-O 3.43Å; L509-F598 HydrophobicContact CB-CD1 3.91Å; L509-F598 HydrophobicContact CB-CE1 3.82Å; L509-F598 HydrophobicContact CD1-CD1 3.84Å; L509-F598 HydrophobicContact CD1-CD2 4.12Å; L509-F598 HydrophobicContact CD1-CE1 3.52Å; L509-F598 HydrophobicContact CD1-CE2 3.8Å; L509-F598 HydrophobicContact CD1-CG 4.15Å; L509-F598 HydrophobicContact CD1-CZ 3.53Å; L509-F598 HydrophobicContact CG-CE1 4.2Å
510	L	89.5	Confident	78.6	Confident	6 Å²	6	54.6 Å²	54.6	3%	0.031	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	127.5	-176	-58	175.5	0	0	0	110	Y597 I599 M610 L613 F614 A617	L510-Y597 WeakPolarHBondContact CB-O 3.34Å; L510-Y597 PolarHBondContact N-O 2.97Å; L510-I599 HydrophobicContact CD1-CB 4.4Å; L510-I599 HydrophobicContact CD2-CB 4.49Å; L510-I599 HydrophobicContact CD2-CG2 3.86Å; L510-I599 HydrophobicContact CG-CG2 4.4Å; L510-M610 HydrophobicContact CD2-CE 3.44Å; L510-M610 VanDerWaalsContact CD2-CE 3.44Å; L510-L613 HydrophobicContact CD1-CB 4.28Å; L510-L613 HydrophobicContact CD2-CB 3.9Å; L510-L613 HydrophobicContact CD2-CD1 4.34Å; L510-F614 HydrophobicContact CB-CB 4.23Å; L510-F614 HydrophobicContact CB-CD2 4.08Å; L510-F614 WeakPolarHBondContact O-CD2 3.23Å; L510-A617 HydrophobicContact CD1-CB 3.99Å
511	S	84.1	Confident	79.9	Confident	23 Å²	23	48.4 Å²	48.4	16%	0.161	29%	0.285	C	S	.	.			trans	-113.5	154	173	175.1	0	0	0	0	109.5	D513 S517 F614	S511-D513 PolarHBondContact O-N 2.96Å; S511-D513 VanDerWaalsContact O-N 3.11Å; S511-D513 PolarHBondContact OG-N 3.48Å; S511-S517 WeakPolarHBondContact CB-OG 3.3Å; S511-S517 PolarHBondContact N-OG 2.86Å; S511-S517 PolarHBondContact O-OG 3.28Å; S511-F614 WeakPolarHBondContact O-CB 3.3Å
512	P	78.4	Confident	81	Confident	96 Å²	96	49.7 Å²	49.7	62%	0.623	29%	0.285	S	S	*	.	S	Bend	trans	-54.9	-24.3	169.1	-22.2	30.7	0	0	0	113.3	F614	P512-F614 HydrophobicContact CB-CD1 4.26Å; P512-F614 HydrophobicContact CB-CE1 4.29Å; P512-F614 HydrophobicContact CG-CD1 4.13Å; P512-F614 HydrophobicContact CG-CE1 3.76Å; P512-F614 HydrophobicContact CG-CE2 4.2Å; P512-F614 HydrophobicContact CG-CZ 3.8Å
513	D	77.3	Confident	81.9	Confident	65 Å²	65	51 Å²	51	35%	0.348	30%	0.295	S	S	.	.	S	Bend	trans	-95.4	116.7	172.2	-169.9	-24.9	0	0	0	110.4	S511 Q515 I516 S517	S511-D513 PolarHBondContact O-N 2.96Å; S511-D513 VanDerWaalsContact O-N 3.11Å; S511-D513 PolarHBondContact OG-N 3.48Å; D513-Q515 VanDerWaalsContact C-N 3.27Å; D513-Q515 PolarHBondContact O-N 3.17Å; D513-Q515 WeakPolarHBondContact OD1-CB 3.46Å; D513-Q515 PolarHBondContact OD1-N 3.18Å; D513-I516 HydrophobicContact CB-CB 4.13Å; D513-I516 HydrophobicContact CB-CD1 3.75Å; D513-I516 HydrophobicContact CB-CG1 3.81Å; D513-I516 PolarHBondContact O-N 2.92Å; D513-S517 PolarHBondContact O-N 3.01Å; D513-S517 VanDerWaalsContact O-N 3.09Å; D513-S517 PolarHBondContact O-OG 3.25Å
514	P	72.5	Confident	82.5	Confident	36 Å²	36	45.7 Å²	45.7	23%	0.234	26%	0.257	C	S	.	.	H	α-helix	trans	-56.6	-36.4	176	-24.6	34.1	0	0	0	113.5	I516 S517 E518 M610 D611	P514-I516 VanDerWaalsContact C-N 3.34Å; P514-I516 PolarHBondContact O-N 3.26Å; P514-S517 WeakPolarHBondContact O-CB 3.38Å; P514-S517 PolarHBondContact O-N 3.37Å; P514-E518 WeakPolarHBondContact O-CG 3.07Å; P514-E518 PolarHBondContact O-N 3.44Å; P514-M610 HydrophobicContact CB-CB 4.19Å; P514-D611 WeakPolarHBondContact CG-OD1 3.5Å
515	Q	73.2	Confident	82.7	Confident	154 Å²	154	43.9 Å²	43.9	72%	0.72	26%	0.255	S	S	*	.	H	α-helix	trans	-68.5	-35.2	-178.4	-61.6	-175.8	-7.2	0	0	111.9	D513	D513-Q515 VanDerWaalsContact C-N 3.27Å; D513-Q515 PolarHBondContact O-N 3.17Å; D513-Q515 WeakPolarHBondContact OD1-CB 3.46Å; D513-Q515 PolarHBondContact OD1-N 3.18Å
516	I	77	Confident	82.5	Confident	85 Å²	85	48.7 Å²	48.7	44%	0.436	29%	0.286	S	S	.	.	H	α-helix	trans	-69.2	-42.3	173.5	-61	179.6	0	0	0	109.5	D513 P514 E518 G519 L520	D513-I516 HydrophobicContact CB-CB 4.13Å; D513-I516 HydrophobicContact CB-CD1 3.75Å; D513-I516 HydrophobicContact CB-CG1 3.81Å; D513-I516 PolarHBondContact O-N 2.92Å; P514-I516 VanDerWaalsContact C-N 3.34Å; P514-I516 PolarHBondContact O-N 3.26Å; I516-E518 VanDerWaalsContact C-N 3.27Å; I516-E518 PolarHBondContact O-N 2.87Å; I516-G519 PolarHBondContact O-N 2.97Å; I516-L520 HydrophobicContact CG2-CD1 3.68Å; I516-L520 HydrophobicContact CG2-CG 4.26Å; I516-L520 WeakPolarHBondContact O-CG 3.46Å; I516-L520 PolarHBondContact O-N 3.46Å
517	S	76.6	Confident	82.6	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.014	30%	0.302	C	S	.	.	H	α-helix	trans	-59.7	-37.8	178.8	-52	0	0	0	0	112.1	V508 S511 D513 P514 G519 L520	V508-S517 WeakPolarHBondContact CG1-O 3.45Å; S511-S517 WeakPolarHBondContact CB-OG 3.3Å; S511-S517 PolarHBondContact N-OG 2.86Å; S511-S517 PolarHBondContact O-OG 3.28Å; D513-S517 PolarHBondContact O-N 3.01Å; D513-S517 VanDerWaalsContact O-N 3.09Å; D513-S517 PolarHBondContact O-OG 3.25Å; P514-S517 WeakPolarHBondContact O-CB 3.38Å; P514-S517 PolarHBondContact O-N 3.37Å; S517-G519 PolarHBondContact O-N 3.17Å; S517-L520 PolarHBondContact O-N 3.41Å
518	E	69.1	Low	82.6	Confident	90 Å²	90	56.7 Å²	56.7	42%	0.421	33%	0.332	S	S	.	.	H	α-helix	trans	-59.3	-32.8	174.8	-73.4	179.5	176	0	0	112.8	I499 P514 I516 M610	I499-E518 WeakPolarHBondContact CD1-O 3.34Å; P514-E518 WeakPolarHBondContact O-CG 3.07Å; P514-E518 PolarHBondContact O-N 3.44Å; I516-E518 VanDerWaalsContact C-N 3.27Å; I516-E518 PolarHBondContact O-N 2.87Å; E518-M610 HydrophobicContact CG-CG 3.89Å
519	G	73	Confident	82.8	Confident	57 Å²	57	56.6 Å²	56.6	59%	0.588	33%	0.332	S	S	*	.	H	α-helix	trans	-84.7	-8.6	178.4	0	0	0	0	0	115.3	I516 S517	I516-G519 PolarHBondContact O-N 2.97Å; S517-G519 PolarHBondContact O-N 3.17Å
520	L	83.4	Confident	83	Confident	52 Å²	52	60.7 Å²	60.7	27%	0.272	35%	0.346	S	S	.	.			trans	-105.4	50.6	-175	-62.6	169.7	0	0	0	112.1	V508 L509 I516 S517 F522	V508-L520 WeakPolarHBondContact CA-O 3.21Å; L509-L520 HydrophobicContact CB-CB 3.9Å; L509-L520 HydrophobicContact CB-CD1 4.31Å; L509-L520 HydrophobicContact CD2-CD1 4.09Å; L509-L520 HydrophobicContact CG-CD1 4.25Å; L509-L520 PolarHBondContact N-O 2.81Å; I516-L520 HydrophobicContact CG2-CD1 3.68Å; I516-L520 HydrophobicContact CG2-CG 4.26Å; I516-L520 WeakPolarHBondContact O-CG 3.46Å; I516-L520 PolarHBondContact O-N 3.46Å; S517-L520 PolarHBondContact O-N 3.41Å; L520-F522 HydrophobicContact CB-CE2 4.45Å; L520-F522 WeakPolarHBondContact O-CE2 3.36Å
521	L	85.9	Confident	83.3	Confident	49 Å²	49	60.5 Å²	60.5	26%	0.257	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	132	178	-174.8	150.8	0	0	0	110.5	P502 F506 V508	P502-L521 HydrophobicContact CG-CD1 4.33Å; P502-L521 HydrophobicContact CG-CD2 3.78Å; F506-L521 HydrophobicContact CB-CD2 4.03Å; F506-L521 HydrophobicContact CB-CG 4.24Å; F506-L521 HydrophobicContact CD2-CD1 3.44Å; F506-L521 VanDerWaalsContact CD2-CD1 3.44Å; F506-L521 HydrophobicContact CD2-CD2 4.25Å; F506-L521 HydrophobicContact CD2-CG 3.61Å; F506-L521 HydrophobicContact CE2-CD1 3.52Å; F506-L521 HydrophobicContact CE2-CG 4.2Å; F506-L521 HydrophobicContact CG-CD1 4.03Å; F506-L521 HydrophobicContact CG-CD2 4.23Å; F506-L521 HydrophobicContact CG-CG 4.1Å; F506-L521 HydrophobicContact CZ-CD1 4.2Å; V508-L521 HydrophobicContact CG2-CD1 4.36Å; V508-L521 HydrophobicContact CG2-CG 4.39Å
522	F	87.8	Confident	83.7	Confident	54 Å²	54	59.4 Å²	59.4	24%	0.237	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	112.1	176.8	-54	-91.5	0	0	0	109.9	F506 V507 L509 L520 V539	F506-F522 CarbonylContact C-O 3.32Å; F506-F522 VanDerWaalsContact CA-O 3.23Å; F506-F522 WeakPolarHBondContact CA-O 3.19Å; F506-F522 VanDerWaalsContact CB-O 3.31Å; F506-F522 WeakPolarHBondContact CB-O 3.46Å; V507-F522 HydrophobicContact CG2-CB 3.9Å; V507-F522 HydrophobicContact CG2-CD2 4.4Å; V507-F522 PolarHBondContact N-O 3.09Å; V507-F522 PolarHBondContact O-N 3.33Å; L509-F522 HydrophobicContact CB-CE2 3.98Å; L520-F522 HydrophobicContact CB-CE2 4.45Å; L520-F522 WeakPolarHBondContact O-CE2 3.36Å; F522-V539 HydrophobicContact CB-CG2 3.97Å; F522-V539 HydrophobicContact CD1-CG1 4.12Å; F522-V539 HydrophobicContact CD1-CG2 4.48Å; F522-V539 HydrophobicContact CD2-CG1 4.04Å; F522-V539 HydrophobicContact CE1-CG1 4.32Å; F522-V539 HydrophobicContact CE2-CG1 4.25Å; F522-V539 HydrophobicContact CG-CG1 3.98Å; F522-V539 HydrophobicContact CG-CG2 4.24Å; F522-V539 HydrophobicContact CZ-CG1 4.38Å
523	S	87.1	Confident	84.2	Confident	55 Å²	55	56.9 Å²	56.9	39%	0.385	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	139.3	170.3	-72	0	0	0	0	110.6	E504	E504-S523 WeakPolarHBondContact OE1-CB 3.38Å; E504-S523 PolarHBondContact OE1-OG 3.22Å
524	L	88.2	Confident	84.6	Confident	3 Å²	3	57.1 Å²	57.1	2%	0.016	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-102.6	130.1	177.8	-63.5	174	0	0	0	110	P505 V507 N529 L553 L555 L600	P505-L524 WeakPolarHBondContact O-CB 3.45Å; P505-L524 PolarHBondContact O-N 3.47Å; V507-L524 HydrophobicContact CG1-CD1 3.99Å; V507-L524 HydrophobicContact CG1-CD2 4.38Å; V507-L524 HydrophobicContact CG1-CG 4.42Å; V507-L524 HydrophobicContact CG2-CD2 4.15Å; L524-N529 HydrophobicContact CD2-CB 3.93Å; L524-L553 HydrophobicContact CD1-CD1 4.13Å; L524-L553 HydrophobicContact CD1-CD2 3.69Å; L524-L553 HydrophobicContact CD2-CD2 4.37Å; L524-L555 HydrophobicContact CB-CD1 3.32Å; L524-L555 HydrophobicContact CB-CG 4.41Å; L524-L555 HydrophobicContact CD1-CD1 4.01Å; L524-L555 HydrophobicContact CD1-CG 4.46Å; L524-L555 HydrophobicContact CG-CD1 4.34Å; L524-L600 HydrophobicContact CD1-CD1 3.66Å
525	S	85.8	Confident	85.1	Confident	54 Å²	54	66.4 Å²	66.4	38%	0.378	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-83.4	150.3	176.8	65.5	0	0	0	0	111.8	G527 N529	S525-G527 PolarHBondContact O-N 3.24Å; S525-N529 PolarHBondContact N-OD1 3.46Å; S525-N529 PolarHBondContact O-ND2 3.34Å; S525-N529 PolarHBondContact OG-OD1 3.28Å
526	P	85.3	Confident	85.7	Confident	118 Å²	118	63.2 Å²	63.2	77%	0.766	35%	0.345	S	S	*	.	S	Bend	trans	-58.5	133.2	171.2	-22	32.5	0	0	0	111.2
527	G	89.3	Confident	86.4	Confident	32 Å²	32	59.8 Å²	59.8	33%	0.33	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	100.4	-148.1	-172	0	0	0	0	0	112.3	S525 N529 S554 L555	S525-G527 PolarHBondContact O-N 3.24Å; G527-N529 PolarHBondContact O-ND2 2.94Å; G527-S554 CarbonylContact O-C 3.45Å; G527-S554 WeakPolarHBondContact O-CA 3.43Å; G527-L555 PolarHBondContact N-O 3.43Å; G527-L555 PolarHBondContact O-N 2.83Å
528	E	91.1	Very high	87	Confident	137 Å²	137	63.4 Å²	63.4	64%	0.64	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	128.6	-173.4	-62.1	-172.5	170.5	0	0	112	T552	E528-T552 HydrophobicContact CB-CG2 3.82Å; E528-T552 HydrophobicContact CG-CG2 4.21Å
529	N	93.1	Very high	88	Confident	3 Å²	3	59.2 Å²	59.2	2%	0.016	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	111.7	173.9	-57.5	-91.8	0	0	0	108.3	L524 S525 G527 D538 T552 L553	L524-N529 HydrophobicContact CD2-CB 3.93Å; S525-N529 PolarHBondContact N-OD1 3.46Å; S525-N529 PolarHBondContact O-ND2 3.34Å; S525-N529 PolarHBondContact OG-OD1 3.28Å; G527-N529 PolarHBondContact O-ND2 2.94Å; N529-D538 HydrophobicContact CB-CB 4.38Å; N529-T552 CarbonylContact O-C 3.53Å; N529-L553 WeakPolarHBondContact CA-O 3.47Å; N529-L553 WeakPolarHBondContact CB-O 3.49Å; N529-L553 PolarHBondContact N-O 3.25Å; N529-L553 PolarHBondContact ND2-O 3.34Å; N529-L553 PolarHBondContact O-N 3.21Å
530	R	95.4	Very high	88.8	Confident	103 Å²	103	58.9 Å²	58.9	39%	0.389	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	135.6	-176.3	-67.4	172.9	-65.1	171.5	4.7	110.5	C536 C537 D538 V539 L549 T552	R530-C536 PolarHBondContact NH2-O 3.27Å; R530-C537 HydrophobicContact CB-CB 4.3Å; R530-C537 WeakPolarHBondContact O-CB 3.37Å; R530-D538 WeakPolarHBondContact CB-OD2 3.42Å; R530-D538 PolarHBondContact N-OD2 2.84Å; R530-D538 IonicContact NE-OD2 2.67Å; R530-D538 PolarHBondContact O-N 3Å; R530-V539 PolarHBondContact O-N 3.32Å; R530-L549 HydrophobicContact CB-CD1 3.63Å; R530-L549 HydrophobicContact CG-CD1 3.93Å; R530-T552 HydrophobicContact CG-CG2 4.35Å
531	I	95.3	Very high	89	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.01	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	126.1	-177.9	-45.7	-174.9	0	0	0	109.6	V539 V541 H550 C551 L553 L592 F598	I531-V539 WeakPolarHBondContact CA-O 3.43Å; I531-V539 HydrophobicContact CB-CB 4.37Å; I531-V539 HydrophobicContact CG1-CB 4.04Å; I531-V539 HydrophobicContact CG1-CG2 4.36Å; I531-V539 HydrophobicContact CG2-CB 4.08Å; I531-V539 HydrophobicContact CG2-CG1 4.15Å; I531-V541 HydrophobicContact CG2-CG2 4.02Å; I531-H550 WeakPolarHBondContact O-CA 3.46Å; I531-H550 WeakPolarHBondContact O-CB 3.47Å; I531-H550 PolarHBondContact O-N 2.73Å; I531-C551 PolarHBondContact N-O 3.04Å; I531-C551 PolarHBondContact O-N 3.41Å; I531-C551 VanDerWaalsContact O-N 3.1Å; I531-L553 HydrophobicContact CD1-CB 4.35Å; I531-L592 HydrophobicContact CG2-CD1 3.72Å; I531-F598 HydrophobicContact CG2-CZ 4.34Å
532	G	93	Very high	88.7	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.6	-170.6	-179.1	0	0	0	0	0	114.1	V539 V540 V541 A547 P548	G532-V539 PolarHBondContact N-O 3.08Å; G532-V539 VanDerWaalsContact N-O 3.17Å; G532-V540 WeakPolarHBondContact O-CA 3.46Å; G532-V541 PolarHBondContact O-N 3.08Å; G532-A547 WeakPolarHBondContact CA-O 3.45Å; G532-P548 CarbonylContact C-O 3.48Å; G532-P548 WeakPolarHBondContact CA-O 3.2Å
533	T	88.2	Confident	88.2	Confident	43 Å²	43	60 Å²	60	26%	0.264	33%	0.325	S	S	.	.	S	Bend	trans	-84.9	-16.1	179.4	67.8	0	0	0	0	113.9	V541 I546 A547 P548	T533-V541 VanDerWaalsContact CA-O 3.28Å; T533-V541 WeakPolarHBondContact CA-O 3.5Å; T533-V541 WeakPolarHBondContact CG2-O 3.44Å; T533-I546 HydrophobicContact CG2-CB 3.79Å; T533-I546 HydrophobicContact CG2-CG2 3.83Å; T533-I546 WeakPolarHBondContact CG2-O 3.17Å; T533-A547 PolarHBondContact N-O 3.48Å; T533-P548 PolarHBondContact N-O 2.89Å; T533-P548 VanDerWaalsContact N-O 3.13Å; T533-P548 VanDerWaalsContact OG1-CA 3.28Å; T533-P548 WeakPolarHBondContact OG1-CA 3.44Å
534	D	87.3	Confident	87.8	Confident	71 Å²	71	62.5 Å²	62.5	38%	0.38	34%	0.343	S	S	.	.	S	Bend	trans	-69.8	135.7	179	-163.8	-45.8	0	0	0	110.2	C536 C537 P548	D534-C536 PolarHBondContact O-N 3.31Å; D534-C536 VanDerWaalsContact O-N 3.14Å; D534-C536 WeakPolarHBondContact OD1-CB 3.47Å; D534-C536 PolarHBondContact OD1-N 3.33Å; D534-C536 PolarHBondContact OD1-SG 3.37Å; D534-C537 WeakPolarHBondContact O-CB 3.39Å; D534-C537 PolarHBondContact O-N 3.4Å; D534-P548 HydrophobicContact CB-CB 4.1Å; D534-P548 WeakPolarHBondContact CB-O 3.4Å; D534-P548 PolarHBondContact N-O 3.01Å
535	R	83.1	Confident	87.6	Confident	230 Å²	230	71 Å²	71	87%	0.868	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-17.8	177.4	-65.2	-175.4	178.8	-177.8	-0.2	113	C537	R535-C537 VanDerWaalsContact C-N 3.27Å
536	C	84.7	Confident	87.8	Confident	87 Å²	87	69 Å²	69	59%	0.588	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-5	175.6	-53.3	0	0	0	0	113.6	R530 D534	R530-C536 PolarHBondContact NH2-O 3.27Å; D534-C536 PolarHBondContact O-N 3.31Å; D534-C536 VanDerWaalsContact O-N 3.14Å; D534-C536 WeakPolarHBondContact OD1-CB 3.47Å; D534-C536 PolarHBondContact OD1-N 3.33Å; D534-C536 PolarHBondContact OD1-SG 3.37Å
537	C	91	Very high	88.1	Confident	13 Å²	13	64.2 Å²	64.2	9%	0.088	33%	0.33	C	S	.	.	S	Bend	trans	-77.2	151.1	175.9	-68.4	0	0	0	0	111.6	R530 D534 R535 V540 P548	R530-C537 HydrophobicContact CB-CB 4.3Å; R530-C537 WeakPolarHBondContact O-CB 3.37Å; D534-C537 WeakPolarHBondContact O-CB 3.39Å; D534-C537 PolarHBondContact O-N 3.4Å; R535-C537 VanDerWaalsContact C-N 3.27Å; C537-V540 HydrophobicContact CB-CG2 4.33Å; C537-V540 WeakPolarHBondContact O-CG2 3.26Å; C537-P548 PolarHBondContact SG-O 3.2Å; C537-P548 VanDerWaalsContact SG-O 3.32Å
538	D	89.9	Confident	88.3	Confident	78 Å²	78	66.3 Å²	66.3	42%	0.417	34%	0.339	S	S	.	.	S	Bend	trans	-73.2	-33.8	178.4	-52.6	-72.2	0	0	0	111.2	N529 R530	N529-D538 HydrophobicContact CB-CB 4.38Å; R530-D538 WeakPolarHBondContact CB-OD2 3.42Å; R530-D538 PolarHBondContact N-OD2 2.84Å; R530-D538 IonicContact NE-OD2 2.67Å; R530-D538 PolarHBondContact O-N 3Å
539	V	90.7	Very high	88.4	Confident	2 Å²	2	62.9 Å²	62.9	1%	0.012	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	102.6	169.3	-176.5	0	0	0	0	108.9	V507 F522 R530 I531 G532 V541 F598	V507-V539 HydrophobicContact CG2-CG2 4.32Å; F522-V539 HydrophobicContact CB-CG2 3.97Å; F522-V539 HydrophobicContact CD1-CG1 4.12Å; F522-V539 HydrophobicContact CD1-CG2 4.48Å; F522-V539 HydrophobicContact CD2-CG1 4.04Å; F522-V539 HydrophobicContact CE1-CG1 4.32Å; F522-V539 HydrophobicContact CE2-CG1 4.25Å; F522-V539 HydrophobicContact CG-CG1 3.98Å; F522-V539 HydrophobicContact CG-CG2 4.24Å; F522-V539 HydrophobicContact CZ-CG1 4.38Å; R530-V539 PolarHBondContact O-N 3.32Å; I531-V539 WeakPolarHBondContact CA-O 3.43Å; I531-V539 HydrophobicContact CB-CB 4.37Å; I531-V539 HydrophobicContact CG1-CB 4.04Å; I531-V539 HydrophobicContact CG1-CG2 4.36Å; I531-V539 HydrophobicContact CG2-CB 4.08Å; I531-V539 HydrophobicContact CG2-CG1 4.15Å; G532-V539 PolarHBondContact N-O 3.08Å; G532-V539 VanDerWaalsContact N-O 3.17Å; V539-V541 HydrophobicContact CG1-CG1 4.47Å; V539-F598 HydrophobicContact CG1-CE1 4.11Å; V539-F598 HydrophobicContact CG1-CZ 4.48Å
540	V	88.5	Confident	88.5	Confident	51 Å²	51	62.8 Å²	62.8	31%	0.309	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	121.6	178.7	-173.2	0	0	0	0	109.5	G532 C537	G532-V540 WeakPolarHBondContact O-CA 3.46Å; C537-V540 HydrophobicContact CB-CG2 4.33Å; C537-V540 WeakPolarHBondContact O-CG2 3.26Å
541	V	88.8	Confident	88.5	Confident	4 Å²	4	57.9 Å²	57.9	2%	0.024	31%	0.305	C	S	.	.			trans	-128.4	150.7	176.4	-82.2	0	0	0	0	111.7	L509 I531 G532 T533 V539 I546 L592 Q596 F598	L509-V541 HydrophobicContact CD1-CG1 4.39Å; L509-V541 HydrophobicContact CD2-CG1 3.99Å; I531-V541 HydrophobicContact CG2-CG2 4.02Å; G532-V541 PolarHBondContact O-N 3.08Å; T533-V541 VanDerWaalsContact CA-O 3.28Å; T533-V541 WeakPolarHBondContact CA-O 3.5Å; T533-V541 WeakPolarHBondContact CG2-O 3.44Å; V539-V541 HydrophobicContact CG1-CG1 4.47Å; V541-I546 HydrophobicContact CG2-CD1 4.32Å; V541-I546 HydrophobicContact CG2-CG2 4.3Å; V541-L592 HydrophobicContact CG2-CD1 4.44Å; V541-Q596 HydrophobicContact CB-CG 4.46Å; V541-F598 HydrophobicContact CG1-CE1 4.16Å; V541-F598 HydrophobicContact CG1-CZ 3.56Å; V541-F598 HydrophobicContact CG2-CZ 4.39Å
542	H	80.3	Confident	88.5	Confident	146 Å²	146	58.9 Å²	58.9	68%	0.676	31%	0.311	S	S	*	.			trans	-103.4	140.3	178.7	-63.2	-57.7	0	0	0	111.2	Q596	H542-Q596 PolarHBondContact O-NE2 3.48Å
543	G	76.1	Confident	88.6	Confident	27 Å²	27	58.9 Å²	58.9	28%	0.278	31%	0.311	S	S	.	.			trans	-178.7	149.3	176.4	0	0	0	0	0	110.8	R545 E595	G543-R545 VanDerWaalsContact C-N 3.3Å; G543-E595 WeakPolarHBondContact CA-OE2 3.27Å
544	S	79.1	Confident	88.7	Confident	109 Å²	109	57.6 Å²	57.6	76%	0.762	30%	0.304	S	S	*	.	S	Bend	trans	-73	-26.5	-177.4	76	0	0	0	0	112.6	E595	S544-E595 PolarHBondContact N-OE2 3.32Å; S544-E595 PolarHBondContact OG-OE1 3.02Å
545	R	83.8	Confident	88.8	Confident	181 Å²	181	54.9 Å²	54.9	68%	0.683	29%	0.29	S	S	*	.	S	Bend	trans	-108.9	2.5	179.8	-63.1	179.1	-175.2	-168.7	1.3	113.6	G543 A593 E595	G543-R545 VanDerWaalsContact C-N 3.3Å; R545-A593 HydrophobicContact CB-CB 3.68Å; R545-A593 WeakPolarHBondContact O-CB 3.45Å; R545-E595 WeakPolarHBondContact CG-OE1 3.42Å; R545-E595 PolarHBondContact N-OE1 3.07Å; R545-E595 PolarHBondContact N-OE2 3.16Å
546	I	90.9	Very high	88.8	Confident	11 Å²	11	49.5 Å²	49.5	6%	0.056	27%	0.273	C	S	.	.			trans	-85.8	135.4	177.8	-55.2	177.5	0	0	0	108	T533 V541 H550 A593 Q596	T533-I546 HydrophobicContact CG2-CB 3.79Å; T533-I546 HydrophobicContact CG2-CG2 3.83Å; T533-I546 WeakPolarHBondContact CG2-O 3.17Å; V541-I546 HydrophobicContact CG2-CD1 4.32Å; V541-I546 HydrophobicContact CG2-CG2 4.3Å; I546-H550 HydrophobicContact CG2-CB 3.79Å; I546-A593 HydrophobicContact CG1-CB 4.28Å; I546-Q596 HydrophobicContact CD1-CB 4.04Å; I546-Q596 HydrophobicContact CD1-CG 3.25Å
547	A	91.7	Very high	88.3	Confident	18 Å²	18	55.3 Å²	55.3	15%	0.149	29%	0.288	C	S	.	.			trans	-83.5	159.4	-177.9	0	0	0	0	0	110.8	G532 T533 L549 H550 N569	G532-A547 WeakPolarHBondContact CA-O 3.45Å; T533-A547 PolarHBondContact N-O 3.48Å; A547-L549 PolarHBondContact O-N 2.93Å; A547-H550 HydrophobicContact CB-CB 4.39Å; A547-H550 PolarHBondContact N-ND1 3.43Å; A547-H550 VanDerWaalsContact N-ND1 3.15Å; A547-N569 WeakPolarHBondContact CB-ND2 3.32Å
548	P	91.6	Very high	87.3	Confident	77 Å²	77	61.2 Å²	61.2	50%	0.5	32%	0.319	S	S	.	.	S	Bend	trans	-47.2	-46.4	172.2	-30	36.4	0	0	0	113	G532 T533 D534 C537	G532-P548 CarbonylContact C-O 3.48Å; G532-P548 WeakPolarHBondContact CA-O 3.2Å; T533-P548 PolarHBondContact N-O 2.89Å; T533-P548 VanDerWaalsContact N-O 3.13Å; T533-P548 VanDerWaalsContact OG1-CA 3.28Å; T533-P548 WeakPolarHBondContact OG1-CA 3.44Å; D534-P548 HydrophobicContact CB-CB 4.1Å; D534-P548 WeakPolarHBondContact CB-O 3.4Å; D534-P548 PolarHBondContact N-O 3.01Å; C537-P548 PolarHBondContact SG-O 3.2Å; C537-P548 VanDerWaalsContact SG-O 3.32Å
549	L	94.4	Very high	86.4	Confident	64 Å²	64	61.5 Å²	61.5	34%	0.335	32%	0.32	S	S	.	.	S	Bend	trans	-122.4	104.1	164.8	176.3	63.9	0	0	0	108.4	R530 A547 T566 N569	R530-L549 HydrophobicContact CB-CD1 3.63Å; R530-L549 HydrophobicContact CG-CD1 3.93Å; A547-L549 PolarHBondContact O-N 2.93Å; L549-T566 WeakPolarHBondContact O-CB 3.35Å; L549-T566 PolarHBondContact O-OG1 2.99Å; L549-N569 PolarHBondContact O-ND2 3.02Å
550	H	94.7	Very high	85.9	Confident	2 Å²	2	66 Å²	66	1%	0.009	34%	0.344	C	S	.	.			trans	-87.3	-43.5	-173.9	-157.7	75.9	0	0	0	112.5	I531 I546 A547 T566 N569 D570 A593	I531-H550 WeakPolarHBondContact O-CA 3.46Å; I531-H550 WeakPolarHBondContact O-CB 3.47Å; I531-H550 PolarHBondContact O-N 2.73Å; I546-H550 HydrophobicContact CG2-CB 3.79Å; A547-H550 HydrophobicContact CB-CB 4.39Å; A547-H550 PolarHBondContact N-ND1 3.43Å; A547-H550 VanDerWaalsContact N-ND1 3.15Å; H550-T566 WeakPolarHBondContact O-CB 3.46Å; H550-T566 PolarHBondContact O-N 3.45Å; H550-T566 PolarHBondContact O-OG1 3.01Å; H550-N569 WeakPolarHBondContact CA-ND2 3.47Å; H550-N569 PolarHBondContact O-ND2 3.41Å; H550-D570 PolarHBondContact NE2-O 3.34Å; H550-A593 PolarHBondContact NE2-N 2.74Å
551	C	95.2	Very high	86	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	165.7	174.8	64.1	0	0	0	0	111.8	I531 I563 V564 V571	I531-C551 PolarHBondContact N-O 3.04Å; I531-C551 PolarHBondContact O-N 3.41Å; I531-C551 VanDerWaalsContact O-N 3.1Å; C551-I563 HydrophobicContact CB-CD1 4.49Å; C551-I563 HydrophobicContact CB-CG1 4.3Å; C551-V564 WeakPolarHBondContact CA-O 3.34Å; C551-V564 WeakPolarHBondContact CB-O 3.41Å; C551-V571 HydrophobicContact CB-CG2 3.87Å
552	T	95.2	Very high	86.2	Confident	22 Å²	22	65 Å²	65	14%	0.135	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	128.1	174.4	-56.3	0	0	0	0	109.4	E528 N529 R530 V564	E528-T552 HydrophobicContact CB-CG2 3.82Å; E528-T552 HydrophobicContact CG-CG2 4.21Å; N529-T552 CarbonylContact O-C 3.53Å; R530-T552 HydrophobicContact CG-CG2 4.35Å; T552-V564 PolarHBondContact N-O 3.02Å; T552-V564 PolarHBondContact O-N 3.23Å
553	L	94.7	Very high	87	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	112.9	173.5	-171.1	159.9	0	0	0	108.9	V507 L524 N529 I531 L555 I562 L584 L590 L600	V507-L553 HydrophobicContact CG1-CD1 4.2Å; L524-L553 HydrophobicContact CD1-CD1 4.13Å; L524-L553 HydrophobicContact CD1-CD2 3.69Å; L524-L553 HydrophobicContact CD2-CD2 4.37Å; N529-L553 WeakPolarHBondContact CA-O 3.47Å; N529-L553 WeakPolarHBondContact CB-O 3.49Å; N529-L553 PolarHBondContact N-O 3.25Å; N529-L553 PolarHBondContact ND2-O 3.34Å; N529-L553 PolarHBondContact O-N 3.21Å; I531-L553 HydrophobicContact CD1-CB 4.35Å; L553-L555 HydrophobicContact CD2-CD2 4.36Å; L553-L555 HydrophobicContact CD2-CG 4Å; L553-I562 CarbonylContact C-O 3.55Å; L553-I562 WeakPolarHBondContact CA-O 3.39Å; L553-L584 HydrophobicContact CD1-CD1 3.84Å; L553-L584 HydrophobicContact CG-CD1 4Å; L553-L590 HydrophobicContact CD1-CD1 4.43Å; L553-L600 HydrophobicContact CD1-CD1 4.1Å
554	S	91.5	Very high	87.8	Confident	17 Å²	17	59.1 Å²	59.1	12%	0.119	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	123	-179.6	-48.5	0	0	0	0	111.2	G527 A561 I562	G527-S554 CarbonylContact O-C 3.45Å; G527-S554 WeakPolarHBondContact O-CA 3.43Å; S554-A561 WeakPolarHBondContact O-CA 3.21Å; S554-I562 PolarHBondContact N-O 2.98Å; S554-I562 PolarHBondContact O-N 2.88Å
555	L	90.1	Very high	88.5	Confident	14 Å²	14	54.5 Å²	54.5	7%	0.073	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	121.8	171.9	-74.9	172.7	0	0	0	110.6	P505 L524 G527 L553 A561 L602	P505-L555 HydrophobicContact CB-CD1 3.91Å; P505-L555 HydrophobicContact CB-CD2 4.31Å; P505-L555 HydrophobicContact CG-CD1 4.21Å; L524-L555 HydrophobicContact CB-CD1 3.32Å; L524-L555 HydrophobicContact CB-CG 4.41Å; L524-L555 HydrophobicContact CD1-CD1 4.01Å; L524-L555 HydrophobicContact CD1-CG 4.46Å; L524-L555 HydrophobicContact CG-CD1 4.34Å; G527-L555 PolarHBondContact N-O 3.43Å; G527-L555 PolarHBondContact O-N 2.83Å; L553-L555 HydrophobicContact CD2-CD2 4.36Å; L553-L555 HydrophobicContact CD2-CG 4Å; L555-A561 HydrophobicContact CD2-CB 3.8Å; L555-L602 HydrophobicContact CD2-CD2 3.73Å
556	K	82.9	Confident	88.9	Confident	117 Å²	117	48.2 Å²	48.2	51%	0.509	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-86.5	164.7	172	-65	-178.1	179.5	177.2	0	110.9	D558 N559 D560	K556-D558 PolarHBondContact O-N 3.05Å; K556-N559 PolarHBondContact O-N 3.48Å; K556-D560 HydrophobicContact CB-CB 4.15Å; K556-D560 WeakPolarHBondContact CB-O 3.23Å; K556-D560 HydrophobicContact CD-CB 4.27Å; K556-D560 PolarHBondContact N-O 3.44Å
557	K	73.1	Confident	88.7	Confident	208 Å²	208	57.6 Å²	57.6	90%	0.904	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-26.1	-178.9	-71.1	-173.1	177.4	-177.7	0	114.1	N559	K557-N559 VanDerWaalsContact C-N 3.28Å; K557-N559 PolarHBondContact O-N 3.35Å
558	D	71	Confident	88.3	Confident	138 Å²	138	60.3 Å²	60.3	74%	0.738	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	23.7	-177.9	-58.7	-30.7	0	0	0	112.9	K556 D560	K556-D558 PolarHBondContact O-N 3.05Å; D558-D560 PolarHBondContact O-N 3.01Å
559	N	69.5	Low	88.2	Confident	84 Å²	84	58.4 Å²	58.4	45%	0.449	31%	0.31	S	S	.	.	S	Bend	trans	57.9	11.6	-170.6	-78.4	-5.2	0	0	0	115.1	K556 K557 A561	K556-N559 PolarHBondContact O-N 3.48Å; K557-N559 VanDerWaalsContact C-N 3.28Å; K557-N559 PolarHBondContact O-N 3.35Å; N559-A561 PolarHBondContact O-N 3.45Å
560	D	81.5	Confident	88	Confident	96 Å²	96	59.1 Å²	59.1	51%	0.513	32%	0.315	S	S	.	.			trans	-71.9	123	170.5	-85.5	-17.4	0	0	0	110.4	K556 D558	K556-D560 HydrophobicContact CB-CB 4.15Å; K556-D560 WeakPolarHBondContact CB-O 3.23Å; K556-D560 HydrophobicContact CD-CB 4.27Å; K556-D560 PolarHBondContact N-O 3.44Å; D558-D560 PolarHBondContact O-N 3.01Å
561	A	90.5	Very high	87.9	Confident	2 Å²	2	59 Å²	59	2%	0.017	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	139.9	175.5	0	0	0	0	0	111	S554 L555 N559 L584 L600 L602	S554-A561 WeakPolarHBondContact O-CA 3.21Å; L555-A561 HydrophobicContact CD2-CB 3.8Å; N559-A561 PolarHBondContact O-N 3.45Å; A561-L584 HydrophobicContact CB-CB 3.86Å; A561-L584 HydrophobicContact CB-CD1 4.38Å; A561-L584 PolarHBondContact O-N 2.98Å; A561-L600 HydrophobicContact CB-CD2 4.36Å; A561-L602 HydrophobicContact CB-CD1 4.04Å; A561-L602 HydrophobicContact CB-CD2 3.63Å; A561-L602 HydrophobicContact CB-CG 4.46Å
562	I	93.5	Very high	87.7	Confident	31 Å²	31	59.5 Å²	59.5	16%	0.159	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	144.8	169	59.9	174.1	0	0	0	109.5	L553 S554 V581 R582 T583	L553-I562 CarbonylContact C-O 3.55Å; L553-I562 WeakPolarHBondContact CA-O 3.39Å; S554-I562 PolarHBondContact N-O 2.98Å; S554-I562 PolarHBondContact O-N 2.88Å; I562-V581 HydrophobicContact CB-CG1 4.1Å; I562-V581 HydrophobicContact CD1-CG1 4.03Å; I562-V581 HydrophobicContact CG2-CG1 4.43Å; I562-R582 CarbonylContact C-O 3.53Å; I562-R582 VanDerWaalsContact CA-O 3.27Å; I562-R582 WeakPolarHBondContact CA-O 3.47Å; I562-T583 HydrophobicContact CG2-CG2 4.14Å
563	I	95.4	Very high	87.6	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	135.9	169.1	-166.9	161	0	0	0	109.5	C551 V571 V573 R582 L584 L590	C551-I563 HydrophobicContact CB-CD1 4.49Å; C551-I563 HydrophobicContact CB-CG1 4.3Å; I563-V571 HydrophobicContact CD1-CG1 3.75Å; I563-V571 HydrophobicContact CG1-CG1 4.41Å; I563-V573 HydrophobicContact CG2-CG2 3.94Å; I563-R582 HydrophobicContact CG2-CB 4.04Å; I563-R582 PolarHBondContact N-O 2.88Å; I563-R582 PolarHBondContact O-N 2.91Å; I563-L584 HydrophobicContact CB-CD1 3.64Å; I563-L584 HydrophobicContact CB-CD2 4.3Å; I563-L584 HydrophobicContact CB-CG 4.05Å; I563-L584 HydrophobicContact CG2-CD1 4.08Å; I563-L584 HydrophobicContact CG2-CD2 3.78Å; I563-L584 HydrophobicContact CG2-CG 3.95Å; I563-L590 HydrophobicContact CD1-CD1 4.13Å; I563-L590 HydrophobicContact CD1-CD2 4.3Å
564	V	93.7	Very high	87.4	Confident	50 Å²	50	60.6 Å²	60.6	30%	0.303	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	106.4	178.1	-170.9	0	0	0	0	107.5	C551 T552 V581	C551-V564 WeakPolarHBondContact CA-O 3.34Å; C551-V564 WeakPolarHBondContact CB-O 3.41Å; T552-V564 PolarHBondContact N-O 3.02Å; T552-V564 PolarHBondContact O-N 3.23Å; V564-V581 HydrophobicContact CG1-CG2 4.17Å; V564-V581 HydrophobicContact CG2-CB 4.46Å; V564-V581 HydrophobicContact CG2-CG1 4.17Å; V564-V581 HydrophobicContact CG2-CG2 3.92Å
565	P	94.8	Very high	87.1	Confident	13 Å²	13	60.1 Å²	60.1	8%	0.084	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	138.1	173.1	28.7	-34.8	0	0	0	109.6	K567 V571 T578	P565-K567 PolarHBondContact O-N 2.96Å; P565-V571 HydrophobicContact CB-CB 4.05Å; P565-V571 HydrophobicContact CB-CG2 3.73Å; P565-T578 HydrophobicContact CG-CG2 4.35Å; P565-T578 WeakPolarHBondContact CG-O 3.13Å
566	T	91.5	Very high	86.9	Confident	49 Å²	49	63.9 Å²	63.9	30%	0.301	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-66.9	135	167.3	-57.7	0	0	0	0	107.8	L549 H550 G568 N569	L549-T566 WeakPolarHBondContact O-CB 3.35Å; L549-T566 PolarHBondContact O-OG1 2.99Å; H550-T566 WeakPolarHBondContact O-CB 3.46Å; H550-T566 PolarHBondContact O-N 3.45Å; H550-T566 PolarHBondContact O-OG1 3.01Å; T566-G568 PolarHBondContact O-N 2.93Å; T566-N569 WeakPolarHBondContact CB-ND2 3.32Å; T566-N569 VanDerWaalsContact O-CB 3.29Å; T566-N569 WeakPolarHBondContact O-CB 3.48Å; T566-N569 PolarHBondContact O-N 3.17Å
567	K	85.7	Confident	87.2	Confident	207 Å²	207	59.8 Å²	59.8	90%	0.9	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	123.2	-173.5	-170	176.6	-176.5	175.2	0	112.2	P565	P565-K567 PolarHBondContact O-N 2.96Å
568	G	83.6	Confident	87.8	Confident	75 Å²	75	50 Å²	50	77%	0.773	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.8	-4.1	179.9	0	0	0	0	0	115.1	T566	T566-G568 PolarHBondContact O-N 2.93Å
569	N	90.3	Very high	88.4	Confident	37 Å²	37	50 Å²	50	20%	0.198	28%	0.276	C	S	.	.			trans	-95.8	134.5	176.2	-67.3	-20.6	0	0	0	111.2	A547 L549 H550 T566 V571	A547-N569 WeakPolarHBondContact CB-ND2 3.32Å; L549-N569 PolarHBondContact O-ND2 3.02Å; H550-N569 WeakPolarHBondContact CA-ND2 3.47Å; H550-N569 PolarHBondContact O-ND2 3.41Å; T566-N569 WeakPolarHBondContact CB-ND2 3.32Å; T566-N569 VanDerWaalsContact O-CB 3.29Å; T566-N569 WeakPolarHBondContact O-CB 3.48Å; T566-N569 PolarHBondContact O-N 3.17Å; N569-V571 PolarHBondContact O-N 3.23Å
570	D	88.8	Confident	89.2	Confident	80 Å²	80	52.5 Å²	52.5	43%	0.428	29%	0.289	S	S	.	.			trans	-80.5	108.2	-178.1	-71.3	-31.9	0	0	0	111.4	H550 F572 L577 A593	H550-D570 PolarHBondContact NE2-O 3.34Å; D570-F572 HydrophobicContact CB-CE2 3.74Å; D570-F572 HydrophobicContact CB-CZ 4.2Å; D570-L577 HydrophobicContact CB-CD1 4.07Å; D570-A593 PolarHBondContact O-N 3.39Å
571	V	93.5	Very high	89.6	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	123.9	173.9	-179.7	0	0	0	0	109.6	C551 I563 P565 N569 T578 L592	C551-V571 HydrophobicContact CB-CG2 3.87Å; I563-V571 HydrophobicContact CD1-CG1 3.75Å; I563-V571 HydrophobicContact CG1-CG1 4.41Å; P565-V571 HydrophobicContact CB-CB 4.05Å; P565-V571 HydrophobicContact CB-CG2 3.73Å; N569-V571 PolarHBondContact O-N 3.23Å; V571-T578 WeakPolarHBondContact O-CB 3.48Å; V571-T578 PolarHBondContact O-N 3.26Å; V571-L592 HydrophobicContact CB-CD2 4.45Å; V571-L592 HydrophobicContact CG1-CD2 3.92Å; V571-L592 HydrophobicContact CG2-CD2 4.08Å
572	F	92	Very high	89.7	Confident	10 Å²	10	56 Å²	56	4%	0.044	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	134.4	179.2	-56.5	-98	0	0	0	110.2	D570 G575 I576 L577 L590 C591 Y621	D570-F572 HydrophobicContact CB-CE2 3.74Å; D570-F572 HydrophobicContact CB-CZ 4.2Å; F572-G575 WeakPolarHBondContact CD1-O 3.48Å; F572-I576 CarbonylContact C-O 3.52Å; F572-I576 VanDerWaalsContact CA-O 3.3Å; F572-I576 WeakPolarHBondContact CA-O 3.47Å; F572-L577 HydrophobicContact CD1-CB 3.9Å; F572-L577 HydrophobicContact CD1-CD1 4.3Å; F572-L577 HydrophobicContact CE1-CB 3.68Å; F572-L577 HydrophobicContact CE1-CD1 3.93Å; F572-L577 HydrophobicContact CE1-CG 4.35Å; F572-L577 HydrophobicContact CE2-CD1 4.2Å; F572-L577 HydrophobicContact CZ-CB 4.43Å; F572-L577 HydrophobicContact CZ-CD1 3.85Å; F572-L590 CarbonylContact O-C 3.57Å; F572-L590 VanDerWaalsContact O-CA 3.3Å; F572-L590 WeakPolarHBondContact O-CA 3.48Å; F572-C591 HydrophobicContact CB-CB 4.13Å; F572-C591 PolarHBondContact N-O 2.68Å; F572-C591 PolarHBondContact O-N 3.19Å; F572-Y621 HydrophobicContact CD1-CD2 4.09Å; F572-Y621 HydrophobicContact CD1-CE2 4.29Å; F572-Y621 AromaticContact CD2-CD2 3.87Å; F572-Y621 HydrophobicContact CD2-CD2 3.87Å; F572-Y621 AromaticContact CD2-CE2 3.79Å; F572-Y621 HydrophobicContact CD2-CE2 3.79Å; F572-Y621 HydrophobicContact CE1-CD2 4.25Å; F572-Y621 HydrophobicContact CE1-CE2 4.02Å; F572-Y621 HydrophobicContact CE2-CD2 4.05Å; F572-Y621 AromaticContact CE2-CE2 3.49Å; F572-Y621 HydrophobicContact CE2-CE2 3.49Å; F572-Y621 VanDerWaalsContact CE2-CE2 3.49Å; F572-Y621 AromaticContact CG-CD2 3.91Å; F572-Y621 HydrophobicContact CG-CD2 3.91Å; F572-Y621 HydrophobicContact CG-CE2 4.2Å; F572-Y621 HydrophobicContact CZ-CD2 4.25Å; F572-Y621 AromaticContact CZ-CE2 3.63Å; F572-Y621 HydrophobicContact CZ-CE2 3.63Å
573	V	92.9	Very high	89.6	Confident	2 Å²	2	59.5 Å²	59.5	1%	0.012	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	116.2	173.6	-178.2	0	0	0	0	107.4	I563 G575 I576 L584 D588 L590	I563-V573 HydrophobicContact CG2-CG2 3.94Å; V573-G575 PolarHBondContact O-N 2.75Å; V573-I576 PolarHBondContact N-O 2.66Å; V573-I576 PolarHBondContact O-N 2.93Å; V573-L584 HydrophobicContact CG1-CD2 3.77Å; V573-L584 HydrophobicContact CG2-CD2 4.04Å; V573-D588 HydrophobicContact CG1-CB 4.39Å; V573-L590 HydrophobicContact CB-CD2 4.38Å; V573-L590 HydrophobicContact CG1-CD2 4.14Å; V573-L590 HydrophobicContact CG2-CD2 3.81Å
574	N	89	Confident	89.5	Confident	42 Å²	42	59.9 Å²	59.9	23%	0.225	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	47.8	-174.8	-60.8	-34.9	0	0	0	111.4	I576 D588 R589 E620	N574-I576 PolarHBondContact O-N 3.41Å; N574-I576 VanDerWaalsContact O-N 3.16Å; N574-D588 PolarHBondContact ND2-OD1 3.34Å; N574-R589 PolarHBondContact N-O 3.24Å; N574-R589 VanDerWaalsContact OD1-CZ 3.31Å; N574-R589 PolarHBondContact OD1-N 3.34Å; N574-R589 PolarHBondContact OD1-NH2 3.31Å; N574-R589 VanDerWaalsContact OD1-NH2 3.14Å; N574-E620 VanDerWaalsContact C-CD 3.45Å; N574-E620 WeakPolarHBondContact CA-OE1 3.29Å; N574-E620 VanDerWaalsContact CB-OE1 3.25Å; N574-E620 WeakPolarHBondContact CB-OE1 3.31Å; N574-E620 VanDerWaalsContact O-OE1 3.14Å
575	G	85.2	Confident	89.3	Confident	8 Å²	8	66.5 Å²	66.5	8%	0.082	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	-15	-177.4	0	0	0	0	0	115.6	F572 V573 A624	F572-G575 WeakPolarHBondContact CD1-O 3.48Å; V573-G575 PolarHBondContact O-N 2.75Å; G575-A624 WeakPolarHBondContact O-CB 3.24Å
576	I	87	Confident	89.1	Confident	92 Å²	92	69.2 Å²	69.2	47%	0.472	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	123.5	-174.8	-58.4	168.8	0	0	0	110.1	F572 V573 N574 T578	F572-I576 CarbonylContact C-O 3.52Å; F572-I576 VanDerWaalsContact CA-O 3.3Å; F572-I576 WeakPolarHBondContact CA-O 3.47Å; V573-I576 PolarHBondContact N-O 2.66Å; V573-I576 PolarHBondContact O-N 2.93Å; N574-I576 PolarHBondContact O-N 3.41Å; N574-I576 VanDerWaalsContact O-N 3.16Å; I576-T578 PolarHBondContact O-N 3.34Å; I576-T578 PolarHBondContact O-OG1 2.92Å
577	L	89.1	Confident	88.9	Confident	31 Å²	31	68 Å²	68	16%	0.162	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	129.5	173	-179.2	67.2	0	0	0	109.4	D570 F572 E579 R628	D570-L577 HydrophobicContact CB-CD1 4.07Å; F572-L577 HydrophobicContact CD1-CB 3.9Å; F572-L577 HydrophobicContact CD1-CD1 4.3Å; F572-L577 HydrophobicContact CE1-CB 3.68Å; F572-L577 HydrophobicContact CE1-CD1 3.93Å; F572-L577 HydrophobicContact CE1-CG 4.35Å; F572-L577 HydrophobicContact CE2-CD1 4.2Å; F572-L577 HydrophobicContact CZ-CB 4.43Å; F572-L577 HydrophobicContact CZ-CD1 3.85Å; L577-E579 HydrophobicContact CD2-CG 3.98Å; L577-E579 HydrophobicContact CG-CG 4.14Å; L577-R628 VanDerWaalsContact CD2-CZ 3.49Å
578	T	86.1	Confident	89.2	Confident	4 Å²	4	59 Å²	59	3%	0.025	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	111.3	179.5	-61.5	0	0	0	0	107.3	P565 V571 I576 D580 R582	P565-T578 HydrophobicContact CG-CG2 4.35Å; P565-T578 WeakPolarHBondContact CG-O 3.13Å; V571-T578 WeakPolarHBondContact O-CB 3.48Å; V571-T578 PolarHBondContact O-N 3.26Å; I576-T578 PolarHBondContact O-N 3.34Å; I576-T578 PolarHBondContact O-OG1 2.92Å; T578-D580 WeakPolarHBondContact CG2-O 3.41Å; T578-R582 HydrophobicContact CG2-CB 3.51Å; T578-R582 HydrophobicContact CG2-CG 4.33Å; T578-R582 WeakPolarHBondContact OG1-CD 3.42Å
579	E	82.8	Confident	89.6	Confident	138 Å²	138	58.6 Å²	58.6	65%	0.645	30%	0.297	S	S	*	.			trans	-95.6	-24	178.3	-62.7	-174.8	175.2	0	0	111.8	L577 R628	L577-E579 HydrophobicContact CD2-CG 3.98Å; L577-E579 HydrophobicContact CG-CG 4.14Å; E579-R628 IonicContact OE1-NH2 2.76Å; E579-R628 PolarHBondContact OE1-NH2 3.3Å
580	D	85.9	Confident	89.7	Confident	135 Å²	135	57 Å²	57	72%	0.722	29%	0.288	S	S	*	.	S	Bend	trans	-123.9	177.7	-178.2	-69.3	-47.5	0	0	0	112	T578 R582	T578-D580 WeakPolarHBondContact CG2-O 3.41Å; D580-R582 PolarHBondContact O-N 3.28Å
581	V	91.3	Very high	89.9	Confident	93 Å²	93	53.4 Å²	53.4	56%	0.564	27%	0.269	S	S	*	.			trans	-54.3	126.7	176	-177.8	0	0	0	0	110.9	I562 V564	I562-V581 HydrophobicContact CB-CG1 4.1Å; I562-V581 HydrophobicContact CD1-CG1 4.03Å; I562-V581 HydrophobicContact CG2-CG1 4.43Å; V564-V581 HydrophobicContact CG1-CG2 4.17Å; V564-V581 HydrophobicContact CG2-CB 4.46Å; V564-V581 HydrophobicContact CG2-CG1 4.17Å; V564-V581 HydrophobicContact CG2-CG2 3.92Å
582	R	91.1	Very high	89.9	Confident	79 Å²	79	53.5 Å²	53.5	30%	0.298	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	132.5	179.5	-168.5	172.4	-168.3	124.5	3.2	111.9	I562 I563 T578 D580	I562-R582 CarbonylContact C-O 3.53Å; I562-R582 VanDerWaalsContact CA-O 3.27Å; I562-R582 WeakPolarHBondContact CA-O 3.47Å; I563-R582 HydrophobicContact CG2-CB 4.04Å; I563-R582 PolarHBondContact N-O 2.88Å; I563-R582 PolarHBondContact O-N 2.91Å; T578-R582 HydrophobicContact CG2-CB 3.51Å; T578-R582 HydrophobicContact CG2-CG 4.33Å; T578-R582 WeakPolarHBondContact OG1-CD 3.42Å; D580-R582 PolarHBondContact O-N 3.28Å
583	T	91.8	Very high	89.7	Confident	104 Å²	104	53.5 Å²	53.5	64%	0.638	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.8	130.7	172.1	53.5	0	0	0	0	110.3	I562	I562-T583 HydrophobicContact CG2-CG2 4.14Å
584	L	93	Very high	89.3	Confident	8 Å²	8	54.2 Å²	54.2	4%	0.042	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	150.8	178.8	-65.2	173.8	0	0	0	110.8	L553 A561 I563 V573 D588 L590 L600	L553-L584 HydrophobicContact CD1-CD1 3.84Å; L553-L584 HydrophobicContact CG-CD1 4Å; A561-L584 HydrophobicContact CB-CB 3.86Å; A561-L584 HydrophobicContact CB-CD1 4.38Å; A561-L584 PolarHBondContact O-N 2.98Å; I563-L584 HydrophobicContact CB-CD1 3.64Å; I563-L584 HydrophobicContact CB-CD2 4.3Å; I563-L584 HydrophobicContact CB-CG 4.05Å; I563-L584 HydrophobicContact CG2-CD1 4.08Å; I563-L584 HydrophobicContact CG2-CD2 3.78Å; I563-L584 HydrophobicContact CG2-CG 3.95Å; V573-L584 HydrophobicContact CG1-CD2 3.77Å; V573-L584 HydrophobicContact CG2-CD2 4.04Å; L584-D588 WeakPolarHBondContact CA-OD2 3.19Å; L584-D588 HydrophobicContact CD2-CB 4.42Å; L584-L590 HydrophobicContact CD2-CD2 3.68Å; L584-L600 HydrophobicContact CB-CD2 3.59Å; L584-L600 HydrophobicContact CD1-CD2 3.81Å; L584-L600 HydrophobicContact CG-CD2 4.24Å
585	R	90.3	Very high	89.2	Confident	190 Å²	190	54.9 Å²	54.9	72%	0.717	28%	0.281	S	S	*	.			trans	-122.4	160.9	176.6	-64.2	-179.2	178.8	174.3	-0.1	110.6	G587 D588	R585-G587 PolarHBondContact O-N 3.06Å; R585-D588 PolarHBondContact N-OD2 3.13Å; R585-D588 WeakPolarHBondContact O-CB 3.38Å; R585-D588 PolarHBondContact O-N 2.81Å; R585-D588 VanDerWaalsContact O-N 3.16Å
586	N	89.5	Confident	89.5	Confident	70 Å²	70	56.6 Å²	56.6	37%	0.374	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	127.7	173.7	-165.2	29.6	0	0	0	110.5	Y601 L602 E603	N586-Y601 WeakPolarHBondContact OD1-CA 3.5Å; N586-L602 HydrophobicContact CB-CB 4.16Å; N586-L602 PolarHBondContact OD1-N 3.48Å; N586-E603 PolarHBondContact OD1-N 2.78Å
587	G	87.8	Confident	89.8	Confident	22 Å²	22	52.6 Å²	52.6	23%	0.227	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.2	4	-178.3	0	0	0	0	0	115.9	R585 R589 L600	R585-G587 PolarHBondContact O-N 3.06Å; G587-R589 PolarHBondContact O-NH1 3.43Å; G587-L600 VanDerWaalsContact CA-O 3.28Å; G587-L600 WeakPolarHBondContact CA-O 3.47Å; G587-L600 PolarHBondContact N-O 2.83Å
588	D	92.5	Very high	90	Very high	19 Å²	19	51.2 Å²	51.2	10%	0.102	26%	0.259	C	S	.	.			trans	-64.2	138.4	176.1	-82.2	-13	0	0	0	111.6	V573 N574 L584 R585 I599 L600	V573-D588 HydrophobicContact CG1-CB 4.39Å; N574-D588 PolarHBondContact ND2-OD1 3.34Å; L584-D588 WeakPolarHBondContact CA-OD2 3.19Å; L584-D588 HydrophobicContact CD2-CB 4.42Å; R585-D588 PolarHBondContact N-OD2 3.13Å; R585-D588 WeakPolarHBondContact O-CB 3.38Å; R585-D588 PolarHBondContact O-N 2.81Å; R585-D588 VanDerWaalsContact O-N 3.16Å; D588-I599 WeakPolarHBondContact O-CA 3.49Å; D588-L600 PolarHBondContact O-N 3.48Å
589	R	90.8	Very high	90.3	Very high	67 Å²	67	51.4 Å²	51.4	25%	0.253	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	122.8	179.7	-66.9	163.7	-59	-67.9	-4.7	109.3	N574 G587 F598 A617 E620	N574-R589 PolarHBondContact N-O 3.24Å; N574-R589 VanDerWaalsContact OD1-CZ 3.31Å; N574-R589 PolarHBondContact OD1-N 3.34Å; N574-R589 PolarHBondContact OD1-NH2 3.31Å; N574-R589 VanDerWaalsContact OD1-NH2 3.14Å; G587-R589 PolarHBondContact O-NH1 3.43Å; R589-F598 CarbonylContact C-O 3.55Å; R589-F598 VanDerWaalsContact CA-O 3.27Å; R589-F598 WeakPolarHBondContact CA-O 3.43Å; R589-A617 HydrophobicContact CB-CB 4.38Å; R589-E620 IonicContact CZ-OE1 2.87Å; R589-E620 IonicContact CZ-OE2 2.77Å; R589-E620 VanDerWaalsContact CZ-OE2 3.27Å; R589-E620 IonicContact NE-OE2 3.6Å; R589-E620 PolarHBondContact NE-OE2 2.86Å; R589-E620 IonicContact NH2-OE1 3.41Å; R589-E620 PolarHBondContact NH2-OE1 3.03Å; R589-E620 IonicContact NH2-OE2 3.54Å; R589-E620 PolarHBondContact NH2-OE2 2.97Å
590	L	93.9	Very high	90.7	Very high	3 Å²	3	44.9 Å²	44.9	2%	0.016	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	139.5	-178.1	-45.2	173.8	0	0	0	108.9	L553 I563 F572 V573 L584 Y597 F598	L553-L590 HydrophobicContact CD1-CD1 4.43Å; I563-L590 HydrophobicContact CD1-CD1 4.13Å; I563-L590 HydrophobicContact CD1-CD2 4.3Å; F572-L590 CarbonylContact O-C 3.57Å; F572-L590 VanDerWaalsContact O-CA 3.3Å; F572-L590 WeakPolarHBondContact O-CA 3.48Å; V573-L590 HydrophobicContact CB-CD2 4.38Å; V573-L590 HydrophobicContact CG1-CD2 4.14Å; V573-L590 HydrophobicContact CG2-CD2 3.81Å; L584-L590 HydrophobicContact CD2-CD2 3.68Å; L590-Y597 CarbonylContact O-C 3.52Å; L590-Y597 WeakPolarHBondContact O-CA 3.48Å; L590-F598 HydrophobicContact CB-CB 4.15Å; L590-F598 PolarHBondContact N-O 3.19Å; L590-F598 PolarHBondContact O-N 2.9Å
591	C	93	Very high	90.8	Very high	5 Å²	5	39.6 Å²	39.6	3%	0.034	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	127.6	170.7	178.1	0	0	0	0	110.2	F572 G594 Q596 Y597	F572-C591 HydrophobicContact CB-CB 4.13Å; F572-C591 PolarHBondContact N-O 2.68Å; F572-C591 PolarHBondContact O-N 3.19Å; C591-G594 WeakPolarHBondContact SG-CA 3.42Å; C591-Q596 CarbonylContact C-O 3.55Å; C591-Q596 VanDerWaalsContact CA-O 3.23Å; C591-Q596 WeakPolarHBondContact CA-O 3.29Å; C591-Y597 HydrophobicContact CB-CD1 3.93Å; C591-Y597 HydrophobicContact CB-CE1 4.07Å; C591-Y597 WeakPolarHBondContact SG-CE1 3.48Å
592	L	93.4	Very high	90.6	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.01	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	121.4	-178.8	-51.5	-172.5	0	0	0	109.4	I531 V541 V571 G594 E595 Q596 F598	I531-L592 HydrophobicContact CG2-CD1 3.72Å; V541-L592 HydrophobicContact CG2-CD1 4.44Å; V571-L592 HydrophobicContact CB-CD2 4.45Å; V571-L592 HydrophobicContact CG1-CD2 3.92Å; V571-L592 HydrophobicContact CG2-CD2 4.08Å; L592-G594 PolarHBondContact O-N 3.46Å; L592-E595 PolarHBondContact O-N 2.91Å; L592-Q596 HydrophobicContact CB-CB 4.45Å; L592-Q596 PolarHBondContact N-O 2.92Å; L592-Q596 PolarHBondContact O-N 3.33Å; L592-F598 HydrophobicContact CD1-CD2 4.43Å; L592-F598 HydrophobicContact CD1-CE2 3.59Å; L592-F598 HydrophobicContact CD1-CZ 4.24Å; L592-F598 HydrophobicContact CG-CD2 4.33Å; L592-F598 HydrophobicContact CG-CE2 3.87Å
593	A	87.1	Confident	90.2	Very high	10 Å²	10	38.4 Å²	38.4	8%	0.083	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	15.4	179.7	0	0	0	0	0	116.3	R545 I546 H550 D570 E595	R545-A593 HydrophobicContact CB-CB 3.68Å; R545-A593 WeakPolarHBondContact O-CB 3.45Å; I546-A593 HydrophobicContact CG1-CB 4.28Å; H550-A593 PolarHBondContact NE2-N 2.74Å; D570-A593 PolarHBondContact O-N 3.39Å; A593-E595 PolarHBondContact O-N 3.44Å
594	G	85.7	Confident	89.3	Confident	17 Å²	17	36.5 Å²	36.5	18%	0.175	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	76	4.9	-172.3	0	0	0	0	0	114.9	C591 L592 Y597 Y621	C591-G594 WeakPolarHBondContact SG-CA 3.42Å; L592-G594 PolarHBondContact O-N 3.46Å; G594-Y597 PolarHBondContact O-OH 3.24Å; G594-Y621 VanDerWaalsContact CA-CZ 3.46Å
595	E	86.7	Confident	88.1	Confident	55 Å²	55	37.7 Å²	37.7	26%	0.257	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-43.4	-173.1	-67.1	-174	173.4	0	0	112.7	G543 S544 R545 L592 A593 Y597	G543-E595 WeakPolarHBondContact CA-OE2 3.27Å; S544-E595 PolarHBondContact N-OE2 3.32Å; S544-E595 PolarHBondContact OG-OE1 3.02Å; R545-E595 WeakPolarHBondContact CG-OE1 3.42Å; R545-E595 PolarHBondContact N-OE1 3.07Å; R545-E595 PolarHBondContact N-OE2 3.16Å; L592-E595 PolarHBondContact O-N 2.91Å; A593-E595 PolarHBondContact O-N 3.44Å; E595-Y597 WeakPolarHBondContact O-CE2 3.36Å
596	Q	90.8	Very high	86.9	Confident	44 Å²	44	39.1 Å²	39.1	21%	0.206	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	137.2	-175.6	-63.9	-64.5	-18.9	0	0	111	L509 V541 H542 I546 C591 L592 F598	L509-Q596 HydrophobicContact CD1-CB 4.1Å; V541-Q596 HydrophobicContact CB-CG 4.46Å; H542-Q596 PolarHBondContact O-NE2 3.48Å; I546-Q596 HydrophobicContact CD1-CB 4.04Å; I546-Q596 HydrophobicContact CD1-CG 3.25Å; C591-Q596 CarbonylContact C-O 3.55Å; C591-Q596 VanDerWaalsContact CA-O 3.23Å; C591-Q596 WeakPolarHBondContact CA-O 3.29Å; L592-Q596 HydrophobicContact CB-CB 4.45Å; L592-Q596 PolarHBondContact N-O 2.92Å; L592-Q596 PolarHBondContact O-N 3.33Å; Q596-F598 HydrophobicContact CB-CE2 3.94Å
597	Y	93.1	Very high	85.6	Confident	9 Å²	9	46.6 Å²	46.6	4%	0.035	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	130.5	-173.3	-59.2	-93.5	0	0	0	109.1	L509 L510 L590 C591 G594 E595 F614 A617 Q618 Y621	L509-Y597 WeakPolarHBondContact CD1-O 3.43Å; L510-Y597 WeakPolarHBondContact CB-O 3.34Å; L510-Y597 PolarHBondContact N-O 2.97Å; L590-Y597 CarbonylContact O-C 3.52Å; L590-Y597 WeakPolarHBondContact O-CA 3.48Å; C591-Y597 HydrophobicContact CB-CD1 3.93Å; C591-Y597 HydrophobicContact CB-CE1 4.07Å; C591-Y597 WeakPolarHBondContact SG-CE1 3.48Å; G594-Y597 PolarHBondContact O-OH 3.24Å; E595-Y597 WeakPolarHBondContact O-CE2 3.36Å; Y597-F614 HydrophobicContact CD2-CD2 4.23Å; Y597-F614 AromaticContact CD2-CE2 3.56Å; Y597-F614 HydrophobicContact CD2-CE2 3.56Å; Y597-F614 HydrophobicContact CD2-CZ 4.21Å; Y597-F614 HydrophobicContact CE2-CE2 4.06Å; Y597-F614 HydrophobicContact CE2-CZ 4.26Å; Y597-F614 HydrophobicContact CG-CE2 4.26Å; Y597-A617 HydrophobicContact CD1-CB 3.97Å; Y597-Q618 HydrophobicContact CE1-CB 4.07Å; Y597-Q618 HydrophobicContact CE1-CG 4.39Å; Y597-Y621 HydrophobicContact CE1-CD1 4.45Å
598	F	93.4	Very high	84.4	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.009	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	158.3	178.8	-58.1	-101.8	0	0	0	110.8	V507 V508 L509 I531 V539 V541 R589 L590 L592 Q596	V507-F598 HydrophobicContact CB-CD1 4.42Å; V507-F598 HydrophobicContact CG2-CD1 4.44Å; V508-F598 CarbonylContact O-C 3.47Å; V508-F598 WeakPolarHBondContact O-CA 3.36Å; L509-F598 HydrophobicContact CB-CD1 3.91Å; L509-F598 HydrophobicContact CB-CE1 3.82Å; L509-F598 HydrophobicContact CD1-CD1 3.84Å; L509-F598 HydrophobicContact CD1-CD2 4.12Å; L509-F598 HydrophobicContact CD1-CE1 3.52Å; L509-F598 HydrophobicContact CD1-CE2 3.8Å; L509-F598 HydrophobicContact CD1-CG 4.15Å; L509-F598 HydrophobicContact CD1-CZ 3.53Å; L509-F598 HydrophobicContact CG-CE1 4.2Å; I531-F598 HydrophobicContact CG2-CZ 4.34Å; V539-F598 HydrophobicContact CG1-CE1 4.11Å; V539-F598 HydrophobicContact CG1-CZ 4.48Å; V541-F598 HydrophobicContact CG1-CE1 4.16Å; V541-F598 HydrophobicContact CG1-CZ 3.56Å; V541-F598 HydrophobicContact CG2-CZ 4.39Å; R589-F598 CarbonylContact C-O 3.55Å; R589-F598 VanDerWaalsContact CA-O 3.27Å; R589-F598 WeakPolarHBondContact CA-O 3.43Å; L590-F598 HydrophobicContact CB-CB 4.15Å; L590-F598 PolarHBondContact N-O 3.19Å; L590-F598 PolarHBondContact O-N 2.9Å; L592-F598 HydrophobicContact CD1-CD2 4.43Å; L592-F598 HydrophobicContact CD1-CE2 3.59Å; L592-F598 HydrophobicContact CD1-CZ 4.24Å; L592-F598 HydrophobicContact CG-CD2 4.33Å; L592-F598 HydrophobicContact CG-CE2 3.87Å; Q596-F598 HydrophobicContact CB-CE2 3.94Å
599	I	91.4	Very high	83.4	Confident	8 Å²	8	52 Å²	52	4%	0.041	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	134.3	161.4	-172.1	163.5	0	0	0	109.4	V507 V508 L510 D588 Y601 L613	V507-I599 WeakPolarHBondContact CA-O 3.3Å; V508-I599 HydrophobicContact CB-CG2 3.89Å; V508-I599 HydrophobicContact CG2-CG2 4.45Å; V508-I599 PolarHBondContact N-O 3.44Å; V508-I599 PolarHBondContact O-N 3.11Å; L510-I599 HydrophobicContact CD1-CB 4.4Å; L510-I599 HydrophobicContact CD2-CB 4.49Å; L510-I599 HydrophobicContact CD2-CG2 3.86Å; L510-I599 HydrophobicContact CG-CG2 4.4Å; D588-I599 WeakPolarHBondContact O-CA 3.49Å; I599-Y601 HydrophobicContact CB-CE2 4.44Å; I599-Y601 HydrophobicContact CD1-CE2 4.34Å; I599-Y601 HydrophobicContact CG1-CE2 4.12Å; I599-Y601 HydrophobicContact CG2-CD2 4.3Å; I599-Y601 HydrophobicContact CG2-CE2 3.59Å; I599-L613 HydrophobicContact CD1-CD1 4.12Å; I599-L613 HydrophobicContact CD1-CD2 4.1Å
600	L	91.9	Very high	82.5	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	133.4	179.2	176.2	67.3	0	0	0	110.9	V507 L524 L553 A561 L584 G587 D588 L602	V507-L600 HydrophobicContact CG1-CB 4.33Å; V507-L600 HydrophobicContact CG1-CD1 3.52Å; L524-L600 HydrophobicContact CD1-CD1 3.66Å; L553-L600 HydrophobicContact CD1-CD1 4.1Å; A561-L600 HydrophobicContact CB-CD2 4.36Å; L584-L600 HydrophobicContact CB-CD2 3.59Å; L584-L600 HydrophobicContact CD1-CD2 3.81Å; L584-L600 HydrophobicContact CG-CD2 4.24Å; G587-L600 VanDerWaalsContact CA-O 3.28Å; G587-L600 WeakPolarHBondContact CA-O 3.47Å; G587-L600 PolarHBondContact N-O 2.83Å; D588-L600 PolarHBondContact O-N 3.48Å; L600-L602 HydrophobicContact CD1-CD2 3.96Å; L600-L602 HydrophobicContact CD2-CD1 4.42Å; L600-L602 HydrophobicContact CD2-CD2 3.96Å; L600-L602 HydrophobicContact CD2-CG 4.08Å; L600-L602 HydrophobicContact CG-CD2 4.02Å; L600-L602 HydrophobicContact CG-CG 4.14Å
601	Y	88.7	Confident	81.6	Confident	25 Å²	25	54.1 Å²	54.1	10%	0.098	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	111.3	169.4	-68.8	-79.7	0	0	0	110.4	P505 F506 V508 N586 I599 P605	P505-Y601 CarbonylContact C-O 3.49Å; P505-Y601 VanDerWaalsContact CA-O 3.26Å; P505-Y601 WeakPolarHBondContact CA-O 3.14Å; F506-Y601 HydrophobicContact CD2-CD2 4.02Å; F506-Y601 HydrophobicContact CE1-CG 4.35Å; F506-Y601 AromaticContact CE2-CD2 3.32Å; F506-Y601 HydrophobicContact CE2-CD2 3.32Å; F506-Y601 HydrophobicContact CE2-CE2 4.11Å; F506-Y601 AromaticContact CE2-CG 3.83Å; F506-Y601 HydrophobicContact CE2-CG 3.83Å; F506-Y601 AromaticContact CZ-CD2 3.7Å; F506-Y601 HydrophobicContact CZ-CD2 3.7Å; F506-Y601 AromaticContact CZ-CG 3.72Å; F506-Y601 HydrophobicContact CZ-CG 3.72Å; F506-Y601 PolarHBondContact N-O 3.43Å; F506-Y601 PolarHBondContact O-N 2.87Å; V508-Y601 HydrophobicContact CG2-CD2 4.17Å; V508-Y601 HydrophobicContact CG2-CE2 4.16Å; N586-Y601 WeakPolarHBondContact OD1-CA 3.5Å; I599-Y601 HydrophobicContact CB-CE2 4.44Å; I599-Y601 HydrophobicContact CD1-CE2 4.34Å; I599-Y601 HydrophobicContact CG1-CE2 4.12Å; I599-Y601 HydrophobicContact CG2-CD2 4.3Å; I599-Y601 HydrophobicContact CG2-CE2 3.59Å; Y601-P605 HydrophobicContact CD1-CB 4.28Å; Y601-P605 HydrophobicContact CD1-CG 3.82Å; Y601-P605 HydrophobicContact CE1-CB 4.16Å; Y601-P605 HydrophobicContact CE1-CG 3.87Å; Y601-P605 HydrophobicContact CG-CG 4.38Å
602	L	87.6	Confident	80.9	Confident	15 Å²	15	55.2 Å²	55.2	8%	0.079	28%	0.279	C	S	.	.	S	Bend	trans	-89.2	-22.3	174.6	-60.3	178.1	0	0	0	112.5	P505 L555 A561 N586 L600	P505-L602 HydrophobicContact CB-CD2 4.34Å; L555-L602 HydrophobicContact CD2-CD2 3.73Å; A561-L602 HydrophobicContact CB-CD1 4.04Å; A561-L602 HydrophobicContact CB-CD2 3.63Å; A561-L602 HydrophobicContact CB-CG 4.46Å; N586-L602 HydrophobicContact CB-CB 4.16Å; N586-L602 PolarHBondContact OD1-N 3.48Å; L600-L602 HydrophobicContact CD1-CD2 3.96Å; L600-L602 HydrophobicContact CD2-CD1 4.42Å; L600-L602 HydrophobicContact CD2-CD2 3.96Å; L600-L602 HydrophobicContact CD2-CG 4.08Å; L600-L602 HydrophobicContact CG-CD2 4.02Å; L600-L602 HydrophobicContact CG-CG 4.14Å
603	E	81.2	Confident	80.3	Confident	131 Å²	131	56.2 Å²	56.2	61%	0.612	29%	0.285	S	S	*	.	S	Bend	trans	-126.5	139.1	174.8	-62.6	176.4	171.9	0	0	108.2	N586 P605	N586-E603 PolarHBondContact OD1-N 2.78Å; E603-P605 VanDerWaalsContact O-CD 3.23Å; E603-P605 WeakPolarHBondContact O-CD 3.4Å; E603-P605 VanDerWaalsContact O-N 3.16Å
604	S	72.6	Confident	80.3	Confident	65 Å²	65	57.1 Å²	57.1	46%	0.455	29%	0.287	S	S	.	.			trans	-63.3	115	-179	54.7	0	0	0	0	110.6	P502	P502-S604 WeakPolarHBondContact O-CB 3.49Å
605	P	68.2	Low	80	Confident	32 Å²	32	60.8 Å²	60.8	21%	0.208	30%	0.302	C	S	.	.			trans	-70.9	145.1	-179.9	29.7	-35.2	0	0	0	110.1	F506 Y601 E603 R607 C608	F506-P605 HydrophobicContact CZ-CG 4.26Å; Y601-P605 HydrophobicContact CD1-CB 4.28Å; Y601-P605 HydrophobicContact CD1-CG 3.82Å; Y601-P605 HydrophobicContact CE1-CB 4.16Å; Y601-P605 HydrophobicContact CE1-CG 3.87Å; Y601-P605 HydrophobicContact CG-CG 4.38Å; E603-P605 VanDerWaalsContact O-CD 3.23Å; E603-P605 WeakPolarHBondContact O-CD 3.4Å; E603-P605 VanDerWaalsContact O-N 3.16Å; P605-R607 PolarHBondContact O-N 2.99Å; P605-R607 VanDerWaalsContact O-N 3.17Å; P605-C608 WeakPolarHBondContact CG-SG 3.48Å
606	K	66.3	Low	79.7	Confident	220 Å²	220	64.6 Å²	64.6	96%	0.957	32%	0.318	S	S	*	.	S	Bend	trans	-60.7	-24.9	174.4	-66.8	-174.9	-179.8	-179.2	0	112.8
607	R	61.9	Low	79.3	Confident	228 Å²	228	62.8 Å²	62.8	86%	0.86	31%	0.311	S	S	*	.			trans	-155.6	127.6	176.6	-112.4	179.4	175.8	176.5	-1.8	109.2	P605	P605-R607 PolarHBondContact O-N 2.99Å; P605-R607 VanDerWaalsContact O-N 3.17Å
608	C	63.1	Low	79	Confident	44 Å²	44	65.7 Å²	65.7	30%	0.297	32%	0.324	S	S	.	.			trans	-89.6	106	165.4	-64.6	0	0	0	0	108.1	P605 M610	P605-C608 WeakPolarHBondContact CG-SG 3.48Å; C608-M610 HydrophobicContact CB-SD 4.34Å
609	N	70.2	Confident	78.3	Confident	109 Å²	109	69.3 Å²	69.3	58%	0.583	35%	0.347	S	S	*	.			trans	-98.4	112.6	165.6	-176.5	4.2	0	0	0	108.3	D611 L613	N609-D611 WeakPolarHBondContact OD1-CB 3.34Å; N609-D611 PolarHBondContact OD1-N 3.28Å; N609-D611 VanDerWaalsContact OD1-N 3.1Å; N609-L613 WeakPolarHBondContact O-CD1 3.33Å
610	M	72.5	Confident	77.9	Confident	8 Å²	8	71.4 Å²	71.4	4%	0.039	36%	0.356	C	S	.	.			trans	-87	-9	-175.9	-58.3	-55.6	-71.7	0	0	113.4	V508 L510 P514 E518 C608 G612 L613	V508-M610 HydrophobicContact CB-CE 4.08Å; V508-M610 HydrophobicContact CG1-CE 3.37Å; L510-M610 HydrophobicContact CD2-CE 3.44Å; L510-M610 VanDerWaalsContact CD2-CE 3.44Å; P514-M610 HydrophobicContact CB-CB 4.19Å; E518-M610 HydrophobicContact CG-CG 3.89Å; C608-M610 HydrophobicContact CB-SD 4.34Å; M610-G612 PolarHBondContact O-N 2.87Å; M610-L613 HydrophobicContact CE-CD1 4.17Å; M610-L613 PolarHBondContact O-N 3.41Å; M610-L613 HydrophobicContact SD-CD1 3.88Å
611	D	74	Confident	77.6	Confident	107 Å²	107	72.3 Å²	72.3	57%	0.572	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	120	-175.7	-78.8	-20.9	0	0	0	112.6	P514 N609 L613	P514-D611 WeakPolarHBondContact CG-OD1 3.5Å; N609-D611 WeakPolarHBondContact OD1-CB 3.34Å; N609-D611 PolarHBondContact OD1-N 3.28Å; N609-D611 VanDerWaalsContact OD1-N 3.1Å; D611-L613 PolarHBondContact O-N 3.13Å
612	G	78.4	Confident	77.3	Confident	28 Å²	28	74.8 Å²	74.8	29%	0.289	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.5	7.3	175.8	0	0	0	0	0	115.3	M610 K616	M610-G612 PolarHBondContact O-N 2.87Å; G612-K616 VanDerWaalsContact O-CG 3.31Å; G612-K616 WeakPolarHBondContact O-CG 3.39Å; G612-K616 PolarHBondContact O-N 3.47Å; G612-K616 VanDerWaalsContact O-N 3.09Å
613	L	82	Confident	76.9	Confident	24 Å²	24	82 Å²	82	13%	0.126	40%	0.401	C	S	.	.	H	α-helix	trans	-64.9	-40.5	175.8	-78.7	178.3	0	0	0	112	L510 I599 N609 M610 D611 K616 A617	L510-L613 HydrophobicContact CD1-CB 4.28Å; L510-L613 HydrophobicContact CD2-CB 3.9Å; L510-L613 HydrophobicContact CD2-CD1 4.34Å; I599-L613 HydrophobicContact CD1-CD1 4.12Å; I599-L613 HydrophobicContact CD1-CD2 4.1Å; N609-L613 WeakPolarHBondContact O-CD1 3.33Å; M610-L613 HydrophobicContact CE-CD1 4.17Å; M610-L613 PolarHBondContact O-N 3.41Å; M610-L613 HydrophobicContact SD-CD1 3.88Å; D611-L613 PolarHBondContact O-N 3.13Å; L613-K616 PolarHBondContact O-N 2.83Å; L613-A617 WeakPolarHBondContact O-CB 3.48Å; L613-A617 PolarHBondContact O-N 2.92Å
614	F	85.6	Confident	76.8	Confident	29 Å²	29	77 Å²	77	13%	0.127	38%	0.381	C	S	.	.	H	α-helix	trans	-57.8	-52.2	175.5	177.8	-92.3	0	0	0	111.3	L510 S511 P512 Y597 K616 A617 Q618	L510-F614 HydrophobicContact CB-CB 4.23Å; L510-F614 HydrophobicContact CB-CD2 4.08Å; L510-F614 WeakPolarHBondContact O-CD2 3.23Å; S511-F614 WeakPolarHBondContact O-CB 3.3Å; P512-F614 HydrophobicContact CB-CD1 4.26Å; P512-F614 HydrophobicContact CB-CE1 4.29Å; P512-F614 HydrophobicContact CG-CD1 4.13Å; P512-F614 HydrophobicContact CG-CE1 3.76Å; P512-F614 HydrophobicContact CG-CE2 4.2Å; P512-F614 HydrophobicContact CG-CZ 3.8Å; Y597-F614 HydrophobicContact CD2-CD2 4.23Å; Y597-F614 AromaticContact CD2-CE2 3.56Å; Y597-F614 HydrophobicContact CD2-CE2 3.56Å; Y597-F614 HydrophobicContact CD2-CZ 4.21Å; Y597-F614 HydrophobicContact CE2-CE2 4.06Å; Y597-F614 HydrophobicContact CE2-CZ 4.26Å; Y597-F614 HydrophobicContact CG-CE2 4.26Å; F614-K616 VanDerWaalsContact C-N 3.29Å; F614-K616 PolarHBondContact O-N 3.25Å; F614-A617 PolarHBondContact O-N 3.38Å; F614-Q618 WeakPolarHBondContact O-CB 3.46Å; F614-Q618 PolarHBondContact O-N 3.3Å
615	D	81.4	Confident	77	Confident	93 Å²	93	77.3 Å²	77.3	50%	0.497	38%	0.376	S	S	.	.	H	α-helix	trans	-59.6	-41.4	-179.9	-61.7	-39.6	0	0	0	111.5	Q618 V619	D615-Q618 PolarHBondContact O-N 3.13Å; D615-V619 WeakPolarHBondContact O-CB 3.49Å; D615-V619 WeakPolarHBondContact O-CG2 3.09Å; D615-V619 PolarHBondContact O-N 2.99Å
616	K	80.4	Confident	77.3	Confident	136 Å²	136	80.3 Å²	80.3	59%	0.591	39%	0.39	S	S	*	.	H	α-helix	trans	-61.6	-48.4	176.2	-75.9	173.1	-177.6	171.7	0	111.8	G612 L613 F614 V619 E620	G612-K616 VanDerWaalsContact O-CG 3.31Å; G612-K616 WeakPolarHBondContact O-CG 3.39Å; G612-K616 PolarHBondContact O-N 3.47Å; G612-K616 VanDerWaalsContact O-N 3.09Å; L613-K616 PolarHBondContact O-N 2.83Å; F614-K616 VanDerWaalsContact C-N 3.29Å; F614-K616 PolarHBondContact O-N 3.25Å; K616-V619 PolarHBondContact O-N 3.1Å; K616-E620 WeakPolarHBondContact O-CB 3.35Å; K616-E620 PolarHBondContact O-N 3.44Å
617	A	82.2	Confident	77.7	Confident	6 Å²	6	75.3 Å²	75.3	5%	0.05	37%	0.37	C	S	.	.	H	α-helix	trans	-63.6	-41.3	179.7	0	0	0	0	0	111.7	L510 R589 Y597 L613 F614 E620 Y621	L510-A617 HydrophobicContact CD1-CB 3.99Å; R589-A617 HydrophobicContact CB-CB 4.38Å; Y597-A617 HydrophobicContact CD1-CB 3.97Å; L613-A617 WeakPolarHBondContact O-CB 3.48Å; L613-A617 PolarHBondContact O-N 2.92Å; F614-A617 PolarHBondContact O-N 3.38Å; A617-E620 PolarHBondContact O-N 2.94Å; A617-Y621 PolarHBondContact O-N 3.28Å; A617-Y621 VanDerWaalsContact O-N 3.08Å
618	Q	85	Confident	78.3	Confident	69 Å²	69	70.5 Å²	70.5	32%	0.322	35%	0.352	S	S	.	.	H	α-helix	trans	-65.5	-45.4	177.8	-172.9	178.1	52.3	0	0	112.2	Y597 F614 D615 E620 Y621 L622	Y597-Q618 HydrophobicContact CE1-CB 4.07Å; Y597-Q618 HydrophobicContact CE1-CG 4.39Å; F614-Q618 WeakPolarHBondContact O-CB 3.46Å; F614-Q618 PolarHBondContact O-N 3.3Å; D615-Q618 PolarHBondContact O-N 3.13Å; Q618-E620 VanDerWaalsContact C-N 3.31Å; Q618-E620 PolarHBondContact O-N 3.47Å; Q618-Y621 PolarHBondContact O-N 3.48Å; Q618-L622 HydrophobicContact CG-CD1 4.05Å; Q618-L622 HydrophobicContact CG-CG 4.48Å; Q618-L622 WeakPolarHBondContact O-CB 3.16Å; Q618-L622 VanDerWaalsContact O-CG 3.32Å; Q618-L622 WeakPolarHBondContact O-CG 3.16Å; Q618-L622 PolarHBondContact O-N 3.2Å
619	V	80	Confident	78.8	Confident	79 Å²	79	73 Å²	73	48%	0.479	36%	0.362	S	S	.	.	H	α-helix	trans	-62.5	-39.7	177.8	168.4	0	0	0	0	111.4	D615 K616 L622 R623	D615-V619 WeakPolarHBondContact O-CB 3.49Å; D615-V619 WeakPolarHBondContact O-CG2 3.09Å; D615-V619 PolarHBondContact O-N 2.99Å; K616-V619 PolarHBondContact O-N 3.1Å; V619-L622 PolarHBondContact O-N 2.99Å; V619-R623 WeakPolarHBondContact O-CB 3.2Å; V619-R623 PolarHBondContact O-N 3.19Å
620	E	83.3	Confident	79	Confident	52 Å²	52	72.3 Å²	72.3	24%	0.243	36%	0.358	C	S	.	.	H	α-helix	trans	-64.4	-45.8	177.9	-169.5	174.8	-170.7	0	0	112	N574 R589 K616 A617 Q618 R623 A624	N574-E620 VanDerWaalsContact C-CD 3.45Å; N574-E620 WeakPolarHBondContact CA-OE1 3.29Å; N574-E620 VanDerWaalsContact CB-OE1 3.25Å; N574-E620 WeakPolarHBondContact CB-OE1 3.31Å; N574-E620 VanDerWaalsContact O-OE1 3.14Å; R589-E620 IonicContact CZ-OE1 2.87Å; R589-E620 IonicContact CZ-OE2 2.77Å; R589-E620 VanDerWaalsContact CZ-OE2 3.27Å; R589-E620 IonicContact NE-OE2 3.6Å; R589-E620 PolarHBondContact NE-OE2 2.86Å; R589-E620 IonicContact NH2-OE1 3.41Å; R589-E620 PolarHBondContact NH2-OE1 3.03Å; R589-E620 IonicContact NH2-OE2 3.54Å; R589-E620 PolarHBondContact NH2-OE2 2.97Å; K616-E620 WeakPolarHBondContact O-CB 3.35Å; K616-E620 PolarHBondContact O-N 3.44Å; A617-E620 PolarHBondContact O-N 2.94Å; Q618-E620 VanDerWaalsContact C-N 3.31Å; Q618-E620 PolarHBondContact O-N 3.47Å; E620-R623 PolarHBondContact O-N 3.32Å; E620-A624 PolarHBondContact O-N 3.34Å; E620-A624 VanDerWaalsContact O-N 3.14Å
621	Y	85.4	Confident	79.1	Confident	19 Å²	19	77.6 Å²	77.6	8%	0.075	39%	0.386	C	S	.	.	H	α-helix	trans	-58.6	-51	172.8	163.7	-106.6	0	0	0	112.1	F572 G594 Y597 A617 Q618 R623 A624 Q625	F572-Y621 HydrophobicContact CD1-CD2 4.09Å; F572-Y621 HydrophobicContact CD1-CE2 4.29Å; F572-Y621 AromaticContact CD2-CD2 3.87Å; F572-Y621 HydrophobicContact CD2-CD2 3.87Å; F572-Y621 AromaticContact CD2-CE2 3.79Å; F572-Y621 HydrophobicContact CD2-CE2 3.79Å; F572-Y621 HydrophobicContact CE1-CD2 4.25Å; F572-Y621 HydrophobicContact CE1-CE2 4.02Å; F572-Y621 HydrophobicContact CE2-CD2 4.05Å; F572-Y621 AromaticContact CE2-CE2 3.49Å; F572-Y621 HydrophobicContact CE2-CE2 3.49Å; F572-Y621 VanDerWaalsContact CE2-CE2 3.49Å; F572-Y621 AromaticContact CG-CD2 3.91Å; F572-Y621 HydrophobicContact CG-CD2 3.91Å; F572-Y621 HydrophobicContact CG-CE2 4.2Å; F572-Y621 HydrophobicContact CZ-CD2 4.25Å; F572-Y621 AromaticContact CZ-CE2 3.63Å; F572-Y621 HydrophobicContact CZ-CE2 3.63Å; G594-Y621 VanDerWaalsContact CA-CZ 3.46Å; Y597-Y621 HydrophobicContact CE1-CD1 4.45Å; A617-Y621 PolarHBondContact O-N 3.28Å; A617-Y621 VanDerWaalsContact O-N 3.08Å; Q618-Y621 PolarHBondContact O-N 3.48Å; Y621-R623 VanDerWaalsContact C-N 3.3Å; Y621-R623 PolarHBondContact O-N 3.31Å; Y621-A624 PolarHBondContact O-N 2.97Å; Y621-Q625 WeakPolarHBondContact O-CB 3.27Å; Y621-Q625 PolarHBondContact O-N 3.1Å; Y621-Q625 PolarHBondContact OH-NE2 2.93Å; Y621-Q625 VanDerWaalsContact OH-NE2 3.16Å; Y621-Q625 PolarHBondContact OH-OE1 3.49Å; Y621-Q625 VanDerWaalsContact OH-OE1 3.1Å
622	L	82.9	Confident	78.8	Confident	77 Å²	77	79.1 Å²	79.1	40%	0.403	39%	0.388	S	S	.	.	H	α-helix	trans	-62.5	-36.8	-178.6	-71.7	173.5	0	0	0	112.2	Q618 V619 N626	Q618-L622 HydrophobicContact CG-CD1 4.05Å; Q618-L622 HydrophobicContact CG-CG 4.48Å; Q618-L622 WeakPolarHBondContact O-CB 3.16Å; Q618-L622 VanDerWaalsContact O-CG 3.32Å; Q618-L622 WeakPolarHBondContact O-CG 3.16Å; Q618-L622 PolarHBondContact O-N 3.2Å; V619-L622 PolarHBondContact O-N 2.99Å; L622-N626 WeakPolarHBondContact O-CB 3.41Å; L622-N626 PolarHBondContact O-N 3.21Å; L622-N626 VanDerWaalsContact O-N 3.07Å; L622-N626 PolarHBondContact O-ND2 3.15Å; L622-N626 VanDerWaalsContact O-ND2 3.1Å
623	R	79	Confident	78.1	Confident	167 Å²	167	81.1 Å²	81.1	63%	0.63	39%	0.394	S	S	*	.	H	α-helix	trans	-63.4	-50.8	176.4	-174.1	-177.5	-68.9	-174.5	-1.9	111	V619 E620 Y621 Q625 N626 E627	V619-R623 WeakPolarHBondContact O-CB 3.2Å; V619-R623 PolarHBondContact O-N 3.19Å; E620-R623 PolarHBondContact O-N 3.32Å; Y621-R623 VanDerWaalsContact C-N 3.3Å; Y621-R623 PolarHBondContact O-N 3.31Å; R623-Q625 VanDerWaalsContact C-N 3.32Å; R623-Q625 PolarHBondContact O-N 3.41Å; R623-N626 PolarHBondContact O-N 3.31Å; R623-E627 PolarHBondContact O-N 3.4Å
624	A	77.4	Confident	77.4	Confident	25 Å²	25	84.2 Å²	84.2	21%	0.207	41%	0.408	C	S	.	.	H	α-helix	trans	-65.8	-35.2	-179.4	0	0	0	0	0	112.7	G575 E620 Y621 E627 R628	G575-A624 WeakPolarHBondContact O-CB 3.24Å; E620-A624 PolarHBondContact O-N 3.34Å; E620-A624 VanDerWaalsContact O-N 3.14Å; Y621-A624 PolarHBondContact O-N 2.97Å; A624-E627 PolarHBondContact O-N 3.45Å; A624-R628 PolarHBondContact O-N 3.3Å
625	Q	78.7	Confident	76.5	Confident	71 Å²	71	85.8 Å²	85.8	33%	0.332	42%	0.422	S	S	.	.	H	α-helix	trans	-64.9	-40.4	174.7	-170	174.7	33.2	0	0	111.9	Y621 R623 R628 L629	Y621-Q625 WeakPolarHBondContact O-CB 3.27Å; Y621-Q625 PolarHBondContact O-N 3.1Å; Y621-Q625 PolarHBondContact OH-NE2 2.93Å; Y621-Q625 VanDerWaalsContact OH-NE2 3.16Å; Y621-Q625 PolarHBondContact OH-OE1 3.49Å; Y621-Q625 VanDerWaalsContact OH-OE1 3.1Å; R623-Q625 VanDerWaalsContact C-N 3.32Å; R623-Q625 PolarHBondContact O-N 3.41Å; Q625-R628 PolarHBondContact O-N 3.01Å; Q625-L629 HydrophobicContact CG-CD1 4.46Å; Q625-L629 WeakPolarHBondContact O-CG 3.48Å; Q625-L629 PolarHBondContact O-N 3.27Å; Q625-L629 VanDerWaalsContact O-N 3.08Å
626	N	73.7	Confident	75.1	Confident	95 Å²	95	86.9 Å²	86.9	51%	0.508	43%	0.426	S	S	.	.	H	α-helix	trans	-66.3	-43.8	176.6	-78.1	-34.8	0	0	0	112.3	L622 R623 R628 L629 L630	L622-N626 WeakPolarHBondContact O-CB 3.41Å; L622-N626 PolarHBondContact O-N 3.21Å; L622-N626 VanDerWaalsContact O-N 3.07Å; L622-N626 PolarHBondContact O-ND2 3.15Å; L622-N626 VanDerWaalsContact O-ND2 3.1Å; R623-N626 PolarHBondContact O-N 3.31Å; N626-R628 PolarHBondContact O-N 2.96Å; N626-L629 PolarHBondContact O-N 3.46Å; N626-L630 WeakPolarHBondContact O-CG 3.49Å; N626-L630 PolarHBondContact O-N 3.47Å
627	E	75	Confident	74.1	Confident	116 Å²	116	87.9 Å²	87.9	54%	0.542	43%	0.426	S	S	.	.	H	α-helix	trans	-58.9	-45.4	175.1	-76.7	175.3	-178.7	0	0	111.5	R623 A624 L629 L630 D631	R623-E627 PolarHBondContact O-N 3.4Å; A624-E627 PolarHBondContact O-N 3.45Å; E627-L629 VanDerWaalsContact C-N 3.32Å; E627-L629 PolarHBondContact O-N 3.25Å; E627-L630 WeakPolarHBondContact O-CB 3.43Å; E627-L630 PolarHBondContact O-N 2.91Å; E627-L630 VanDerWaalsContact O-N 3.17Å; E627-D631 PolarHBondContact O-N 2.9Å
628	R	74.4	Confident	72.7	Confident	126 Å²	126	91.8 Å²	91.8	48%	0.475	45%	0.449	S	S	.	.	H	α-helix	trans	-61	-39.5	176.6	-169.1	-176.2	-173.1	-168.6	10	112.8	L577 E579 A624 Q625 N626 K632	L577-R628 VanDerWaalsContact CD2-CZ 3.49Å; E579-R628 IonicContact OE1-NH2 2.76Å; E579-R628 PolarHBondContact OE1-NH2 3.3Å; A624-R628 PolarHBondContact O-N 3.3Å; Q625-R628 PolarHBondContact O-N 3.01Å; N626-R628 PolarHBondContact O-N 2.96Å; R628-K632 WeakPolarHBondContact O-CB 3.22Å; R628-K632 PolarHBondContact O-N 2.78Å; R628-K632 VanDerWaalsContact O-N 3.11Å
629	L	74.2	Confident	71.1	Confident	96 Å²	96	93.4 Å²	93.4	50%	0.503	46%	0.463	S	S	.	.	H	α-helix	trans	-68	-38.2	177.1	-74.5	170.6	0	0	0	111.5	Q625 N626 E627 K632 V633	Q625-L629 HydrophobicContact CG-CD1 4.46Å; Q625-L629 WeakPolarHBondContact O-CG 3.48Å; Q625-L629 PolarHBondContact O-N 3.27Å; Q625-L629 VanDerWaalsContact O-N 3.08Å; N626-L629 PolarHBondContact O-N 3.46Å; E627-L629 VanDerWaalsContact C-N 3.32Å; E627-L629 PolarHBondContact O-N 3.25Å; L629-K632 PolarHBondContact O-N 3.05Å; L629-V633 WeakPolarHBondContact O-CG2 3.48Å; L629-V633 PolarHBondContact O-N 3.16Å
630	L	74.5	Confident	69.5	Low	96 Å²	96	97.7 Å²	97.7	50%	0.503	48%	0.475	S	S	.	.	H	α-helix	trans	-63.1	-48.3	174.8	-75.2	165	0	0	0	111.4	N626 E627 K632 V633 E634	N626-L630 WeakPolarHBondContact O-CG 3.49Å; N626-L630 PolarHBondContact O-N 3.47Å; E627-L630 WeakPolarHBondContact O-CB 3.43Å; E627-L630 PolarHBondContact O-N 2.91Å; E627-L630 VanDerWaalsContact O-N 3.17Å; L630-K632 PolarHBondContact O-N 3.41Å; L630-V633 CarbonylContact O-C 3.58Å; L630-V633 WeakPolarHBondContact O-CA 3.4Å; L630-V633 WeakPolarHBondContact O-CB 3.38Å; L630-V633 PolarHBondContact O-N 2.74Å; L630-E634 PolarHBondContact O-N 2.85Å
631	D	73.1	Confident	67.9	Low	119 Å²	119	102 Å²	102	64%	0.636	49%	0.493	S	S	*	.	H	α-helix	trans	-58.8	-36.7	175.6	-81.7	-11.5	0	0	0	112.4	E627 V633 E634 S635	E627-D631 PolarHBondContact O-N 2.9Å; D631-V633 VanDerWaalsContact C-N 3.34Å; D631-E634 PolarHBondContact O-N 3.38Å; D631-S635 WeakPolarHBondContact O-CB 3.42Å; D631-S635 PolarHBondContact O-N 3.36Å; D631-S635 PolarHBondContact O-OG 3.17Å
632	K	68.9	Low	66.1	Low	139 Å²	139	105.2 Å²	105.2	60%	0.604	52%	0.515	S	S	*	.	H	α-helix	trans	-68.3	-34.5	176.4	-152.1	171.5	-172.2	176.1	0	111.9	R628 L629 L630 S635 M636	R628-K632 WeakPolarHBondContact O-CB 3.22Å; R628-K632 PolarHBondContact O-N 2.78Å; R628-K632 VanDerWaalsContact O-N 3.11Å; L629-K632 PolarHBondContact O-N 3.05Å; L630-K632 PolarHBondContact O-N 3.41Å; K632-S635 WeakPolarHBondContact CA-OG 3.49Å; K632-S635 PolarHBondContact O-OG 2.95Å; K632-S635 VanDerWaalsContact O-OG 3.05Å; K632-M636 WeakPolarHBondContact O-CE 3.28Å; K632-M636 VanDerWaalsContact O-CG 3.3Å; K632-M636 WeakPolarHBondContact O-CG 3.17Å; K632-M636 PolarHBondContact O-N 3.26Å
633	V	62.9	Low	64.4	Low	69 Å²	69	104.2 Å²	104.2	42%	0.418	52%	0.518	S	S	.	.	H	α-helix	trans	-72.4	-40.9	173.8	172	0	0	0	0	111.3	L629 L630 D631 M636 R637	L629-V633 WeakPolarHBondContact O-CG2 3.48Å; L629-V633 PolarHBondContact O-N 3.16Å; L630-V633 CarbonylContact O-C 3.58Å; L630-V633 WeakPolarHBondContact O-CA 3.4Å; L630-V633 WeakPolarHBondContact O-CB 3.38Å; L630-V633 PolarHBondContact O-N 2.74Å; D631-V633 VanDerWaalsContact C-N 3.34Å; V633-M636 HydrophobicContact CG2-CE 4.15Å; V633-M636 PolarHBondContact O-N 3.35Å; V633-R637 PolarHBondContact O-N 3.01Å
634	E	67.2	Low	62.7	Low	89 Å²	89	99.8 Å²	99.8	42%	0.416	51%	0.512	S	S	.	.	H	α-helix	trans	-66	-45.3	179.7	-157.2	68.5	-160.5	0	0	111.1	L630 D631 M636 R637 V638	L630-E634 PolarHBondContact O-N 2.85Å; D631-E634 PolarHBondContact O-N 3.38Å; E634-M636 VanDerWaalsContact C-N 3.34Å; E634-M636 PolarHBondContact O-N 2.9Å; E634-R637 WeakPolarHBondContact O-CA 3.35Å; E634-R637 WeakPolarHBondContact O-CB 3.43Å; E634-R637 PolarHBondContact O-N 3.2Å; E634-R637 IonicContact OE2-NH1 3.31Å; E634-V638 PolarHBondContact O-N 2.74Å
635	S	66.2	Low	61.1	Low	62 Å²	62	105.1 Å²	105.1	43%	0.434	53%	0.533	S	S	.	.	H	α-helix	trans	-61.8	-38.3	174.1	52.6	0	0	0	0	112.6	D631 K632 R637 V638 V639	D631-S635 WeakPolarHBondContact O-CB 3.42Å; D631-S635 PolarHBondContact O-N 3.36Å; D631-S635 PolarHBondContact O-OG 3.17Å; K632-S635 WeakPolarHBondContact CA-OG 3.49Å; K632-S635 PolarHBondContact O-OG 2.95Å; K632-S635 VanDerWaalsContact O-OG 3.05Å; S635-R637 VanDerWaalsContact C-N 3.3Å; S635-R637 PolarHBondContact O-N 3.02Å; S635-V638 PolarHBondContact O-N 3.49Å; S635-V639 VanDerWaalsContact O-CG2 3.32Å; S635-V639 WeakPolarHBondContact O-CG2 3.41Å; S635-V639 PolarHBondContact O-N 2.81Å; S635-V639 VanDerWaalsContact O-N 3.16Å
636	M	53.4	Low	59.3	Low	116 Å²	116	105.7 Å²	105.7	57%	0.571	55%	0.545	S	S	*	.	H	α-helix	trans	-64.1	-31.8	171.5	-77.5	-170.6	-60.1	0	0	113.1	K632 V633 E634 K640	K632-M636 WeakPolarHBondContact O-CE 3.28Å; K632-M636 VanDerWaalsContact O-CG 3.3Å; K632-M636 WeakPolarHBondContact O-CG 3.17Å; K632-M636 PolarHBondContact O-N 3.26Å; V633-M636 HydrophobicContact CG2-CE 4.15Å; V633-M636 PolarHBondContact O-N 3.35Å; E634-M636 VanDerWaalsContact C-N 3.34Å; E634-M636 PolarHBondContact O-N 2.9Å; M636-K640 PolarHBondContact O-N 3.11Å
637	R	57.9	Low	57.8	Low	158 Å²	158	106.9 Å²	106.9	60%	0.596	56%	0.555	S	S	*	*	H	α-helix	trans	-70.4	-44.5	175.4	-85.3	-179.9	169.7	169	-1.4	112.3	V633 E634 S635 V639 K640 K641	V633-R637 PolarHBondContact O-N 3.01Å; E634-R637 WeakPolarHBondContact O-CA 3.35Å; E634-R637 WeakPolarHBondContact O-CB 3.43Å; E634-R637 PolarHBondContact O-N 3.2Å; E634-R637 IonicContact OE2-NH1 3.31Å; S635-R637 VanDerWaalsContact C-N 3.3Å; S635-R637 PolarHBondContact O-N 3.02Å; R637-V639 VanDerWaalsContact C-N 3.33Å; R637-V639 PolarHBondContact O-N 3.1Å; R637-K640 PolarHBondContact O-N 2.94Å; R637-K641 PolarHBondContact O-N 2.8Å
638	V	53.2	Low	55.9	Low	87 Å²	87	105.3 Å²	105.3	53%	0.527	56%	0.562	S	S	.	*	H	α-helix	trans	-60.9	-44.6	178.4	176.6	0	0	0	0	110.4	E634 S635 K640 K641 V642	E634-V638 PolarHBondContact O-N 2.74Å; S635-V638 PolarHBondContact O-N 3.49Å; V638-K640 VanDerWaalsContact C-N 3.31Å; V638-K640 PolarHBondContact O-N 3.04Å; V638-K641 PolarHBondContact O-N 3.24Å; V638-K641 VanDerWaalsContact O-N 3.12Å; V638-V642 WeakPolarHBondContact O-CG2 3.38Å; V638-V642 PolarHBondContact O-N 2.95Å; V638-V642 VanDerWaalsContact O-N 3.12Å
639	V	51.3	Low	54	Low	104 Å²	104	105.2 Å²	105.2	63%	0.63	58%	0.575	S	S	*	*	H	α-helix	trans	-59.9	-40.8	176.5	173.8	0	0	0	0	111.6	S635 R637 K641 A643	S635-V639 VanDerWaalsContact O-CG2 3.32Å; S635-V639 WeakPolarHBondContact O-CG2 3.41Å; S635-V639 PolarHBondContact O-N 2.81Å; S635-V639 VanDerWaalsContact O-N 3.16Å; R637-V639 VanDerWaalsContact C-N 3.33Å; R637-V639 PolarHBondContact O-N 3.1Å; V639-K641 PolarHBondContact O-N 3.14Å; V639-A643 WeakPolarHBondContact O-CB 3.29Å; V639-A643 PolarHBondContact O-N 3.28Å; V639-A643 VanDerWaalsContact O-N 3.08Å
640	K	47.8	Very low	51.9	Low	168 Å²	168	109.1 Å²	109.1	73%	0.73	59%	0.591	S	S	*	*	H	α-helix	trans	-63.2	-38.7	175.4	-95.6	-176.2	174	177.7	0	113	M636 R637 V638 A643 S644	M636-K640 PolarHBondContact O-N 3.11Å; R637-K640 PolarHBondContact O-N 2.94Å; V638-K640 VanDerWaalsContact C-N 3.31Å; V638-K640 PolarHBondContact O-N 3.04Å; K640-A643 PolarHBondContact O-N 2.97Å; K640-S644 PolarHBondContact O-N 3.22Å; K640-S644 PolarHBondContact O-OG 2.89Å
641	K	49.1	Very low	49.8	Very low	142 Å²	142	111.1 Å²	111.1	62%	0.617	61%	0.608	S	S	*	*	H	α-helix	trans	-68.5	-44.1	-177.6	-141.4	-179.9	-177.7	-171.9	0	111.7	R637 V638 V639 A643 S644 E645	R637-K641 PolarHBondContact O-N 2.8Å; V638-K641 PolarHBondContact O-N 3.24Å; V638-K641 VanDerWaalsContact O-N 3.12Å; V639-K641 PolarHBondContact O-N 3.14Å; K641-A643 VanDerWaalsContact C-N 3.35Å; K641-A643 PolarHBondContact O-N 3.44Å; K641-S644 PolarHBondContact O-N 3.45Å; K641-S644 PolarHBondContact O-OG 3.35Å; K641-E645 PolarHBondContact O-N 3.4Å
642	V	47.4	Very low	47.7	Very low	87 Å²	87	117 Å²	117	53%	0.527	62%	0.621	S	S	.	*	H	α-helix	trans	-65.2	-38.7	175.9	-179.9	0	0	0	0	111.5	V638 S644 E645 S646	V638-V642 WeakPolarHBondContact O-CG2 3.38Å; V638-V642 PolarHBondContact O-N 2.95Å; V638-V642 VanDerWaalsContact O-N 3.12Å; V642-S644 VanDerWaalsContact C-N 3.33Å; V642-S644 PolarHBondContact O-N 2.7Å; V642-E645 PolarHBondContact O-N 3.5Å; V642-S646 PolarHBondContact O-N 2.96Å; V642-S646 PolarHBondContact O-OG 3.04Å
643	A	46.4	Very low	45.8	Very low	56 Å²	56	118.2 Å²	118.2	46%	0.463	63%	0.632	S	S	.	*	H	α-helix	trans	-64.7	-36.3	175.6	0	0	0	0	0	112.4	V639 K640 K641 V647	V639-A643 WeakPolarHBondContact O-CB 3.29Å; V639-A643 PolarHBondContact O-N 3.28Å; V639-A643 VanDerWaalsContact O-N 3.08Å; K640-A643 PolarHBondContact O-N 2.97Å; K641-A643 VanDerWaalsContact C-N 3.35Å; K641-A643 PolarHBondContact O-N 3.44Å; A643-V647 WeakPolarHBondContact O-CG2 3.38Å
644	S	44.9	Very low	44.3	Very low	74 Å²	74	120.6 Å²	120.6	52%	0.517	65%	0.649	S	S	.	*	H	α-helix	trans	-71.5	-34.9	179.1	53	0	0	0	0	114.1	K640 K641 V642 S646	K640-S644 PolarHBondContact O-N 3.22Å; K640-S644 PolarHBondContact O-OG 2.89Å; K641-S644 PolarHBondContact O-N 3.45Å; K641-S644 PolarHBondContact O-OG 3.35Å; V642-S644 VanDerWaalsContact C-N 3.33Å; V642-S644 PolarHBondContact O-N 2.7Å; S644-S646 VanDerWaalsContact C-N 3.34Å
645	E	42.6	Very low	42.3	Very low	138 Å²	138	125.7 Å²	125.7	65%	0.645	68%	0.675	S	S	*	*	H	α-helix	trans	-73.3	-28	179.4	-73.2	176.6	-179.3	0	0	112.4	K641 V642 V647	K641-E645 PolarHBondContact O-N 3.4Å; V642-E645 PolarHBondContact O-N 3.5Å; E645-V647 PolarHBondContact O-N 3.34Å
646	S	40.8	Very low	40.5	Very low	83 Å²	83	134.6 Å²	134.6	58%	0.58	70%	0.699	S	S	*	*	H	α-helix	trans	-74.3	-23.7	-179.8	-53.3	0	0	0	0	113.5	V642 S644	V642-S646 PolarHBondContact O-N 2.96Å; V642-S646 PolarHBondContact O-OG 3.04Å; S644-S646 VanDerWaalsContact C-N 3.34Å
647	V	42.2	Very low	39.4	Very low	119 Å²	119	134.5 Å²	134.5	72%	0.721	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-17.9	-177.7	176.8	0	0	0	0	112.4	A643 E645 V649	A643-V647 WeakPolarHBondContact O-CG2 3.38Å; E645-V647 PolarHBondContact O-N 3.34Å; V647-V649 PolarHBondContact O-N 3.25Å
648	A	35.3	Very low	38.1	Very low	83 Å²	83	135.1 Å²	135.1	69%	0.686	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	-12.9	-173.1	0	0	0	0	0	115
649	V	33.7	Very low	36.9	Very low	125 Å²	125	134.1 Å²	134.1	76%	0.758	73%	0.73	S	S	*	*	S	Bend	trans	-98.9	-16.3	-168	-179	0	0	0	0	114.7	V647	V647-V649 PolarHBondContact O-N 3.25Å
650	E	30.4	Very low	35.6	Very low	177 Å²	177	136.9 Å²	136.9	83%	0.827	74%	0.74	S	S	*	*			trans	-101.5	16.5	-162.5	-95.6	-172.5	171.8	0	0	119
651	T	32	Very low	34.8	Very low	139 Å²	139	138 Å²	138	85%	0.853	75%	0.748	S	S	*	*			trans	-119.4	70.3	177.7	50.4	0	0	0	0	114.6
652	R	28.4	Very low	33.5	Very low	242 Å²	242	139.9 Å²	139.9	91%	0.913	76%	0.759	S	S	*	*			trans	-139.3	97.6	160.1	-77.2	-175.2	177.1	175.6	0.2	110.3
653	I	29.2	Very low	32.6	Very low	164 Å²	164	143.4 Å²	143.4	84%	0.841	78%	0.775	S	S	*	*			trans	-139	131.1	163.7	-56.5	-178.8	0	0	0	110.3
654	P	30.1	Very low	31.5	Very low	119 Å²	119	149.4 Å²	149.4	77%	0.773	79%	0.793	S	S	*	*			trans	-94.4	146.6	-167.4	7.4	14.5	0	0	0	114
655	M	26.7	Very low	30.6	Very low	197 Å²	197	152.5 Å²	152.5	97%	0.97	81%	0.809	S	S	*	*			trans	-70.6	127.9	176.8	-69	-161.9	-94.5	0	0	112.3
656	R	28.7	Very low	29.6	Very low	248 Å²	248	155 Å²	155	94%	0.936	82%	0.82	S	S	*	*			trans	-115.2	134.8	167.2	-93.5	-176.1	174.7	171.2	-1.1	110.8
657	S	28.5	Very low	28.8	Very low	114 Å²	114	160.1 Å²	160.1	80%	0.797	83%	0.832	S	S	*	*			trans	-78.6	131.9	-178.9	49.1	0	0	0	0	114.2
658	I	30.8	Very low	27.9	Very low	172 Å²	172	162.4 Å²	162.4	88%	0.882	84%	0.839	S	S	*	*			trans	-156.4	132.8	164	-54.6	-179	0	0	0	104.9
659	G	28	Very low	27.3	Very low	65 Å²	65	164.6 Å²	164.6	67%	0.67	84%	0.843	S	S	*	*			cis	119.3	96.8	29.7	0	0	0	0	0	108.4
660	I	24.6	Very low	26.7	Very low	162 Å²	162	163.7 Å²	163.7	83%	0.831	84%	0.843	S	S	*	*			trans	-3.3	126.4	164.6	-57	157.3	0	0	0	117.4
661	Q	30.3	Very low	26.3	Very low	191 Å²	191	161.4 Å²	161.4	89%	0.893	84%	0.841	S	S	*	*			trans	-170.1	128	133.8	-106.9	170.4	6.1	0	0	112.3
662	E	23.5	Very low	25.8	Very low	182 Å²	182	160.6 Å²	160.6	85%	0.85	84%	0.838	S	S	*	*			trans	-72.7	130.2	172.9	-64.5	171	151.2	0	0	110.4
663	N	27.2	Very low	25.6	Very low	162 Å²	162	155 Å²	155	87%	0.866	83%	0.831	S	S	*	*			trans	-169.5	132.5	138.5	-100.7	-26.7	0	0	0	111.3	T665	N663-T665 PolarHBondContact O-N 3.09Å
664	H	24.7	Very low	25.2	Very low	182 Å²	182	158.8 Å²	158.8	84%	0.843	84%	0.835	S	S	*	*			trans	-59.4	126.2	-179.5	-72.8	-88.5	0	0	0	112.7
665	T	24.8	Very low	24.8	Very low	138 Å²	138	161.9 Å²	161.9	85%	0.847	83%	0.831	S	S	*	*				-170.2	111.1	129.4	17.6	0	0	0	0	108.5	N663 K667	N663-T665 PolarHBondContact O-N 3.09Å; T665-K667 PolarHBondContact O-N 3.44Å; T665-K667 VanDerWaalsContact O-N 3.07Å
666	E	22.9	Very low	24.6	Very low	191 Å²	191	157.3 Å²	157.3	89%	0.893	82%	0.817	S	S	*	*			trans	-65	103	174.5	-69	175.1	154.9	0	0	109.8
667	K	22.4	Very low	24.3	Very low	190 Å²	190	150.3 Å²	150.3	83%	0.826	81%	0.812	S	S	*	*			trans	-126.9	103.5	152.7	-80.2	-170.4	177.2	-179.4	0	108.2	T665 V669	T665-K667 PolarHBondContact O-N 3.44Å; T665-K667 VanDerWaalsContact O-N 3.07Å; K667-V669 PolarHBondContact O-N 3.42Å; K667-V669 VanDerWaalsContact O-N 3.08Å
668	I	24.2	Very low	24.1	Very low	168 Å²	168	147.3 Å²	147.3	86%	0.862	79%	0.788	S	S	*	*			trans	-65	102.5	176.4	-63.3	166.4	0	0	0	107.2
669	V	21.5	Very low	23.6	Very low	128 Å²	128	146 Å²	146	78%	0.776	79%	0.787	S	S	*	*			trans	-98.4	115.9	169.6	174.5	0	0	0	0	107.2	K667	K667-V669 PolarHBondContact O-N 3.42Å; K667-V669 VanDerWaalsContact O-N 3.08Å
670	S	22.4	Very low	23.4	Very low	107 Å²	107	147.5 Å²	147.5	75%	0.748	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-76.7	133.2	177.2	26.4	0	0	0	0	111.6
671	T	21.4	Very low	23.2	Very low	128 Å²	128	146.6 Å²	146.6	79%	0.785	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-85.7	136.1	-175.2	-26.9	0	0	0	0	111.6
672	P	22.4	Very low	22.9	Very low	123 Å²	123	141 Å²	141	80%	0.799	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-88.4	135.5	176.5	18.9	-6.7	0	0	0	112.9
673	T	23	Very low	22.8	Very low	125 Å²	125	143.8 Å²	143.8	77%	0.767	77%	0.769	S	S	*	*			trans	-124.9	113	173.4	39.6	0	0	0	0	113
674	R	21.7	Very low	22.6	Very low	243 Å²	243	144.4 Å²	144.4	92%	0.917	77%	0.766	S	S	*	*			trans	33.7	126	132.5	-94.9	-179.7	173.9	-176.9	-2.7	122.3	S748	R674-S748 CarbonylContact C-O 3.51Å
675	R	20.3	Very low	22.3	Very low	184 Å²	184	144.1 Å²	144.1	69%	0.694	77%	0.765	S	S	*	*			trans	-65.2	146.8	165	-56.2	-179.1	173.8	168.8	-4.9	114.7	S748 M749	R675-S748 VanDerWaalsContact CA-CB 3.47Å; R675-S748 VanDerWaalsContact CA-O 3.32Å; R675-S748 WeakPolarHBondContact CA-O 3.36Å; R675-S748 WeakPolarHBondContact CB-OG 3.3Å; R675-M749 HydrophobicContact CG-CG 4.47Å
676	C	24.4	Very low	22.1	Very low	101 Å²	101	141.9 Å²	141.9	68%	0.682	76%	0.761	S	S	*	*			trans	-142.5	135.6	165.5	-115.8	0	0	0	0	111.4	S748	C676-S748 VanDerWaalsContact C-OG 3.3Å; C676-S748 PolarHBondContact N-OG 2.9Å; C676-S748 PolarHBondContact O-OG 2.86Å
677	A	21	Very low	21.9	Very low	101 Å²	101	137.6 Å²	137.6	84%	0.835	76%	0.757	S	S	*	*			trans	-91.9	160.6	-171.4	0	0	0	0	0	114.1
678	N	24	Very low	21.9	Very low	51 Å²	51	134.3 Å²	134.3	27%	0.273	75%	0.753	S	S	.	*			trans	-85.6	154	-168.1	-67.4	-27.2	0	0	0	115.2	L747	N678-L747 WeakPolarHBondContact OD1-CD1 3.29Å
679	T	21.1	Very low	21.8	Very low	143 Å²	143	131 Å²	131	88%	0.877	75%	0.745	S	S	*	*			trans	-129.1	121.2	155.1	46.5	0	0	0	0	109.5
680	Q	24.4	Very low	21.8	Very low	98 Å²	98	130.1 Å²	130.1	46%	0.458	73%	0.734	S	S	.	*			trans	-75.1	143.6	171.4	-65	166.9	-63.6	0	0	111.9	E716	Q680-E716 VanDerWaalsContact CD-O 3.29Å; Q680-E716 HydrophobicContact CG-CB 3.95Å; Q680-E716 HydrophobicContact CG-CG 4.15Å; Q680-E716 PolarHBondContact NE2-O 3.26Å
681	T	20.8	Very low	21.8	Very low	143 Å²	143	128.8 Å²	128.8	88%	0.877	73%	0.725	S	S	*	*			trans	-154.6	121.2	131.6	33.2	0	0	0	0	108.7
682	A	22.2	Very low	22.1	Very low	74 Å²	74	126.1 Å²	126.1	61%	0.612	72%	0.716	S	S	*	*			trans	-65.5	151.8	171.6	0	0	0	0	0	113
683	R	21.8	Very low	22.4	Very low	240 Å²	240	128.7 Å²	128.7	91%	0.906	72%	0.718	S	S	*	*				178.8	118.2	118.1	-94.8	169.8	-174.2	178.3	2.4	112.5
684	H	23.6	Very low	22.7	Very low	174 Å²	174	123.8 Å²	123.8	81%	0.806	69%	0.69	S	S	*	*			trans	1	145.7	149.9	-64.9	-82.9	0	0	0	121.3
685	E	17.4	Very low	22.9	Very low	177 Å²	177	117.3 Å²	117.3	83%	0.827	67%	0.673	S	S	*	*				-166.6	145.4	106.7	-103	166.9	-162.2	0	0	111.4
686	A	21.2	Very low	23.3	Very low	91 Å²	91	115.6 Å²	115.6	75%	0.752	68%	0.677	S	S	*	*			trans	-105.5	157.1	-170.5	0	0	0	0	0	111.7
687	A	19.3	Very low	23.6	Very low	100 Å²	100	113.9 Å²	113.9	83%	0.826	67%	0.67	S	S	*	*			trans	-149.1	134.3	158.2	0	0	0	0	0	110.7
688	V	22.7	Very low	24	Very low	122 Å²	122	110.4 Å²	110.4	74%	0.739	64%	0.639	S	S	*	*			trans	-125	142.8	-168.1	172.8	0	0	0	0	109.2
689	S	20.9	Very low	24.4	Very low	97 Å²	97	109.4 Å²	109.4	68%	0.678	64%	0.642	S	S	*	*			trans	-165.3	129.6	148.3	60.8	0	0	0	0	107.7
690	I	22	Very low	25.3	Very low	110 Å²	110	105.3 Å²	105.3	56%	0.564	62%	0.619	S	S	*	*			trans	-170.1	150.3	159.2	-90.6	138.3	0	0	0	109.5	A694 C698	I690-A694 HydrophobicContact CG2-CB 3.14Å; I690-C698 HydrophobicContact CG2-CB 4.33Å
691	S	22.3	Very low	26.1	Very low	79 Å²	79	103.4 Å²	103.4	55%	0.552	61%	0.611	S	S	*	*			trans	-75.1	163.4	-169.9	53.1	0	0	0	0	115.9	E693 A694 I695	S691-E693 PolarHBondContact O-N 3.5Å; S691-A694 CarbonylContact O-C 3.6Å; S691-A694 WeakPolarHBondContact O-CA 3.46Å; S691-A694 WeakPolarHBondContact O-CB 3.23Å; S691-A694 PolarHBondContact O-N 3.49Å; S691-I695 WeakPolarHBondContact O-CG1 3.49Å; S691-I695 PolarHBondContact O-N 3.12Å
692	A	27.1	Very low	27	Very low	73 Å²	73	99.7 Å²	99.7	60%	0.603	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	-40.5	-168.8	0	0	0	0	0	117.8	A694 I695 D696	A692-A694 VanDerWaalsContact C-N 3.25Å; A692-A694 PolarHBondContact O-N 2.94Å; A692-I695 VanDerWaalsContact C-N 3.35Å; A692-I695 WeakPolarHBondContact O-CA 3.44Å; A692-I695 VanDerWaalsContact O-CB 3.31Å; A692-I695 WeakPolarHBondContact O-CB 3.33Å; A692-I695 PolarHBondContact O-N 2.94Å; A692-D696 PolarHBondContact O-N 3.1Å
693	E	29	Very low	28.3	Very low	176 Å²	176	98.1 Å²	98.1	82%	0.822	58%	0.575	S	S	*	*	H	α-helix	trans	-70.3	-31.5	174.5	-69.2	155.2	179.6	0	0	111.2	S691 I695 A697	S691-E693 PolarHBondContact O-N 3.5Å; E693-I695 VanDerWaalsContact C-N 3.31Å; E693-A697 PolarHBondContact O-N 3.47Å
694	A	28.6	Very low	29.8	Very low	23 Å²	23	86.9 Å²	86.9	19%	0.19	53%	0.533	C	S	.	.	H	α-helix	trans	-85.5	-0.5	168.4	0	0	0	0	0	111.9	I690 S691 A692 C698	I690-A694 HydrophobicContact CG2-CB 3.14Å; S691-A694 CarbonylContact O-C 3.6Å; S691-A694 WeakPolarHBondContact O-CA 3.46Å; S691-A694 WeakPolarHBondContact O-CB 3.23Å; S691-A694 PolarHBondContact O-N 3.49Å; A692-A694 VanDerWaalsContact C-N 3.25Å; A692-A694 PolarHBondContact O-N 2.94Å; A694-C698 CarbonylContact O-C 3.55Å; A694-C698 WeakPolarHBondContact O-CA 2.99Å; A694-C698 WeakPolarHBondContact O-CB 3.48Å; A694-C698 PolarHBondContact O-N 3.37Å; A694-C698 PolarHBondContact O-SG 2.74Å
695	I	26.2	Very low	31.3	Very low	107 Å²	107	82.4 Å²	82.4	55%	0.549	52%	0.515	S	S	.	.	H	α-helix	trans	-80.3	-32.2	164.4	-69.3	174.1	0	0	0	108.7	S691 A692 E693 G699	S691-I695 WeakPolarHBondContact O-CG1 3.49Å; S691-I695 PolarHBondContact O-N 3.12Å; A692-I695 VanDerWaalsContact C-N 3.35Å; A692-I695 WeakPolarHBondContact O-CA 3.44Å; A692-I695 VanDerWaalsContact O-CB 3.31Å; A692-I695 WeakPolarHBondContact O-CB 3.33Å; A692-I695 PolarHBondContact O-N 2.94Å; E693-I695 VanDerWaalsContact C-N 3.31Å; I695-G699 WeakPolarHBondContact O-CA 3.46Å; I695-G699 PolarHBondContact O-N 3.23Å
696	D	29.6	Very low	32.9	Very low	147 Å²	147	80.1 Å²	80.1	79%	0.786	50%	0.503	S	S	*	.	H	α-helix	trans	-76.7	-44.9	170.1	-96.8	9.4	0	0	0	111.6	A692	A692-D696 PolarHBondContact O-N 3.1Å
697	A	31.3	Very low	34.7	Very low	66 Å²	66	76.8 Å²	76.8	55%	0.545	47%	0.472	S	S	.	.	H	α-helix	trans	-80.3	-44.2	179.8	0	0	0	0	0	114.1	E693 S700	E693-A697 PolarHBondContact O-N 3.47Å; A697-S700 PolarHBondContact O-N 2.61Å; A697-S700 PolarHBondContact O-OG 3.32Å
698	C	28.9	Very low	36.9	Very low	27 Å²	27	72.5 Å²	72.5	18%	0.182	44%	0.435	C	S	.	.	H	α-helix	trans	-81.7	-4.7	171.1	-48.5	0	0	0	0	112.4	I690 A694 S700 I701 V702	I690-C698 HydrophobicContact CG2-CB 4.33Å; A694-C698 CarbonylContact O-C 3.55Å; A694-C698 WeakPolarHBondContact O-CA 2.99Å; A694-C698 WeakPolarHBondContact O-CB 3.48Å; A694-C698 PolarHBondContact O-N 3.37Å; A694-C698 PolarHBondContact O-SG 2.74Å; C698-S700 PolarHBondContact O-N 2.81Å; C698-I701 HydrophobicContact CB-CB 4.47Å; C698-I701 PolarHBondContact O-N 3.36Å; C698-I701 VanDerWaalsContact O-N 3.15Å; C698-V702 WeakPolarHBondContact O-CB 3.47Å; C698-V702 WeakPolarHBondContact O-CG2 3.49Å; C698-V702 PolarHBondContact O-N 2.99Å
699	G	31.6	Very low	38.6	Very low	31 Å²	31	72 Å²	72	32%	0.32	43%	0.428	S	S	.	.	H	α-helix	trans	-50.2	-38.8	161.2	0	0	0	0	0	110.3	I695 A703	I695-G699 WeakPolarHBondContact O-CA 3.46Å; I695-G699 PolarHBondContact O-N 3.23Å; G699-A703 WeakPolarHBondContact O-CA 3.27Å; G699-A703 WeakPolarHBondContact O-CB 3.39Å; G699-A703 PolarHBondContact O-N 3.45Å
700	S	40.6	Very low	40.7	Very low	57 Å²	57	71.3 Å²	71.3	40%	0.399	41%	0.414	S	S	.	.	H	α-helix	trans	-75	-40.1	175.5	89	0	0	0	0	113.6	A697 C698 A703 V704	A697-S700 PolarHBondContact O-N 2.61Å; A697-S700 PolarHBondContact O-OG 3.32Å; C698-S700 PolarHBondContact O-N 2.81Å; S700-A703 PolarHBondContact O-N 3.1Å; S700-V704 WeakPolarHBondContact O-CB 3.45Å; S700-V704 WeakPolarHBondContact O-CG2 3.44Å; S700-V704 PolarHBondContact O-N 3.25Å
701	I	40.7	Very low	42.8	Very low	57 Å²	57	66 Å²	66	29%	0.292	39%	0.387	S	S	.	.	H	α-helix	trans	-67.4	-47.2	-179.5	-64.5	173.3	0	0	0	110.7	C698 A703 V704 D705 L738 L740	C698-I701 HydrophobicContact CB-CB 4.47Å; C698-I701 PolarHBondContact O-N 3.36Å; C698-I701 VanDerWaalsContact O-N 3.15Å; I701-A703 VanDerWaalsContact C-N 3.35Å; I701-V704 PolarHBondContact O-N 3.16Å; I701-D705 PolarHBondContact O-N 3.04Å; I701-L738 HydrophobicContact CD1-CD2 3.85Å; I701-L738 HydrophobicContact CG1-CD2 3.67Å; I701-L740 HydrophobicContact CG1-CD1 4.17Å
702	V	41	Very low	45.1	Very low	66 Å²	66	63.5 Å²	63.5	40%	0.4	37%	0.367	S	S	.	.	H	α-helix	trans	-66.7	-40.1	176.8	176.2	0	0	0	0	109.6	C698 V704 D705 F706	C698-V702 WeakPolarHBondContact O-CB 3.47Å; C698-V702 WeakPolarHBondContact O-CG2 3.49Å; C698-V702 PolarHBondContact O-N 2.99Å; V702-V704 PolarHBondContact O-N 3.44Å; V702-D705 PolarHBondContact O-N 3.49Å; V702-F706 HydrophobicContact CG1-CD2 3.53Å; V702-F706 HydrophobicContact CG1-CE2 3.66Å; V702-F706 WeakPolarHBondContact O-CB 3.37Å; V702-F706 VanDerWaalsContact O-CD2 3.31Å; V702-F706 WeakPolarHBondContact O-CD2 3.36Å; V702-F706 PolarHBondContact O-N 3.08Å
703	A	47.4	Very low	46.7	Very low	41 Å²	41	63.5 Å²	63.5	34%	0.339	36%	0.363	S	S	.	.	H	α-helix	trans	-60.4	-44.3	172.7	0	0	0	0	0	111.5	G699 S700 I701 F706 M707	G699-A703 WeakPolarHBondContact O-CA 3.27Å; G699-A703 WeakPolarHBondContact O-CB 3.39Å; G699-A703 PolarHBondContact O-N 3.45Å; S700-A703 PolarHBondContact O-N 3.1Å; I701-A703 VanDerWaalsContact C-N 3.35Å; A703-F706 CarbonylContact O-C 3.49Å; A703-F706 PolarHBondContact O-N 3.44Å; A703-M707 HydrophobicContact CB-SD 4.38Å; A703-M707 WeakPolarHBondContact O-CB 3.04Å; A703-M707 WeakPolarHBondContact O-CG 3.44Å; A703-M707 PolarHBondContact O-N 2.95Å
704	V	53.4	Low	48.3	Very low	4 Å²	4	56 Å²	56	2%	0.024	33%	0.328	C	S	.	.	H	α-helix	trans	-66.8	-40.3	179.6	174	0	0	0	0	110.8	S700 I701 V702 M707 V708 L726 L740 V742 A757 F760	S700-V704 WeakPolarHBondContact O-CB 3.45Å; S700-V704 WeakPolarHBondContact O-CG2 3.44Å; S700-V704 PolarHBondContact O-N 3.25Å; I701-V704 PolarHBondContact O-N 3.16Å; V702-V704 PolarHBondContact O-N 3.44Å; V704-M707 CarbonylContact O-C 3.02Å; V704-M707 PolarHBondContact O-N 3.28Å; V704-V708 HydrophobicContact CG1-CG2 4.25Å; V704-V708 WeakPolarHBondContact O-CB 3.46Å; V704-V708 VanDerWaalsContact O-CG2 3.23Å; V704-V708 WeakPolarHBondContact O-CG2 3.2Å; V704-V708 PolarHBondContact O-N 2.96Å; V704-L726 HydrophobicContact CG1-CD2 3.87Å; V704-L740 HydrophobicContact CB-CD1 4.31Å; V704-L740 HydrophobicContact CG1-CD1 4.31Å; V704-L740 HydrophobicContact CG2-CD1 4.41Å; V704-V742 HydrophobicContact CG1-CG2 4.39Å; V704-A757 HydrophobicContact CG1-CB 4.25Å; V704-A757 HydrophobicContact CG2-CB 3.79Å; V704-F760 HydrophobicContact CG1-CD1 4.45Å
705	D	55.7	Low	50.2	Low	79 Å²	79	54.9 Å²	54.9	42%	0.422	32%	0.319	S	S	.	.	H	α-helix	trans	-63.4	-46.2	174.1	-115.5	-10.6	0	0	0	111.2	I701 V702 M707 V708 L709 L726	I701-D705 PolarHBondContact O-N 3.04Å; V702-D705 PolarHBondContact O-N 3.49Å; D705-M707 VanDerWaalsContact C-N 3.31Å; D705-M707 PolarHBondContact O-N 3.38Å; D705-V708 PolarHBondContact O-N 3.21Å; D705-L709 WeakPolarHBondContact O-CB 3.03Å; D705-L709 VanDerWaalsContact O-CG 3.26Å; D705-L709 WeakPolarHBondContact O-CG 3.17Å; D705-L709 PolarHBondContact O-N 3.02Å; D705-L726 WeakPolarHBondContact OD1-CD1 3.43Å
706	F	51.1	Low	51.8	Low	129 Å²	129	51.9 Å²	51.9	57%	0.566	30%	0.303	S	S	*	.	H	α-helix	trans	-61.5	-39.1	173.4	-92.7	-76	0	0	0	111.8	V702 A703 L709 E710	V702-F706 HydrophobicContact CG1-CD2 3.53Å; V702-F706 HydrophobicContact CG1-CE2 3.66Å; V702-F706 WeakPolarHBondContact O-CB 3.37Å; V702-F706 VanDerWaalsContact O-CD2 3.31Å; V702-F706 WeakPolarHBondContact O-CD2 3.36Å; V702-F706 PolarHBondContact O-N 3.08Å; A703-F706 CarbonylContact O-C 3.49Å; A703-F706 PolarHBondContact O-N 3.44Å; F706-L709 PolarHBondContact O-N 3.16Å; F706-E710 WeakPolarHBondContact O-CB 3.19Å; F706-E710 PolarHBondContact O-N 2.67Å
707	M	58.4	Low	53.2	Low	22 Å²	22	47.6 Å²	47.6	11%	0.108	28%	0.284	C	S	.	.	H	α-helix	trans	-70.7	-37.4	177.8	-73.3	162.7	62.5	0	0	111.4	A703 V704 D705 A711 F760 Q761 W764	A703-M707 HydrophobicContact CB-SD 4.38Å; A703-M707 WeakPolarHBondContact O-CB 3.04Å; A703-M707 WeakPolarHBondContact O-CG 3.44Å; A703-M707 PolarHBondContact O-N 2.95Å; V704-M707 CarbonylContact O-C 3.02Å; V704-M707 PolarHBondContact O-N 3.28Å; D705-M707 VanDerWaalsContact C-N 3.31Å; D705-M707 PolarHBondContact O-N 3.38Å; M707-A711 WeakPolarHBondContact O-CA 3.45Å; M707-A711 WeakPolarHBondContact O-CB 3.36Å; M707-A711 PolarHBondContact O-N 3.11Å; M707-F760 HydrophobicContact CB-CE1 3.74Å; M707-F760 HydrophobicContact CB-CZ 4.32Å; M707-F760 HydrophobicContact CE-CD1 4.18Å; M707-F760 HydrophobicContact CE-CE1 4.03Å; M707-Q761 HydrophobicContact CE-CB 3.58Å; M707-Q761 HydrophobicContact CE-CG 3.55Å; M707-Q761 HydrophobicContact SD-CG 4.32Å; M707-W764 HydrophobicContact CE-CB 4.01Å; M707-W764 HydrophobicContact CE-CG 4.13Å
708	V	66.8	Low	54.7	Low	9 Å²	9	45.1 Å²	45.1	6%	0.055	26%	0.263	C	S	.	.	H	α-helix	trans	-65.7	-41.6	173	165	0	0	0	0	109.7	V704 D705 N712 F724 L726 V742 F760	V704-V708 HydrophobicContact CG1-CG2 4.25Å; V704-V708 WeakPolarHBondContact O-CB 3.46Å; V704-V708 VanDerWaalsContact O-CG2 3.23Å; V704-V708 WeakPolarHBondContact O-CG2 3.2Å; V704-V708 PolarHBondContact O-N 2.96Å; D705-V708 PolarHBondContact O-N 3.21Å; V708-N712 VanDerWaalsContact O-CB 3.24Å; V708-N712 WeakPolarHBondContact O-CB 3.45Å; V708-N712 PolarHBondContact O-N 3.21Å; V708-N712 PolarHBondContact O-ND2 2.94Å; V708-F724 HydrophobicContact CB-CB 4.48Å; V708-F724 HydrophobicContact CG1-CB 3.95Å; V708-F724 WeakPolarHBondContact CG1-O 3.21Å; V708-F724 HydrophobicContact CG2-CB 4.27Å; V708-L726 HydrophobicContact CG2-CG 4.43Å; V708-V742 HydrophobicContact CG2-CG1 4.35Å; V708-F760 HydrophobicContact CG2-CD1 4.5Å; V708-F760 HydrophobicContact CG2-CE1 3.8Å; V708-F760 HydrophobicContact CG2-CZ 4.07Å
709	L	57.1	Low	56.4	Low	111 Å²	111	49.3 Å²	49.3	58%	0.581	28%	0.283	S	S	*	.	H	α-helix	trans	-67	-44.5	175.3	-73.7	169.7	0	0	0	112.3	D705 F706 N712 S713	D705-L709 WeakPolarHBondContact O-CB 3.03Å; D705-L709 VanDerWaalsContact O-CG 3.26Å; D705-L709 WeakPolarHBondContact O-CG 3.17Å; D705-L709 PolarHBondContact O-N 3.02Å; F706-L709 PolarHBondContact O-N 3.16Å; L709-N712 PolarHBondContact O-N 2.92Å; L709-S713 VanDerWaalsContact O-CB 3.3Å; L709-S713 WeakPolarHBondContact O-CB 3.48Å; L709-S713 PolarHBondContact O-N 3.41Å
710	E	65.6	Low	58.1	Low	83 Å²	83	49 Å²	49	39%	0.388	27%	0.274	S	S	.	.	H	α-helix	trans	-64	-44.4	176	-168.9	-170.4	-156.4	0	0	110.4	F706 S713 I714 W764	F706-E710 WeakPolarHBondContact O-CB 3.19Å; F706-E710 PolarHBondContact O-N 2.67Å; E710-S713 WeakPolarHBondContact O-CB 3.38Å; E710-S713 PolarHBondContact O-N 3.01Å; E710-I714 HydrophobicContact CG-CD1 4.29Å; E710-I714 WeakPolarHBondContact O-CB 3.49Å; E710-I714 PolarHBondContact O-N 2.93Å; E710-W764 HydrophobicContact CB-CZ2 4.18Å; E710-W764 HydrophobicContact CG-CZ2 3.84Å; E710-W764 PolarHBondContact OE2-NE1 3.3Å
711	A	66.9	Low	59.3	Low	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60.7	-49	175.6	0	0	0	0	0	111.5	M707 S713 I714 M715 F724 F760 W764	M707-A711 WeakPolarHBondContact O-CA 3.45Å; M707-A711 WeakPolarHBondContact O-CB 3.36Å; M707-A711 PolarHBondContact O-N 3.11Å; A711-S713 VanDerWaalsContact C-N 3.31Å; A711-S713 PolarHBondContact O-N 3.11Å; A711-I714 PolarHBondContact O-N 3.06Å; A711-M715 VanDerWaalsContact O-CG 3.27Å; A711-M715 WeakPolarHBondContact O-CG 3.49Å; A711-M715 PolarHBondContact O-N 3.48Å; A711-F724 HydrophobicContact CB-CD2 3.56Å; A711-F724 HydrophobicContact CB-CE2 3.67Å; A711-F724 HydrophobicContact CB-CG 4.23Å; A711-F724 HydrophobicContact CB-CZ 4.38Å; A711-F760 HydrophobicContact CB-CE2 4.38Å; A711-F760 HydrophobicContact CB-CZ 3.98Å; A711-W764 VanDerWaalsContact CA-CZ3 3.48Å; A711-W764 HydrophobicContact CB-CD2 3.85Å; A711-W764 HydrophobicContact CB-CE3 3.47Å; A711-W764 VanDerWaalsContact CB-CE3 3.47Å; A711-W764 HydrophobicContact CB-CH2 3.81Å; A711-W764 HydrophobicContact CB-CZ2 4.05Å; A711-W764 HydrophobicContact CB-CZ3 3.47Å; A711-W764 VanDerWaalsContact CB-CZ3 3.47Å
712	N	69.4	Low	60.7	Low	25 Å²	25	45.6 Å²	45.6	13%	0.134	25%	0.254	C	S	.	.	H	α-helix	trans	-61.3	-40.1	175.4	-76.1	-34.9	0	0	0	112.1	V708 L709 I714 M715 E716 R723 F724	V708-N712 VanDerWaalsContact O-CB 3.24Å; V708-N712 WeakPolarHBondContact O-CB 3.45Å; V708-N712 PolarHBondContact O-N 3.21Å; V708-N712 PolarHBondContact O-ND2 2.94Å; L709-N712 PolarHBondContact O-N 2.92Å; N712-I714 VanDerWaalsContact C-N 3.34Å; N712-I714 PolarHBondContact O-N 2.9Å; N712-M715 PolarHBondContact O-N 2.81Å; N712-E716 WeakPolarHBondContact O-CB 3.49Å; N712-E716 VanDerWaalsContact O-CG 3.28Å; N712-E716 WeakPolarHBondContact O-CG 3.4Å; N712-E716 PolarHBondContact O-N 3.37Å; N712-R723 VanDerWaalsContact OD1-CA 3.26Å; N712-R723 WeakPolarHBondContact OD1-CA 3.19Å; N712-F724 PolarHBondContact ND2-O 3.4Å; N712-F724 PolarHBondContact OD1-N 2.97Å
713	S	60.9	Low	62	Low	74 Å²	74	47.6 Å²	47.6	52%	0.517	25%	0.254	S	S	.	.	H	α-helix	trans	-61.5	-41.6	175.2	-175	0	0	0	0	111.8	L709 E710 A711 E716 S717	L709-S713 VanDerWaalsContact O-CB 3.3Å; L709-S713 WeakPolarHBondContact O-CB 3.48Å; L709-S713 PolarHBondContact O-N 3.41Å; E710-S713 WeakPolarHBondContact O-CB 3.38Å; E710-S713 PolarHBondContact O-N 3.01Å; A711-S713 VanDerWaalsContact C-N 3.31Å; A711-S713 PolarHBondContact O-N 3.11Å; S713-E716 PolarHBondContact O-N 3.07Å; S713-S717 WeakPolarHBondContact O-CB 3.23Å; S713-S717 PolarHBondContact O-N 3.45Å
714	I	62.5	Low	63.2	Low	17 Å²	17	46 Å²	46	9%	0.087	24%	0.24	C	C	.	.	H	α-helix	trans	-72.2	-42.2	177.9	-77.9	172.5	0	0	0	112	E710 A711 N712 E716 S717 S718 W764 L768 H771 F779	E710-I714 HydrophobicContact CG-CD1 4.29Å; E710-I714 WeakPolarHBondContact O-CB 3.49Å; E710-I714 PolarHBondContact O-N 2.93Å; A711-I714 PolarHBondContact O-N 3.06Å; N712-I714 VanDerWaalsContact C-N 3.34Å; N712-I714 PolarHBondContact O-N 2.9Å; I714-E716 VanDerWaalsContact C-N 3.26Å; I714-E716 PolarHBondContact O-N 3.19Å; I714-S717 WeakPolarHBondContact CA-OG 3.01Å; I714-S717 PolarHBondContact O-N 2.58Å; I714-S717 PolarHBondContact O-OG 3.19Å; I714-S718 VanDerWaalsContact O-CB 3.31Å; I714-S718 WeakPolarHBondContact O-CB 3.16Å; I714-S718 PolarHBondContact O-N 3.05Å; I714-S718 PolarHBondContact O-OG 3.42Å; I714-W764 HydrophobicContact CB-CH2 3.81Å; I714-W764 HydrophobicContact CD1-CH2 3.47Å; I714-W764 VanDerWaalsContact CD1-CH2 3.47Å; I714-W764 HydrophobicContact CD1-CZ2 3.7Å; I714-W764 HydrophobicContact CG1-CH2 4.14Å; I714-W764 HydrophobicContact CG2-CH2 4.02Å; I714-L768 HydrophobicContact CD1-CD1 3.42Å; I714-L768 VanDerWaalsContact CD1-CD1 3.42Å; I714-H771 HydrophobicContact CG2-CB 4.15Å; I714-F779 HydrophobicContact CG2-CE2 4.35Å; I714-F779 HydrophobicContact CG2-CZ 4.02Å
715	M	69.8	Low	63.9	Low	1 Å²	1	47.4 Å²	47.4	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-57.5	-45	172.7	-67.5	-51.2	122.1	0	0	110.3	A711 N712 S718 N719 D720 F722 F724 W764 L767 F779 L783	A711-M715 VanDerWaalsContact O-CG 3.27Å; A711-M715 WeakPolarHBondContact O-CG 3.49Å; A711-M715 PolarHBondContact O-N 3.48Å; N712-M715 PolarHBondContact O-N 2.81Å; M715-S718 CarbonylContact O-C 3.52Å; M715-S718 PolarHBondContact O-N 2.94Å; M715-N719 PolarHBondContact O-N 2.89Å; M715-D720 PolarHBondContact O-N 2.82Å; M715-D720 HydrophobicContact SD-CB 4.18Å; M715-F722 WeakPolarHBondContact CB-O 3.4Å; M715-F722 WeakPolarHBondContact CG-O 3.31Å; M715-F724 HydrophobicContact CE-CE2 3.96Å; M715-F724 HydrophobicContact CE-CZ 4.35Å; M715-F724 HydrophobicContact CG-CD2 4.35Å; M715-F724 HydrophobicContact CG-CE2 3.71Å; M715-F724 HydrophobicContact SD-CE2 4.22Å; M715-W764 HydrophobicContact CE-CZ3 4.04Å; M715-L767 HydrophobicContact CE-CD1 4.33Å; M715-F779 HydrophobicContact CE-CE1 4.14Å; M715-F779 HydrophobicContact CE-CE2 4.23Å; M715-F779 HydrophobicContact CE-CZ 3.39Å; M715-F779 HydrophobicContact SD-CE1 4.35Å; M715-F779 HydrophobicContact SD-CZ 4.16Å; M715-L783 HydrophobicContact CE-CD1 3.93Å; M715-L783 HydrophobicContact SD-CD1 3.6Å; M715-L783 VanDerWaalsContact SD-CD1 3.6Å; M715-L783 HydrophobicContact SD-CD2 4.34Å
716	E	60.2	Low	64.2	Low	44 Å²	44	46.4 Å²	46.4	21%	0.206	25%	0.246	C	C	.	.	H	α-helix	trans	-61.1	-47.8	175.5	-82.2	-170.8	-174.6	0	0	111	Q680 N712 S713 I714 S718 N719 R723	Q680-E716 VanDerWaalsContact CD-O 3.29Å; Q680-E716 HydrophobicContact CG-CB 3.95Å; Q680-E716 HydrophobicContact CG-CG 4.15Å; Q680-E716 PolarHBondContact NE2-O 3.26Å; N712-E716 WeakPolarHBondContact O-CB 3.49Å; N712-E716 VanDerWaalsContact O-CG 3.28Å; N712-E716 WeakPolarHBondContact O-CG 3.4Å; N712-E716 PolarHBondContact O-N 3.37Å; S713-E716 PolarHBondContact O-N 3.07Å; I714-E716 VanDerWaalsContact C-N 3.26Å; I714-E716 PolarHBondContact O-N 3.19Å; E716-S718 VanDerWaalsContact C-N 3.26Å; E716-S718 PolarHBondContact O-N 3.21Å; E716-N719 PolarHBondContact O-N 3.08Å; E716-N719 VanDerWaalsContact O-N 3.12Å; E716-R723 IonicContact OE1-CZ 2.84Å; E716-R723 IonicContact OE1-NE 2.78Å; E716-R723 IonicContact OE1-NH2 3.07Å; E716-R723 PolarHBondContact OE1-NH2 2.8Å
717	S	57.7	Low	64.4	Low	57 Å²	57	42.5 Å²	42.5	40%	0.399	23%	0.234	S	C	.	.	H	α-helix	trans	-65.9	-26.3	177.6	79.1	0	0	0	0	114.1	S713 I714 N719 R776	S713-S717 WeakPolarHBondContact O-CB 3.23Å; S713-S717 PolarHBondContact O-N 3.45Å; I714-S717 WeakPolarHBondContact CA-OG 3.01Å; I714-S717 PolarHBondContact O-N 2.58Å; I714-S717 PolarHBondContact O-OG 3.19Å; S717-N719 VanDerWaalsContact C-N 3.34Å; S717-R776 PolarHBondContact O-NH2 3.08Å
718	S	63.2	Low	64	Low	13 Å²	13	48.7 Å²	48.7	9%	0.091	27%	0.268	C	S	.	.	H	α-helix	trans	-88.3	-7.9	177.2	-57.6	0	0	0	0	112.7	I714 M715 E716 D720 H771	I714-S718 VanDerWaalsContact O-CB 3.31Å; I714-S718 WeakPolarHBondContact O-CB 3.16Å; I714-S718 PolarHBondContact O-N 3.05Å; I714-S718 PolarHBondContact O-OG 3.42Å; M715-S718 CarbonylContact O-C 3.52Å; M715-S718 PolarHBondContact O-N 2.94Å; E716-S718 VanDerWaalsContact C-N 3.26Å; E716-S718 PolarHBondContact O-N 3.21Å; S718-D720 WeakPolarHBondContact CB-OD2 3.45Å; S718-D720 PolarHBondContact O-N 3.2Å; S718-H771 PolarHBondContact OG-CE1 3.33Å; S718-H771 VanDerWaalsContact OG-CE1 3.22Å; S718-H771 PolarHBondContact OG-ND1 2.82Å
719	N	64.7	Low	62.9	Low	115 Å²	115	57.5 Å²	57.5	62%	0.615	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	29.3	-177.3	-137.9	17.1	0	0	0	112.9	M715 E716 S717	M715-N719 PolarHBondContact O-N 2.89Å; E716-N719 PolarHBondContact O-N 3.08Å; E716-N719 VanDerWaalsContact O-N 3.12Å; S717-N719 VanDerWaalsContact C-N 3.34Å
720	D	67.9	Low	62	Low	24 Å²	24	57 Å²	57	13%	0.128	31%	0.307	C	S	.	.			trans	-84.3	141.9	177.4	-76.7	-70.4	0	0	0	110.6	M715 S718 F722 F779	M715-D720 PolarHBondContact O-N 2.82Å; M715-D720 HydrophobicContact SD-CB 4.18Å; S718-D720 WeakPolarHBondContact CB-OD2 3.45Å; S718-D720 PolarHBondContact O-N 3.2Å; D720-F722 HydrophobicContact CB-CD2 4.24Å; D720-F722 PolarHBondContact O-N 3.47Å; D720-F722 VanDerWaalsContact O-N 3.12Å; D720-F779 WeakPolarHBondContact OD2-CE1 3.13Å
721	P	65.2	Low	60.7	Low	35 Å²	35	62.4 Å²	62.4	23%	0.227	33%	0.329	C	S	.	.	S	Bend	trans	-80.5	13.1	-171.9	33.9	-36.9	0	0	0	114.1	N746 L747	P721-N746 WeakPolarHBondContact O-CA 3.38Å; P721-L747 PolarHBondContact O-N 2.88Å
722	F	70	Confident	59.3	Low	8 Å²	8	65.6 Å²	65.6	4%	0.035	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	142.2	-173.7	-55.8	-72.3	0	0	0	111.4	M715 D720 I745 N746 L783 F787 F788	M715-F722 WeakPolarHBondContact CB-O 3.4Å; M715-F722 WeakPolarHBondContact CG-O 3.31Å; D720-F722 HydrophobicContact CB-CD2 4.24Å; D720-F722 PolarHBondContact O-N 3.47Å; D720-F722 VanDerWaalsContact O-N 3.12Å; F722-I745 CarbonylContact C-O 3.5Å; F722-N746 HydrophobicContact CD1-CB 3.82Å; F722-N746 HydrophobicContact CE1-CB 3.95Å; F722-N746 WeakPolarHBondContact CE1-ND2 3.25Å; F722-L783 HydrophobicContact CB-CD2 4.37Å; F722-L783 HydrophobicContact CD2-CD2 3.68Å; F722-L783 HydrophobicContact CE2-CD2 4.11Å; F722-L783 HydrophobicContact CG-CD2 4.09Å; F722-F787 HydrophobicContact CB-CE2 3.94Å; F722-F787 HydrophobicContact CB-CZ 3.98Å; F722-F787 HydrophobicContact CD1-CD1 4.23Å; F722-F787 AromaticContact CD1-CD2 3.63Å; F722-F787 HydrophobicContact CD1-CD2 3.63Å; F722-F787 AromaticContact CD1-CE1 3.74Å; F722-F787 HydrophobicContact CD1-CE1 3.74Å; F722-F787 AromaticContact CD1-CE2 3.05Å; F722-F787 HydrophobicContact CD1-CE2 3.05Å; F722-F787 HydrophobicContact CD1-CG 4.17Å; F722-F787 AromaticContact CD1-CZ 3.1Å; F722-F787 HydrophobicContact CD1-CZ 3.1Å; F722-F787 HydrophobicContact CD2-CD2 4.49Å; F722-F787 HydrophobicContact CD2-CE2 4.03Å; F722-F787 HydrophobicContact CE1-CB 4.4Å; F722-F787 AromaticContact CE1-CD1 3.96Å; F722-F787 HydrophobicContact CE1-CD1 3.96Å; F722-F787 AromaticContact CE1-CD2 3.33Å; F722-F787 HydrophobicContact CE1-CD2 3.33Å; F722-F787 AromaticContact CE1-CE1 3.96Å; F722-F787 HydrophobicContact CE1-CE1 3.96Å; F722-F787 AromaticContact CE1-CE2 3.33Å; F722-F787 HydrophobicContact CE1-CE2 3.33Å; F722-F787 AromaticContact CE1-CG 3.65Å; F722-F787 HydrophobicContact CE1-CG 3.65Å; F722-F787 AromaticContact CE1-CZ 3.64Å; F722-F787 HydrophobicContact CE1-CZ 3.64Å; F722-F787 HydrophobicContact CE2-CD2 4.29Å; F722-F787 HydrophobicContact CE2-CE2 4.28Å; F722-F787 HydrophobicContact CG-CD2 4.17Å; F722-F787 AromaticContact CG-CE2 3.41Å; F722-F787 HydrophobicContact CG-CE2 3.41Å; F722-F787 VanDerWaalsContact CG-CE2 3.41Å; F722-F787 AromaticContact CG-CZ 3.73Å; F722-F787 HydrophobicContact CG-CZ 3.73Å; F722-F787 AromaticContact CZ-CD2 3.71Å; F722-F787 HydrophobicContact CZ-CD2 3.71Å; F722-F787 AromaticContact CZ-CE2 3.95Å; F722-F787 HydrophobicContact CZ-CE2 3.95Å; F722-F787 HydrophobicContact CZ-CG 4.23Å; F722-F788 HydrophobicContact CZ-CE2 4.29Å
723	R	68.8	Low	57.8	Low	108 Å²	108	71.9 Å²	71.9	41%	0.408	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	151.4	170.6	-90.4	-171.8	175	155.3	-0.9	111.3	N712 E716 M744 I745 L747	N712-R723 VanDerWaalsContact OD1-CA 3.26Å; N712-R723 WeakPolarHBondContact OD1-CA 3.19Å; E716-R723 IonicContact OE1-CZ 2.84Å; E716-R723 IonicContact OE1-NE 2.78Å; E716-R723 IonicContact OE1-NH2 3.07Å; E716-R723 PolarHBondContact OE1-NH2 2.8Å; R723-M744 CarbonylContact O-C 3.48Å; R723-M744 WeakPolarHBondContact O-CA 2.93Å; R723-I745 PolarHBondContact N-O 3.26Å; R723-I745 PolarHBondContact O-N 3.32Å; R723-L747 HydrophobicContact CG-CD1 4.38Å
724	F	72.1	Confident	56.7	Low	8 Å²	8	78.2 Å²	78.2	4%	0.035	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	137.1	172	-57.1	-94.7	0	0	0	108.7	V708 A711 N712 M715 V742 M744 F760 L767	V708-F724 HydrophobicContact CB-CB 4.48Å; V708-F724 HydrophobicContact CG1-CB 3.95Å; V708-F724 WeakPolarHBondContact CG1-O 3.21Å; V708-F724 HydrophobicContact CG2-CB 4.27Å; A711-F724 HydrophobicContact CB-CD2 3.56Å; A711-F724 HydrophobicContact CB-CE2 3.67Å; A711-F724 HydrophobicContact CB-CG 4.23Å; A711-F724 HydrophobicContact CB-CZ 4.38Å; N712-F724 PolarHBondContact ND2-O 3.4Å; N712-F724 PolarHBondContact OD1-N 2.97Å; M715-F724 HydrophobicContact CE-CE2 3.96Å; M715-F724 HydrophobicContact CE-CZ 4.35Å; M715-F724 HydrophobicContact CG-CD2 4.35Å; M715-F724 HydrophobicContact CG-CE2 3.71Å; M715-F724 HydrophobicContact SD-CE2 4.22Å; F724-V742 HydrophobicContact CB-CG1 4.15Å; F724-V742 HydrophobicContact CD1-CG1 4.14Å; F724-M744 HydrophobicContact CD1-CE 3.93Å; F724-M744 HydrophobicContact CD1-CG 3.45Å; F724-M744 VanDerWaalsContact CD1-CG 3.45Å; F724-M744 HydrophobicContact CD1-SD 3.87Å; F724-M744 HydrophobicContact CE1-CE 3.07Å; F724-M744 HydrophobicContact CE1-CG 3.64Å; F724-M744 HydrophobicContact CE1-SD 3.4Å; F724-M744 WeakPolarHBondContact CE1-SD 3.45Å; F724-M744 HydrophobicContact CE2-CE 4.45Å; F724-M744 HydrophobicContact CG-CG 4.38Å; F724-M744 HydrophobicContact CZ-CE 3.4Å; F724-M744 HydrophobicContact CZ-SD 4.33Å; F724-F760 AromaticContact CD1-CD2 3.71Å; F724-F760 HydrophobicContact CD1-CD2 3.71Å; F724-F760 AromaticContact CD1-CE2 3.22Å; F724-F760 HydrophobicContact CD1-CE2 3.22Å; F724-F760 HydrophobicContact CD1-CZ 4.08Å; F724-F760 AromaticContact CE1-CD2 3.78Å; F724-F760 HydrophobicContact CE1-CD2 3.78Å; F724-F760 AromaticContact CE1-CE2 3.32Å; F724-F760 HydrophobicContact CE1-CE2 3.32Å; F724-F760 HydrophobicContact CE1-CZ 4.44Å; F724-F760 AromaticContact CG-CE2 3.9Å; F724-F760 HydrophobicContact CG-CE2 3.9Å; F724-F760 HydrophobicContact CG-CZ 4.36Å; F724-F760 HydrophobicContact CZ-CE2 4.09Å; F724-L767 HydrophobicContact CZ-CD1 4.38Å
725	A	67.6	Low	55.5	Low	33 Å²	33	81.3 Å²	81.3	27%	0.273	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	146.9	175.4	0	0	0	0	0	109.4	V742 K743 I745	A725-V742 CarbonylContact O-C 3.43Å; A725-V742 WeakPolarHBondContact O-CA 3.46Å; A725-K743 PolarHBondContact N-O 3.23Å; A725-K743 PolarHBondContact O-N 3.36Å; A725-I745 HydrophobicContact CB-CD1 4.22Å
726	L	61.6	Low	53.9	Low	58 Å²	58	87.7 Å²	87.7	30%	0.304	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	128	169.9	-70.5	166.6	0	0	0	109.2	V704 D705 V708 L740 V742	V704-L726 HydrophobicContact CG1-CD2 3.87Å; D705-L726 WeakPolarHBondContact OD1-CD1 3.43Å; V708-L726 HydrophobicContact CG2-CG 4.43Å; L726-L740 HydrophobicContact CD2-CB 4.22Å; L726-L740 HydrophobicContact CD2-CD2 4.25Å; L726-V742 HydrophobicContact CD2-CG2 3.91Å
727	C	55.5	Low	53.1	Low	48 Å²	48	90.7 Å²	90.7	32%	0.324	49%	0.487	S	S	.	.			trans	-89.6	154.5	167.6	-79.3	0	0	0	0	110.9	T741 K743	C727-T741 HydrophobicContact CB-CG2 3.87Å; C727-T741 PolarHBondContact N-O 2.89Å; C727-K743 WeakPolarHBondContact SG-CB 3.09Å
728	D	50.7	Low	52.4	Low	152 Å²	152	92.1 Å²	92.1	81%	0.813	49%	0.49	S	S	*	.			trans	-44.2	143.2	-167.3	-76	-44.5	0	0	0	114.6	V730	D728-V730 VanDerWaalsContact C-N 3.26Å; D728-V730 PolarHBondContact O-N 3.44Å
729	K	43.5	Very low	51.3	Low	193 Å²	193	94.5 Å²	94.5	84%	0.839	51%	0.506	S	S	*	.			trans	-56.5	85.7	174.9	-61	-179.3	-179	-175.7	0	109.5	K731	K729-K731 PolarHBondContact O-N 2.91Å
730	V	37.9	Very low	50.4	Low	102 Å²	102	90 Å²	90	62%	0.618	48%	0.482	S	S	*	.			trans	-57	127	167.6	-178.9	0	0	0	0	105.6	D728 V732	D728-V730 VanDerWaalsContact C-N 3.26Å; D728-V730 PolarHBondContact O-N 3.44Å; V730-V732 WeakPolarHBondContact O-CG2 3.4Å; V730-V732 PolarHBondContact O-N 2.95Å
731	K	39.1	Very low	49.5	Very low	196 Å²	196	90.3 Å²	90.3	85%	0.852	49%	0.485	S	S	*	.			trans	-54.2	103.8	176.9	-73.3	178.9	175.5	-179.7	0	107.2	K729 E733	K729-K731 PolarHBondContact O-N 2.91Å; K731-E733 PolarHBondContact O-N 2.93Å
732	V	38.3	Very low	48.8	Very low	66 Å²	66	88.6 Å²	88.6	40%	0.4	47%	0.474	S	S	.	.			trans	-73.2	115.8	177.1	-176.6	0	0	0	0	106.2	V730 E736 L738	V730-V732 WeakPolarHBondContact O-CG2 3.4Å; V730-V732 PolarHBondContact O-N 2.95Å; V732-E736 HydrophobicContact CG1-CB 4.33Å; V732-E736 VanDerWaalsContact CG1-O 3.25Å; V732-E736 WeakPolarHBondContact CG1-O 3.44Å; V732-L738 HydrophobicContact CG2-CD1 4.3Å; V732-L738 HydrophobicContact CG2-CG 4.42Å
733	E	37.5	Very low	48.3	Very low	157 Å²	157	91.2 Å²	91.2	73%	0.734	49%	0.485	S	S	*	.			trans	-70.4	150.4	168.8	-68.2	-172.3	167.9	0	0	109.6	K731 G735 E736	K731-E733 PolarHBondContact O-N 2.93Å; E733-G735 PolarHBondContact O-N 2.8Å; E733-G735 VanDerWaalsContact O-N 3.12Å; E733-E736 PolarHBondContact O-N 3.13Å
734	E	36.9	Very low	47.8	Very low	207 Å²	207	86.2 Å²	86.2	97%	0.967	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	118.3	-178.6	-76.5	-179.4	152.2	0	0	111.1
735	G	37.3	Very low	47.1	Very low	83 Å²	83	88.3 Å²	88.3	86%	0.856	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	110.8	-12.7	173.6	0	0	0	0	0	115.5	E733	E733-G735 PolarHBondContact O-N 2.8Å; E733-G735 VanDerWaalsContact O-N 3.12Å
736	E	37.2	Very low	46.7	Very low	135 Å²	135	87.2 Å²	87.2	63%	0.631	47%	0.467	S	S	*	.	S	Bend	trans	-88.7	139.5	171.2	-70.7	-163.7	157.4	0	0	111.8	V732 E733	V732-E736 HydrophobicContact CG1-CB 4.33Å; V732-E736 VanDerWaalsContact CG1-O 3.25Å; V732-E736 WeakPolarHBondContact CG1-O 3.44Å; E733-E736 PolarHBondContact O-N 3.13Å
737	P	41.6	Very low	46.3	Very low	106 Å²	106	87.7 Å²	87.7	69%	0.688	47%	0.47	S	S	*	.			trans	-61.8	141.1	174.4	26.2	-32.3	0	0	0	109.8	C739	P737-C739 PolarHBondContact O-N 2.99Å; P737-C739 PolarHBondContact O-SG 2.81Å
738	L	42.9	Very low	46.1	Very low	88 Å²	88	86.3 Å²	86.3	46%	0.461	46%	0.46	S	S	.	.			trans	-55.3	96.3	-176.1	-156.1	104.7	0	0	0	110.8	I701 V732 L740	I701-L738 HydrophobicContact CD1-CD2 3.85Å; I701-L738 HydrophobicContact CG1-CD2 3.67Å; V732-L738 HydrophobicContact CG2-CD1 4.3Å; V732-L738 HydrophobicContact CG2-CG 4.42Å; L738-L740 VanDerWaalsContact C-N 3.28Å; L738-L740 HydrophobicContact CD2-CD1 3.75Å; L738-L740 HydrophobicContact CD2-CG 3.76Å; L738-L740 PolarHBondContact O-N 2.87Å
739	C	41.1	Very low	46.1	Very low	63 Å²	63	82.1 Å²	82.1	43%	0.426	44%	0.437	S	S	.	.			trans	-81	77.1	179.9	-79.3	0	0	0	0	109.8	P737 T741	P737-C739 PolarHBondContact O-N 2.99Å; P737-C739 PolarHBondContact O-SG 2.81Å; C739-T741 PolarHBondContact O-N 3.37Å; C739-T741 VanDerWaalsContact O-N 3.14Å
740	L	45.8	Very low	46.4	Very low	20 Å²	20	79.8 Å²	79.8	11%	0.105	43%	0.433	C	S	.	.			trans	-70.9	106.9	163.1	-76.9	166.2	0	0	0	107.5	I701 V704 L726 L738 V742 P756 A757	I701-L740 HydrophobicContact CG1-CD1 4.17Å; V704-L740 HydrophobicContact CB-CD1 4.31Å; V704-L740 HydrophobicContact CG1-CD1 4.31Å; V704-L740 HydrophobicContact CG2-CD1 4.41Å; L726-L740 HydrophobicContact CD2-CB 4.22Å; L726-L740 HydrophobicContact CD2-CD2 4.25Å; L738-L740 VanDerWaalsContact C-N 3.28Å; L738-L740 HydrophobicContact CD2-CD1 3.75Å; L738-L740 HydrophobicContact CD2-CG 3.76Å; L738-L740 PolarHBondContact O-N 2.87Å; L740-V742 PolarHBondContact O-N 3.23Å; L740-P756 CarbonylContact O-C 3.6Å; L740-A757 HydrophobicContact CB-CB 3.66Å; L740-A757 HydrophobicContact CD1-CB 4.22Å; L740-A757 PolarHBondContact O-N 3.23Å
741	T	48.9	Very low	47.1	Very low	30 Å²	30	77 Å²	77	18%	0.184	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	107.1	174.9	-67.6	0	0	0	0	108.5	C727 C739 V754	C727-T741 HydrophobicContact CB-CG2 3.87Å; C727-T741 PolarHBondContact N-O 2.89Å; C739-T741 PolarHBondContact O-N 3.37Å; C739-T741 VanDerWaalsContact O-N 3.14Å; T741-V754 HydrophobicContact CG2-CB 3.74Å; T741-V754 HydrophobicContact CG2-CG1 3.21Å; T741-V754 HydrophobicContact CG2-CG2 3.55Å
742	V	51.3	Low	48.1	Very low	0 Å²	0	70.5 Å²	70.5	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	115.8	170.2	-175.2	0	0	0	0	107.4	V704 V708 F724 A725 L726 L740 I753 M755 F760	V704-V742 HydrophobicContact CG1-CG2 4.39Å; V708-V742 HydrophobicContact CG2-CG1 4.35Å; F724-V742 HydrophobicContact CB-CG1 4.15Å; F724-V742 HydrophobicContact CD1-CG1 4.14Å; A725-V742 CarbonylContact O-C 3.43Å; A725-V742 WeakPolarHBondContact O-CA 3.46Å; L726-V742 HydrophobicContact CD2-CG2 3.91Å; L740-V742 PolarHBondContact O-N 3.23Å; V742-I753 VanDerWaalsContact O-O 3.1Å; V742-M755 HydrophobicContact CB-CG 4.27Å; V742-M755 PolarHBondContact N-O 2.99Å; V742-M755 PolarHBondContact O-N 3.49Å; V742-M755 VanDerWaalsContact O-N 3.09Å; V742-F760 HydrophobicContact CB-CB 4.35Å; V742-F760 HydrophobicContact CB-CG 4.43Å; V742-F760 HydrophobicContact CG1-CD2 4.26Å; V742-F760 HydrophobicContact CG1-CG 4.28Å; V742-F760 HydrophobicContact CG2-CB 4Å; V742-F760 HydrophobicContact CG2-CD1 4.14Å; V742-F760 HydrophobicContact CG2-CG 4.07Å
743	K	59.3	Low	49.3	Very low	63 Å²	63	68.7 Å²	68.7	27%	0.274	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	117.6	172.2	-173.1	-178.7	-176.6	-176.7	0	109.3	A725 C727 I745 I753	A725-K743 PolarHBondContact N-O 3.23Å; A725-K743 PolarHBondContact O-N 3.36Å; C727-K743 WeakPolarHBondContact SG-CB 3.09Å; K743-I745 HydrophobicContact CD-CG1 4.29Å; K743-I745 HydrophobicContact CG-CG1 4.14Å; K743-I753 WeakPolarHBondContact CA-O 3.4Å
744	M	57.2	Low	50.6	Low	2 Å²	2	65.6 Å²	65.6	1%	0.01	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	122.9	173.4	-62.7	178	64.8	0	0	110.1	R723 F724 S752 I753 M755 L783 I786 F787	R723-M744 CarbonylContact O-C 3.48Å; R723-M744 WeakPolarHBondContact O-CA 2.93Å; F724-M744 HydrophobicContact CD1-CE 3.93Å; F724-M744 HydrophobicContact CD1-CG 3.45Å; F724-M744 VanDerWaalsContact CD1-CG 3.45Å; F724-M744 HydrophobicContact CD1-SD 3.87Å; F724-M744 HydrophobicContact CE1-CE 3.07Å; F724-M744 HydrophobicContact CE1-CG 3.64Å; F724-M744 HydrophobicContact CE1-SD 3.4Å; F724-M744 WeakPolarHBondContact CE1-SD 3.45Å; F724-M744 HydrophobicContact CE2-CE 4.45Å; F724-M744 HydrophobicContact CG-CG 4.38Å; F724-M744 HydrophobicContact CZ-CE 3.4Å; F724-M744 HydrophobicContact CZ-SD 4.33Å; M744-S752 VanDerWaalsContact O-CA 3.28Å; M744-S752 WeakPolarHBondContact O-CA 3.41Å; M744-I753 PolarHBondContact N-O 3.48Å; M744-I753 PolarHBondContact O-N 2.94Å; M744-M755 HydrophobicContact SD-CE 3.75Å; M744-M755 HydrophobicContact SD-SD 4.17Å; M744-L783 HydrophobicContact CE-CD2 4.38Å; M744-I786 HydrophobicContact CE-CG2 4.33Å; M744-I786 HydrophobicContact SD-CG2 4.18Å; M744-F787 HydrophobicContact CB-CE1 3.77Å; M744-F787 HydrophobicContact CB-CZ 3.58Å; M744-F787 HydrophobicContact CE-CD2 4.31Å; M744-F787 HydrophobicContact CE-CE1 4.35Å; M744-F787 HydrophobicContact CE-CE2 3.33Å; M744-F787 HydrophobicContact CE-CZ 3.37Å; M744-F787 HydrophobicContact CG-CZ 4.46Å; M744-F787 HydrophobicContact SD-CZ 4.33Å
745	I	59.1	Low	51.9	Low	52 Å²	52	56.4 Å²	56.4	27%	0.267	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	122	-173.5	-52.7	171.9	0	0	0	109.2	F722 R723 A725 K743	F722-I745 CarbonylContact C-O 3.5Å; R723-I745 PolarHBondContact N-O 3.26Å; R723-I745 PolarHBondContact O-N 3.32Å; A725-I745 HydrophobicContact CB-CD1 4.22Å; K743-I745 HydrophobicContact CD-CG1 4.29Å; K743-I745 HydrophobicContact CG-CG1 4.14Å
746	N	57.8	Low	53.2	Low	10 Å²	10	54.8 Å²	54.8	5%	0.053	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	123.9	167.8	179.1	-22.3	0	0	0	109.5	P721 F722 S748 M749 I751	P721-N746 WeakPolarHBondContact O-CA 3.38Å; F722-N746 HydrophobicContact CD1-CB 3.82Å; F722-N746 HydrophobicContact CE1-CB 3.95Å; F722-N746 WeakPolarHBondContact CE1-ND2 3.25Å; N746-S748 PolarHBondContact O-N 2.61Å; N746-S748 VanDerWaalsContact OD1-CB 3.29Å; N746-S748 WeakPolarHBondContact OD1-CB 3.43Å; N746-S748 PolarHBondContact OD1-N 3.18Å; N746-M749 CarbonylContact C-O 3.52Å; N746-M749 VanDerWaalsContact CB-O 3.23Å; N746-M749 WeakPolarHBondContact CB-O 3.21Å; N746-M749 CarbonylContact O-C 3.5Å; N746-M749 PolarHBondContact OD1-N 3.42Å; N746-I751 PolarHBondContact N-O 3.22Å
747	L	53.4	Low	54.4	Low	69 Å²	69	48.8 Å²	48.8	36%	0.361	28%	0.279	S	S	.	.	S	Bend	trans	-71.3	-12.9	-174.8	-68	164.3	0	0	0	113.2	N678 P721 R723	N678-L747 WeakPolarHBondContact OD1-CD1 3.29Å; P721-L747 PolarHBondContact O-N 2.88Å; R723-L747 HydrophobicContact CG-CD1 4.38Å
748	S	52.6	Low	55.4	Low	18 Å²	18	47 Å²	47	13%	0.126	27%	0.268	C	S	.	.	S	Bend	trans	-107.1	-21.9	-176.1	-85	0	0	0	0	114.3	R674 R675 C676 N746	R674-S748 CarbonylContact C-O 3.51Å; R675-S748 VanDerWaalsContact CA-CB 3.47Å; R675-S748 VanDerWaalsContact CA-O 3.32Å; R675-S748 WeakPolarHBondContact CA-O 3.36Å; R675-S748 WeakPolarHBondContact CB-OG 3.3Å; C676-S748 VanDerWaalsContact C-OG 3.3Å; C676-S748 PolarHBondContact N-OG 2.9Å; C676-S748 PolarHBondContact O-OG 2.86Å; N746-S748 PolarHBondContact O-N 2.61Å; N746-S748 VanDerWaalsContact OD1-CB 3.29Å; N746-S748 WeakPolarHBondContact OD1-CB 3.43Å; N746-S748 PolarHBondContact OD1-N 3.18Å
749	M	49.5	Very low	56.6	Low	65 Å²	65	44.8 Å²	44.8	32%	0.32	26%	0.257	S	S	.	.	S	Bend	trans	-147.9	136.4	176.5	-67.3	-168.9	-62.2	0	0	107	R675 N746 I751 F788	R675-M749 HydrophobicContact CG-CG 4.47Å; N746-M749 CarbonylContact C-O 3.52Å; N746-M749 VanDerWaalsContact CB-O 3.23Å; N746-M749 WeakPolarHBondContact CB-O 3.21Å; N746-M749 CarbonylContact O-C 3.5Å; N746-M749 PolarHBondContact OD1-N 3.42Å; M749-I751 HydrophobicContact CB-CD1 4.34Å; M749-I751 HydrophobicContact CB-CG1 4.24Å; M749-I751 HydrophobicContact CE-CD1 3.95Å; M749-I751 PolarHBondContact O-N 2.89Å; M749-F788 HydrophobicContact CE-CE1 4.21Å; M749-F788 HydrophobicContact CE-CZ 4.17Å
750	D	48.9	Very low	58	Low	143 Å²	143	41.8 Å²	41.8	77%	0.765	24%	0.237	S	C	*	.			trans	-77	71.8	-176.2	-147.3	3.4	0	0	0	110.5
751	I	54.5	Low	58.9	Low	43 Å²	43	45.8 Å²	45.8	22%	0.221	26%	0.255	C	S	.	.			trans	-101	115.3	171.6	-56.4	172.3	0	0	0	105.5	N746 M749 I753 F787 F788	N746-I751 PolarHBondContact N-O 3.22Å; M749-I751 HydrophobicContact CB-CD1 4.34Å; M749-I751 HydrophobicContact CB-CG1 4.24Å; M749-I751 HydrophobicContact CE-CD1 3.95Å; M749-I751 PolarHBondContact O-N 2.89Å; I751-I753 HydrophobicContact CG2-CG1 4.44Å; I751-F787 HydrophobicContact CG2-CD1 3.96Å; I751-F788 HydrophobicContact CD1-CD1 4.41Å; I751-F788 HydrophobicContact CD1-CE1 3.45Å; I751-F788 VanDerWaalsContact CD1-CE1 3.45Å; I751-F788 HydrophobicContact CD1-CZ 3.83Å
752	S	59.3	Low	59.9	Low	60 Å²	60	48.4 Å²	48.4	42%	0.42	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	114.1	174.9	55.6	0	0	0	0	111.6	M744	M744-S752 VanDerWaalsContact O-CA 3.28Å; M744-S752 WeakPolarHBondContact O-CA 3.41Å
753	I	63.5	Low	61	Low	28 Å²	28	49.2 Å²	49.2	14%	0.144	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	126.9	172.4	-61.4	175.7	0	0	0	107.7	V742 K743 M744 I751 M755 I786 F787	V742-I753 VanDerWaalsContact O-O 3.1Å; K743-I753 WeakPolarHBondContact CA-O 3.4Å; M744-I753 PolarHBondContact N-O 3.48Å; M744-I753 PolarHBondContact O-N 2.94Å; I751-I753 HydrophobicContact CG2-CG1 4.44Å; I753-M755 HydrophobicContact CG2-CE 4.14Å; I753-I786 WeakPolarHBondContact CD1-O 3.45Å; I753-F787 HydrophobicContact CD1-CD1 3.87Å; I753-F787 HydrophobicContact CD1-CG 4.39Å; I753-F787 HydrophobicContact CG1-CD1 4.46Å
754	V	63.6	Low	61.6	Low	92 Å²	92	46.6 Å²	46.6	56%	0.558	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.6	122.3	171.9	155.1	0	0	0	0	107.2	T741	T741-V754 HydrophobicContact CG2-CB 3.74Å; T741-V754 HydrophobicContact CG2-CG1 3.21Å; T741-V754 HydrophobicContact CG2-CG2 3.55Å
755	M	65.4	Low	62	Low	14 Å²	14	49 Å²	49	7%	0.069	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	151.1	173.4	63.1	178.1	54.8	0	0	112.1	V742 M744 I753 F760 I786	V742-M755 HydrophobicContact CB-CG 4.27Å; V742-M755 PolarHBondContact N-O 2.99Å; V742-M755 PolarHBondContact O-N 3.49Å; V742-M755 VanDerWaalsContact O-N 3.09Å; M744-M755 HydrophobicContact SD-CE 3.75Å; M744-M755 HydrophobicContact SD-SD 4.17Å; I753-M755 HydrophobicContact CG2-CE 4.14Å; M755-F760 HydrophobicContact CG-CB 4.26Å; M755-F760 HydrophobicContact SD-CB 3.89Å; M755-F760 HydrophobicContact SD-CD2 4.5Å; M755-I786 HydrophobicContact CE-CG2 3.89Å
756	P	64.8	Low	62.7	Low	49 Å²	49	46.9 Å²	46.9	32%	0.318	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	149.6	170.6	-20.3	32.2	0	0	0	112	L740 S758 D759 F760	L740-P756 CarbonylContact O-C 3.6Å; P756-S758 VanDerWaalsContact C-N 3.25Å; P756-S758 PolarHBondContact O-N 3.46Å; P756-D759 PolarHBondContact O-N 3.07Å; P756-D759 VanDerWaalsContact O-N 3.09Å; P756-F760 PolarHBondContact O-N 3.06Å
757	A	61.4	Low	63.5	Low	10 Å²	10	46.4 Å²	46.4	8%	0.083	27%	0.267	C	S	.	.	H	α-helix	trans	-59	-32.8	177.4	0	0	0	0	0	114	V704 L740 D759 F760 Q761	V704-A757 HydrophobicContact CG1-CB 4.25Å; V704-A757 HydrophobicContact CG2-CB 3.79Å; L740-A757 HydrophobicContact CB-CB 3.66Å; L740-A757 HydrophobicContact CD1-CB 4.22Å; L740-A757 PolarHBondContact O-N 3.23Å; A757-D759 VanDerWaalsContact C-N 3.34Å; A757-F760 PolarHBondContact O-N 3.42Å; A757-Q761 WeakPolarHBondContact O-CB 3.12Å; A757-Q761 PolarHBondContact O-N 2.83Å
758	S	63.6	Low	64.2	Low	68 Å²	68	44.8 Å²	44.8	48%	0.476	26%	0.258	S	S	.	.	H	α-helix	trans	-60	-46.4	173.7	53.7	0	0	0	0	111.4	P756 F760 Q761 D762	P756-S758 VanDerWaalsContact C-N 3.25Å; P756-S758 PolarHBondContact O-N 3.46Å; S758-F760 VanDerWaalsContact C-N 3.35Å; S758-Q761 WeakPolarHBondContact O-CB 3.45Å; S758-Q761 PolarHBondContact O-N 3.24Å; S758-D762 PolarHBondContact O-N 2.89Å; S758-D762 VanDerWaalsContact O-N 3.16Å
759	D	67.2	Low	64.9	Low	41 Å²	41	44.8 Å²	44.8	22%	0.219	26%	0.26	C	S	.	.	H	α-helix	trans	-68.7	-39.5	-179.5	-65.9	12.3	0	0	0	109.9	P756 A757 Q761 D762 H763	P756-D759 PolarHBondContact O-N 3.07Å; P756-D759 VanDerWaalsContact O-N 3.09Å; A757-D759 VanDerWaalsContact C-N 3.34Å; D759-Q761 VanDerWaalsContact C-N 3.28Å; D759-Q761 PolarHBondContact O-N 3.35Å; D759-D762 PolarHBondContact O-N 2.79Å; D759-H763 PolarHBondContact O-N 3.48Å; D759-H763 PolarHBondContact O-ND1 3.07Å
760	F	70.2	Confident	66	Low	1 Å²	1	42 Å²	42	0%	0.004	25%	0.246	C	C	.	.	H	α-helix	trans	-59.2	-41.2	172.6	170.6	-111.9	0	0	0	111.5	V704 M707 V708 A711 F724 V742 M755 P756 A757 S758 D762 H763 W764	V704-F760 HydrophobicContact CG1-CD1 4.45Å; M707-F760 HydrophobicContact CB-CE1 3.74Å; M707-F760 HydrophobicContact CB-CZ 4.32Å; M707-F760 HydrophobicContact CE-CD1 4.18Å; M707-F760 HydrophobicContact CE-CE1 4.03Å; V708-F760 HydrophobicContact CG2-CD1 4.5Å; V708-F760 HydrophobicContact CG2-CE1 3.8Å; V708-F760 HydrophobicContact CG2-CZ 4.07Å; A711-F760 HydrophobicContact CB-CE2 4.38Å; A711-F760 HydrophobicContact CB-CZ 3.98Å; F724-F760 AromaticContact CD1-CD2 3.71Å; F724-F760 HydrophobicContact CD1-CD2 3.71Å; F724-F760 AromaticContact CD1-CE2 3.22Å; F724-F760 HydrophobicContact CD1-CE2 3.22Å; F724-F760 HydrophobicContact CD1-CZ 4.08Å; F724-F760 AromaticContact CE1-CD2 3.78Å; F724-F760 HydrophobicContact CE1-CD2 3.78Å; F724-F760 AromaticContact CE1-CE2 3.32Å; F724-F760 HydrophobicContact CE1-CE2 3.32Å; F724-F760 HydrophobicContact CE1-CZ 4.44Å; F724-F760 AromaticContact CG-CE2 3.9Å; F724-F760 HydrophobicContact CG-CE2 3.9Å; F724-F760 HydrophobicContact CG-CZ 4.36Å; F724-F760 HydrophobicContact CZ-CE2 4.09Å; V742-F760 HydrophobicContact CB-CB 4.35Å; V742-F760 HydrophobicContact CB-CG 4.43Å; V742-F760 HydrophobicContact CG1-CD2 4.26Å; V742-F760 HydrophobicContact CG1-CG 4.28Å; V742-F760 HydrophobicContact CG2-CB 4Å; V742-F760 HydrophobicContact CG2-CD1 4.14Å; V742-F760 HydrophobicContact CG2-CG 4.07Å; M755-F760 HydrophobicContact CG-CB 4.26Å; M755-F760 HydrophobicContact SD-CB 3.89Å; M755-F760 HydrophobicContact SD-CD2 4.5Å; P756-F760 PolarHBondContact O-N 3.06Å; A757-F760 PolarHBondContact O-N 3.42Å; S758-F760 VanDerWaalsContact C-N 3.35Å; F760-D762 VanDerWaalsContact C-N 3.35Å; F760-D762 PolarHBondContact O-N 3.22Å; F760-H763 PolarHBondContact O-N 2.85Å; F760-W764 HydrophobicContact CE1-CB 4.5Å; F760-W764 HydrophobicContact CE2-CB 4.17Å; F760-W764 HydrophobicContact CZ-CB 4.14Å; F760-W764 HydrophobicContact CZ-CG 4.24Å; F760-W764 WeakPolarHBondContact O-CB 3.37Å; F760-W764 PolarHBondContact O-N 3.26Å
761	Q	65.4	Low	66.9	Low	103 Å²	103	37.7 Å²	37.7	48%	0.481	22%	0.221	S	C	.	.	H	α-helix	trans	-61	-42.8	178.7	-176.2	172	7.3	0	0	112.7	M707 A757 S758 D759 W764 A765	M707-Q761 HydrophobicContact CE-CB 3.58Å; M707-Q761 HydrophobicContact CE-CG 3.55Å; M707-Q761 HydrophobicContact SD-CG 4.32Å; A757-Q761 WeakPolarHBondContact O-CB 3.12Å; A757-Q761 PolarHBondContact O-N 2.83Å; S758-Q761 WeakPolarHBondContact O-CB 3.45Å; S758-Q761 PolarHBondContact O-N 3.24Å; D759-Q761 VanDerWaalsContact C-N 3.28Å; D759-Q761 PolarHBondContact O-N 3.35Å; Q761-W764 PolarHBondContact O-N 3.2Å; Q761-A765 WeakPolarHBondContact O-CB 3.38Å; Q761-A765 PolarHBondContact O-N 3.32Å
762	D	70.4	Confident	67.4	Low	85 Å²	85	42 Å²	42	46%	0.455	24%	0.24	S	C	.	.	H	α-helix	trans	-64.9	-47.1	176.2	-71.5	-18.5	0	0	0	111.7	S758 D759 F760 W764 A765 V766	S758-D762 PolarHBondContact O-N 2.89Å; S758-D762 VanDerWaalsContact O-N 3.16Å; D759-D762 PolarHBondContact O-N 2.79Å; F760-D762 VanDerWaalsContact C-N 3.35Å; F760-D762 PolarHBondContact O-N 3.22Å; D762-W764 VanDerWaalsContact C-N 3.29Å; D762-W764 PolarHBondContact O-N 3.26Å; D762-A765 PolarHBondContact O-N 3.43Å; D762-V766 WeakPolarHBondContact O-CG2 3.47Å; D762-V766 PolarHBondContact O-N 3.16Å
763	H	73.4	Confident	67.9	Low	18 Å²	18	42 Å²	42	8%	0.083	24%	0.24	C	C	.	.	H	α-helix	trans	-63.2	-38	176.2	-67.9	103.2	0	0	0	111.8	D759 F760 V766 L767 I786	D759-H763 PolarHBondContact O-N 3.48Å; D759-H763 PolarHBondContact O-ND1 3.07Å; F760-H763 PolarHBondContact O-N 2.85Å; H763-V766 PolarHBondContact O-N 3.2Å; H763-L767 WeakPolarHBondContact O-CB 3.34Å; H763-L767 WeakPolarHBondContact O-CG 3.19Å; H763-L767 PolarHBondContact O-N 3.35Å; H763-I786 HydrophobicContact CB-CD1 3.97Å
764	W	72.1	Confident	68.1	Low	7 Å²	7	43.3 Å²	43.3	3%	0.027	26%	0.261	C	S	.	.	H	α-helix	trans	-66.7	-43.6	179.7	-177.3	-122.3	0	0	0	111.7	M707 E710 A711 I714 M715 F760 Q761 D762 V766 L767 L768	M707-W764 HydrophobicContact CE-CB 4.01Å; M707-W764 HydrophobicContact CE-CG 4.13Å; E710-W764 HydrophobicContact CB-CZ2 4.18Å; E710-W764 HydrophobicContact CG-CZ2 3.84Å; E710-W764 PolarHBondContact OE2-NE1 3.3Å; A711-W764 VanDerWaalsContact CA-CZ3 3.48Å; A711-W764 HydrophobicContact CB-CD2 3.85Å; A711-W764 HydrophobicContact CB-CE3 3.47Å; A711-W764 VanDerWaalsContact CB-CE3 3.47Å; A711-W764 HydrophobicContact CB-CH2 3.81Å; A711-W764 HydrophobicContact CB-CZ2 4.05Å; A711-W764 HydrophobicContact CB-CZ3 3.47Å; A711-W764 VanDerWaalsContact CB-CZ3 3.47Å; I714-W764 HydrophobicContact CB-CH2 3.81Å; I714-W764 HydrophobicContact CD1-CH2 3.47Å; I714-W764 VanDerWaalsContact CD1-CH2 3.47Å; I714-W764 HydrophobicContact CD1-CZ2 3.7Å; I714-W764 HydrophobicContact CG1-CH2 4.14Å; I714-W764 HydrophobicContact CG2-CH2 4.02Å; M715-W764 HydrophobicContact CE-CZ3 4.04Å; F760-W764 HydrophobicContact CE1-CB 4.5Å; F760-W764 HydrophobicContact CE2-CB 4.17Å; F760-W764 HydrophobicContact CZ-CB 4.14Å; F760-W764 HydrophobicContact CZ-CG 4.24Å; F760-W764 WeakPolarHBondContact O-CB 3.37Å; F760-W764 PolarHBondContact O-N 3.26Å; Q761-W764 PolarHBondContact O-N 3.2Å; D762-W764 VanDerWaalsContact C-N 3.29Å; D762-W764 PolarHBondContact O-N 3.26Å; W764-V766 VanDerWaalsContact C-N 3.25Å; W764-V766 PolarHBondContact O-N 3.45Å; W764-L767 HydrophobicContact CE3-CB 3.96Å; W764-L767 HydrophobicContact CE3-CD1 4.31Å; W764-L767 HydrophobicContact CZ3-CB 3.98Å; W764-L767 PolarHBondContact O-N 3.47Å; W764-L768 HydrophobicContact CH2-CD1 4.37Å; W764-L768 HydrophobicContact CZ2-CB 4.22Å; W764-L768 HydrophobicContact CZ2-CD1 3.92Å; W764-L768 VanDerWaalsContact O-CB 3.26Å; W764-L768 WeakPolarHBondContact O-CB 3.48Å; W764-L768 PolarHBondContact O-N 2.99Å
765	A	66.6	Low	68.5	Low	52 Å²	52	42.6 Å²	42.6	43%	0.43	25%	0.25	S	S	.	.	H	α-helix	trans	-57	-41	175.6	0	0	0	0	0	111.8	Q761 D762 A769	Q761-A765 WeakPolarHBondContact O-CB 3.38Å; Q761-A765 PolarHBondContact O-N 3.32Å; D762-A765 PolarHBondContact O-N 3.43Å; A765-A769 WeakPolarHBondContact O-CB 3.45Å; A765-A769 PolarHBondContact O-N 3.12Å
766	V	73.6	Confident	68.6	Low	8 Å²	8	49.2 Å²	49.2	5%	0.048	27%	0.274	C	S	.	.	H	α-helix	trans	-69.3	-44.9	176.7	179.8	0	0	0	0	111.6	D762 H763 W764 A769 L770 Y782 A808	D762-V766 WeakPolarHBondContact O-CG2 3.47Å; D762-V766 PolarHBondContact O-N 3.16Å; H763-V766 PolarHBondContact O-N 3.2Å; W764-V766 VanDerWaalsContact C-N 3.25Å; W764-V766 PolarHBondContact O-N 3.45Å; V766-A769 PolarHBondContact O-N 2.87Å; V766-L770 HydrophobicContact CG1-CD1 3.89Å; V766-L770 HydrophobicContact CG1-CG 4.34Å; V766-L770 WeakPolarHBondContact O-CB 3.24Å; V766-L770 VanDerWaalsContact O-CG 3.3Å; V766-L770 WeakPolarHBondContact O-CG 3.32Å; V766-L770 PolarHBondContact O-N 2.96Å; V766-Y782 HydrophobicContact CB-CD1 4.46Å; V766-Y782 HydrophobicContact CB-CE1 3.71Å; V766-Y782 HydrophobicContact CG1-CD1 3.92Å; V766-Y782 HydrophobicContact CG1-CD2 4.14Å; V766-Y782 HydrophobicContact CG1-CE1 3.54Å; V766-Y782 HydrophobicContact CG1-CE2 3.77Å; V766-Y782 HydrophobicContact CG1-CG 4.2Å; V766-Y782 VanDerWaalsContact CG1-CZ 3.47Å; V766-A808 HydrophobicContact CG2-CB 3.57Å
767	L	74.2	Confident	69	Low	1 Å²	1	54.7 Å²	54.7	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-62.5	-43.9	177.8	-76	172.3	0	0	0	111.8	M715 F724 H763 W764 L770 H771 F779 Y782 L783 I786	M715-L767 HydrophobicContact CE-CD1 4.33Å; F724-L767 HydrophobicContact CZ-CD1 4.38Å; H763-L767 WeakPolarHBondContact O-CB 3.34Å; H763-L767 WeakPolarHBondContact O-CG 3.19Å; H763-L767 PolarHBondContact O-N 3.35Å; W764-L767 HydrophobicContact CE3-CB 3.96Å; W764-L767 HydrophobicContact CE3-CD1 4.31Å; W764-L767 HydrophobicContact CZ3-CB 3.98Å; W764-L767 PolarHBondContact O-N 3.47Å; L767-L770 PolarHBondContact O-N 3.12Å; L767-H771 VanDerWaalsContact O-CB 3.28Å; L767-H771 WeakPolarHBondContact O-CB 3.45Å; L767-H771 PolarHBondContact O-N 3.47Å; L767-F779 HydrophobicContact CB-CD2 4.36Å; L767-F779 HydrophobicContact CB-CE2 3.84Å; L767-F779 HydrophobicContact CD2-CD2 3.75Å; L767-F779 HydrophobicContact CD2-CE2 3.66Å; L767-F779 HydrophobicContact CD2-CG 4.35Å; L767-F779 HydrophobicContact CD2-CZ 4.2Å; L767-F779 HydrophobicContact CG-CE2 4.33Å; L767-F779 VanDerWaalsContact O-CD2 3.29Å; L767-F779 WeakPolarHBondContact O-CD2 3.46Å; L767-F779 VanDerWaalsContact O-CE2 3.26Å; L767-F779 WeakPolarHBondContact O-CE2 3.29Å; L767-Y782 HydrophobicContact CD2-CD1 3.78Å; L767-Y782 HydrophobicContact CG-CD1 4.03Å; L767-Y782 HydrophobicContact CG-CE1 4.32Å; L767-L783 HydrophobicContact CD1-CG 4.3Å; L767-L783 HydrophobicContact CD2-CB 4.44Å; L767-L783 HydrophobicContact CD2-CD1 3.98Å; L767-L783 HydrophobicContact CD2-CG 3.76Å; L767-I786 HydrophobicContact CD1-CD1 4.28Å
768	L	67.8	Low	69.7	Low	34 Å²	34	59.4 Å²	59.4	18%	0.178	31%	0.309	C	S	.	.	H	α-helix	trans	-62.1	-45.7	177.1	-174.5	63.2	0	0	0	110.8	I714 W764 L770 H771 Q772	I714-L768 HydrophobicContact CD1-CD1 3.42Å; I714-L768 VanDerWaalsContact CD1-CD1 3.42Å; W764-L768 HydrophobicContact CH2-CD1 4.37Å; W764-L768 HydrophobicContact CZ2-CB 4.22Å; W764-L768 HydrophobicContact CZ2-CD1 3.92Å; W764-L768 VanDerWaalsContact O-CB 3.26Å; W764-L768 WeakPolarHBondContact O-CB 3.48Å; W764-L768 PolarHBondContact O-N 2.99Å; L768-L770 PolarHBondContact O-N 3.44Å; L768-H771 PolarHBondContact O-N 3.49Å; L768-Q772 HydrophobicContact CD1-CG 4.35Å; L768-Q772 VanDerWaalsContact O-CB 3.31Å; L768-Q772 WeakPolarHBondContact O-CB 3.32Å; L768-Q772 VanDerWaalsContact O-CG 3.23Å; L768-Q772 WeakPolarHBondContact O-CG 3.3Å; L768-Q772 PolarHBondContact O-N 3.27Å
769	A	67.7	Low	70.3	Confident	18 Å²	18	56.3 Å²	56.3	15%	0.149	29%	0.287	C	S	.	.	H	α-helix	trans	-61.3	-43.6	175.2	0	0	0	0	0	112.1	A765 V766 S773	A765-A769 WeakPolarHBondContact O-CB 3.45Å; A765-A769 PolarHBondContact O-N 3.12Å; V766-A769 PolarHBondContact O-N 2.87Å; A769-S773 VanDerWaalsContact O-CB 3.3Å; A769-S773 WeakPolarHBondContact O-CB 3.15Å; A769-S773 PolarHBondContact O-N 3.21Å; A769-S773 PolarHBondContact O-OG 3.47Å
770	L	71.6	Confident	70.4	Confident	8 Å²	8	56.1 Å²	56.1	4%	0.042	29%	0.289	C	S	.	.	H	α-helix	trans	-66.1	-40.1	177.2	-73.9	172.6	0	0	0	112.1	V766 L767 L768 S773 G774 K775 R778 F779 Y782 A811	V766-L770 HydrophobicContact CG1-CD1 3.89Å; V766-L770 HydrophobicContact CG1-CG 4.34Å; V766-L770 WeakPolarHBondContact O-CB 3.24Å; V766-L770 VanDerWaalsContact O-CG 3.3Å; V766-L770 WeakPolarHBondContact O-CG 3.32Å; V766-L770 PolarHBondContact O-N 2.96Å; L767-L770 PolarHBondContact O-N 3.12Å; L768-L770 PolarHBondContact O-N 3.44Å; L770-S773 WeakPolarHBondContact CA-OG 3.22Å; L770-S773 PolarHBondContact O-N 3.47Å; L770-S773 PolarHBondContact O-OG 3.05Å; L770-G774 PolarHBondContact O-N 2.9Å; L770-K775 PolarHBondContact O-N 2.77Å; L770-R778 HydrophobicContact CD2-CB 3.94Å; L770-F779 HydrophobicContact CB-CB 4.08Å; L770-F779 HydrophobicContact CB-CD2 4.01Å; L770-Y782 HydrophobicContact CD1-CD1 4.37Å; L770-Y782 HydrophobicContact CD1-CG 4.03Å; L770-A811 HydrophobicContact CD2-CB 4.16Å; L770-A811 HydrophobicContact CG-CB 4.45Å
771	H	69.2	Low	70.5	Confident	52 Å²	52	60.1 Å²	60.1	24%	0.241	31%	0.31	C	S	.	.	H	α-helix	trans	-64.4	-48.9	175.9	-177.1	77.8	0	0	0	111.2	I714 S718 L767 L768 S773 G774 F779	I714-H771 HydrophobicContact CG2-CB 4.15Å; S718-H771 PolarHBondContact OG-CE1 3.33Å; S718-H771 VanDerWaalsContact OG-CE1 3.22Å; S718-H771 PolarHBondContact OG-ND1 2.82Å; L767-H771 VanDerWaalsContact O-CB 3.28Å; L767-H771 WeakPolarHBondContact O-CB 3.45Å; L767-H771 PolarHBondContact O-N 3.47Å; L768-H771 PolarHBondContact O-N 3.49Å; H771-S773 VanDerWaalsContact C-N 3.26Å; H771-S773 PolarHBondContact O-N 2.85Å; H771-G774 WeakPolarHBondContact O-CA 3.41Å; H771-G774 PolarHBondContact O-N 2.83Å; H771-F779 HydrophobicContact CB-CD2 3.97Å; H771-F779 HydrophobicContact CB-CE2 3.77Å
772	Q	65.4	Low	71	Confident	133 Å²	133	55.6 Å²	55.6	62%	0.621	29%	0.289	S	S	*	.	H	α-helix	trans	-63.4	-32.1	177.1	-72.1	175.9	-2.7	0	0	112.2	L768 G774	L768-Q772 HydrophobicContact CD1-CG 4.35Å; L768-Q772 VanDerWaalsContact O-CB 3.31Å; L768-Q772 WeakPolarHBondContact O-CB 3.32Å; L768-Q772 VanDerWaalsContact O-CG 3.23Å; L768-Q772 WeakPolarHBondContact O-CG 3.3Å; L768-Q772 PolarHBondContact O-N 3.27Å; Q772-G774 PolarHBondContact O-N 2.72Å
773	S	69.5	Low	71.2	Confident	59 Å²	59	51.6 Å²	51.6	41%	0.413	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-7.9	172.9	79.1	0	0	0	0	114	A769 L770 H771 K775	A769-S773 VanDerWaalsContact O-CB 3.3Å; A769-S773 WeakPolarHBondContact O-CB 3.15Å; A769-S773 PolarHBondContact O-N 3.21Å; A769-S773 PolarHBondContact O-OG 3.47Å; L770-S773 WeakPolarHBondContact CA-OG 3.22Å; L770-S773 PolarHBondContact O-N 3.47Å; L770-S773 PolarHBondContact O-OG 3.05Å; H771-S773 VanDerWaalsContact C-N 3.26Å; H771-S773 PolarHBondContact O-N 2.85Å; S773-K775 PolarHBondContact O-N 3.43Å; S773-K775 WeakPolarHBondContact OG-CB 3.45Å; S773-K775 WeakPolarHBondContact OG-CG 3.11Å; S773-K775 PolarHBondContact OG-N 3.14Å
774	G	67.8	Low	71.1	Confident	56 Å²	56	53.4 Å²	53.4	58%	0.577	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	4	-177.1	0	0	0	0	0	114.8	L770 H771 Q772 R776	L770-G774 PolarHBondContact O-N 2.9Å; H771-G774 WeakPolarHBondContact O-CA 3.41Å; H771-G774 PolarHBondContact O-N 2.83Å; Q772-G774 PolarHBondContact O-N 2.72Å; G774-R776 PolarHBondContact O-N 3.07Å
775	K	70.7	Confident	71	Confident	77 Å²	77	54.8 Å²	54.8	34%	0.335	29%	0.289	S	S	.	.			trans	-78.5	64.9	-176.9	-64.6	-175	-173.8	-174	0	111.9	L770 S773 K777 R778 F779 E814	L770-K775 PolarHBondContact O-N 2.77Å; S773-K775 PolarHBondContact O-N 3.43Å; S773-K775 WeakPolarHBondContact OG-CB 3.45Å; S773-K775 WeakPolarHBondContact OG-CG 3.11Å; S773-K775 PolarHBondContact OG-N 3.14Å; K775-K777 VanDerWaalsContact C-N 3.28Å; K775-K777 PolarHBondContact O-N 3.22Å; K775-K777 VanDerWaalsContact O-N 3.13Å; K775-R778 HydrophobicContact CB-CB 4.21Å; K775-R778 PolarHBondContact O-N 2.86Å; K775-F779 PolarHBondContact O-N 3.29Å; K775-E814 IonicContact NZ-OE1 2.98Å; K775-E814 IonicContact NZ-OE2 2.88Å; K775-E814 PolarHBondContact NZ-OE2 3.23Å
776	R	68.7	Low	71.1	Confident	153 Å²	153	53.2 Å²	53.2	58%	0.577	27%	0.273	S	S	*	.	H	α-helix	trans	-50.7	-39.3	-176	-89.4	-162.7	164.6	121.6	1	114.9	S717 G774 F779 S780	S717-R776 PolarHBondContact O-NH2 3.08Å; G774-R776 PolarHBondContact O-N 3.07Å; R776-F779 WeakPolarHBondContact O-CB 3.41Å; R776-F779 PolarHBondContact O-N 3.43Å; R776-S780 WeakPolarHBondContact O-CB 3.45Å; R776-S780 PolarHBondContact O-N 2.92Å
777	K	73.3	Confident	70.5	Confident	165 Å²	165	53.6 Å²	53.6	72%	0.717	27%	0.274	S	S	*	.	H	α-helix	trans	-63.5	-48.5	177.7	-170.8	176.6	179.3	179.7	0	111.6	K775 F779 S780 D781	K775-K777 VanDerWaalsContact C-N 3.28Å; K775-K777 PolarHBondContact O-N 3.22Å; K775-K777 VanDerWaalsContact O-N 3.13Å; K777-F779 VanDerWaalsContact C-N 3.34Å; K777-F779 PolarHBondContact O-N 2.85Å; K777-S780 PolarHBondContact O-N 3.35Å; K777-D781 WeakPolarHBondContact O-CB 3.28Å; K777-D781 PolarHBondContact O-N 3.06Å
778	R	75.6	Confident	69.9	Low	109 Å²	109	58 Å²	58	41%	0.411	29%	0.293	S	S	.	.	H	α-helix	trans	-65	-38.3	176	-72.5	-168.3	179.3	166	-1.8	112.2	L770 K775 D781 Y782 E814	L770-R778 HydrophobicContact CD2-CB 3.94Å; K775-R778 HydrophobicContact CB-CB 4.21Å; K775-R778 PolarHBondContact O-N 2.86Å; R778-D781 PolarHBondContact O-N 3.48Å; R778-Y782 VanDerWaalsContact O-CB 3.24Å; R778-Y782 WeakPolarHBondContact O-CB 3.45Å; R778-Y782 PolarHBondContact O-N 3.48Å; R778-E814 IonicContact NH1-OE1 2.66Å; R778-E814 IonicContact NH1-OE2 3.25Å; R778-E814 PolarHBondContact NH1-OE2 3.02Å
779	F	74.9	Confident	69.3	Low	2 Å²	2	59.4 Å²	59.4	1%	0.009	31%	0.309	C	S	.	.	H	α-helix	trans	-57.6	-50.2	173.2	178.6	-92	0	0	0	110.9	I714 M715 D720 L767 L770 H771 K775 R776 K777 Y782 L783	I714-F779 HydrophobicContact CG2-CE2 4.35Å; I714-F779 HydrophobicContact CG2-CZ 4.02Å; M715-F779 HydrophobicContact CE-CE1 4.14Å; M715-F779 HydrophobicContact CE-CE2 4.23Å; M715-F779 HydrophobicContact CE-CZ 3.39Å; M715-F779 HydrophobicContact SD-CE1 4.35Å; M715-F779 HydrophobicContact SD-CZ 4.16Å; D720-F779 WeakPolarHBondContact OD2-CE1 3.13Å; L767-F779 HydrophobicContact CB-CD2 4.36Å; L767-F779 HydrophobicContact CB-CE2 3.84Å; L767-F779 HydrophobicContact CD2-CD2 3.75Å; L767-F779 HydrophobicContact CD2-CE2 3.66Å; L767-F779 HydrophobicContact CD2-CG 4.35Å; L767-F779 HydrophobicContact CD2-CZ 4.2Å; L767-F779 HydrophobicContact CG-CE2 4.33Å; L767-F779 VanDerWaalsContact O-CD2 3.29Å; L767-F779 WeakPolarHBondContact O-CD2 3.46Å; L767-F779 VanDerWaalsContact O-CE2 3.26Å; L767-F779 WeakPolarHBondContact O-CE2 3.29Å; L770-F779 HydrophobicContact CB-CB 4.08Å; L770-F779 HydrophobicContact CB-CD2 4.01Å; H771-F779 HydrophobicContact CB-CD2 3.97Å; H771-F779 HydrophobicContact CB-CE2 3.77Å; K775-F779 PolarHBondContact O-N 3.29Å; R776-F779 WeakPolarHBondContact O-CB 3.41Å; R776-F779 PolarHBondContact O-N 3.43Å; K777-F779 VanDerWaalsContact C-N 3.34Å; K777-F779 PolarHBondContact O-N 2.85Å; F779-Y782 PolarHBondContact O-N 3.43Å; F779-L783 HydrophobicContact CD1-CD1 3.81Å; F779-L783 HydrophobicContact CE1-CD1 3.31Å; F779-L783 HydrophobicContact CZ-CD1 3.77Å; F779-L783 WeakPolarHBondContact O-CB 3.19Å; F779-L783 PolarHBondContact O-N 2.95Å
780	S	69.3	Low	67.9	Low	37 Å²	37	64.1 Å²	64.1	26%	0.259	34%	0.338	S	S	.	.	H	α-helix	trans	-66.5	-41.6	178.6	-163.7	0	0	0	0	112.2	R776 K777 Y782 L783 N784	R776-S780 WeakPolarHBondContact O-CB 3.45Å; R776-S780 PolarHBondContact O-N 2.92Å; K777-S780 PolarHBondContact O-N 3.35Å; S780-Y782 PolarHBondContact O-N 3.43Å; S780-L783 PolarHBondContact O-N 3.45Å; S780-N784 WeakPolarHBondContact O-CB 3.25Å; S780-N784 VanDerWaalsContact O-CG 3.23Å; S780-N784 PolarHBondContact O-N 3.32Å; S780-N784 PolarHBondContact O-ND2 2.97Å
781	D	73.1	Confident	66.3	Low	85 Å²	85	72.6 Å²	72.6	46%	0.455	38%	0.378	S	S	.	.	H	α-helix	trans	-62.3	-42.4	175.5	-66.8	-23	0	0	0	111.2	K777 R778 N784 S785	K777-D781 WeakPolarHBondContact O-CB 3.28Å; K777-D781 PolarHBondContact O-N 3.06Å; R778-D781 PolarHBondContact O-N 3.48Å; D781-N784 PolarHBondContact O-N 3.24Å; D781-S785 WeakPolarHBondContact O-CB 3.4Å; D781-S785 PolarHBondContact O-N 2.96Å
782	Y	76.5	Confident	64.7	Low	9 Å²	9	79.4 Å²	79.4	4%	0.035	41%	0.407	C	S	.	.	H	α-helix	trans	-66.4	-45.7	176.5	-170.1	-100.4	0	0	0	111.3	V766 L767 L770 R778 F779 S780 N784 S785 I786 L804 L807	V766-Y782 HydrophobicContact CB-CD1 4.46Å; V766-Y782 HydrophobicContact CB-CE1 3.71Å; V766-Y782 HydrophobicContact CG1-CD1 3.92Å; V766-Y782 HydrophobicContact CG1-CD2 4.14Å; V766-Y782 HydrophobicContact CG1-CE1 3.54Å; V766-Y782 HydrophobicContact CG1-CE2 3.77Å; V766-Y782 HydrophobicContact CG1-CG 4.2Å; V766-Y782 VanDerWaalsContact CG1-CZ 3.47Å; L767-Y782 HydrophobicContact CD2-CD1 3.78Å; L767-Y782 HydrophobicContact CG-CD1 4.03Å; L767-Y782 HydrophobicContact CG-CE1 4.32Å; L770-Y782 HydrophobicContact CD1-CD1 4.37Å; L770-Y782 HydrophobicContact CD1-CG 4.03Å; R778-Y782 VanDerWaalsContact O-CB 3.24Å; R778-Y782 WeakPolarHBondContact O-CB 3.45Å; R778-Y782 PolarHBondContact O-N 3.48Å; F779-Y782 PolarHBondContact O-N 3.43Å; S780-Y782 PolarHBondContact O-N 3.43Å; Y782-N784 VanDerWaalsContact C-N 3.34Å; Y782-N784 PolarHBondContact O-N 3Å; Y782-S785 WeakPolarHBondContact O-CB 3.4Å; Y782-S785 PolarHBondContact O-N 3.43Å; Y782-S785 VanDerWaalsContact O-N 3.09Å; Y782-S785 PolarHBondContact O-OG 3.41Å; Y782-I786 HydrophobicContact CD1-CD1 4.01Å; Y782-I786 HydrophobicContact CE1-CD1 3.84Å; Y782-I786 HydrophobicContact CE1-CG1 4.42Å; Y782-I786 WeakPolarHBondContact O-CG1 3.4Å; Y782-I786 PolarHBondContact O-N 3.33Å; Y782-I786 VanDerWaalsContact O-N 3.09Å; Y782-L804 HydrophobicContact CD2-CD2 4.32Å; Y782-L804 HydrophobicContact CE2-CB 4.41Å; Y782-L804 HydrophobicContact CE2-CD2 3.78Å; Y782-L807 HydrophobicContact CD2-CB 4.45Å; Y782-L807 HydrophobicContact CE2-CB 4.41Å
783	L	74.8	Confident	63.1	Low	0 Å²	0	82.2 Å²	82.2	0%	0	42%	0.42	C	S	.	.	H	α-helix	trans	-55.2	-48.9	171.8	-112.2	155.8	0	0	0	111.8	M715 F722 M744 L767 F779 S780 S785 I786 F787	M715-L783 HydrophobicContact CE-CD1 3.93Å; M715-L783 HydrophobicContact SD-CD1 3.6Å; M715-L783 VanDerWaalsContact SD-CD1 3.6Å; M715-L783 HydrophobicContact SD-CD2 4.34Å; F722-L783 HydrophobicContact CB-CD2 4.37Å; F722-L783 HydrophobicContact CD2-CD2 3.68Å; F722-L783 HydrophobicContact CE2-CD2 4.11Å; F722-L783 HydrophobicContact CG-CD2 4.09Å; M744-L783 HydrophobicContact CE-CD2 4.38Å; L767-L783 HydrophobicContact CD1-CG 4.3Å; L767-L783 HydrophobicContact CD2-CB 4.44Å; L767-L783 HydrophobicContact CD2-CD1 3.98Å; L767-L783 HydrophobicContact CD2-CG 3.76Å; F779-L783 HydrophobicContact CD1-CD1 3.81Å; F779-L783 HydrophobicContact CE1-CD1 3.31Å; F779-L783 HydrophobicContact CZ-CD1 3.77Å; F779-L783 WeakPolarHBondContact O-CB 3.19Å; F779-L783 PolarHBondContact O-N 2.95Å; S780-L783 PolarHBondContact O-N 3.45Å; L783-S785 VanDerWaalsContact C-N 3.25Å; L783-S785 PolarHBondContact O-N 3.39Å; L783-I786 WeakPolarHBondContact O-CB 3.23Å; L783-I786 PolarHBondContact O-N 3.04Å; L783-I786 VanDerWaalsContact O-N 3.07Å; L783-F787 HydrophobicContact CD2-CD2 3.99Å; L783-F787 HydrophobicContact CD2-CE2 3.59Å; L783-F787 WeakPolarHBondContact O-CD2 3.5Å; L783-F787 PolarHBondContact O-N 3.14Å
784	N	70	Confident	61.2	Low	56 Å²	56	88.4 Å²	88.4	30%	0.299	44%	0.442	S	S	.	.	H	α-helix	trans	-63	-33.4	177.4	-73.8	-38.8	0	0	0	111.6	S780 D781 Y782 I786 F787 F788	S780-N784 WeakPolarHBondContact O-CB 3.25Å; S780-N784 VanDerWaalsContact O-CG 3.23Å; S780-N784 PolarHBondContact O-N 3.32Å; S780-N784 PolarHBondContact O-ND2 2.97Å; D781-N784 PolarHBondContact O-N 3.24Å; Y782-N784 VanDerWaalsContact C-N 3.34Å; Y782-N784 PolarHBondContact O-N 3Å; N784-I786 VanDerWaalsContact C-N 3.29Å; N784-I786 PolarHBondContact O-N 3.24Å; N784-F787 PolarHBondContact O-N 2.93Å; N784-F788 HydrophobicContact CB-CD2 4.05Å; N784-F788 WeakPolarHBondContact O-CA 3.3Å; N784-F788 WeakPolarHBondContact O-CB 3.46Å; N784-F788 PolarHBondContact O-N 3.28Å; N784-F788 WeakPolarHBondContact OD1-CE2 3.41Å
785	S	71.1	Confident	59.5	Low	37 Å²	37	93.1 Å²	93.1	26%	0.259	45%	0.454	S	S	.	.	H	α-helix	trans	-66.5	-30.3	174.5	80.1	0	0	0	0	113	D781 Y782 L783 A789	D781-S785 WeakPolarHBondContact O-CB 3.4Å; D781-S785 PolarHBondContact O-N 2.96Å; Y782-S785 WeakPolarHBondContact O-CB 3.4Å; Y782-S785 PolarHBondContact O-N 3.43Å; Y782-S785 VanDerWaalsContact O-N 3.09Å; Y782-S785 PolarHBondContact O-OG 3.41Å; L783-S785 VanDerWaalsContact C-N 3.25Å; L783-S785 PolarHBondContact O-N 3.39Å; S785-A789 VanDerWaalsContact O-CB 3.25Å; S785-A789 WeakPolarHBondContact O-CB 3.28Å; S785-A789 PolarHBondContact O-N 3.48Å
786	I	68.1	Low	57.3	Low	19 Å²	19	96.7 Å²	96.7	10%	0.097	47%	0.472	C	S	.	.	H	α-helix	trans	-69.1	-40.6	172.9	-61	167.1	0	0	0	110.1	M744 I753 M755 H763 L767 Y782 L783 N784	M744-I786 HydrophobicContact CE-CG2 4.33Å; M744-I786 HydrophobicContact SD-CG2 4.18Å; I753-I786 WeakPolarHBondContact CD1-O 3.45Å; M755-I786 HydrophobicContact CE-CG2 3.89Å; H763-I786 HydrophobicContact CB-CD1 3.97Å; L767-I786 HydrophobicContact CD1-CD1 4.28Å; Y782-I786 HydrophobicContact CD1-CD1 4.01Å; Y782-I786 HydrophobicContact CE1-CD1 3.84Å; Y782-I786 HydrophobicContact CE1-CG1 4.42Å; Y782-I786 WeakPolarHBondContact O-CG1 3.4Å; Y782-I786 PolarHBondContact O-N 3.33Å; Y782-I786 VanDerWaalsContact O-N 3.09Å; L783-I786 WeakPolarHBondContact O-CB 3.23Å; L783-I786 PolarHBondContact O-N 3.04Å; L783-I786 VanDerWaalsContact O-N 3.07Å; N784-I786 VanDerWaalsContact C-N 3.29Å; N784-I786 PolarHBondContact O-N 3.24Å
787	F	60.8	Low	55.2	Low	15 Å²	15	96 Å²	96	7%	0.066	49%	0.487	C	S	.	.	H	α-helix	trans	-87.6	-33.5	-174.1	-80.3	-77.7	0	0	0	116.3	F722 M744 I751 I753 L783 N784	F722-F787 HydrophobicContact CB-CE2 3.94Å; F722-F787 HydrophobicContact CB-CZ 3.98Å; F722-F787 HydrophobicContact CD1-CD1 4.23Å; F722-F787 AromaticContact CD1-CD2 3.63Å; F722-F787 HydrophobicContact CD1-CD2 3.63Å; F722-F787 AromaticContact CD1-CE1 3.74Å; F722-F787 HydrophobicContact CD1-CE1 3.74Å; F722-F787 AromaticContact CD1-CE2 3.05Å; F722-F787 HydrophobicContact CD1-CE2 3.05Å; F722-F787 HydrophobicContact CD1-CG 4.17Å; F722-F787 AromaticContact CD1-CZ 3.1Å; F722-F787 HydrophobicContact CD1-CZ 3.1Å; F722-F787 HydrophobicContact CD2-CD2 4.49Å; F722-F787 HydrophobicContact CD2-CE2 4.03Å; F722-F787 HydrophobicContact CE1-CB 4.4Å; F722-F787 AromaticContact CE1-CD1 3.96Å; F722-F787 HydrophobicContact CE1-CD1 3.96Å; F722-F787 AromaticContact CE1-CD2 3.33Å; F722-F787 HydrophobicContact CE1-CD2 3.33Å; F722-F787 AromaticContact CE1-CE1 3.96Å; F722-F787 HydrophobicContact CE1-CE1 3.96Å; F722-F787 AromaticContact CE1-CE2 3.33Å; F722-F787 HydrophobicContact CE1-CE2 3.33Å; F722-F787 AromaticContact CE1-CG 3.65Å; F722-F787 HydrophobicContact CE1-CG 3.65Å; F722-F787 AromaticContact CE1-CZ 3.64Å; F722-F787 HydrophobicContact CE1-CZ 3.64Å; F722-F787 HydrophobicContact CE2-CD2 4.29Å; F722-F787 HydrophobicContact CE2-CE2 4.28Å; F722-F787 HydrophobicContact CG-CD2 4.17Å; F722-F787 AromaticContact CG-CE2 3.41Å; F722-F787 HydrophobicContact CG-CE2 3.41Å; F722-F787 VanDerWaalsContact CG-CE2 3.41Å; F722-F787 AromaticContact CG-CZ 3.73Å; F722-F787 HydrophobicContact CG-CZ 3.73Å; F722-F787 AromaticContact CZ-CD2 3.71Å; F722-F787 HydrophobicContact CZ-CD2 3.71Å; F722-F787 AromaticContact CZ-CE2 3.95Å; F722-F787 HydrophobicContact CZ-CE2 3.95Å; F722-F787 HydrophobicContact CZ-CG 4.23Å; M744-F787 HydrophobicContact CB-CE1 3.77Å; M744-F787 HydrophobicContact CB-CZ 3.58Å; M744-F787 HydrophobicContact CE-CD2 4.31Å; M744-F787 HydrophobicContact CE-CE1 4.35Å; M744-F787 HydrophobicContact CE-CE2 3.33Å; M744-F787 HydrophobicContact CE-CZ 3.37Å; M744-F787 HydrophobicContact CG-CZ 4.46Å; M744-F787 HydrophobicContact SD-CZ 4.33Å; I751-F787 HydrophobicContact CG2-CD1 3.96Å; I753-F787 HydrophobicContact CD1-CD1 3.87Å; I753-F787 HydrophobicContact CD1-CG 4.39Å; I753-F787 HydrophobicContact CG1-CD1 4.46Å; L783-F787 HydrophobicContact CD2-CD2 3.99Å; L783-F787 HydrophobicContact CD2-CE2 3.59Å; L783-F787 WeakPolarHBondContact O-CD2 3.5Å; L783-F787 PolarHBondContact O-N 3.14Å; N784-F787 PolarHBondContact O-N 2.93Å
788	F	62.4	Low	53	Low	94 Å²	94	92.4 Å²	92.4	41%	0.412	48%	0.48	S	S	.	.	H	α-helix	trans	-124.8	16.3	-166.5	-57.7	-74.2	0	0	0	112.7	F722 M749 I751 N784	F722-F788 HydrophobicContact CZ-CE2 4.29Å; M749-F788 HydrophobicContact CE-CE1 4.21Å; M749-F788 HydrophobicContact CE-CZ 4.17Å; I751-F788 HydrophobicContact CD1-CD1 4.41Å; I751-F788 HydrophobicContact CD1-CE1 3.45Å; I751-F788 VanDerWaalsContact CD1-CE1 3.45Å; I751-F788 HydrophobicContact CD1-CZ 3.83Å; N784-F788 HydrophobicContact CB-CD2 4.05Å; N784-F788 WeakPolarHBondContact O-CA 3.3Å; N784-F788 WeakPolarHBondContact O-CB 3.46Å; N784-F788 PolarHBondContact O-N 3.28Å; N784-F788 WeakPolarHBondContact OD1-CE2 3.41Å
789	A	54	Low	50.7	Low	63 Å²	63	97.8 Å²	97.8	52%	0.521	50%	0.5	S	S	.	.			trans	-57.5	129.2	169.3	0	0	0	0	0	109.3	S785 E791	S785-A789 VanDerWaalsContact O-CB 3.25Å; S785-A789 WeakPolarHBondContact O-CB 3.28Å; S785-A789 PolarHBondContact O-N 3.48Å; A789-E791 PolarHBondContact O-N 3.12Å
790	P	40.1	Very low	48.6	Very low	117 Å²	117	106.4 Å²	106.4	76%	0.76	53%	0.532	S	S	*	.			trans	-60.8	128.1	178	22.2	-30.3	0	0	0	109.8	K792	P790-K792 PolarHBondContact O-N 3.39Å; P790-K792 VanDerWaalsContact O-N 3.11Å
791	E	37.4	Very low	46.7	Very low	186 Å²	186	106.3 Å²	106.3	87%	0.869	53%	0.53	S	S	*	.			trans	-56.2	114	172.3	-70.1	179.7	157.7	0	0	108.6	A789	A789-E791 PolarHBondContact O-N 3.12Å
792	K	35.1	Very low	44.7	Very low	196 Å²	196	105.7 Å²	105.7	85%	0.852	53%	0.533	S	S	*	.			trans	-86.8	143.5	167.2	-86.5	-168.4	175.4	-173.1	0	109.7	P790	P790-K792 PolarHBondContact O-N 3.39Å; P790-K792 VanDerWaalsContact O-N 3.11Å
793	E	32.7	Very low	42.9	Very low	191 Å²	191	112.1 Å²	112.1	89%	0.893	57%	0.567	S	S	*	*			trans	-47.2	148.5	-174.4	-65.4	171.5	153.3	0	0	115	N795	E793-N795 VanDerWaalsContact C-N 3.34Å; E793-N795 PolarHBondContact O-N 3.2Å
794	E	29.1	Very low	41.1	Very low	189 Å²	189	113.5 Å²	113.5	88%	0.883	58%	0.575	S	S	*	*	S	Bend	trans	-70	19.8	-150.6	-69.2	177.8	135.5	0	0	118.9
795	N	32.2	Very low	39.6	Very low	155 Å²	155	116.4 Å²	116.4	83%	0.829	59%	0.585	S	S	*	*			trans	-125	18.1	-161.6	-78.5	-36	0	0	0	119.3	E793	E793-N795 VanDerWaalsContact C-N 3.34Å; E793-N795 PolarHBondContact O-N 3.2Å
796	E	24.9	Very low	38.3	Very low	152 Å²	152	119.1 Å²	119.1	71%	0.71	60%	0.601	S	S	*	*			trans	-138.1	138.7	165.9	-73.5	-172.2	153.1	0	0	113.1	T798	E796-T798 HydrophobicContact CB-CG2 3.71Å; E796-T798 PolarHBondContact O-N 2.89Å; E796-T798 PolarHBondContact O-OG1 3.05Å; E796-T798 VanDerWaalsContact O-OG1 3.12Å
797	P	24.4	Very low	37.1	Very low	138 Å²	138	122.7 Å²	122.7	90%	0.896	62%	0.62	S	S	*	*			trans	-73.9	74.2	178	32.9	-33	0	0	0	108.8	R799	P797-R799 PolarHBondContact O-N 3.46Å
798	T	27	Very low	36.1	Very low	91 Å²	91	122.7 Å²	122.7	56%	0.558	62%	0.623	S	S	*	*			trans	-96.9	101.3	-168.1	39.6	0	0	0	0	110.2	E796 R800	E796-T798 HydrophobicContact CB-CG2 3.71Å; E796-T798 PolarHBondContact O-N 2.89Å; E796-T798 PolarHBondContact O-OG1 3.05Å; E796-T798 VanDerWaalsContact O-OG1 3.12Å; T798-R800 PolarHBondContact O-N 3.48Å
799	R	26.2	Very low	35.2	Very low	222 Å²	222	121.4 Å²	121.4	84%	0.838	62%	0.62	S	S	*	*			trans	-26.9	99.2	149.5	-86	173.7	158.1	163.2	-5.9	110.2	P797 V801 S802	P797-R799 PolarHBondContact O-N 3.46Å; R799-V801 PolarHBondContact O-N 2.93Å; R799-S802 PolarHBondContact O-N 3.31Å; R799-S802 PolarHBondContact O-OG 3.49Å
800	R	31.2	Very low	34.9	Very low	183 Å²	183	120.6 Å²	120.6	69%	0.691	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	-8.3	-177.9	-81.1	-176	177.5	179.1	-1.5	114	T798	T798-R800 PolarHBondContact O-N 3.48Å
801	V	29.7	Very low	34.9	Very low	35 Å²	35	115.6 Å²	115.6	21%	0.212	58%	0.582	C	S	.	*	T	Hydrogen-bonded Turn	trans	-78.5	-24	-179.1	-172	0	0	0	0	113	R799 N803 L804 F805	R799-V801 PolarHBondContact O-N 2.93Å; V801-N803 PolarHBondContact O-N 2.9Å; V801-L804 PolarHBondContact O-N 3.44Å; V801-F805 HydrophobicContact CG1-CD2 4.21Å; V801-F805 HydrophobicContact CG1-CE2 4.07Å
802	S	31.9	Very low	34.9	Very low	72 Å²	72	111 Å²	111	50%	0.503	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.8	-28.1	-170.8	58.1	0	0	0	0	114.8	R799	R799-S802 PolarHBondContact O-N 3.31Å; R799-S802 PolarHBondContact O-OG 3.49Å
803	N	37.8	Very low	35.3	Very low	143 Å²	143	109.3 Å²	109.3	77%	0.765	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-14.9	-178.9	-69.4	-20.5	0	0	0	113.7	V801 P806	V801-N803 PolarHBondContact O-N 2.9Å; N803-P806 WeakPolarHBondContact O-CD 3.35Å
804	L	37.2	Very low	35.9	Very low	29 Å²	29	105 Å²	105	15%	0.152	54%	0.535	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-9.5	179.4	-71.1	162.3	0	0	0	112.7	Y782 V801 P806 L807 A808	Y782-L804 HydrophobicContact CD2-CD2 4.32Å; Y782-L804 HydrophobicContact CE2-CB 4.41Å; Y782-L804 HydrophobicContact CE2-CD2 3.78Å; V801-L804 PolarHBondContact O-N 3.44Å; L804-P806 VanDerWaalsContact C-N 3.3Å; L804-L807 PolarHBondContact O-N 2.97Å; L804-A808 PolarHBondContact O-N 3.32Å
805	F	39.2	Very low	36.3	Very low	118 Å²	118	98.2 Å²	98.2	52%	0.518	51%	0.509	S	S	.	.	H	α-helix	trans	-49.2	-39.5	177	-114.4	-96	0	0	0	114.2	V801 I809	V801-F805 HydrophobicContact CG1-CD2 4.21Å; V801-F805 HydrophobicContact CG1-CE2 4.07Å; F805-I809 HydrophobicContact CD1-CD1 3.62Å; F805-I809 HydrophobicContact CD1-CG1 4.09Å; F805-I809 HydrophobicContact CE1-CD1 4.1Å; F805-I809 WeakPolarHBondContact O-CB 3.41Å; F805-I809 VanDerWaalsContact O-CG1 3.23Å; F805-I809 WeakPolarHBondContact O-CG1 3.21Å; F805-I809 PolarHBondContact O-N 3.45Å
806	P	43.4	Very low	36.4	Very low	93 Å²	93	99.2 Å²	99.2	60%	0.604	51%	0.508	S	S	*	.	H	α-helix	trans	-67.1	-39	177.9	-21	33.1	0	0	0	113.4	N803 L804 A810	N803-P806 WeakPolarHBondContact O-CD 3.35Å; L804-P806 VanDerWaalsContact C-N 3.3Å; P806-A810 WeakPolarHBondContact O-CB 3.26Å; P806-A810 PolarHBondContact O-N 3.08Å
807	L	42.8	Very low	36.5	Very low	94 Å²	94	101.9 Å²	101.9	49%	0.492	51%	0.512	S	S	.	.	H	α-helix	trans	-72.8	-42.2	179.1	-95.2	144.8	0	0	0	111.5	Y782 L804 A810 A811	Y782-L807 HydrophobicContact CD2-CB 4.45Å; Y782-L807 HydrophobicContact CE2-CB 4.41Å; L804-L807 PolarHBondContact O-N 2.97Å; L807-A810 PolarHBondContact O-N 3.36Å; L807-A811 WeakPolarHBondContact O-CB 3.44Å; L807-A811 PolarHBondContact O-N 3.15Å
808	A	39.3	Very low	36.5	Very low	16 Å²	16	101.6 Å²	101.6	13%	0.132	51%	0.508	C	S	.	.	H	α-helix	trans	-64.2	-45.8	175.5	0	0	0	0	0	111.5	V766 L804 A811 L812	V766-A808 HydrophobicContact CG2-CB 3.57Å; L804-A808 PolarHBondContact O-N 3.32Å; A808-A811 PolarHBondContact O-N 3.33Å; A808-L812 VanDerWaalsContact O-CB 3.31Å; A808-L812 WeakPolarHBondContact O-CB 3.43Å; A808-L812 WeakPolarHBondContact O-CG 3.18Å; A808-L812 PolarHBondContact O-N 3.27Å
809	I	43.3	Very low	36.4	Very low	66 Å²	66	101.8 Å²	101.8	34%	0.338	51%	0.512	S	S	.	.	H	α-helix	trans	-64.9	-40.1	175	-72.2	-176.7	0	0	0	111	F805 A811 L812 K813	F805-I809 HydrophobicContact CD1-CD1 3.62Å; F805-I809 HydrophobicContact CD1-CG1 4.09Å; F805-I809 HydrophobicContact CE1-CD1 4.1Å; F805-I809 WeakPolarHBondContact O-CB 3.41Å; F805-I809 VanDerWaalsContact O-CG1 3.23Å; F805-I809 WeakPolarHBondContact O-CG1 3.21Å; F805-I809 PolarHBondContact O-N 3.45Å; I809-A811 VanDerWaalsContact C-N 3.34Å; I809-A811 PolarHBondContact O-N 2.8Å; I809-L812 PolarHBondContact O-N 3.05Å; I809-K813 HydrophobicContact CG2-CD 3.71Å; I809-K813 HydrophobicContact CG2-CG 3.96Å; I809-K813 WeakPolarHBondContact O-CB 3.37Å; I809-K813 WeakPolarHBondContact O-CG 3.28Å; I809-K813 PolarHBondContact O-N 2.87Å
810	A	47.8	Very low	36.3	Very low	46 Å²	46	99.6 Å²	99.6	38%	0.38	52%	0.516	S	S	.	.	H	α-helix	trans	-63.4	-41.6	176.5	0	0	0	0	0	111.6	P806 L807 E814	P806-A810 WeakPolarHBondContact O-CB 3.26Å; P806-A810 PolarHBondContact O-N 3.08Å; L807-A810 PolarHBondContact O-N 3.36Å; A810-E814 WeakPolarHBondContact O-CB 3.5Å; A810-E814 WeakPolarHBondContact O-CG 3.39Å; A810-E814 PolarHBondContact O-N 3.4Å
811	A	39.9	Very low	35.9	Very low	12 Å²	12	96.2 Å²	96.2	10%	0.099	53%	0.526	C	S	.	.	H	α-helix	trans	-66.4	-42	176.2	0	0	0	0	0	112.4	L770 L807 A808 I809 S815	L770-A811 HydrophobicContact CD2-CB 4.16Å; L770-A811 HydrophobicContact CG-CB 4.45Å; L807-A811 WeakPolarHBondContact O-CB 3.44Å; L807-A811 PolarHBondContact O-N 3.15Å; A808-A811 PolarHBondContact O-N 3.33Å; I809-A811 VanDerWaalsContact C-N 3.34Å; I809-A811 PolarHBondContact O-N 2.8Å; A811-S815 WeakPolarHBondContact O-CB 2.87Å; A811-S815 PolarHBondContact O-N 3.24Å; A811-S815 VanDerWaalsContact O-N 3.16Å; A811-S815 PolarHBondContact O-OG 3.41Å
812	L	37.1	Very low	35.6	Very low	90 Å²	90	98.8 Å²	98.8	47%	0.471	55%	0.546	S	S	.	.	H	α-helix	trans	-72.9	-36.7	178.7	-75.5	165	0	0	0	112.9	A808 I809 E814 S815	A808-L812 VanDerWaalsContact O-CB 3.31Å; A808-L812 WeakPolarHBondContact O-CB 3.43Å; A808-L812 WeakPolarHBondContact O-CG 3.18Å; A808-L812 PolarHBondContact O-N 3.27Å; I809-L812 PolarHBondContact O-N 3.05Å; L812-E814 VanDerWaalsContact C-N 3.34Å; L812-S815 PolarHBondContact O-N 3.29Å; L812-S815 PolarHBondContact O-OG 3.16Å
813	K	45.2	Very low	35.1	Very low	161 Å²	161	105.1 Å²	105.1	70%	0.7	57%	0.565	S	S	*	*	H	α-helix	trans	-68	-34.6	173.3	-78.8	-175	176.1	-179	0	111.7	I809	I809-K813 HydrophobicContact CG2-CD 3.71Å; I809-K813 HydrophobicContact CG2-CG 3.96Å; I809-K813 WeakPolarHBondContact O-CB 3.37Å; I809-K813 WeakPolarHBondContact O-CG 3.28Å; I809-K813 PolarHBondContact O-N 2.87Å
814	E	43.7	Very low	34.3	Very low	99 Å²	99	106.1 Å²	106.1	46%	0.463	57%	0.57	S	S	.	*	H	α-helix	trans	-76.2	-19.3	175.9	-77.5	-179.1	165.9	0	0	113.3	K775 R778 A810 L812	K775-E814 IonicContact NZ-OE1 2.98Å; K775-E814 IonicContact NZ-OE2 2.88Å; K775-E814 PolarHBondContact NZ-OE2 3.23Å; R778-E814 IonicContact NH1-OE1 2.66Å; R778-E814 IonicContact NH1-OE2 3.25Å; R778-E814 PolarHBondContact NH1-OE2 3.02Å; A810-E814 WeakPolarHBondContact O-CB 3.5Å; A810-E814 WeakPolarHBondContact O-CG 3.39Å; A810-E814 PolarHBondContact O-N 3.4Å; L812-E814 VanDerWaalsContact C-N 3.34Å
815	S	38.2	Very low	33.5	Very low	47 Å²	47	107.9 Å²	107.9	33%	0.329	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.8	2.1	-177.2	69.4	0	0	0	0	115.2	A811 L812 R817	A811-S815 WeakPolarHBondContact O-CB 2.87Å; A811-S815 PolarHBondContact O-N 3.24Å; A811-S815 VanDerWaalsContact O-N 3.16Å; A811-S815 PolarHBondContact O-OG 3.41Å; L812-S815 PolarHBondContact O-N 3.29Å; L812-S815 PolarHBondContact O-OG 3.16Å; S815-R817 PolarHBondContact O-N 2.82Å
816	H	35.1	Very low	32.7	Very low	176 Å²	176	113.3 Å²	113.3	82%	0.815	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	49.4	22.3	174.5	-74.8	-68.3	0	0	0	116.2
817	R	26.9	Very low	31.7	Very low	209 Å²	209	115.3 Å²	115.3	79%	0.789	62%	0.622	S	S	*	*			trans	-115.4	90.1	177.4	-74.7	-170.6	176.4	-171.2	-0.5	111.2	S815	S815-R817 PolarHBondContact O-N 2.82Å
818	T	24.4	Very low	30.8	Very low	132 Å²	132	116.9 Å²	116.9	81%	0.81	64%	0.636	S	S	*	*			trans	-91.5	89	166.8	48.5	0	0	0	0	109.6
819	S	24.7	Very low	30.1	Very low	94 Å²	94	123.4 Å²	123.4	66%	0.657	67%	0.669	S	S	*	*			trans	-169.1	98.8	157.9	63.7	0	0	0	0	111.8
820	I	23.8	Very low	29.2	Very low	177 Å²	177	126.7 Å²	126.7	91%	0.908	69%	0.687	S	S	*	*	S	Bend	trans	-154	-22.2	141.5	-101.5	161.3	0	0	0	108.6
821	A	23.5	Very low	28.2	Very low	111 Å²	111	129.9 Å²	129.9	92%	0.917	70%	0.704	S	S	*	*	S	Bend	trans	-90.9	14.6	176	0	0	0	0	0	115.5
822	S	22.7	Very low	27.6	Very low	89 Å²	89	134.5 Å²	134.5	62%	0.622	73%	0.731	S	S	*	*			trans	-145.3	64.6	179.5	63.8	0	0	0	0	112
823	F	21	Very low	27	Very low	205 Å²	205	137.8 Å²	137.8	90%	0.899	75%	0.748	S	S	*	*			trans	-116.1	86.1	158.2	-154.7	-94.4	0	0	0	106.9
824	D	21.6	Very low	26.1	Very low	165 Å²	165	136.7 Å²	136.7	88%	0.882	76%	0.755	S	S	*	*			trans	-98.5	120.9	172.7	-136.4	-2.1	0	0	0	106.9	R826	D824-R826 PolarHBondContact O-N 3.4Å
825	G	20.1	Very low	25.4	Very low	65 Å²	65	137.2 Å²	137.2	67%	0.67	76%	0.76	S	S	*	*			trans	-69.1	112.3	-171.7	0	0	0	0	0	112.4
826	R	21.5	Very low	25.2	Very low	233 Å²	233	139.2 Å²	139.2	88%	0.879	77%	0.771	S	S	*	*			trans	-139.4	104.5	156.9	-71.3	-168.4	179.7	-178.7	0.2	110	D824 T828	D824-R826 PolarHBondContact O-N 3.4Å; R826-T828 PolarHBondContact O-N 2.93Å
827	V	23.3	Very low	25	Very low	134 Å²	134	135.6 Å²	135.6	81%	0.812	76%	0.763	S	S	*	*			trans	-66.6	119.3	163.1	177	0	0	0	0	106.7
828	T	24.3	Very low	25.3	Very low	127 Å²	127	131.6 Å²	131.6	78%	0.779	76%	0.757	S	S	*	*			trans	-96.8	114.5	173	49.7	0	0	0	0	108.7	R826 D830	R826-T828 PolarHBondContact O-N 2.93Å; T828-D830 PolarHBondContact O-N 3.08Å
829	D	23.7	Very low	25.7	Very low	154 Å²	154	127 Å²	127	82%	0.824	73%	0.733	S	S	*	*			trans	-64.5	115.6	173.3	-60.8	-51	0	0	0	110.3
830	D	24.7	Very low	25.9	Very low	134 Å²	134	127.2 Å²	127.2	72%	0.717	73%	0.726	S	S	*	*			trans	-126.8	107.8	170.9	-149.9	-13	0	0	0	110.2	T828 T832	T828-D830 PolarHBondContact O-N 3.08Å; D830-T832 PolarHBondContact O-N 2.76Å
831	P	27.3	Very low	26.1	Very low	113 Å²	113	126.1 Å²	126.1	73%	0.734	71%	0.714	S	S	*	*			trans	-94.7	28	-162.6	36.7	-36.2	0	0	0	115.1
832	T	26.5	Very low	26.5	Very low	109 Å²	109	124.2 Å²	124.2	67%	0.669	70%	0.699	S	S	*	*			trans	-100.1	13.5	-165	49.7	0	0	0	0	117.6	D830	D830-T832 PolarHBondContact O-N 2.76Å
833	L	25.1	Very low	26.8	Very low	159 Å²	159	126.2 Å²	126.2	83%	0.832	70%	0.702	S	S	*	*			trans	-122.5	77.4	173.7	-79.4	161.2	0	0	0	111.9	L835	L833-L835 PolarHBondContact O-N 3.3Å
834	T	26.8	Very low	27.1	Very low	139 Å²	139	119.8 Å²	119.8	85%	0.853	68%	0.682	S	S	*	*			trans	-72.3	72.5	169.8	35.1	0	0	0	0	111
835	L	28.6	Very low	27.3	Very low	109 Å²	109	114.7 Å²	114.7	57%	0.571	67%	0.669	S	S	*	*			trans	-79.8	128.2	158.1	-75.5	163.8	0	0	0	107.9	L833 L840	L833-L835 PolarHBondContact O-N 3.3Å; L835-L840 HydrophobicContact CB-CD1 4.13Å; L835-L840 HydrophobicContact CB-CG 4.22Å
836	T	33.8	Very low	27.7	Very low	89 Å²	89	119.6 Å²	119.6	55%	0.546	67%	0.674	S	S	.	*			trans	-59.8	142.9	-178	51.2	0	0	0	0	110.3	D838 A839 L840	T836-D838 PolarHBondContact O-N 3.03Å; T836-A839 PolarHBondContact O-N 2.87Å; T836-L840 PolarHBondContact O-N 2.87Å; T836-L840 VanDerWaalsContact O-N 3.1Å
837	P	30.3	Very low	28.1	Very low	100 Å²	100	110.7 Å²	110.7	65%	0.649	65%	0.648	S	S	*	*	H	α-helix	trans	-54.1	-27.9	-179.1	-27	33.9	0	0	0	113.7	K841	P837-K841 WeakPolarHBondContact O-CB 3.24Å; P837-K841 PolarHBondContact O-N 2.92Å
838	D	33.9	Very low	28.2	Very low	126 Å²	126	107.1 Å²	107.1	67%	0.674	63%	0.632	S	S	*	*	H	α-helix	trans	-74.5	-35.8	177.6	-65.8	-26.1	0	0	0	112.7	T836 K841 A842	T836-D838 PolarHBondContact O-N 3.03Å; D838-K841 PolarHBondContact O-N 3.46Å; D838-A842 WeakPolarHBondContact O-CB 3.44Å; D838-A842 PolarHBondContact O-N 3.24Å
839	A	32.3	Very low	28.6	Very low	35 Å²	35	104.6 Å²	104.6	29%	0.289	61%	0.614	S	S	.	*	H	α-helix	trans	-70.8	-38.7	174.6	0	0	0	0	0	111.2	T836 A842 L843	T836-A839 PolarHBondContact O-N 2.87Å; A839-A842 PolarHBondContact O-N 3.1Å; A839-L843 PolarHBondContact O-N 3.44Å; A839-L843 VanDerWaalsContact O-N 3.07Å
840	L	29.2	Very low	29	Very low	99 Å²	99	106.1 Å²	106.1	52%	0.518	61%	0.613	S	S	.	*	H	α-helix	trans	-64.4	-38.9	170	-86.2	161.3	0	0	0	111.5	L835 T836 S844	L835-L840 HydrophobicContact CB-CD1 4.13Å; L835-L840 HydrophobicContact CB-CG 4.22Å; T836-L840 PolarHBondContact O-N 2.87Å; T836-L840 VanDerWaalsContact O-N 3.1Å; L840-S844 WeakPolarHBondContact O-CB 3.35Å; L840-S844 PolarHBondContact O-N 2.88Å; L840-S844 PolarHBondContact O-OG 3.14Å
841	K	28.5	Very low	29.4	Very low	153 Å²	153	105.7 Å²	105.7	67%	0.665	61%	0.611	S	S	*	*	H	α-helix	trans	-66.8	-38.4	174.8	-98.2	-179	175.7	174.7	0	113.7	P837 D838 S844 G845	P837-K841 WeakPolarHBondContact O-CB 3.24Å; P837-K841 PolarHBondContact O-N 2.92Å; D838-K841 PolarHBondContact O-N 3.46Å; K841-S844 VanDerWaalsContact CA-OG 3.31Å; K841-S844 WeakPolarHBondContact CA-OG 3.3Å; K841-S844 PolarHBondContact O-OG 2.9Å; K841-S844 VanDerWaalsContact O-OG 3.1Å; K841-G845 PolarHBondContact O-N 3.19Å; K841-G845 VanDerWaalsContact O-N 3.1Å
842	A	32	Very low	29.8	Very low	72 Å²	72	105.7 Å²	105.7	60%	0.595	60%	0.601	S	S	*	*	H	α-helix	trans	-69.3	-41.3	179.3	0	0	0	0	0	111.6	D838 A839 G845	D838-A842 WeakPolarHBondContact O-CB 3.44Å; D838-A842 PolarHBondContact O-N 3.24Å; A839-A842 PolarHBondContact O-N 3.1Å; A842-G845 PolarHBondContact O-N 3.02Å
843	L	28.1	Very low	30.4	Very low	130 Å²	130	102 Å²	102	68%	0.681	59%	0.585	S	S	*	*	H	α-helix	trans	-75.7	-35	175.8	-78.7	160.3	0	0	0	112.5	A839 G845 Q846	A839-L843 PolarHBondContact O-N 3.44Å; A839-L843 VanDerWaalsContact O-N 3.07Å; L843-G845 PolarHBondContact O-N 2.92Å; L843-Q846 PolarHBondContact O-N 3.43Å
844	S	27.5	Very low	31.2	Very low	70 Å²	70	95.2 Å²	95.2	49%	0.49	55%	0.549	S	S	.	.	H	α-helix	trans	-67.5	-17.4	172.6	70.8	0	0	0	0	112.8	L840 K841 Q846	L840-S844 WeakPolarHBondContact O-CB 3.35Å; L840-S844 PolarHBondContact O-N 2.88Å; L840-S844 PolarHBondContact O-OG 3.14Å; K841-S844 VanDerWaalsContact CA-OG 3.31Å; K841-S844 WeakPolarHBondContact CA-OG 3.3Å; K841-S844 PolarHBondContact O-OG 2.9Å; K841-S844 VanDerWaalsContact O-OG 3.1Å; S844-Q846 PolarHBondContact O-N 3.16Å
845	G	25.8	Very low	31.8	Very low	58 Å²	58	91.7 Å²	91.7	60%	0.598	53%	0.533	S	S	*	.	H	α-helix	trans	-66.4	-21.8	174.8	0	0	0	0	0	114.2	K841 A842 L843	K841-G845 PolarHBondContact O-N 3.19Å; K841-G845 VanDerWaalsContact O-N 3.1Å; A842-G845 PolarHBondContact O-N 3.02Å; L843-G845 PolarHBondContact O-N 2.92Å
846	Q	28.9	Very low	32.6	Very low	169 Å²	169	89.3 Å²	89.3	79%	0.79	53%	0.526	S	S	*	.	H	α-helix	trans	-107.3	-14.5	180	-69.4	-175.8	-15.9	0	0	113.8	L843 S844	L843-Q846 PolarHBondContact O-N 3.43Å; S844-Q846 PolarHBondContact O-N 3.16Å
847	S	28.7	Very low	33.1	Very low	45 Å²	45	87.8 Å²	87.8	32%	0.315	51%	0.514	S	S	.	.	H	α-helix	trans	-78.7	-16.9	-178.9	-161.8	0	0	0	0	114.7	L849 F850 D851	S847-L849 PolarHBondContact O-N 3.06Å; S847-F850 PolarHBondContact O-N 3.27Å; S847-D851 PolarHBondContact O-N 3.37Å; S847-D851 VanDerWaalsContact O-N 3.16Å; S847-D851 PolarHBondContact OG-OD2 2.84Å
848	A	27	Very low	33.8	Very low	59 Å²	59	83 Å²	83	49%	0.488	48%	0.483	S	S	.	.	H	α-helix	trans	-58.6	-20	-169.2	0	0	0	0	0	114.8	E852	A848-E852 WeakPolarHBondContact O-CB 3.48Å; A848-E852 PolarHBondContact O-N 2.88Å
849	L	32	Very low	34.3	Very low	75 Å²	75	82.2 Å²	82.2	39%	0.393	48%	0.479	S	S	.	.	H	α-helix	trans	-93.9	-20.7	178.5	-127.4	108.9	0	0	0	114.9	S847 P896	S847-L849 PolarHBondContact O-N 3.06Å; L849-P896 HydrophobicContact CD2-CG 4.24Å
850	F	32.8	Very low	35.2	Very low	186 Å²	186	81.9 Å²	81.9	82%	0.816	47%	0.472	S	S	*	.	H	α-helix	trans	-83.9	-34.1	171.7	-85	-78.9	0	0	0	111.2	S847	S847-F850 PolarHBondContact O-N 3.27Å
851	D	33.4	Very low	36.2	Very low	125 Å²	125	85.9 Å²	85.9	67%	0.668	49%	0.488	S	S	*	.	H	α-helix	trans	-78.5	-32.4	178.9	-70	-39.2	0	0	0	112.9	S847 G853	S847-D851 PolarHBondContact O-N 3.37Å; S847-D851 VanDerWaalsContact O-N 3.16Å; S847-D851 PolarHBondContact OG-OD2 2.84Å; D851-G853 PolarHBondContact O-N 3.4Å
852	E	35.6	Very low	37.6	Very low	112 Å²	112	79.5 Å²	79.5	52%	0.523	46%	0.462	S	S	.	.	S	Bend	trans	-93	75.3	171.2	-64.1	-169.6	-177.5	0	0	110.3	A848 I857	A848-E852 WeakPolarHBondContact O-CB 3.48Å; A848-E852 PolarHBondContact O-N 2.88Å; E852-I857 HydrophobicContact CB-CG1 4.28Å; E852-I857 WeakPolarHBondContact O-CG1 3.49Å
853	G	38.4	Very low	38.8	Very low	32 Å²	32	82.2 Å²	82.2	33%	0.33	48%	0.477	S	S	.	.			trans	-48.2	150.9	175.1	0	0	0	0	0	111.7	D851 A855 S856 I857	D851-G853 PolarHBondContact O-N 3.4Å; G853-A855 CarbonylContact O-C 3.57Å; G853-A855 PolarHBondContact O-N 2.89Å; G853-S856 VanDerWaalsContact O-CA 3.26Å; G853-S856 WeakPolarHBondContact O-CA 3.37Å; G853-S856 WeakPolarHBondContact O-CB 3.19Å; G853-S856 PolarHBondContact O-N 3.25Å; G853-I857 PolarHBondContact O-N 2.98Å
854	F	41.3	Very low	40.2	Very low	17 Å²	17	77.1 Å²	77.1	8%	0.075	45%	0.452	C	S	.	.	H	α-helix	trans	-50.5	-27.9	-178.2	-158.1	-92.4	0	0	0	113.5	N858 N878 L882 F899 H903	F854-N858 WeakPolarHBondContact O-CB 3.35Å; F854-N858 PolarHBondContact O-N 2.89Å; F854-N878 HydrophobicContact CE1-CB 4.28Å; F854-N878 HydrophobicContact CE2-CB 4.03Å; F854-N878 HydrophobicContact CZ-CB 3.68Å; F854-L882 HydrophobicContact CE2-CD2 4.19Å; F854-F899 HydrophobicContact CB-CD1 3.6Å; F854-F899 HydrophobicContact CB-CE1 3.39Å; F854-F899 HydrophobicContact CG-CD1 4.25Å; F854-F899 HydrophobicContact CG-CE1 4.41Å; F854-H903 HydrophobicContact CD1-CB 3.69Å; F854-H903 AromaticContact CD1-CD2 3.76Å; F854-H903 AromaticContact CD1-CG 3.44Å; F854-H903 VanDerWaalsContact CD1-CG 3.44Å; F854-H903 AromaticContact CD1-ND1 3.78Å; F854-H903 HydrophobicContact CE1-CB 3.81Å; F854-H903 AromaticContact CE1-CG 3.72Å; F854-H903 AromaticContact CE1-ND1 3.73Å
855	A	39.9	Very low	41.7	Very low	64 Å²	64	77.9 Å²	77.9	53%	0.529	46%	0.455	S	S	.	.	H	α-helix	trans	-67	-41.3	169.7	0	0	0	0	0	113.5	G853 N858 N859	G853-A855 CarbonylContact O-C 3.57Å; G853-A855 PolarHBondContact O-N 2.89Å; A855-N858 CarbonylContact O-C 3.51Å; A855-N858 PolarHBondContact O-N 3.17Å; A855-N859 WeakPolarHBondContact O-CB 3.46Å; A855-N859 PolarHBondContact O-N 3.34Å
856	S	44.7	Very low	43.5	Very low	59 Å²	59	76.9 Å²	76.9	41%	0.413	43%	0.434	S	S	.	.	H	α-helix	trans	-62.9	-41.9	170.7	-163.6	0	0	0	0	111.8	G853 N858 N859	G853-S856 VanDerWaalsContact O-CA 3.26Å; G853-S856 WeakPolarHBondContact O-CA 3.37Å; G853-S856 WeakPolarHBondContact O-CB 3.19Å; G853-S856 PolarHBondContact O-N 3.25Å; S856-N858 VanDerWaalsContact C-N 3.3Å; S856-N858 PolarHBondContact O-N 3.01Å; S856-N859 CarbonylContact O-C 3.48Å; S856-N859 VanDerWaalsContact O-CA 3.23Å; S856-N859 WeakPolarHBondContact O-CA 3.46Å; S856-N859 WeakPolarHBondContact O-CB 3.43Å; S856-N859 PolarHBondContact O-N 2.95Å
857	I	44.5	Very low	45.2	Very low	57 Å²	57	70.1 Å²	70.1	29%	0.292	40%	0.403	S	S	.	.	H	α-helix	trans	-64.1	-36.7	174	-55.7	175.7	0	0	0	110.9	E852 G853 N859 I860	E852-I857 HydrophobicContact CB-CG1 4.28Å; E852-I857 WeakPolarHBondContact O-CG1 3.49Å; G853-I857 PolarHBondContact O-N 2.98Å; I857-N859 VanDerWaalsContact C-N 3.28Å; I857-I860 WeakPolarHBondContact O-CG1 3.06Å
858	N	46.2	Very low	47	Very low	0 Å²	0	69.4 Å²	69.4	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-73.5	-20.4	171	-83.4	-27	0	0	0	113	F854 A855 S856 I860 K866 W871 S875 N878 H903	F854-N858 WeakPolarHBondContact O-CB 3.35Å; F854-N858 PolarHBondContact O-N 2.89Å; A855-N858 CarbonylContact O-C 3.51Å; A855-N858 PolarHBondContact O-N 3.17Å; S856-N858 VanDerWaalsContact C-N 3.3Å; S856-N858 PolarHBondContact O-N 3.01Å; N858-I860 PolarHBondContact O-N 3.42Å; N858-K866 PolarHBondContact O-NZ 3.46Å; N858-W871 HydrophobicContact CB-CE3 4.31Å; N858-W871 HydrophobicContact CB-CZ3 4.01Å; N858-S875 PolarHBondContact ND2-OG 2.72Å; N858-N878 PolarHBondContact OD1-ND2 3.43Å; N858-H903 PolarHBondContact ND2-CE1 2.95Å; N858-H903 PolarHBondContact ND2-NE2 3.43Å
859	N	43.6	Very low	49.2	Very low	109 Å²	109	67.1 Å²	67.1	58%	0.583	38%	0.377	S	S	*	.			trans	-76.5	43.4	168.4	-132	18.8	0	0	0	110.6	A855 S856 I857 Q861	A855-N859 WeakPolarHBondContact O-CB 3.46Å; A855-N859 PolarHBondContact O-N 3.34Å; S856-N859 CarbonylContact O-C 3.48Å; S856-N859 VanDerWaalsContact O-CA 3.23Å; S856-N859 WeakPolarHBondContact O-CA 3.46Å; S856-N859 WeakPolarHBondContact O-CB 3.43Å; S856-N859 PolarHBondContact O-N 2.95Å; I857-N859 VanDerWaalsContact C-N 3.28Å; N859-Q861 PolarHBondContact O-N 2.93Å; N859-Q861 VanDerWaalsContact O-N 3.09Å
860	I	51.3	Low	51.2	Low	28 Å²	28	63.6 Å²	63.6	14%	0.144	36%	0.358	C	S	.	.			trans	-41.5	123.6	158.3	-62.9	166.2	0	0	0	106.2	I857 N858 C862 K866 L874 L993	I857-I860 WeakPolarHBondContact O-CG1 3.06Å; N858-I860 PolarHBondContact O-N 3.42Å; I860-C862 HydrophobicContact CG2-CB 3.94Å; I860-C862 PolarHBondContact O-N 3.28Å; I860-K866 PolarHBondContact O-NZ 2.82Å; I860-L874 HydrophobicContact CD1-CD1 4.22Å; I860-L874 HydrophobicContact CD1-CD2 3.33Å; I860-L874 HydrophobicContact CD1-CG 4.36Å; I860-L993 WeakPolarHBondContact CD1-O 2.93Å; I860-L993 HydrophobicContact CG2-CB 3.31Å; I860-L993 HydrophobicContact CG2-CD1 4.03Å; I860-L993 HydrophobicContact CG2-CG 4.19Å
861	Q	50.7	Low	53.2	Low	184 Å²	184	59.2 Å²	59.2	86%	0.86	34%	0.337	S	S	*	.	S	Bend	trans	-60.6	35.9	178.4	-65.9	179.3	-17.7	0	0	113.2	N859	N859-Q861 PolarHBondContact O-N 2.93Å; N859-Q861 VanDerWaalsContact O-N 3.09Å
862	C	58.1	Low	55.3	Low	18 Å²	18	53.3 Å²	53.3	12%	0.122	31%	0.305	C	S	.	.			trans	-87.2	114.7	171.7	177.8	0	0	0	0	107.2	I860 S864 H985	I860-C862 HydrophobicContact CG2-CB 3.94Å; I860-C862 PolarHBondContact O-N 3.28Å; C862-S864 PolarHBondContact O-N 3.02Å; C862-S864 VanDerWaalsContact O-N 3.17Å; C862-S864 PolarHBondContact SG-OG 3.41Å; C862-H985 PolarHBondContact SG-CE1 3.06Å; C862-H985 PolarHBondContact SG-ND1 3.09Å
863	S	56.3	Low	57.4	Low	129 Å²	129	48 Å²	48	90%	0.902	28%	0.281	S	S	*	.			trans	-69.4	-1.5	176.2	50.7	0	0	0	0	113.9
864	S	58.7	Low	59.3	Low	24 Å²	24	47 Å²	47	17%	0.168	27%	0.267	C	S	.	.	S	Bend	trans	-79.8	140.1	-178.7	81.2	0	0	0	0	112	C862 K866 H985	C862-S864 PolarHBondContact O-N 3.02Å; C862-S864 VanDerWaalsContact O-N 3.17Å; C862-S864 PolarHBondContact SG-OG 3.41Å; S864-K866 PolarHBondContact O-N 2.95Å; S864-H985 WeakPolarHBondContact OG-CB 3.44Å; S864-H985 PolarHBondContact OG-ND1 3.41Å
865	P	59	Low	61.1	Low	86 Å²	86	46.2 Å²	46.2	56%	0.558	26%	0.264	S	S	*	.	P	Polyproline II helix	trans	-67.7	120.5	178.4	25.7	-32.7	0	0	0	111
866	K	62.6	Low	63.2	Low	36 Å²	36	43.1 Å²	43.1	16%	0.157	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-88.6	142.5	179.4	-67.5	170.6	-173.3	153.6	0	112.2	N858 I860 S864 D870 W871 L874	N858-K866 PolarHBondContact O-NZ 3.46Å; I860-K866 PolarHBondContact O-NZ 2.82Å; S864-K866 PolarHBondContact O-N 2.95Å; K866-D870 HydrophobicContact CB-CB 4.02Å; K866-D870 HydrophobicContact CG-CB 4.37Å; K866-W871 HydrophobicContact CB-CD2 4.28Å; K866-W871 HydrophobicContact CB-CZ2 3.95Å; K866-W871 HydrophobicContact CD-CD2 4.25Å; K866-W871 HydrophobicContact CD-CE3 4.26Å; K866-W871 HydrophobicContact CD-CH2 3.83Å; K866-W871 HydrophobicContact CD-CZ2 3.78Å; K866-W871 HydrophobicContact CD-CZ3 4.07Å; K866-W871 HydrophobicContact CG-CZ2 4.47Å; K866-L874 HydrophobicContact CD-CD1 3.71Å
867	M	64.2	Low	65	Low	28 Å²	28	40.9 Å²	40.9	14%	0.138	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-99.9	164.7	177.6	-61.2	-154.9	66.7	0	0	112.8	I869 D870 W871 S980	M867-I869 HydrophobicContact CB-CG2 4.37Å; M867-I869 PolarHBondContact O-N 3.04Å; M867-I869 VanDerWaalsContact O-N 3.15Å; M867-D870 HydrophobicContact CB-CB 4.42Å; M867-D870 WeakPolarHBondContact CB-OD2 3.32Å; M867-D870 PolarHBondContact N-OD2 2.96Å; M867-D870 WeakPolarHBondContact O-CA 3.37Å; M867-D870 VanDerWaalsContact O-CB 3.24Å; M867-D870 WeakPolarHBondContact O-CB 3.5Å; M867-D870 PolarHBondContact O-N 2.98Å; M867-W871 PolarHBondContact O-N 2.95Å; M867-S980 VanDerWaalsContact CE-CA 3.43Å; M867-S980 VanDerWaalsContact SD-C 3.56Å; M867-S980 WeakPolarHBondContact SD-CA 3.37Å; M867-S980 WeakPolarHBondContact SD-CB 3.04Å
868	P	67.9	Low	66.6	Low	30 Å²	30	38.8 Å²	38.8	20%	0.195	21%	0.214	C	C	.	.	H	α-helix	trans	-52	-40.4	179.1	-30	36.8	0	0	0	114.1	W871 F872 Y911 Y914	P868-W871 PolarHBondContact O-N 3.46Å; P868-F872 PolarHBondContact O-N 2.92Å; P868-Y911 HydrophobicContact CB-CD2 4.17Å; P868-Y914 HydrophobicContact CG-CD2 3.95Å; P868-Y914 HydrophobicContact CG-CE2 3.89Å
869	I	72.2	Confident	68.4	Low	10 Å²	10	38.8 Å²	38.8	5%	0.051	21%	0.214	C	C	.	.	H	α-helix	trans	-70.8	-29	174.1	-174.7	160.7	0	0	0	113.3	M867 F872 L873 Y911 V981	M867-I869 HydrophobicContact CB-CG2 4.37Å; M867-I869 PolarHBondContact O-N 3.04Å; M867-I869 VanDerWaalsContact O-N 3.15Å; I869-F872 PolarHBondContact O-N 3.11Å; I869-L873 HydrophobicContact CG1-CD1 3.98Å; I869-L873 HydrophobicContact CG1-CG 4.05Å; I869-L873 WeakPolarHBondContact O-CB 3.09Å; I869-L873 VanDerWaalsContact O-CG 3.3Å; I869-L873 WeakPolarHBondContact O-CG 3.36Å; I869-L873 PolarHBondContact O-N 2.7Å; I869-Y911 HydrophobicContact CB-CD2 4.36Å; I869-Y911 HydrophobicContact CB-CE2 3.83Å; I869-Y911 HydrophobicContact CD1-CE2 4.48Å; I869-V981 HydrophobicContact CD1-CG2 4.08Å; I869-V981 HydrophobicContact CG2-CG1 4.29Å; I869-V981 HydrophobicContact CG2-CG2 3.38Å
870	D	74.3	Confident	70.3	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-66.6	-45.7	174.7	-62	-22.5	0	0	0	109.9	K866 M867 F872 L873 L874 S984 L986	K866-D870 HydrophobicContact CB-CB 4.02Å; K866-D870 HydrophobicContact CG-CB 4.37Å; M867-D870 HydrophobicContact CB-CB 4.42Å; M867-D870 WeakPolarHBondContact CB-OD2 3.32Å; M867-D870 PolarHBondContact N-OD2 2.96Å; M867-D870 WeakPolarHBondContact O-CA 3.37Å; M867-D870 VanDerWaalsContact O-CB 3.24Å; M867-D870 WeakPolarHBondContact O-CB 3.5Å; M867-D870 PolarHBondContact O-N 2.98Å; D870-F872 VanDerWaalsContact C-N 3.28Å; D870-F872 PolarHBondContact O-N 3.45Å; D870-L873 PolarHBondContact O-N 3.44Å; D870-L874 VanDerWaalsContact O-CB 3.27Å; D870-L874 WeakPolarHBondContact O-CB 3.47Å; D870-L874 VanDerWaalsContact O-CG 3.22Å; D870-L874 WeakPolarHBondContact O-CG 3.43Å; D870-L874 PolarHBondContact O-N 3.44Å; D870-S984 VanDerWaalsContact CG-OG 3.25Å; D870-S984 WeakPolarHBondContact OD1-CB 3.17Å; D870-S984 PolarHBondContact OD1-OG 2.94Å; D870-L986 VanDerWaalsContact CA-CD1 3.44Å; D870-L986 HydrophobicContact CB-CD1 3.29Å
871	W	73.7	Confident	71.7	Confident	95 Å²	95	38.8 Å²	38.8	36%	0.36	20%	0.204	S	C	.	.	H	α-helix	trans	-58.5	-41.6	172.3	-67.5	112	0	0	0	111.7	N858 K866 M867 P868 S875	N858-W871 HydrophobicContact CB-CE3 4.31Å; N858-W871 HydrophobicContact CB-CZ3 4.01Å; K866-W871 HydrophobicContact CB-CD2 4.28Å; K866-W871 HydrophobicContact CB-CZ2 3.95Å; K866-W871 HydrophobicContact CD-CD2 4.25Å; K866-W871 HydrophobicContact CD-CE3 4.26Å; K866-W871 HydrophobicContact CD-CH2 3.83Å; K866-W871 HydrophobicContact CD-CZ2 3.78Å; K866-W871 HydrophobicContact CD-CZ3 4.07Å; K866-W871 HydrophobicContact CG-CZ2 4.47Å; M867-W871 PolarHBondContact O-N 2.95Å; P868-W871 PolarHBondContact O-N 3.46Å; W871-S875 VanDerWaalsContact O-CB 3.29Å; W871-S875 WeakPolarHBondContact O-CB 3.04Å; W871-S875 PolarHBondContact O-N 2.86Å; W871-S875 PolarHBondContact O-OG 3.32Å
872	F	79.5	Confident	73.1	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.7	-48	175.6	-177.8	-95.7	0	0	0	112.7	P868 I869 D870 S875 A876 M904 C907 F928 V967 A971	P868-F872 PolarHBondContact O-N 2.92Å; I869-F872 PolarHBondContact O-N 3.11Å; D870-F872 VanDerWaalsContact C-N 3.28Å; D870-F872 PolarHBondContact O-N 3.45Å; F872-S875 WeakPolarHBondContact O-CB 3.38Å; F872-S875 PolarHBondContact O-N 3.11Å; F872-A876 WeakPolarHBondContact O-CB 3.46Å; F872-A876 PolarHBondContact O-N 3.13Å; F872-M904 HydrophobicContact CE2-CE 3.74Å; F872-M904 HydrophobicContact CZ-CE 3.64Å; F872-C907 HydrophobicContact CB-CB 4.19Å; F872-C907 HydrophobicContact CD2-CB 3.82Å; F872-F928 HydrophobicContact CD2-CZ 4.1Å; F872-F928 HydrophobicContact CE1-CE2 4.33Å; F872-F928 HydrophobicContact CE1-CZ 4.25Å; F872-F928 AromaticContact CE2-CE2 4Å; F872-F928 HydrophobicContact CE2-CE2 4Å; F872-F928 AromaticContact CE2-CZ 3.48Å; F872-F928 HydrophobicContact CE2-CZ 3.48Å; F872-F928 VanDerWaalsContact CE2-CZ 3.48Å; F872-F928 AromaticContact CZ-CE2 3.63Å; F872-F928 HydrophobicContact CZ-CE2 3.63Å; F872-F928 AromaticContact CZ-CZ 3.56Å; F872-F928 HydrophobicContact CZ-CZ 3.56Å; F872-V967 HydrophobicContact CZ-CG1 3.74Å; F872-A971 HydrophobicContact CD1-CB 3.8Å; F872-A971 HydrophobicContact CE1-CB 3.34Å; F872-A971 HydrophobicContact CZ-CB 3.98Å
873	L	79.5	Confident	74.2	Confident	2 Å²	2	30 Å²	30	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-69.3	-36.3	-178.3	-70.1	176.5	0	0	0	112.3	I869 D870 A876 G877 V968 L996 V1004	I869-L873 HydrophobicContact CG1-CD1 3.98Å; I869-L873 HydrophobicContact CG1-CG 4.05Å; I869-L873 WeakPolarHBondContact O-CB 3.09Å; I869-L873 VanDerWaalsContact O-CG 3.3Å; I869-L873 WeakPolarHBondContact O-CG 3.36Å; I869-L873 PolarHBondContact O-N 2.7Å; D870-L873 PolarHBondContact O-N 3.44Å; L873-A876 PolarHBondContact O-N 3.42Å; L873-G877 PolarHBondContact O-N 3.15Å; L873-V968 HydrophobicContact CD2-CG1 4.2Å; L873-L996 HydrophobicContact CB-CD2 4.13Å; L873-L996 HydrophobicContact CD1-CD1 4.27Å; L873-V1004 HydrophobicContact CD1-CG2 4.21Å; L873-V1004 HydrophobicContact CD2-CG2 3.67Å
874	L	77.9	Confident	75.3	Confident	10 Å²	10	29 Å²	29	5%	0.052	14%	0.143	C	C	.	.	H	α-helix	trans	-62.9	-44.5	171.1	-75.4	174	0	0	0	111.4	I860 K866 D870 A876 G877 N878 L986	I860-L874 HydrophobicContact CD1-CD1 4.22Å; I860-L874 HydrophobicContact CD1-CD2 3.33Å; I860-L874 HydrophobicContact CD1-CG 4.36Å; K866-L874 HydrophobicContact CD-CD1 3.71Å; D870-L874 VanDerWaalsContact O-CB 3.27Å; D870-L874 WeakPolarHBondContact O-CB 3.47Å; D870-L874 VanDerWaalsContact O-CG 3.22Å; D870-L874 WeakPolarHBondContact O-CG 3.43Å; D870-L874 PolarHBondContact O-N 3.44Å; L874-A876 VanDerWaalsContact C-N 3.32Å; L874-A876 PolarHBondContact O-N 2.88Å; L874-G877 PolarHBondContact O-N 3.47Å; L874-N878 WeakPolarHBondContact O-CB 3.39Å; L874-N878 PolarHBondContact O-N 3.03Å; L874-L986 HydrophobicContact CD1-CD1 4.21Å; L874-L986 HydrophobicContact CD2-CD1 4.39Å; L874-L986 HydrophobicContact CD2-CD2 3.39Å; L874-L986 HydrophobicContact CD2-CG 4.35Å; L874-L986 HydrophobicContact CG-CD1 3.9Å; L874-L986 HydrophobicContact CG-CD2 3.75Å; L874-L986 HydrophobicContact CG-CG 4.38Å
875	S	79	Confident	76.3	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61.5	-41.9	174.7	-58.5	0	0	0	0	111.5	N858 W871 F872 N878 F879 H903	N858-S875 PolarHBondContact ND2-OG 2.72Å; W871-S875 VanDerWaalsContact O-CB 3.29Å; W871-S875 WeakPolarHBondContact O-CB 3.04Å; W871-S875 PolarHBondContact O-N 2.86Å; W871-S875 PolarHBondContact O-OG 3.32Å; F872-S875 WeakPolarHBondContact O-CB 3.38Å; F872-S875 PolarHBondContact O-N 3.11Å; S875-N878 PolarHBondContact O-N 2.81Å; S875-F879 WeakPolarHBondContact O-CB 3.41Å; S875-F879 PolarHBondContact O-N 3.39Å; S875-H903 PolarHBondContact OG-CE1 3.5Å; S875-H903 PolarHBondContact OG-ND1 3.18Å
876	A	83.6	Confident	77.2	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-65.2	-39.6	176.5	0	0	0	0	0	112.3	F872 L873 L874 F879 E880 M904 V968 L1000	F872-A876 WeakPolarHBondContact O-CB 3.46Å; F872-A876 PolarHBondContact O-N 3.13Å; L873-A876 PolarHBondContact O-N 3.42Å; L874-A876 VanDerWaalsContact C-N 3.32Å; L874-A876 PolarHBondContact O-N 2.88Å; A876-F879 PolarHBondContact O-N 3.5Å; A876-E880 WeakPolarHBondContact O-CB 3.35Å; A876-E880 PolarHBondContact O-N 3.26Å; A876-M904 HydrophobicContact CB-CE 4.22Å; A876-V968 HydrophobicContact CB-CG2 4.14Å; A876-L1000 HydrophobicContact CB-CD1 4.04Å; A876-L1000 HydrophobicContact CB-CD2 4.43Å
877	G	82.2	Confident	77.8	Confident	11 Å²	11	35 Å²	35	11%	0.113	15%	0.15	C	C	.	.	H	α-helix	trans	-67.6	-41.1	175.4	0	0	0	0	0	112.8	L873 L874 F879 E880 R881	L873-G877 PolarHBondContact O-N 3.15Å; L874-G877 PolarHBondContact O-N 3.47Å; G877-F879 VanDerWaalsContact C-N 3.33Å; G877-E880 PolarHBondContact O-N 2.75Å; G877-R881 WeakPolarHBondContact O-CG 3.35Å; G877-R881 PolarHBondContact O-N 3.23Å; G877-R881 VanDerWaalsContact O-N 3.1Å
878	N	78.3	Confident	78.3	Confident	13 Å²	13	38 Å²	38	7%	0.07	17%	0.174	C	C	.	.	H	α-helix	trans	-65.3	-39.5	173.2	-75.9	-22.4	0	0	0	111.4	F854 N858 L874 S875 R881 L882	F854-N878 HydrophobicContact CE1-CB 4.28Å; F854-N878 HydrophobicContact CE2-CB 4.03Å; F854-N878 HydrophobicContact CZ-CB 3.68Å; N858-N878 PolarHBondContact OD1-ND2 3.43Å; L874-N878 WeakPolarHBondContact O-CB 3.39Å; L874-N878 PolarHBondContact O-N 3.03Å; S875-N878 PolarHBondContact O-N 2.81Å; N878-R881 PolarHBondContact O-N 3.43Å; N878-L882 WeakPolarHBondContact O-CB 3.4Å; N878-L882 PolarHBondContact O-N 3.4Å
879	F	83.7	Confident	78.6	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-65.8	-39.8	175.2	-167.7	-112	0	0	0	112.3	S875 A876 G877 L882 L883 V897 L901 M904 L935 I939 L963	S875-F879 WeakPolarHBondContact O-CB 3.41Å; S875-F879 PolarHBondContact O-N 3.39Å; A876-F879 PolarHBondContact O-N 3.5Å; G877-F879 VanDerWaalsContact C-N 3.33Å; F879-L882 WeakPolarHBondContact O-CB 3.44Å; F879-L882 PolarHBondContact O-N 3.17Å; F879-L883 HydrophobicContact CD1-CD1 3.94Å; F879-L883 HydrophobicContact CD1-CG 4.31Å; F879-L883 HydrophobicContact CE1-CD1 3.66Å; F879-L883 HydrophobicContact CE1-CD2 4.26Å; F879-L883 HydrophobicContact CE1-CG 4.04Å; F879-L883 HydrophobicContact CZ-CD1 4.32Å; F879-L883 HydrophobicContact CZ-CD2 4.09Å; F879-L883 HydrophobicContact CZ-CG 4.25Å; F879-L883 WeakPolarHBondContact O-CG 3.37Å; F879-L883 PolarHBondContact O-N 3.35Å; F879-V897 HydrophobicContact CE2-CG1 3.94Å; F879-V897 WeakPolarHBondContact CE2-O 3.5Å; F879-V897 HydrophobicContact CZ-CG1 4.13Å; F879-L901 HydrophobicContact CE2-CB 4.09Å; F879-L901 HydrophobicContact CZ-CB 4.33Å; F879-L901 HydrophobicContact CZ-CD1 4.43Å; F879-M904 HydrophobicContact CB-CG 4.48Å; F879-M904 HydrophobicContact CB-SD 3.85Å; F879-M904 HydrophobicContact CD1-SD 3.63Å; F879-M904 HydrophobicContact CE1-SD 4.35Å; F879-M904 HydrophobicContact CG-SD 3.76Å; F879-L935 HydrophobicContact CE1-CD1 4.39Å; F879-L935 HydrophobicContact CE1-CD2 4.15Å; F879-I939 HydrophobicContact CE1-CD1 4.42Å; F879-I939 HydrophobicContact CZ-CD1 3.72Å; F879-L963 HydrophobicContact CD1-CD1 3.97Å; F879-L963 HydrophobicContact CD1-CD2 3.76Å; F879-L963 HydrophobicContact CD1-CG 4.44Å; F879-L963 HydrophobicContact CE1-CD1 4.48Å; F879-L963 HydrophobicContact CE1-CD2 4.43Å
880	E	84.3	Confident	78.4	Confident	5 Å²	5	41 Å²	41	2%	0.023	19%	0.189	C	C	.	.	H	α-helix	trans	-57.1	-51.4	172.4	176.7	179.5	-149	0	0	111.4	A876 G877 L882 L883 E884 L960 L963 S997 H999	A876-E880 WeakPolarHBondContact O-CB 3.35Å; A876-E880 PolarHBondContact O-N 3.26Å; G877-E880 PolarHBondContact O-N 2.75Å; E880-L882 PolarHBondContact O-N 3.45Å; E880-L883 PolarHBondContact O-N 3.45Å; E880-E884 PolarHBondContact O-N 3Å; E880-L960 HydrophobicContact CG-CD1 3.96Å; E880-L963 HydrophobicContact CB-CD2 4.38Å; E880-S997 PolarHBondContact OE1-OG 3.04Å; E880-S997 VanDerWaalsContact OE1-OG 3.08Å; E880-S997 VanDerWaalsContact OE2-CB 3.23Å; E880-S997 WeakPolarHBondContact OE2-CB 3.36Å; E880-S997 PolarHBondContact OE2-OG 3.01Å; E880-H999 WeakPolarHBondContact OE1-CB 3.21Å; E880-H999 IonicContact OE1-CG 3.78Å; E880-H999 IonicContact OE1-ND1 2.61Å
881	R	81.2	Confident	78.2	Confident	132 Å²	132	46.8 Å²	46.8	50%	0.498	22%	0.22	S	C	.	.	H	α-helix	trans	-59.3	-35.6	176.2	-66.7	173.9	-167.4	171.8	2.5	111.9	G877 N878 E884 R885	G877-R881 WeakPolarHBondContact O-CG 3.35Å; G877-R881 PolarHBondContact O-N 3.23Å; G877-R881 VanDerWaalsContact O-N 3.1Å; N878-R881 PolarHBondContact O-N 3.43Å; R881-E884 PolarHBondContact O-N 3.32Å; R881-R885 WeakPolarHBondContact O-CG 3.22Å; R881-R885 PolarHBondContact O-N 3.22Å; R881-R885 VanDerWaalsContact O-N 3.09Å
882	L	79.5	Confident	78.1	Confident	15 Å²	15	47.9 Å²	47.9	8%	0.079	23%	0.23	C	C	.	.	H	α-helix	trans	-70.7	-38.5	179.6	-160.1	57.1	0	0	0	112.5	F854 N878 F879 E880 E884 R885 F886 Y893 P896 V897	F854-L882 HydrophobicContact CE2-CD2 4.19Å; N878-L882 WeakPolarHBondContact O-CB 3.4Å; N878-L882 PolarHBondContact O-N 3.4Å; F879-L882 WeakPolarHBondContact O-CB 3.44Å; F879-L882 PolarHBondContact O-N 3.17Å; E880-L882 PolarHBondContact O-N 3.45Å; L882-E884 VanDerWaalsContact C-N 3.32Å; L882-R885 PolarHBondContact O-N 3.07Å; L882-F886 VanDerWaalsContact O-CB 3.28Å; L882-F886 WeakPolarHBondContact O-CB 3.32Å; L882-F886 PolarHBondContact O-N 2.82Å; L882-Y893 HydrophobicContact CD1-CD1 3.66Å; L882-Y893 HydrophobicContact CD1-CE1 4.25Å; L882-P896 HydrophobicContact CD1-CB 3.68Å; L882-P896 HydrophobicContact CD2-CB 3.82Å; L882-P896 WeakPolarHBondContact CD2-O 3.23Å; L882-P896 HydrophobicContact CG-CB 4.11Å; L882-V897 HydrophobicContact CD2-CG2 4.31Å; L882-V897 HydrophobicContact CG-CG2 3.89Å
883	L	80.4	Confident	77.8	Confident	4 Å²	4	49.8 Å²	49.8	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-65.5	-35.5	172.9	-70.1	175.7	0	0	0	112	F879 E880 F886 R887 V897 I959 L963	F879-L883 HydrophobicContact CD1-CD1 3.94Å; F879-L883 HydrophobicContact CD1-CG 4.31Å; F879-L883 HydrophobicContact CE1-CD1 3.66Å; F879-L883 HydrophobicContact CE1-CD2 4.26Å; F879-L883 HydrophobicContact CE1-CG 4.04Å; F879-L883 HydrophobicContact CZ-CD1 4.32Å; F879-L883 HydrophobicContact CZ-CD2 4.09Å; F879-L883 HydrophobicContact CZ-CG 4.25Å; F879-L883 WeakPolarHBondContact O-CG 3.37Å; F879-L883 PolarHBondContact O-N 3.35Å; E880-L883 PolarHBondContact O-N 3.45Å; L883-F886 PolarHBondContact O-N 3.45Å; L883-R887 WeakPolarHBondContact O-CB 3.32Å; L883-R887 PolarHBondContact O-N 3.42Å; L883-V897 HydrophobicContact CD2-CG1 4.15Å; L883-V897 HydrophobicContact CD2-CG2 4.35Å; L883-I959 HydrophobicContact CD1-CB 4.48Å; L883-I959 HydrophobicContact CD1-CG2 3.7Å; L883-I959 HydrophobicContact CD2-CG2 3.8Å; L883-I959 HydrophobicContact CG-CG2 4.43Å; L883-L963 HydrophobicContact CD1-CD2 4.15Å
884	E	79.2	Confident	77.4	Confident	108 Å²	108	51.7 Å²	51.7	51%	0.505	25%	0.247	S	C	.	.	H	α-helix	trans	-64	-43.4	173	-70.8	-179.6	165	0	0	111.8	E880 R881 L882 R887 S888	E880-E884 PolarHBondContact O-N 3Å; R881-E884 PolarHBondContact O-N 3.32Å; L882-E884 VanDerWaalsContact C-N 3.32Å; E884-R887 VanDerWaalsContact O-CB 3.28Å; E884-R887 WeakPolarHBondContact O-CB 2.94Å; E884-R887 PolarHBondContact O-N 3.01Å; E884-S888 PolarHBondContact O-N 2.7Å
885	R	79.5	Confident	77	Confident	122 Å²	122	58.9 Å²	58.9	46%	0.46	28%	0.278	S	S	.	.	H	α-helix	trans	-68.9	-39.5	175.3	-68.4	-178.4	-177	-173.6	2	112.6	R881 L882 R887 S888 N889 Y893	R881-R885 WeakPolarHBondContact O-CG 3.22Å; R881-R885 PolarHBondContact O-N 3.22Å; R881-R885 VanDerWaalsContact O-N 3.09Å; L882-R885 PolarHBondContact O-N 3.07Å; R885-R887 VanDerWaalsContact C-N 3.25Å; R885-R887 PolarHBondContact O-N 2.8Å; R885-S888 WeakPolarHBondContact CA-OG 3.29Å; R885-S888 PolarHBondContact O-N 3.19Å; R885-S888 PolarHBondContact O-OG 2.96Å; R885-N889 PolarHBondContact O-N 3.09Å; R885-Y893 HydrophobicContact CB-CD1 3.81Å; R885-Y893 HydrophobicContact CB-CD2 3.99Å; R885-Y893 HydrophobicContact CB-CE1 3.69Å; R885-Y893 HydrophobicContact CB-CE2 3.91Å; R885-Y893 HydrophobicContact CB-CG 3.95Å; R885-Y893 HydrophobicContact CG-CE1 4.24Å
886	F	78.5	Confident	76.7	Confident	6 Å²	6	60.3 Å²	60.3	3%	0.026	29%	0.287	C	S	.	.	H	α-helix	trans	-59.8	-36.6	172.4	178.5	-102.5	0	0	0	112	L882 L883 S888 N889 P890 I894 V897 T942 V952 A954	L882-F886 VanDerWaalsContact O-CB 3.28Å; L882-F886 WeakPolarHBondContact O-CB 3.32Å; L882-F886 PolarHBondContact O-N 2.82Å; L883-F886 PolarHBondContact O-N 3.45Å; F886-S888 VanDerWaalsContact C-N 3.3Å; F886-S888 PolarHBondContact O-N 2.82Å; F886-N889 CarbonylContact O-C 3.55Å; F886-N889 PolarHBondContact O-N 3.2Å; F886-P890 HydrophobicContact CD2-CB 4.21Å; F886-P890 WeakPolarHBondContact CD2-O 3.19Å; F886-P890 HydrophobicContact CE2-CB 3.81Å; F886-P890 WeakPolarHBondContact CE2-O 3.25Å; F886-P890 HydrophobicContact CZ-CB 4.01Å; F886-P890 VanDerWaalsContact O-CA 3.22Å; F886-P890 WeakPolarHBondContact O-CA 3.28Å; F886-P890 WeakPolarHBondContact O-CD 3.48Å; F886-P890 VanDerWaalsContact O-CG 3.3Å; F886-P890 WeakPolarHBondContact O-CG 3.45Å; F886-P890 VanDerWaalsContact O-N 3.09Å; F886-I894 HydrophobicContact CE2-CB 4.13Å; F886-V897 HydrophobicContact CB-CG2 3.74Å; F886-V897 HydrophobicContact CD2-CG2 4.05Å; F886-V897 HydrophobicContact CG-CG2 3.93Å; F886-T942 HydrophobicContact CE1-CG2 4.35Å; F886-V952 HydrophobicContact CZ-CG1 4.19Å; F886-A954 HydrophobicContact CD1-CB 4.31Å; F886-A954 HydrophobicContact CE1-CB 3.59Å; F886-A954 HydrophobicContact CZ-CB 4.33Å
887	R	74.4	Confident	76.2	Confident	144 Å²	144	60.5 Å²	60.5	54%	0.543	29%	0.288	S	S	.	.	H	α-helix	trans	-59.5	-40.8	172.3	-170.8	176.6	-174.9	-168.2	-9.9	112.5	L883 E884 R885 P956	L883-R887 WeakPolarHBondContact O-CB 3.32Å; L883-R887 PolarHBondContact O-N 3.42Å; E884-R887 VanDerWaalsContact O-CB 3.28Å; E884-R887 WeakPolarHBondContact O-CB 2.94Å; E884-R887 PolarHBondContact O-N 3.01Å; R885-R887 VanDerWaalsContact C-N 3.25Å; R885-R887 PolarHBondContact O-N 2.8Å; R887-P956 HydrophobicContact CB-CB 4.4Å; R887-P956 HydrophobicContact CB-CG 3.48Å; R887-P956 VanDerWaalsContact CB-CG 3.48Å; R887-P956 HydrophobicContact CG-CG 3.41Å; R887-P956 VanDerWaalsContact CG-CG 3.41Å
888	S	74.6	Confident	75.7	Confident	91 Å²	91	62 Å²	62	64%	0.636	29%	0.293	S	S	*	.	H	α-helix	trans	-75.8	-37	177.7	46.7	0	0	0	0	113.3	E884 R885 F886	E884-S888 PolarHBondContact O-N 2.7Å; R885-S888 WeakPolarHBondContact CA-OG 3.29Å; R885-S888 PolarHBondContact O-N 3.19Å; R885-S888 PolarHBondContact O-OG 2.96Å; F886-S888 VanDerWaalsContact C-N 3.3Å; F886-S888 PolarHBondContact O-N 2.82Å
889	N	74.4	Confident	75.3	Confident	77 Å²	77	66.3 Å²	66.3	41%	0.412	31%	0.311	S	S	.	.			trans	-143.5	77.7	-174.2	-133.7	-3.4	0	0	0	111.5	R885 F886 N891 E892 Y893	R885-N889 PolarHBondContact O-N 3.09Å; F886-N889 CarbonylContact O-C 3.55Å; F886-N889 PolarHBondContact O-N 3.2Å; N889-N891 VanDerWaalsContact C-N 3.33Å; N889-N891 PolarHBondContact O-N 2.94Å; N889-E892 HydrophobicContact CB-CB 4.36Å; N889-E892 PolarHBondContact ND2-OE2 2.85Å; N889-E892 PolarHBondContact O-N 3.16Å; N889-Y893 HydrophobicContact CB-CD2 4.02Å; N889-Y893 HydrophobicContact CB-CE2 4.18Å; N889-Y893 WeakPolarHBondContact O-CD2 3.36Å; N889-Y893 PolarHBondContact O-N 3.46Å
890	P	69.3	Low	74.6	Confident	25 Å²	25	66.3 Å²	66.3	16%	0.162	31%	0.311	C	S	.	.	H	α-helix	trans	-60.5	-39.1	-169.9	-23.3	31	0	0	0	114	F886 E892 Y893 I894 V952	F886-P890 HydrophobicContact CD2-CB 4.21Å; F886-P890 WeakPolarHBondContact CD2-O 3.19Å; F886-P890 HydrophobicContact CE2-CB 3.81Å; F886-P890 WeakPolarHBondContact CE2-O 3.25Å; F886-P890 HydrophobicContact CZ-CB 4.01Å; F886-P890 VanDerWaalsContact O-CA 3.22Å; F886-P890 WeakPolarHBondContact O-CA 3.28Å; F886-P890 WeakPolarHBondContact O-CD 3.48Å; F886-P890 VanDerWaalsContact O-CG 3.3Å; F886-P890 WeakPolarHBondContact O-CG 3.45Å; F886-P890 VanDerWaalsContact O-N 3.09Å; P890-E892 VanDerWaalsContact C-N 3.34Å; P890-E892 PolarHBondContact O-N 3.14Å; P890-Y893 PolarHBondContact O-N 3.01Å; P890-I894 WeakPolarHBondContact O-CB 3.28Å; P890-I894 PolarHBondContact O-N 2.87Å; P890-I894 VanDerWaalsContact O-N 3.11Å; P890-V952 HydrophobicContact CB-CB 3.75Å; P890-V952 HydrophobicContact CB-CG1 3.7Å; P890-V952 HydrophobicContact CB-CG2 4.23Å; P890-V952 HydrophobicContact CG-CB 4.14Å; P890-V952 HydrophobicContact CG-CG1 4.23Å
891	N	70.1	Confident	74.3	Confident	122 Å²	122	66.2 Å²	66.2	65%	0.652	31%	0.311	S	S	*	.	H	α-helix	trans	-67.6	-34.4	-175.4	-66.9	-17.2	0	0	0	112.7	N889 I894	N889-N891 VanDerWaalsContact C-N 3.33Å; N889-N891 PolarHBondContact O-N 2.94Å; N891-I894 WeakPolarHBondContact O-CG2 3.4Å
892	E	71.6	Confident	73.8	Confident	119 Å²	119	65 Å²	65	56%	0.556	31%	0.311	S	S	*	.	H	α-helix	trans	-80	-34.1	-177.9	-166.9	178.9	-169.9	0	0	111.5	N889 P890	N889-E892 HydrophobicContact CB-CB 4.36Å; N889-E892 PolarHBondContact ND2-OE2 2.85Å; N889-E892 PolarHBondContact O-N 3.16Å; P890-E892 VanDerWaalsContact C-N 3.34Å; P890-E892 PolarHBondContact O-N 3.14Å
893	Y	72.1	Confident	73.4	Confident	39 Å²	39	66.3 Å²	66.3	15%	0.153	32%	0.316	C	S	.	.	H	α-helix	trans	-101.2	0.7	-172.6	-72.4	-83.9	0	0	0	114.8	L882 R885 N889 P890 F895 P896 V897	L882-Y893 HydrophobicContact CD1-CD1 3.66Å; L882-Y893 HydrophobicContact CD1-CE1 4.25Å; R885-Y893 HydrophobicContact CB-CD1 3.81Å; R885-Y893 HydrophobicContact CB-CD2 3.99Å; R885-Y893 HydrophobicContact CB-CE1 3.69Å; R885-Y893 HydrophobicContact CB-CE2 3.91Å; R885-Y893 HydrophobicContact CB-CG 3.95Å; R885-Y893 HydrophobicContact CG-CE1 4.24Å; N889-Y893 HydrophobicContact CB-CD2 4.02Å; N889-Y893 HydrophobicContact CB-CE2 4.18Å; N889-Y893 WeakPolarHBondContact O-CD2 3.36Å; N889-Y893 PolarHBondContact O-N 3.46Å; P890-Y893 PolarHBondContact O-N 3.01Å; Y893-F895 PolarHBondContact O-N 2.74Å; Y893-P896 HydrophobicContact CD1-CB 4.47Å; Y893-P896 HydrophobicContact CD1-CG 4.42Å; Y893-P896 WeakPolarHBondContact O-CD 3.41Å; Y893-V897 WeakPolarHBondContact O-CB 3.43Å; Y893-V897 VanDerWaalsContact O-CG2 3.27Å; Y893-V897 WeakPolarHBondContact O-CG2 3.49Å; Y893-V897 PolarHBondContact O-N 2.68Å
894	I	71.8	Confident	73.3	Confident	42 Å²	42	66.1 Å²	66.1	22%	0.215	32%	0.315	C	S	.	.	H	α-helix	trans	-56.3	-49.9	179.4	-172.1	168.2	0	0	0	113.1	F886 P890 N891 V897 M898 L943	F886-I894 HydrophobicContact CE2-CB 4.13Å; P890-I894 WeakPolarHBondContact O-CB 3.28Å; P890-I894 PolarHBondContact O-N 2.87Å; P890-I894 VanDerWaalsContact O-N 3.11Å; N891-I894 WeakPolarHBondContact O-CG2 3.4Å; I894-V897 PolarHBondContact O-N 2.74Å; I894-M898 WeakPolarHBondContact O-CG 3.31Å; I894-M898 PolarHBondContact O-N 3.32Å; I894-L943 HydrophobicContact CD1-CD1 4.48Å; I894-L943 HydrophobicContact CD1-CD2 3.38Å; I894-L943 HydrophobicContact CD1-CG 4.49Å; I894-L943 HydrophobicContact CG1-CD2 3.71Å
895	F	69.1	Low	73.2	Confident	161 Å²	161	65.1 Å²	65.1	71%	0.706	31%	0.31	S	S	*	.	H	α-helix	trans	-67.3	-46.3	179.7	-68.4	-74.7	0	0	0	111.9	Y893 V897 M898 F899	Y893-F895 PolarHBondContact O-N 2.74Å; F895-V897 VanDerWaalsContact C-N 3.31Å; F895-V897 PolarHBondContact O-N 3.22Å; F895-M898 PolarHBondContact O-N 3.39Å; F895-M898 VanDerWaalsContact O-N 3.16Å; F895-F899 PolarHBondContact O-N 3.1Å
896	P	72.5	Confident	72.8	Confident	30 Å²	30	63 Å²	63	20%	0.195	31%	0.311	C	S	.	.	H	α-helix	trans	-51.9	-46	169.7	-30.9	34.9	0	0	0	113.5	L849 L882 Y893 M898 F899 G900	L849-P896 HydrophobicContact CD2-CG 4.24Å; L882-P896 HydrophobicContact CD1-CB 3.68Å; L882-P896 HydrophobicContact CD2-CB 3.82Å; L882-P896 WeakPolarHBondContact CD2-O 3.23Å; L882-P896 HydrophobicContact CG-CB 4.11Å; Y893-P896 HydrophobicContact CD1-CB 4.47Å; Y893-P896 HydrophobicContact CD1-CG 4.42Å; Y893-P896 WeakPolarHBondContact O-CD 3.41Å; P896-M898 VanDerWaalsContact C-N 3.34Å; P896-M898 PolarHBondContact O-N 3.08Å; P896-F899 PolarHBondContact O-N 3.16Å; P896-G900 PolarHBondContact O-N 2.8Å
897	V	73.6	Confident	72.4	Confident	4 Å²	4	63.1 Å²	63.1	2%	0.024	31%	0.313	C	S	.	.	H	α-helix	trans	-59.4	-45.1	177.9	169	0	0	0	0	110.8	F879 L882 L883 F886 Y893 I894 F895 F899 G900 L901 I939	F879-V897 HydrophobicContact CE2-CG1 3.94Å; F879-V897 WeakPolarHBondContact CE2-O 3.5Å; F879-V897 HydrophobicContact CZ-CG1 4.13Å; L882-V897 HydrophobicContact CD2-CG2 4.31Å; L882-V897 HydrophobicContact CG-CG2 3.89Å; L883-V897 HydrophobicContact CD2-CG1 4.15Å; L883-V897 HydrophobicContact CD2-CG2 4.35Å; F886-V897 HydrophobicContact CB-CG2 3.74Å; F886-V897 HydrophobicContact CD2-CG2 4.05Å; F886-V897 HydrophobicContact CG-CG2 3.93Å; Y893-V897 WeakPolarHBondContact O-CB 3.43Å; Y893-V897 VanDerWaalsContact O-CG2 3.27Å; Y893-V897 WeakPolarHBondContact O-CG2 3.49Å; Y893-V897 PolarHBondContact O-N 2.68Å; I894-V897 PolarHBondContact O-N 2.74Å; F895-V897 VanDerWaalsContact C-N 3.31Å; F895-V897 PolarHBondContact O-N 3.22Å; V897-F899 VanDerWaalsContact C-N 3.31Å; V897-F899 PolarHBondContact O-N 2.73Å; V897-G900 PolarHBondContact O-N 3.46Å; V897-L901 WeakPolarHBondContact O-CB 3.43Å; V897-L901 PolarHBondContact O-N 2.86Å; V897-I939 HydrophobicContact CG1-CG2 4.48Å
898	M	72	Confident	72.5	Confident	42 Å²	42	56.5 Å²	56.5	21%	0.207	29%	0.288	C	S	.	.	H	α-helix	trans	-61.4	-39.7	176.8	-69.4	-58.9	-61.7	0	0	112.4	I894 F895 P896 L901 Q902 W936 I939 L943	I894-M898 WeakPolarHBondContact O-CG 3.31Å; I894-M898 PolarHBondContact O-N 3.32Å; F895-M898 PolarHBondContact O-N 3.39Å; F895-M898 VanDerWaalsContact O-N 3.16Å; P896-M898 VanDerWaalsContact C-N 3.34Å; P896-M898 PolarHBondContact O-N 3.08Å; M898-L901 PolarHBondContact O-N 3.44Å; M898-Q902 WeakPolarHBondContact O-CG 3.44Å; M898-Q902 PolarHBondContact O-N 3.17Å; M898-Q902 VanDerWaalsContact O-N 3.1Å; M898-W936 HydrophobicContact CE-CH2 3.58Å; M898-W936 HydrophobicContact CE-CZ2 4.38Å; M898-W936 HydrophobicContact CE-CZ3 3.89Å; M898-I939 HydrophobicContact SD-CG2 3.86Å; M898-L943 HydrophobicContact CG-CD1 4.47Å; M898-L943 HydrophobicContact SD-CD1 3.82Å
899	F	68.9	Low	72.3	Confident	104 Å²	104	55.4 Å²	55.4	46%	0.456	28%	0.275	S	S	.	.	H	α-helix	trans	-68.3	-43.6	177.1	-168.3	-104.1	0	0	0	112.5	F854 F895 P896 V897 L901 Q902 H903	F854-F899 HydrophobicContact CB-CD1 3.6Å; F854-F899 HydrophobicContact CB-CE1 3.39Å; F854-F899 HydrophobicContact CG-CD1 4.25Å; F854-F899 HydrophobicContact CG-CE1 4.41Å; F895-F899 PolarHBondContact O-N 3.1Å; P896-F899 PolarHBondContact O-N 3.16Å; V897-F899 VanDerWaalsContact C-N 3.31Å; V897-F899 PolarHBondContact O-N 2.73Å; F899-L901 PolarHBondContact O-N 2.75Å; F899-Q902 WeakPolarHBondContact O-CB 3.34Å; F899-Q902 PolarHBondContact O-N 3.09Å; F899-H903 PolarHBondContact O-N 3.47Å
900	G	69.7	Low	72	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-60.4	-35.4	175.5	0	0	0	0	0	112.6	P896 V897 H903 M904	P896-G900 PolarHBondContact O-N 2.8Å; V897-G900 PolarHBondContact O-N 3.46Å; G900-H903 PolarHBondContact O-N 2.88Å; G900-M904 PolarHBondContact O-N 3.38Å
901	L	77	Confident	71.8	Confident	4 Å²	4	55.8 Å²	55.8	2%	0.021	27%	0.273	C	S	.	.	H	α-helix	trans	-68.3	-42.1	174.6	-177.3	65.3	0	0	0	112.6	F879 V897 M898 F899 H903 M904 H905 L935 W936 I939	F879-L901 HydrophobicContact CE2-CB 4.09Å; F879-L901 HydrophobicContact CZ-CB 4.33Å; F879-L901 HydrophobicContact CZ-CD1 4.43Å; V897-L901 WeakPolarHBondContact O-CB 3.43Å; V897-L901 PolarHBondContact O-N 2.86Å; M898-L901 PolarHBondContact O-N 3.44Å; F899-L901 PolarHBondContact O-N 2.75Å; L901-H903 VanDerWaalsContact C-N 3.31Å; L901-H903 PolarHBondContact O-N 3.21Å; L901-M904 PolarHBondContact O-N 3.19Å; L901-H905 PolarHBondContact O-N 2.97Å; L901-L935 HydrophobicContact CD1-CD2 3.75Å; L901-L935 HydrophobicContact CD1-CG 3.98Å; L901-W936 HydrophobicContact CD2-CD2 4.12Å; L901-W936 HydrophobicContact CD2-CE3 3.18Å; L901-W936 HydrophobicContact CD2-CZ3 3.57Å; L901-W936 HydrophobicContact CG-CE3 3.92Å; L901-W936 HydrophobicContact CG-CZ3 4.27Å; L901-I939 HydrophobicContact CB-CD1 4.49Å; L901-I939 HydrophobicContact CD1-CD1 3.86Å; L901-I939 HydrophobicContact CD2-CD1 3.51Å; L901-I939 HydrophobicContact CG-CD1 4.17Å
902	Q	71.2	Confident	71.7	Confident	107 Å²	107	50 Å²	50	50%	0.5	24%	0.243	S	C	.	.	H	α-helix	trans	-59.9	-44.2	173.1	-74.2	177.3	-18.1	0	0	110.9	M898 F899 M904 H905 V906	M898-Q902 WeakPolarHBondContact O-CG 3.44Å; M898-Q902 PolarHBondContact O-N 3.17Å; M898-Q902 VanDerWaalsContact O-N 3.1Å; F899-Q902 WeakPolarHBondContact O-CB 3.34Å; F899-Q902 PolarHBondContact O-N 3.09Å; Q902-M904 PolarHBondContact O-N 3.36Å; Q902-H905 WeakPolarHBondContact O-CB 3.22Å; Q902-H905 PolarHBondContact O-N 3.32Å; Q902-H905 VanDerWaalsContact O-N 3.12Å; Q902-V906 WeakPolarHBondContact O-CG2 3.34Å; Q902-V906 PolarHBondContact O-N 2.92Å
903	H	72.4	Confident	71.4	Confident	41 Å²	41	48.1 Å²	48.1	19%	0.19	24%	0.236	C	C	.	.	H	α-helix	trans	-61.6	-44.6	176.7	-168.2	-78.1	0	0	0	111.8	F854 N858 S875 F899 G900 L901 H905 V906 C907	F854-H903 HydrophobicContact CD1-CB 3.69Å; F854-H903 AromaticContact CD1-CD2 3.76Å; F854-H903 AromaticContact CD1-CG 3.44Å; F854-H903 VanDerWaalsContact CD1-CG 3.44Å; F854-H903 AromaticContact CD1-ND1 3.78Å; F854-H903 HydrophobicContact CE1-CB 3.81Å; F854-H903 AromaticContact CE1-CG 3.72Å; F854-H903 AromaticContact CE1-ND1 3.73Å; N858-H903 PolarHBondContact ND2-CE1 2.95Å; N858-H903 PolarHBondContact ND2-NE2 3.43Å; S875-H903 PolarHBondContact OG-CE1 3.5Å; S875-H903 PolarHBondContact OG-ND1 3.18Å; F899-H903 PolarHBondContact O-N 3.47Å; G900-H903 PolarHBondContact O-N 2.88Å; L901-H903 VanDerWaalsContact C-N 3.31Å; L901-H903 PolarHBondContact O-N 3.21Å; H903-H905 VanDerWaalsContact C-N 3.28Å; H903-H905 PolarHBondContact O-N 3.12Å; H903-V906 PolarHBondContact O-N 3.27Å; H903-C907 PolarHBondContact O-N 3.19Å; H903-C907 PolarHBondContact O-SG 3.23Å; H903-C907 VanDerWaalsContact O-SG 3.39Å
904	M	77.4	Confident	70.9	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-58.8	-37.9	172.8	-81	-165.1	70.4	0	0	112.9	F872 A876 F879 G900 L901 Q902 C907 E908 M932 L963 V967	F872-M904 HydrophobicContact CE2-CE 3.74Å; F872-M904 HydrophobicContact CZ-CE 3.64Å; A876-M904 HydrophobicContact CB-CE 4.22Å; F879-M904 HydrophobicContact CB-CG 4.48Å; F879-M904 HydrophobicContact CB-SD 3.85Å; F879-M904 HydrophobicContact CD1-SD 3.63Å; F879-M904 HydrophobicContact CE1-SD 4.35Å; F879-M904 HydrophobicContact CG-SD 3.76Å; G900-M904 PolarHBondContact O-N 3.38Å; L901-M904 PolarHBondContact O-N 3.19Å; Q902-M904 PolarHBondContact O-N 3.36Å; M904-C907 PolarHBondContact O-N 3.1Å; M904-E908 PolarHBondContact O-N 2.94Å; M904-M932 HydrophobicContact CB-CE 4.01Å; M904-M932 HydrophobicContact CE-SD 4.32Å; M904-L963 HydrophobicContact CE-CD1 3.51Å; M904-L963 HydrophobicContact SD-CD1 3.74Å; M904-V967 HydrophobicContact CE-CG1 3.8Å
905	H	76.8	Confident	70.1	Confident	87 Å²	87	51.9 Å²	51.9	40%	0.403	26%	0.26	S	S	.	.	H	α-helix	trans	-67.7	-41.2	177.2	-176.2	40.2	0	0	0	112.3	L901 Q902 H903 C907 E908 L909 M932	L901-H905 PolarHBondContact O-N 2.97Å; Q902-H905 WeakPolarHBondContact O-CB 3.22Å; Q902-H905 PolarHBondContact O-N 3.32Å; Q902-H905 VanDerWaalsContact O-N 3.12Å; H903-H905 VanDerWaalsContact C-N 3.28Å; H903-H905 PolarHBondContact O-N 3.12Å; H905-C907 VanDerWaalsContact C-N 3.33Å; H905-C907 PolarHBondContact O-N 3.48Å; H905-E908 IonicContact CE1-OE2 3.05Å; H905-E908 PolarHBondContact CE1-OE2 2.97Å; H905-E908 IonicContact ND1-OE2 3.27Å; H905-E908 PolarHBondContact ND1-OE2 3.41Å; H905-E908 VanDerWaalsContact ND1-OE2 3.14Å; H905-E908 WeakPolarHBondContact O-CB 3.4Å; H905-E908 PolarHBondContact O-N 2.96Å; H905-E908 VanDerWaalsContact O-N 3.12Å; H905-L909 WeakPolarHBondContact O-CG 3.49Å; H905-L909 PolarHBondContact O-N 3.32Å; H905-M932 HydrophobicContact CB-CE 4.18Å
906	V	71.9	Confident	69.3	Low	77 Å²	77	45.8 Å²	45.8	47%	0.467	24%	0.235	S	C	.	.	H	α-helix	trans	-61	-44.5	173.1	174.5	0	0	0	0	110.6	Q902 H903 E908 L909 I910	Q902-V906 WeakPolarHBondContact O-CG2 3.34Å; Q902-V906 PolarHBondContact O-N 2.92Å; H903-V906 PolarHBondContact O-N 3.27Å; V906-E908 VanDerWaalsContact C-N 3.28Å; V906-E908 PolarHBondContact O-N 3.38Å; V906-L909 PolarHBondContact O-N 3.32Å; V906-I910 HydrophobicContact CG1-CD1 3.85Å; V906-I910 WeakPolarHBondContact O-CG1 3.42Å; V906-I910 PolarHBondContact O-N 3.44Å
907	C	70	Confident	68.3	Low	10 Å²	10	54 Å²	54	7%	0.068	26%	0.262	C	S	.	.	H	α-helix	trans	-61	-36.6	174	-67	0	0	0	0	112.2	F872 H903 M904 H905 Y911	F872-C907 HydrophobicContact CB-CB 4.19Å; F872-C907 HydrophobicContact CD2-CB 3.82Å; H903-C907 PolarHBondContact O-N 3.19Å; H903-C907 PolarHBondContact O-SG 3.23Å; H903-C907 VanDerWaalsContact O-SG 3.39Å; M904-C907 PolarHBondContact O-N 3.1Å; H905-C907 VanDerWaalsContact C-N 3.33Å; H905-C907 PolarHBondContact O-N 3.48Å; C907-Y911 WeakPolarHBondContact O-CB 3.34Å; C907-Y911 PolarHBondContact O-N 2.94Å
908	E	76.3	Confident	67.4	Low	5 Å²	5	54.6 Å²	54.6	2%	0.023	27%	0.265	C	S	.	.	H	α-helix	trans	-63.8	-47.1	174.1	176.6	-95.1	150.9	0	0	112.2	M904 H905 V906 I910 Y911 A912 F928 R929 M932	M904-E908 PolarHBondContact O-N 2.94Å; H905-E908 IonicContact CE1-OE2 3.05Å; H905-E908 PolarHBondContact CE1-OE2 2.97Å; H905-E908 IonicContact ND1-OE2 3.27Å; H905-E908 PolarHBondContact ND1-OE2 3.41Å; H905-E908 VanDerWaalsContact ND1-OE2 3.14Å; H905-E908 WeakPolarHBondContact O-CB 3.4Å; H905-E908 PolarHBondContact O-N 2.96Å; H905-E908 VanDerWaalsContact O-N 3.12Å; V906-E908 VanDerWaalsContact C-N 3.28Å; V906-E908 PolarHBondContact O-N 3.38Å; E908-I910 PolarHBondContact O-N 3.02Å; E908-Y911 PolarHBondContact O-N 3.36Å; E908-A912 WeakPolarHBondContact O-CB 3.42Å; E908-A912 PolarHBondContact O-N 3Å; E908-F928 HydrophobicContact CB-CE1 3.73Å; E908-F928 HydrophobicContact CB-CZ 3.92Å; E908-F928 HydrophobicContact CG-CD1 3.58Å; E908-F928 HydrophobicContact CG-CE1 3.22Å; E908-F928 HydrophobicContact CG-CG 4.4Å; E908-F928 HydrophobicContact CG-CZ 3.77Å; E908-R929 WeakPolarHBondContact OE1-CG 3.4Å; E908-R929 IonicContact OE1-NE 3.4Å; E908-R929 PolarHBondContact OE1-NE 3.21Å; E908-M932 HydrophobicContact CB-CG 4.3Å; E908-M932 HydrophobicContact CG-CG 4.06Å
909	L	71.2	Confident	66.7	Low	68 Å²	68	55.7 Å²	55.7	36%	0.356	28%	0.275	S	S	.	.	H	α-helix	trans	-58.9	-49.3	178.9	-69.8	173.5	0	0	0	110.9	H905 V906 Y911 A912 D913	H905-L909 WeakPolarHBondContact O-CG 3.49Å; H905-L909 PolarHBondContact O-N 3.32Å; V906-L909 PolarHBondContact O-N 3.32Å; L909-Y911 VanDerWaalsContact C-N 3.31Å; L909-Y911 PolarHBondContact O-N 3.39Å; L909-A912 PolarHBondContact O-N 2.66Å; L909-D913 WeakPolarHBondContact O-CB 3.15Å; L909-D913 PolarHBondContact O-N 3Å
910	I	67.7	Low	66.2	Low	95 Å²	95	52.8 Å²	52.8	49%	0.487	27%	0.274	S	S	.	.	H	α-helix	trans	-60.9	-42.8	176.8	-63.5	168.4	0	0	0	110.8	V906 E908 Y914	V906-I910 HydrophobicContact CG1-CD1 3.85Å; V906-I910 WeakPolarHBondContact O-CG1 3.42Å; V906-I910 PolarHBondContact O-N 3.44Å; E908-I910 PolarHBondContact O-N 3.02Å; I910-Y914 PolarHBondContact O-N 2.96Å
911	Y	65.8	Low	66	Low	14 Å²	14	53 Å²	53	6%	0.055	28%	0.276	C	S	.	.	H	α-helix	trans	-70.9	-37.3	-178.2	-173.9	-120.4	0	0	0	112.8	P868 I869 C907 E908 L909 F928 A971 L974 S975	P868-Y911 HydrophobicContact CB-CD2 4.17Å; I869-Y911 HydrophobicContact CB-CD2 4.36Å; I869-Y911 HydrophobicContact CB-CE2 3.83Å; I869-Y911 HydrophobicContact CD1-CE2 4.48Å; C907-Y911 WeakPolarHBondContact O-CB 3.34Å; C907-Y911 PolarHBondContact O-N 2.94Å; E908-Y911 PolarHBondContact O-N 3.36Å; L909-Y911 VanDerWaalsContact C-N 3.31Å; L909-Y911 PolarHBondContact O-N 3.39Å; Y911-F928 HydrophobicContact CD1-CD1 4.37Å; Y911-F928 AromaticContact CD1-CE1 3.72Å; Y911-F928 HydrophobicContact CD1-CE1 3.72Å; Y911-F928 HydrophobicContact CD1-CZ 4.33Å; Y911-F928 HydrophobicContact CE1-CE1 4.5Å; Y911-A971 HydrophobicContact CE1-CB 4.32Å; Y911-A971 PolarHBondContact OH-O 3.4Å; Y911-L974 HydrophobicContact CE1-CB 3.73Å; Y911-L974 HydrophobicContact CE1-CD1 4.08Å; Y911-L974 VanDerWaalsContact OH-C 3.23Å; Y911-S975 VanDerWaalsContact OH-CA 3.23Å; Y911-S975 WeakPolarHBondContact OH-CA 3.37Å; Y911-S975 PolarHBondContact OH-N 3.3Å
912	A	67	Low	65.6	Low	2 Å²	2	58.4 Å²	58.4	2%	0.017	30%	0.304	C	S	.	.	H	α-helix	trans	-72.6	-40.3	178.6	0	0	0	0	0	111.6	E908 L909 Y914 R925	E908-A912 WeakPolarHBondContact O-CB 3.42Å; E908-A912 PolarHBondContact O-N 3Å; L909-A912 PolarHBondContact O-N 2.66Å; A912-Y914 VanDerWaalsContact C-N 3.29Å; A912-Y914 PolarHBondContact O-N 3.15Å; A912-R925 PolarHBondContact O-NE 3.37Å; A912-R925 PolarHBondContact O-NH2 3.33Å
913	D	65.8	Low	65.4	Low	79 Å²	79	56.2 Å²	56.2	42%	0.422	30%	0.304	S	S	.	.	H	α-helix	trans	-82.7	-6.7	-177.1	-65.2	-18.6	0	0	0	113.1	L909 R929	L909-D913 WeakPolarHBondContact O-CB 3.15Å; L909-D913 PolarHBondContact O-N 3Å; D913-R929 IonicContact OD1-NH2 3.27Å; D913-R929 PolarHBondContact OD1-NH2 3.47Å
914	Y	61.1	Low	65.3	Low	66 Å²	66	54.4 Å²	54.4	26%	0.259	30%	0.296	S	S	.	.	S	Bend	trans	-53.6	135.4	171.6	-150.5	-96.1	0	0	0	110.3	P868 I910 A912 N916 R925 M978 P979	P868-Y914 HydrophobicContact CG-CD2 3.95Å; P868-Y914 HydrophobicContact CG-CE2 3.89Å; I910-Y914 PolarHBondContact O-N 2.96Å; A912-Y914 VanDerWaalsContact C-N 3.29Å; A912-Y914 PolarHBondContact O-N 3.15Å; Y914-N916 PolarHBondContact O-N 2.82Å; Y914-N916 VanDerWaalsContact O-N 3.1Å; Y914-R925 PolarHBondContact O-NH2 3.42Å; Y914-R925 VanDerWaalsContact O-NH2 3.12Å; Y914-M978 HydrophobicContact CD1-CE 3.99Å; Y914-M978 HydrophobicContact CD1-SD 4.04Å; Y914-M978 WeakPolarHBondContact O-CE 3.22Å; Y914-P979 HydrophobicContact CE1-CG 4.01Å
915	P	54.3	Low	65.2	Low	94 Å²	94	56.5 Å²	56.5	61%	0.61	30%	0.304	S	S	*	.			trans	-63.7	112.9	-170.6	19.3	-31	0	0	0	112.4	M978	P915-M978 WeakPolarHBondContact O-CE 3.46Å
916	N	54	Low	65.2	Low	33 Å²	33	57.3 Å²	57.3	18%	0.176	31%	0.308	C	S	.	.			trans	-118.3	134.7	176.2	-146.1	-44.6	0	0	0	111.5	Y914 M918 V921 V977 M978	Y914-N916 PolarHBondContact O-N 2.82Å; Y914-N916 VanDerWaalsContact O-N 3.1Å; N916-M918 WeakPolarHBondContact OD1-CB 3.44Å; N916-M918 PolarHBondContact OD1-N 2.94Å; N916-V921 HydrophobicContact CB-CB 4.43Å; N916-V921 HydrophobicContact CB-CG1 3.91Å; N916-V921 HydrophobicContact CB-CG2 4.11Å; N916-V921 VanDerWaalsContact CG-CG2 3.45Å; N916-V921 WeakPolarHBondContact ND2-CG2 3.33Å; N916-V977 WeakPolarHBondContact ND2-CG1 3.43Å; N916-V977 PolarHBondContact ND2-O 2.82Å; N916-V977 PolarHBondContact OD1-O 3.11Å; N916-M978 VanDerWaalsContact CA-CE 3.43Å; N916-M978 HydrophobicContact CB-CE 3.17Å; N916-M978 HydrophobicContact CB-SD 4.26Å; N916-M978 VanDerWaalsContact CG-CE 3.4Å; N916-M978 WeakPolarHBondContact ND2-CE 3.37Å; N916-M978 WeakPolarHBondContact ND2-CG 3.37Å; N916-M978 PolarHBondContact ND2-SD 3.02Å; N916-M978 VanDerWaalsContact ND2-SD 3.43Å
917	R	50.8	Low	65.6	Low	203 Å²	203	58.3 Å²	58.3	77%	0.766	31%	0.311	S	S	*	.			trans	-112.2	3.4	173.7	-64	-169.8	-177.2	-172.2	3.4	113.7
918	M	54.6	Low	66.2	Low	16 Å²	16	57.9 Å²	57.9	8%	0.079	31%	0.308	C	S	.	.	S	Bend	trans	-75.7	134.5	177.4	-166.3	179.5	169	0	0	111.2	N916 V921 V977 L1015 I1018 F1085	N916-M918 WeakPolarHBondContact OD1-CB 3.44Å; N916-M918 PolarHBondContact OD1-N 2.94Å; M918-V921 HydrophobicContact CB-CG2 3.84Å; M918-V921 WeakPolarHBondContact O-CG2 3.48Å; M918-V977 HydrophobicContact CB-CG1 3.31Å; M918-V977 HydrophobicContact CG-CG1 3.78Å; M918-V977 HydrophobicContact SD-CB 4.24Å; M918-V977 HydrophobicContact SD-CG1 3.27Å; M918-V977 WeakPolarHBondContact SD-CG1 3.46Å; M918-V977 HydrophobicContact SD-CG2 4.15Å; M918-L1015 HydrophobicContact CE-CD1 3.2Å; M918-L1015 HydrophobicContact CE-CG 4.41Å; M918-L1015 HydrophobicContact SD-CD1 4.18Å; M918-I1018 HydrophobicContact CE-CB 4.09Å; M918-I1018 HydrophobicContact CE-CD1 3.58Å; M918-I1018 HydrophobicContact CE-CG1 4.44Å; M918-I1018 HydrophobicContact CE-CG2 3.88Å; M918-F1085 HydrophobicContact CE-CE2 4.2Å; M918-F1085 HydrophobicContact CG-CD1 4.24Å; M918-F1085 HydrophobicContact CG-CD2 4.28Å; M918-F1085 HydrophobicContact CG-CE1 4.38Å; M918-F1085 HydrophobicContact CG-CE2 4.36Å; M918-F1085 HydrophobicContact CG-CG 4.18Å; M918-F1085 HydrophobicContact CG-CZ 4.37Å
919	P	56.4	Low	66.4	Low	65 Å²	65	61.8 Å²	61.8	42%	0.422	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	143.6	172	-20	30.7	0	0	0	111.7	V921 I1018 F1085	P919-V921 VanDerWaalsContact C-N 3.31Å; P919-V921 PolarHBondContact O-N 3.1Å; P919-I1018 WeakPolarHBondContact O-CD1 3.37Å; P919-F1085 HydrophobicContact CG-CD1 4.49Å; P919-F1085 HydrophobicContact CG-CE1 3.57Å; P919-F1085 HydrophobicContact CG-CZ 4.08Å
920	G	58.5	Low	66.9	Low	42 Å²	42	61.1 Å²	61.1	43%	0.433	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.4	-5.8	176.9	0	0	0	0	0	115.2	D922 A923	G920-D922 PolarHBondContact O-N 3.44Å; G920-A923 WeakPolarHBondContact O-CB 3.39Å; G920-A923 PolarHBondContact O-N 2.86Å
921	V	65.5	Low	67.7	Low	6 Å²	6	56.8 Å²	56.8	4%	0.036	30%	0.299	C	S	.	.	H	α-helix	trans	-56.6	-36.3	176.2	170.6	0	0	0	0	112.2	N916 M918 P919 A923 S924 R925 L974 V977	N916-V921 HydrophobicContact CB-CB 4.43Å; N916-V921 HydrophobicContact CB-CG1 3.91Å; N916-V921 HydrophobicContact CB-CG2 4.11Å; N916-V921 VanDerWaalsContact CG-CG2 3.45Å; N916-V921 WeakPolarHBondContact ND2-CG2 3.33Å; M918-V921 HydrophobicContact CB-CG2 3.84Å; M918-V921 WeakPolarHBondContact O-CG2 3.48Å; P919-V921 VanDerWaalsContact C-N 3.31Å; P919-V921 PolarHBondContact O-N 3.1Å; V921-A923 PolarHBondContact O-N 3.31Å; V921-S924 CarbonylContact O-C 3.51Å; V921-S924 PolarHBondContact O-N 2.5Å; V921-R925 HydrophobicContact CG1-CG 3.9Å; V921-R925 WeakPolarHBondContact O-CG 3.12Å; V921-R925 PolarHBondContact O-N 2.94Å; V921-L974 HydrophobicContact CG1-CD2 4.49Å; V921-V977 HydrophobicContact CG2-CB 4.27Å; V921-V977 HydrophobicContact CG2-CG1 3.29Å
922	D	68.2	Low	68.6	Low	116 Å²	116	56.6 Å²	56.6	62%	0.62	30%	0.299	S	S	*	.	H	α-helix	trans	-61.1	-32.8	179.3	-63	-34.5	0	0	0	112.4	G920 R925 Q926	G920-D922 PolarHBondContact O-N 3.44Å; D922-R925 IonicContact OD1-NH1 3.45Å; D922-R925 PolarHBondContact OD1-NH1 2.83Å; D922-Q926 WeakPolarHBondContact O-CB 3.31Å; D922-Q926 PolarHBondContact O-N 3.34Å
923	A	68.9	Low	69.4	Low	61 Å²	61	63.3 Å²	63.3	50%	0.504	33%	0.328	S	S	.	.	H	α-helix	trans	-67	-42.1	174.9	0	0	0	0	0	111.2	G920 V921 Q926 L927	G920-A923 WeakPolarHBondContact O-CB 3.39Å; G920-A923 PolarHBondContact O-N 2.86Å; V921-A923 PolarHBondContact O-N 3.31Å; A923-Q926 PolarHBondContact O-N 2.81Å; A923-L927 WeakPolarHBondContact O-CG 3.34Å; A923-L927 PolarHBondContact O-N 3.29Å
924	S	69.5	Low	70.1	Confident	3 Å²	3	65.9 Å²	65.9	2%	0.021	33%	0.332	C	S	.	.	H	α-helix	trans	-73.1	-37.3	178.5	-60.5	0	0	0	0	112.5	V921 Q926 L927 F928 Q1014	V921-S924 CarbonylContact O-C 3.51Å; V921-S924 PolarHBondContact O-N 2.5Å; S924-Q926 VanDerWaalsContact C-N 3.31Å; S924-Q926 PolarHBondContact O-N 2.74Å; S924-L927 PolarHBondContact O-N 2.92Å; S924-F928 WeakPolarHBondContact O-CB 3.44Å; S924-F928 PolarHBondContact O-N 2.82Å; S924-Q1014 VanDerWaalsContact OG-CD 3.3Å; S924-Q1014 PolarHBondContact OG-NE2 2.61Å; S924-Q1014 PolarHBondContact OG-OE1 3.18Å
925	R	75.3	Confident	71.2	Confident	44 Å²	44	62.8 Å²	62.8	17%	0.166	32%	0.319	C	S	.	.	H	α-helix	trans	-59.8	-43	169.3	-76.3	176.8	176.3	159.7	-9.3	111	A912 Y914 V921 D922 F928 R929 L974	A912-R925 PolarHBondContact O-NE 3.37Å; A912-R925 PolarHBondContact O-NH2 3.33Å; Y914-R925 PolarHBondContact O-NH2 3.42Å; Y914-R925 VanDerWaalsContact O-NH2 3.12Å; V921-R925 HydrophobicContact CG1-CG 3.9Å; V921-R925 WeakPolarHBondContact O-CG 3.12Å; V921-R925 PolarHBondContact O-N 2.94Å; D922-R925 IonicContact OD1-NH1 3.45Å; D922-R925 PolarHBondContact OD1-NH1 2.83Å; R925-F928 PolarHBondContact O-N 3.04Å; R925-R929 WeakPolarHBondContact O-CB 3.27Å; R925-R929 WeakPolarHBondContact O-CG 3.33Å; R925-R929 PolarHBondContact O-N 3.35Å; R925-L974 HydrophobicContact CG-CD2 4.43Å
926	Q	77.6	Confident	72.5	Confident	104 Å²	104	63 Å²	63	49%	0.486	31%	0.308	S	S	.	.	H	α-helix	trans	-65.7	-40.5	177.2	-175.4	60.1	28.2	0	0	111.8	D922 A923 S924 F928 T930	D922-Q926 WeakPolarHBondContact O-CB 3.31Å; D922-Q926 PolarHBondContact O-N 3.34Å; A923-Q926 PolarHBondContact O-N 2.81Å; S924-Q926 VanDerWaalsContact C-N 3.31Å; S924-Q926 PolarHBondContact O-N 2.74Å; Q926-F928 VanDerWaalsContact C-N 3.34Å; Q926-T930 VanDerWaalsContact O-CB 3.29Å; Q926-T930 WeakPolarHBondContact O-CB 3.25Å; Q926-T930 PolarHBondContact O-N 2.97Å; Q926-T930 PolarHBondContact O-OG1 3.06Å
927	L	78.8	Confident	73.7	Confident	99 Å²	99	66.1 Å²	66.1	52%	0.518	33%	0.325	S	S	.	.	H	α-helix	trans	-60.5	-44.6	173.3	-75.8	167.7	0	0	0	111.1	A923 S924 T930 A931	A923-L927 WeakPolarHBondContact O-CG 3.34Å; A923-L927 PolarHBondContact O-N 3.29Å; S924-L927 PolarHBondContact O-N 2.92Å; L927-T930 PolarHBondContact O-N 2.59Å; L927-A931 WeakPolarHBondContact O-CB 3.42Å; L927-A931 PolarHBondContact O-N 3.28Å
928	F	82	Confident	75	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-64.3	-47	178.8	-174	-139.9	0	0	0	112.7	F872 E908 Y911 S924 R925 Q926 T930 A931 M932 V967 A970 A971 L974	F872-F928 HydrophobicContact CD2-CZ 4.1Å; F872-F928 HydrophobicContact CE1-CE2 4.33Å; F872-F928 HydrophobicContact CE1-CZ 4.25Å; F872-F928 AromaticContact CE2-CE2 4Å; F872-F928 HydrophobicContact CE2-CE2 4Å; F872-F928 AromaticContact CE2-CZ 3.48Å; F872-F928 HydrophobicContact CE2-CZ 3.48Å; F872-F928 VanDerWaalsContact CE2-CZ 3.48Å; F872-F928 AromaticContact CZ-CE2 3.63Å; F872-F928 HydrophobicContact CZ-CE2 3.63Å; F872-F928 AromaticContact CZ-CZ 3.56Å; F872-F928 HydrophobicContact CZ-CZ 3.56Å; E908-F928 HydrophobicContact CB-CE1 3.73Å; E908-F928 HydrophobicContact CB-CZ 3.92Å; E908-F928 HydrophobicContact CG-CD1 3.58Å; E908-F928 HydrophobicContact CG-CE1 3.22Å; E908-F928 HydrophobicContact CG-CG 4.4Å; E908-F928 HydrophobicContact CG-CZ 3.77Å; Y911-F928 HydrophobicContact CD1-CD1 4.37Å; Y911-F928 AromaticContact CD1-CE1 3.72Å; Y911-F928 HydrophobicContact CD1-CE1 3.72Å; Y911-F928 HydrophobicContact CD1-CZ 4.33Å; Y911-F928 HydrophobicContact CE1-CE1 4.5Å; S924-F928 WeakPolarHBondContact O-CB 3.44Å; S924-F928 PolarHBondContact O-N 2.82Å; R925-F928 PolarHBondContact O-N 3.04Å; Q926-F928 VanDerWaalsContact C-N 3.34Å; F928-T930 VanDerWaalsContact C-N 3.28Å; F928-T930 PolarHBondContact O-N 3.08Å; F928-A931 PolarHBondContact O-N 3.47Å; F928-M932 HydrophobicContact CE2-CG 4.36Å; F928-M932 PolarHBondContact O-N 3.47Å; F928-V967 HydrophobicContact CE2-CG1 4.03Å; F928-V967 WeakPolarHBondContact CE2-O 3.49Å; F928-A970 HydrophobicContact CB-CB 4.11Å; F928-A970 HydrophobicContact CD2-CB 4Å; F928-A970 HydrophobicContact CG-CB 4.48Å; F928-A971 HydrophobicContact CD2-CB 4.23Å; F928-A971 HydrophobicContact CE2-CB 3.64Å; F928-A971 HydrophobicContact CZ-CB 3.86Å; F928-L974 HydrophobicContact CB-CD1 3.79Å; F928-L974 HydrophobicContact CD1-CD1 3.8Å; F928-L974 HydrophobicContact CG-CD1 3.99Å
929	R	81.6	Confident	76.1	Confident	87 Å²	87	56.3 Å²	56.3	33%	0.328	29%	0.289	S	S	.	.	H	α-helix	trans	-58.6	-38.7	172.5	-77.1	175.7	-177.5	162.4	-0	112.5	E908 D913 R925 K933	E908-R929 WeakPolarHBondContact OE1-CG 3.4Å; E908-R929 IonicContact OE1-NE 3.4Å; E908-R929 PolarHBondContact OE1-NE 3.21Å; D913-R929 IonicContact OD1-NH2 3.27Å; D913-R929 PolarHBondContact OD1-NH2 3.47Å; R925-R929 WeakPolarHBondContact O-CB 3.27Å; R925-R929 WeakPolarHBondContact O-CG 3.33Å; R925-R929 PolarHBondContact O-N 3.35Å; R929-K933 WeakPolarHBondContact O-CG 3.15Å; R929-K933 PolarHBondContact O-N 3.17Å; R929-K933 VanDerWaalsContact O-N 3.08Å
930	T	82.5	Confident	76.8	Confident	54 Å²	54	55.6 Å²	55.6	33%	0.331	28%	0.282	S	S	.	.	H	α-helix	trans	-68.8	-41.2	178.6	-56.3	0	0	0	0	111.1	Q926 L927 F928 K933 R934	Q926-T930 VanDerWaalsContact O-CB 3.29Å; Q926-T930 WeakPolarHBondContact O-CB 3.25Å; Q926-T930 PolarHBondContact O-N 2.97Å; Q926-T930 PolarHBondContact O-OG1 3.06Å; L927-T930 PolarHBondContact O-N 2.59Å; F928-T930 VanDerWaalsContact C-N 3.28Å; F928-T930 PolarHBondContact O-N 3.08Å; T930-K933 PolarHBondContact O-N 3.23Å; T930-R934 WeakPolarHBondContact O-CG 3.18Å; T930-R934 PolarHBondContact O-N 2.84Å
931	A	84.5	Confident	77.3	Confident	4 Å²	4	56.4 Å²	56.4	3%	0.033	28%	0.28	C	S	.	.	H	α-helix	trans	-62.7	-43.7	174.9	0	0	0	0	0	111.8	L927 F928 K933 R934 L935 E966 V967	L927-A931 WeakPolarHBondContact O-CB 3.42Å; L927-A931 PolarHBondContact O-N 3.28Å; F928-A931 PolarHBondContact O-N 3.47Å; A931-K933 PolarHBondContact O-N 3.37Å; A931-R934 WeakPolarHBondContact O-CB 2.98Å; A931-R934 PolarHBondContact O-N 3.22Å; A931-R934 VanDerWaalsContact O-N 3.16Å; A931-L935 PolarHBondContact O-N 3.11Å; A931-E966 HydrophobicContact CB-CB 3.87Å; A931-V967 HydrophobicContact CB-CB 4.47Å; A931-V967 HydrophobicContact CB-CG2 3.75Å
932	M	84.6	Confident	77.4	Confident	11 Å²	11	57.1 Å²	57.1	5%	0.054	29%	0.285	C	S	.	.	H	α-helix	trans	-61	-41.9	175.5	-77.4	-60	-68.2	0	0	112.6	M904 H905 E908 F928 R934 L935 W936 V967	M904-M932 HydrophobicContact CB-CE 4.01Å; M904-M932 HydrophobicContact CE-SD 4.32Å; H905-M932 HydrophobicContact CB-CE 4.18Å; E908-M932 HydrophobicContact CB-CG 4.3Å; E908-M932 HydrophobicContact CG-CG 4.06Å; F928-M932 HydrophobicContact CE2-CG 4.36Å; F928-M932 PolarHBondContact O-N 3.47Å; M932-R934 VanDerWaalsContact C-N 3.32Å; M932-R934 PolarHBondContact O-N 3.45Å; M932-L935 WeakPolarHBondContact O-CB 3.46Å; M932-L935 PolarHBondContact O-N 2.88Å; M932-L935 HydrophobicContact SD-CD2 4.39Å; M932-W936 PolarHBondContact O-N 3.16Å; M932-V967 HydrophobicContact CG-CG1 4.5Å; M932-V967 HydrophobicContact SD-CG1 3.58Å; M932-V967 VanDerWaalsContact SD-CG1 3.58Å; M932-V967 HydrophobicContact SD-CG2 4.18Å
933	K	82.2	Confident	77.2	Confident	142 Å²	142	53.2 Å²	53.2	62%	0.617	26%	0.264	S	S	*	.	H	α-helix	trans	-63.1	-37.1	174.3	-74.3	178.4	-178	-175.2	0	112.6	R929 T930 A931 W936 N937	R929-K933 WeakPolarHBondContact O-CG 3.15Å; R929-K933 PolarHBondContact O-N 3.17Å; R929-K933 VanDerWaalsContact O-N 3.08Å; T930-K933 PolarHBondContact O-N 3.23Å; A931-K933 PolarHBondContact O-N 3.37Å; K933-W936 PolarHBondContact O-N 2.95Å; K933-N937 WeakPolarHBondContact O-CB 3.34Å; K933-N937 VanDerWaalsContact O-CG 3.25Å; K933-N937 PolarHBondContact O-N 3.37Å; K933-N937 PolarHBondContact O-ND2 3.27Å
934	R	81.8	Confident	76.6	Confident	134 Å²	134	57.4 Å²	57.4	51%	0.506	27%	0.27	S	S	.	.	H	α-helix	trans	-66.8	-42	174.7	-76.2	177.2	170.2	-167.2	-4.5	111.8	T930 A931 M932 W936 N937 A938 I962 E966	T930-R934 WeakPolarHBondContact O-CG 3.18Å; T930-R934 PolarHBondContact O-N 2.84Å; A931-R934 WeakPolarHBondContact O-CB 2.98Å; A931-R934 PolarHBondContact O-N 3.22Å; A931-R934 VanDerWaalsContact O-N 3.16Å; M932-R934 VanDerWaalsContact C-N 3.32Å; M932-R934 PolarHBondContact O-N 3.45Å; R934-W936 VanDerWaalsContact C-N 3.34Å; R934-W936 PolarHBondContact O-N 3.19Å; R934-N937 PolarHBondContact O-N 3.49Å; R934-A938 WeakPolarHBondContact O-CB 3.43Å; R934-A938 PolarHBondContact O-N 2.91Å; R934-I962 HydrophobicContact CB-CG2 4.29Å; R934-E966 WeakPolarHBondContact CD-OE2 3.19Å; R934-E966 IonicContact CZ-OE2 3.01Å; R934-E966 IonicContact NE-OE2 3.28Å; R934-E966 IonicContact NH1-OE1 2.75Å; R934-E966 PolarHBondContact NH1-OE1 2.87Å; R934-E966 IonicContact NH1-OE2 2.94Å; R934-E966 PolarHBondContact NH1-OE2 2.83Å
935	L	83.6	Confident	75.7	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-58.8	-47	174.3	-177.6	64.6	0	0	0	111	F879 L901 A931 M932 N937 A938 I939 I959 I962 L963 V967	F879-L935 HydrophobicContact CE1-CD1 4.39Å; F879-L935 HydrophobicContact CE1-CD2 4.15Å; L901-L935 HydrophobicContact CD1-CD2 3.75Å; L901-L935 HydrophobicContact CD1-CG 3.98Å; A931-L935 PolarHBondContact O-N 3.11Å; M932-L935 WeakPolarHBondContact O-CB 3.46Å; M932-L935 PolarHBondContact O-N 2.88Å; M932-L935 HydrophobicContact SD-CD2 4.39Å; L935-N937 PolarHBondContact O-N 3.28Å; L935-A938 PolarHBondContact O-N 3.07Å; L935-I939 HydrophobicContact CD1-CD1 4.27Å; L935-I939 HydrophobicContact CG-CD1 4.1Å; L935-I939 WeakPolarHBondContact O-CG1 3.23Å; L935-I939 PolarHBondContact O-N 3.16Å; L935-I939 VanDerWaalsContact O-N 3.08Å; L935-I959 HydrophobicContact CD1-CG2 3.66Å; L935-I962 HydrophobicContact CB-CG2 3.98Å; L935-I962 HydrophobicContact CD1-CB 4.42Å; L935-I962 HydrophobicContact CD1-CG2 4.25Å; L935-L963 HydrophobicContact CD1-CB 4.29Å; L935-L963 HydrophobicContact CD2-CD1 4.13Å; L935-V967 HydrophobicContact CB-CG2 4.12Å; L935-V967 HydrophobicContact CD2-CG2 4.22Å
936	W	80.9	Confident	74.3	Confident	100 Å²	100	62.6 Å²	62.6	38%	0.379	31%	0.305	S	S	.	.	H	α-helix	trans	-56.4	-48.1	174.6	178.3	-91.4	0	0	0	112.3	M898 L901 M932 K933 R934 A938 I939 L940	M898-W936 HydrophobicContact CE-CH2 3.58Å; M898-W936 HydrophobicContact CE-CZ2 4.38Å; M898-W936 HydrophobicContact CE-CZ3 3.89Å; L901-W936 HydrophobicContact CD2-CD2 4.12Å; L901-W936 HydrophobicContact CD2-CE3 3.18Å; L901-W936 HydrophobicContact CD2-CZ3 3.57Å; L901-W936 HydrophobicContact CG-CE3 3.92Å; L901-W936 HydrophobicContact CG-CZ3 4.27Å; M932-W936 PolarHBondContact O-N 3.16Å; K933-W936 PolarHBondContact O-N 2.95Å; R934-W936 VanDerWaalsContact C-N 3.34Å; R934-W936 PolarHBondContact O-N 3.19Å; W936-A938 PolarHBondContact O-N 3.44Å; W936-I939 PolarHBondContact O-N 3.03Å; W936-L940 HydrophobicContact CZ2-CD1 4.37Å; W936-L940 HydrophobicContact CZ2-CD2 4.38Å; W936-L940 HydrophobicContact CZ2-CG 4.48Å; W936-L940 WeakPolarHBondContact O-CG 3.32Å; W936-L940 PolarHBondContact O-N 3.39Å
937	N	79.1	Confident	72.8	Confident	98 Å²	98	64.3 Å²	64.3	52%	0.524	32%	0.318	S	S	.	.	H	α-helix	trans	-65.7	-37	179.9	-72.3	-20.1	0	0	0	113	K933 R934 L935 I939 L940 S941	K933-N937 WeakPolarHBondContact O-CB 3.34Å; K933-N937 VanDerWaalsContact O-CG 3.25Å; K933-N937 PolarHBondContact O-N 3.37Å; K933-N937 PolarHBondContact O-ND2 3.27Å; R934-N937 PolarHBondContact O-N 3.49Å; L935-N937 PolarHBondContact O-N 3.28Å; N937-I939 VanDerWaalsContact C-N 3.33Å; N937-L940 PolarHBondContact O-N 3.29Å; N937-S941 WeakPolarHBondContact O-CB 3.26Å; N937-S941 PolarHBondContact O-N 3.04Å; N937-S941 PolarHBondContact O-OG 3.47Å
938	A	79.2	Confident	71.3	Confident	8 Å²	8	69.9 Å²	69.9	7%	0.066	33%	0.333	C	S	.	.	H	α-helix	trans	-67.2	-34.7	177	0	0	0	0	0	112.3	R934 L935 W936 S941 T942 I959 I962	R934-A938 WeakPolarHBondContact O-CB 3.43Å; R934-A938 PolarHBondContact O-N 2.91Å; L935-A938 PolarHBondContact O-N 3.07Å; W936-A938 PolarHBondContact O-N 3.44Å; A938-S941 WeakPolarHBondContact CA-OG 3.05Å; A938-S941 PolarHBondContact O-OG 2.8Å; A938-T942 PolarHBondContact O-N 2.9Å; A938-T942 VanDerWaalsContact O-N 3.16Å; A938-T942 PolarHBondContact O-OG1 2.76Å; A938-I959 HydrophobicContact CB-CG1 4.3Å; A938-I962 HydrophobicContact CB-CD1 3.46Å; A938-I962 VanDerWaalsContact CB-CD1 3.46Å
939	I	76.6	Confident	69.5	Low	4 Å²	4	73.4 Å²	73.4	2%	0.021	37%	0.37	C	S	.	.	H	α-helix	trans	-69.4	-50.2	173.2	-67.3	162.1	0	0	0	109.1	F879 V897 M898 L901 L935 W936 N937 S941 T942 L943 I959	F879-I939 HydrophobicContact CE1-CD1 4.42Å; F879-I939 HydrophobicContact CZ-CD1 3.72Å; V897-I939 HydrophobicContact CG1-CG2 4.48Å; M898-I939 HydrophobicContact SD-CG2 3.86Å; L901-I939 HydrophobicContact CB-CD1 4.49Å; L901-I939 HydrophobicContact CD1-CD1 3.86Å; L901-I939 HydrophobicContact CD2-CD1 3.51Å; L901-I939 HydrophobicContact CG-CD1 4.17Å; L935-I939 HydrophobicContact CD1-CD1 4.27Å; L935-I939 HydrophobicContact CG-CD1 4.1Å; L935-I939 WeakPolarHBondContact O-CG1 3.23Å; L935-I939 PolarHBondContact O-N 3.16Å; L935-I939 VanDerWaalsContact O-N 3.08Å; W936-I939 PolarHBondContact O-N 3.03Å; N937-I939 VanDerWaalsContact C-N 3.33Å; I939-S941 VanDerWaalsContact C-N 3.3Å; I939-S941 PolarHBondContact O-N 2.86Å; I939-T942 WeakPolarHBondContact O-CA 3.31Å; I939-T942 WeakPolarHBondContact O-CB 3.33Å; I939-T942 PolarHBondContact O-N 3.39Å; I939-L943 HydrophobicContact CG2-CD1 4.27Å; I939-L943 HydrophobicContact CG2-CG 4.44Å; I939-L943 WeakPolarHBondContact O-CG 3.39Å; I939-L943 PolarHBondContact O-N 3.11Å; I939-I959 HydrophobicContact CD1-CG2 4.26Å; I939-I959 HydrophobicContact CG1-CD1 3.98Å; I939-I959 HydrophobicContact CG1-CG1 4.33Å; I939-I959 HydrophobicContact CG1-CG2 3.89Å
940	L	71.9	Confident	67.8	Low	51 Å²	51	70.8 Å²	70.8	27%	0.267	37%	0.37	S	S	.	.	H	α-helix	trans	-58	-38.5	176.6	-75.3	-173.9	0	0	0	113.3	W936 N937 T942 L943 K944	W936-L940 HydrophobicContact CZ2-CD1 4.37Å; W936-L940 HydrophobicContact CZ2-CD2 4.38Å; W936-L940 HydrophobicContact CZ2-CG 4.48Å; W936-L940 WeakPolarHBondContact O-CG 3.32Å; W936-L940 PolarHBondContact O-N 3.39Å; N937-L940 PolarHBondContact O-N 3.29Å; L940-T942 VanDerWaalsContact C-N 3.33Å; L940-L943 PolarHBondContact O-N 3.45Å; L940-K944 WeakPolarHBondContact O-CB 3.43Å; L940-K944 WeakPolarHBondContact O-CG 3.49Å; L940-K944 PolarHBondContact O-N 3.48Å
941	S	70.1	Confident	66.1	Low	58 Å²	58	73.8 Å²	73.8	41%	0.406	39%	0.39	S	S	.	.	H	α-helix	trans	-65.3	-39.9	176	59.5	0	0	0	0	111.3	N937 A938 I939 L943 K944 V945	N937-S941 WeakPolarHBondContact O-CB 3.26Å; N937-S941 PolarHBondContact O-N 3.04Å; N937-S941 PolarHBondContact O-OG 3.47Å; A938-S941 WeakPolarHBondContact CA-OG 3.05Å; A938-S941 PolarHBondContact O-OG 2.8Å; I939-S941 VanDerWaalsContact C-N 3.3Å; I939-S941 PolarHBondContact O-N 2.86Å; S941-L943 VanDerWaalsContact C-N 3.27Å; S941-L943 PolarHBondContact O-N 2.92Å; S941-K944 PolarHBondContact O-N 2.85Å; S941-V945 WeakPolarHBondContact O-CG2 3.37Å; S941-V945 PolarHBondContact O-N 3.09Å
942	T	67	Low	64.5	Low	21 Å²	21	75 Å²	75	13%	0.129	40%	0.397	C	S	.	.	H	α-helix	trans	-62.6	-36.2	174.4	-54.3	0	0	0	0	111.6	F886 A938 I939 L940 A954 I959	F886-T942 HydrophobicContact CE1-CG2 4.35Å; A938-T942 PolarHBondContact O-N 2.9Å; A938-T942 VanDerWaalsContact O-N 3.16Å; A938-T942 PolarHBondContact O-OG1 2.76Å; I939-T942 WeakPolarHBondContact O-CA 3.31Å; I939-T942 WeakPolarHBondContact O-CB 3.33Å; I939-T942 PolarHBondContact O-N 3.39Å; L940-T942 VanDerWaalsContact C-N 3.33Å; T942-A954 HydrophobicContact CG2-CB 3.63Å; T942-I959 HydrophobicContact CG2-CD1 4.46Å
943	L	63.7	Low	62.8	Low	35 Å²	35	84.9 Å²	84.9	18%	0.183	43%	0.433	C	S	.	.	H	α-helix	trans	-76.2	-36.3	175.7	-60.9	-174	0	0	0	113.3	I894 M898 I939 L940 S941 V945 N946	I894-L943 HydrophobicContact CD1-CD1 4.48Å; I894-L943 HydrophobicContact CD1-CD2 3.38Å; I894-L943 HydrophobicContact CD1-CG 4.49Å; I894-L943 HydrophobicContact CG1-CD2 3.71Å; M898-L943 HydrophobicContact CG-CD1 4.47Å; M898-L943 HydrophobicContact SD-CD1 3.82Å; I939-L943 HydrophobicContact CG2-CD1 4.27Å; I939-L943 HydrophobicContact CG2-CG 4.44Å; I939-L943 WeakPolarHBondContact O-CG 3.39Å; I939-L943 PolarHBondContact O-N 3.11Å; L940-L943 PolarHBondContact O-N 3.45Å; S941-L943 VanDerWaalsContact C-N 3.27Å; S941-L943 PolarHBondContact O-N 2.92Å; L943-V945 VanDerWaalsContact C-N 3.32Å; L943-V945 PolarHBondContact O-N 2.86Å; L943-N946 WeakPolarHBondContact O-CB 3.48Å; L943-N946 PolarHBondContact O-N 3.29Å; L943-N946 VanDerWaalsContact O-N 3.1Å
944	K	56.5	Low	61.3	Low	148 Å²	148	79.1 Å²	79.1	64%	0.643	41%	0.412	S	S	*	.	H	α-helix	trans	-66.5	-30	-178.2	-84	-178.3	178.1	-175.6	0	113.7	L940 S941 N946 N947	L940-K944 WeakPolarHBondContact O-CB 3.43Å; L940-K944 WeakPolarHBondContact O-CG 3.49Å; L940-K944 PolarHBondContact O-N 3.48Å; S941-K944 PolarHBondContact O-N 2.85Å; K944-N946 PolarHBondContact O-N 2.64Å; K944-N946 VanDerWaalsContact O-N 3.08Å; K944-N947 PolarHBondContact O-N 3.09Å
945	V	51.3	Low	60.4	Low	105 Å²	105	78.9 Å²	78.9	64%	0.636	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-62.6	-13.7	175	178.2	0	0	0	0	111.5	S941 L943	S941-V945 WeakPolarHBondContact O-CG2 3.37Å; S941-V945 PolarHBondContact O-N 3.09Å; L943-V945 VanDerWaalsContact C-N 3.32Å; L943-V945 PolarHBondContact O-N 2.86Å
946	N	45.1	Very low	59.5	Low	52 Å²	52	79.3 Å²	79.3	28%	0.278	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-82.1	-16.5	-179	-147.1	15.2	0	0	0	115	L943 K944 Y948 G949 G950	L943-N946 WeakPolarHBondContact O-CB 3.48Å; L943-N946 PolarHBondContact O-N 3.29Å; L943-N946 VanDerWaalsContact O-N 3.1Å; K944-N946 PolarHBondContact O-N 2.64Å; K944-N946 VanDerWaalsContact O-N 3.08Å; N946-Y948 PolarHBondContact O-N 3.36Å; N946-G949 PolarHBondContact O-N 3.33Å; N946-G950 PolarHBondContact OD1-O 2.95Å
947	N	45.4	Very low	59.2	Low	140 Å²	140	82.2 Å²	82.2	75%	0.749	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-65.7	-6.3	-176.3	-76.4	4.4	0	0	0	114.3	K944	K944-N947 PolarHBondContact O-N 3.09Å
948	Y	47.1	Very low	59	Low	216 Å²	216	83.4 Å²	83.4	85%	0.847	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-103.3	13.3	175.5	-64.4	-76.4	0	0	0	113.6	N946 G950	N946-Y948 PolarHBondContact O-N 3.36Å; Y948-G950 PolarHBondContact O-N 3.19Å; Y948-G950 VanDerWaalsContact O-N 3.11Å
949	G	45.7	Very low	59.1	Low	74 Å²	74	83.1 Å²	83.1	76%	0.763	43%	0.43	S	S	*	.	S	Bend	trans	67.6	10.2	175.8	0	0	0	0	0	115	N946	N946-G949 PolarHBondContact O-N 3.33Å
950	G	45.9	Very low	59.3	Low	32 Å²	32	85 Å²	85	33%	0.33	44%	0.44	S	S	.	.			trans	-76.6	153.4	174.4	0	0	0	0	0	111.7	N946 Y948 V952	N946-G950 PolarHBondContact OD1-O 2.95Å; Y948-G950 PolarHBondContact O-N 3.19Å; Y948-G950 VanDerWaalsContact O-N 3.11Å; G950-V952 PolarHBondContact O-N 3.33Å
951	P	45.5	Very low	59.8	Low	117 Å²	117	86.2 Å²	86.2	76%	0.76	45%	0.453	S	S	*	.			trans	-57.4	134.5	175.6	23.9	-32.3	0	0	0	110	R953	P951-R953 VanDerWaalsContact C-N 3.3Å; P951-R953 PolarHBondContact O-N 3.46Å
952	V	50.8	Low	60.5	Low	28 Å²	28	84.4 Å²	84.4	17%	0.17	44%	0.438	C	S	.	.			trans	-56.8	91.5	175.9	-178.4	0	0	0	0	108.8	F886 P890 G950 A954	F886-V952 HydrophobicContact CZ-CG1 4.19Å; P890-V952 HydrophobicContact CB-CB 3.75Å; P890-V952 HydrophobicContact CB-CG1 3.7Å; P890-V952 HydrophobicContact CB-CG2 4.23Å; P890-V952 HydrophobicContact CG-CB 4.14Å; P890-V952 HydrophobicContact CG-CG1 4.23Å; G950-V952 PolarHBondContact O-N 3.33Å; V952-A954 HydrophobicContact CG1-CB 3.94Å; V952-A954 PolarHBondContact O-N 2.72Å
953	R	49.9	Very low	61.3	Low	220 Å²	220	83.4 Å²	83.4	83%	0.83	43%	0.432	S	S	*	.			trans	-77.3	69.5	165.2	-73.2	-171.7	-178.5	-178.8	1.9	107	P951 E955	P951-R953 VanDerWaalsContact C-N 3.3Å; P951-R953 PolarHBondContact O-N 3.46Å; R953-E955 PolarHBondContact O-N 2.79Å
954	A	50.2	Low	62.2	Low	20 Å²	20	83 Å²	83	17%	0.165	43%	0.43	C	S	.	.			trans	-63.6	126.7	167.6	0	0	0	0	0	106.8	F886 T942 V952 P956	F886-A954 HydrophobicContact CD1-CB 4.31Å; F886-A954 HydrophobicContact CE1-CB 3.59Å; F886-A954 HydrophobicContact CZ-CB 4.33Å; T942-A954 HydrophobicContact CG2-CB 3.63Å; V952-A954 HydrophobicContact CG1-CB 3.94Å; V952-A954 PolarHBondContact O-N 2.72Å; A954-P956 HydrophobicContact CB-CG 4.43Å; A954-P956 WeakPolarHBondContact O-CD 3.33Å
955	E	62.2	Low	63.4	Low	130 Å²	130	77.4 Å²	77.4	61%	0.607	41%	0.414	S	S	*	.			trans	-94.1	76.3	153.4	-75.4	-133.9	-175.3	0	0	107.5	R953 R957 E958	R953-E955 PolarHBondContact O-N 2.79Å; E955-R957 PolarHBondContact O-N 3.41Å; E955-E958 PolarHBondContact O-N 2.76Å
956	P	65.3	Low	65	Low	8 Å²	8	75.6 Å²	75.6	5%	0.052	40%	0.399	C	S	.	.	H	α-helix	trans	-62	-6.7	178.3	23.6	-29.4	0	0	0	112.3	R887 A954 E958 L960	R887-P956 HydrophobicContact CB-CB 4.4Å; R887-P956 HydrophobicContact CB-CG 3.48Å; R887-P956 VanDerWaalsContact CB-CG 3.48Å; R887-P956 HydrophobicContact CG-CG 3.41Å; R887-P956 VanDerWaalsContact CG-CG 3.41Å; A954-P956 HydrophobicContact CB-CG 4.43Å; A954-P956 WeakPolarHBondContact O-CD 3.33Å; P956-E958 VanDerWaalsContact C-N 3.34Å; P956-L960 WeakPolarHBondContact O-CB 3.48Å; P956-L960 PolarHBondContact O-N 2.85Å
957	R	74.3	Confident	67	Low	162 Å²	162	73.1 Å²	73.1	61%	0.611	39%	0.386	S	S	*	.	H	α-helix	trans	-58.9	-41.3	167.7	-70.7	-178.7	171.8	174.6	-3.9	112.6	E955 S961	E955-R957 PolarHBondContact O-N 3.41Å; R957-S961 VanDerWaalsContact O-CB 3.25Å; R957-S961 WeakPolarHBondContact O-CB 3.48Å; R957-S961 PolarHBondContact O-N 3.35Å
958	E	75.9	Confident	68.9	Low	122 Å²	122	66.4 Å²	66.4	57%	0.57	35%	0.35	S	S	*	.	H	α-helix	trans	-70.4	-45.6	179.6	-171.4	176.6	-172.2	0	0	110.7	E955 P956 L960 S961 I962	E955-E958 PolarHBondContact O-N 2.76Å; P956-E958 VanDerWaalsContact C-N 3.34Å; E958-L960 VanDerWaalsContact C-N 3.34Å; E958-L960 PolarHBondContact O-N 2.78Å; E958-S961 WeakPolarHBondContact O-CB 3.29Å; E958-S961 PolarHBondContact O-N 2.91Å; E958-S961 VanDerWaalsContact O-N 3.14Å; E958-I962 HydrophobicContact CG-CD1 4.24Å; E958-I962 WeakPolarHBondContact O-CG1 3.17Å; E958-I962 PolarHBondContact O-N 3.3Å
959	I	80.1	Confident	70.7	Confident	3 Å²	3	57.3 Å²	57.3	2%	0.015	32%	0.315	C	S	.	.	H	α-helix	trans	-58.9	-47.4	175.8	-58.1	172	0	0	0	110.3	L883 L935 A938 I939 T942 S961 I962 L963	L883-I959 HydrophobicContact CD1-CB 4.48Å; L883-I959 HydrophobicContact CD1-CG2 3.7Å; L883-I959 HydrophobicContact CD2-CG2 3.8Å; L883-I959 HydrophobicContact CG-CG2 4.43Å; L935-I959 HydrophobicContact CD1-CG2 3.66Å; A938-I959 HydrophobicContact CB-CG1 4.3Å; I939-I959 HydrophobicContact CD1-CG2 4.26Å; I939-I959 HydrophobicContact CG1-CD1 3.98Å; I939-I959 HydrophobicContact CG1-CG1 4.33Å; I939-I959 HydrophobicContact CG1-CG2 3.89Å; T942-I959 HydrophobicContact CG2-CD1 4.46Å; I959-S961 VanDerWaalsContact C-N 3.3Å; I959-S961 PolarHBondContact O-N 2.78Å; I959-I962 PolarHBondContact O-N 3.16Å; I959-L963 WeakPolarHBondContact O-CB 3.43Å; I959-L963 PolarHBondContact O-N 2.85Å
960	L	81.8	Confident	72.5	Confident	42 Å²	42	54.4 Å²	54.4	22%	0.22	28%	0.284	C	S	.	.	H	α-helix	trans	-63.5	-37	177.5	-175.4	63.3	0	0	0	111.6	E880 P956 E958 L963 L964	E880-L960 HydrophobicContact CG-CD1 3.96Å; P956-L960 WeakPolarHBondContact O-CB 3.48Å; P956-L960 PolarHBondContact O-N 2.85Å; E958-L960 VanDerWaalsContact C-N 3.34Å; E958-L960 PolarHBondContact O-N 2.78Å; L960-L963 HydrophobicContact CD1-CD2 4.27Å; L960-L963 PolarHBondContact O-N 2.81Å; L960-L964 HydrophobicContact CD1-CD1 3.82Å; L960-L964 HydrophobicContact CD1-CG 4.03Å; L960-L964 HydrophobicContact CD2-CD1 4.49Å; L960-L964 HydrophobicContact CG-CD1 3.81Å; L960-L964 HydrophobicContact CG-CG 4.37Å; L960-L964 WeakPolarHBondContact O-CB 3.24Å; L960-L964 VanDerWaalsContact O-CG 3.32Å; L960-L964 WeakPolarHBondContact O-CG 3.36Å; L960-L964 PolarHBondContact O-N 2.87Å
961	S	83	Confident	74.1	Confident	78 Å²	78	52.9 Å²	52.9	55%	0.545	27%	0.268	S	S	.	.	H	α-helix	trans	-65.1	-39.9	175.2	-174.8	0	0	0	0	112.2	R957 E958 I959 G965	R957-S961 VanDerWaalsContact O-CB 3.25Å; R957-S961 WeakPolarHBondContact O-CB 3.48Å; R957-S961 PolarHBondContact O-N 3.35Å; E958-S961 WeakPolarHBondContact O-CB 3.29Å; E958-S961 PolarHBondContact O-N 2.91Å; E958-S961 VanDerWaalsContact O-N 3.14Å; I959-S961 VanDerWaalsContact C-N 3.3Å; I959-S961 PolarHBondContact O-N 2.78Å; S961-G965 WeakPolarHBondContact O-CA 3.33Å; S961-G965 PolarHBondContact O-N 2.78Å
962	I	83.5	Confident	75.6	Confident	20 Å²	20	47.3 Å²	47.3	10%	0.103	23%	0.232	C	C	.	.	H	α-helix	trans	-69.4	-43.9	176.7	-65.2	164.3	0	0	0	110.2	R934 L935 A938 E958 I959 E966 V967	R934-I962 HydrophobicContact CB-CG2 4.29Å; L935-I962 HydrophobicContact CB-CG2 3.98Å; L935-I962 HydrophobicContact CD1-CB 4.42Å; L935-I962 HydrophobicContact CD1-CG2 4.25Å; A938-I962 HydrophobicContact CB-CD1 3.46Å; A938-I962 VanDerWaalsContact CB-CD1 3.46Å; E958-I962 HydrophobicContact CG-CD1 4.24Å; E958-I962 WeakPolarHBondContact O-CG1 3.17Å; E958-I962 PolarHBondContact O-N 3.3Å; I959-I962 PolarHBondContact O-N 3.16Å; I962-E966 HydrophobicContact CG2-CB 4.48Å; I962-E966 WeakPolarHBondContact O-CA 3Å; I962-E966 WeakPolarHBondContact O-CB 3.41Å; I962-E966 PolarHBondContact O-N 3.25Å; I962-V967 HydrophobicContact CG2-CG2 4.44Å; I962-V967 PolarHBondContact O-N 2.87Å
963	L	83.9	Confident	76.9	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.226	C	C	.	.	I	π-helix	trans	-55.9	-56.3	176.1	177.4	67.3	0	0	0	110.9	F879 E880 L883 M904 L935 I959 L960 V967 V968	F879-L963 HydrophobicContact CD1-CD1 3.97Å; F879-L963 HydrophobicContact CD1-CD2 3.76Å; F879-L963 HydrophobicContact CD1-CG 4.44Å; F879-L963 HydrophobicContact CE1-CD1 4.48Å; F879-L963 HydrophobicContact CE1-CD2 4.43Å; E880-L963 HydrophobicContact CB-CD2 4.38Å; L883-L963 HydrophobicContact CD1-CD2 4.15Å; M904-L963 HydrophobicContact CE-CD1 3.51Å; M904-L963 HydrophobicContact SD-CD1 3.74Å; L935-L963 HydrophobicContact CD1-CB 4.29Å; L935-L963 HydrophobicContact CD2-CD1 4.13Å; I959-L963 WeakPolarHBondContact O-CB 3.43Å; I959-L963 PolarHBondContact O-N 2.85Å; L960-L963 HydrophobicContact CD1-CD2 4.27Å; L960-L963 PolarHBondContact O-N 2.81Å; L963-V967 HydrophobicContact CD1-CG1 4.39Å; L963-V967 WeakPolarHBondContact O-CB 3.48Å; L963-V967 PolarHBondContact O-N 3.5Å; L963-V968 HydrophobicContact CD1-CG2 4.43Å; L963-V968 VanDerWaalsContact O-CG2 3.29Å; L963-V968 WeakPolarHBondContact O-CG2 3.36Å; L963-V968 PolarHBondContact O-N 3Å
964	L	83.5	Confident	77.9	Confident	25 Å²	25	36.1 Å²	36.1	13%	0.131	19%	0.188	C	C	.	.	I	π-helix	trans	-73.6	-48.8	-175.4	-65.4	173.4	0	0	0	111.9	L960 H999 L1000 A1003	L960-L964 HydrophobicContact CD1-CD1 3.82Å; L960-L964 HydrophobicContact CD1-CG 4.03Å; L960-L964 HydrophobicContact CD2-CD1 4.49Å; L960-L964 HydrophobicContact CG-CD1 3.81Å; L960-L964 HydrophobicContact CG-CG 4.37Å; L960-L964 WeakPolarHBondContact O-CB 3.24Å; L960-L964 VanDerWaalsContact O-CG 3.32Å; L960-L964 WeakPolarHBondContact O-CG 3.36Å; L960-L964 PolarHBondContact O-N 2.87Å; L964-H999 HydrophobicContact CD1-CB 3.77Å; L964-H999 HydrophobicContact CD2-CB 4.24Å; L964-L1000 HydrophobicContact CD2-CB 4.37Å; L964-L1000 HydrophobicContact CD2-CD1 3.94Å; L964-A1003 HydrophobicContact CB-CB 4.35Å; L964-A1003 HydrophobicContact CD2-CB 4.4Å; L964-A1003 VanDerWaalsContact O-CB 3.22Å; L964-A1003 WeakPolarHBondContact O-CB 3.3Å
965	G	80.4	Confident	78.5	Confident	31 Å²	31	35.2 Å²	35.2	32%	0.32	18%	0.181	S	C	.	.	I	π-helix	trans	-84.6	-21.3	-169.6	0	0	0	0	0	115.4	S961	S961-G965 WeakPolarHBondContact O-CA 3.33Å; S961-G965 PolarHBondContact O-N 2.78Å
966	E	85.7	Confident	78.3	Confident	67 Å²	67	29.5 Å²	29.5	31%	0.313	15%	0.154	S	C	.	.	I	π-helix	trans	-116.2	-55.9	179	-57.8	-168.3	-166.6	0	0	111.3	A931 R934 I962 A970	A931-E966 HydrophobicContact CB-CB 3.87Å; R934-E966 WeakPolarHBondContact CD-OE2 3.19Å; R934-E966 IonicContact CZ-OE2 3.01Å; R934-E966 IonicContact NE-OE2 3.28Å; R934-E966 IonicContact NH1-OE1 2.75Å; R934-E966 PolarHBondContact NH1-OE1 2.87Å; R934-E966 IonicContact NH1-OE2 2.94Å; R934-E966 PolarHBondContact NH1-OE2 2.83Å; I962-E966 HydrophobicContact CG2-CB 4.48Å; I962-E966 WeakPolarHBondContact O-CA 3Å; I962-E966 WeakPolarHBondContact O-CB 3.41Å; I962-E966 PolarHBondContact O-N 3.25Å; E966-A970 WeakPolarHBondContact O-CB 3.44Å; E966-A970 PolarHBondContact O-N 2.9Å
967	V	86.6	Confident	77.6	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.158	C	C	.	.	I	π-helix	trans	-70.1	-53.6	-170.4	171.3	0	0	0	0	111.6	F872 M904 F928 A931 M932 L935 I962 L963 A970 A971	F872-V967 HydrophobicContact CZ-CG1 3.74Å; M904-V967 HydrophobicContact CE-CG1 3.8Å; F928-V967 HydrophobicContact CE2-CG1 4.03Å; F928-V967 WeakPolarHBondContact CE2-O 3.49Å; A931-V967 HydrophobicContact CB-CB 4.47Å; A931-V967 HydrophobicContact CB-CG2 3.75Å; M932-V967 HydrophobicContact CG-CG1 4.5Å; M932-V967 HydrophobicContact SD-CG1 3.58Å; M932-V967 VanDerWaalsContact SD-CG1 3.58Å; M932-V967 HydrophobicContact SD-CG2 4.18Å; L935-V967 HydrophobicContact CB-CG2 4.12Å; L935-V967 HydrophobicContact CD2-CG2 4.22Å; I962-V967 HydrophobicContact CG2-CG2 4.44Å; I962-V967 PolarHBondContact O-N 2.87Å; L963-V967 HydrophobicContact CD1-CG1 4.39Å; L963-V967 WeakPolarHBondContact O-CB 3.48Å; L963-V967 PolarHBondContact O-N 3.5Å; V967-A970 PolarHBondContact O-N 2.81Å; V967-A971 WeakPolarHBondContact O-CB 3.17Å; V967-A971 PolarHBondContact O-N 3.17Å
968	V	85.6	Confident	76.2	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.132	C	C	.	.	I	π-helix	trans	-70.6	-39.9	-179.4	175.5	0	0	0	0	111.1	L873 A876 L963 A970 A971 A972 L1000 A1003 V1004	L873-V968 HydrophobicContact CD2-CG1 4.2Å; A876-V968 HydrophobicContact CB-CG2 4.14Å; L963-V968 HydrophobicContact CD1-CG2 4.43Å; L963-V968 VanDerWaalsContact O-CG2 3.29Å; L963-V968 WeakPolarHBondContact O-CG2 3.36Å; L963-V968 PolarHBondContact O-N 3Å; V968-A970 VanDerWaalsContact C-N 3.33Å; V968-A970 PolarHBondContact O-N 2.97Å; V968-A971 PolarHBondContact O-N 2.93Å; V968-A972 VanDerWaalsContact O-CB 3.24Å; V968-A972 WeakPolarHBondContact O-CB 3.19Å; V968-A972 PolarHBondContact O-N 3.44Å; V968-L1000 HydrophobicContact CB-CD1 4.23Å; V968-L1000 HydrophobicContact CG1-CD1 3.83Å; V968-L1000 HydrophobicContact CG2-CD1 3.52Å; V968-A1003 HydrophobicContact CB-CB 4.03Å; V968-A1003 HydrophobicContact CG1-CB 3.68Å; V968-V1004 HydrophobicContact CG1-CG2 3.89Å
969	E	85	Confident	74.5	Confident	24 Å²	24	17.9 Å²	17.9	11%	0.112	11%	0.109	C	C	.	.	H	α-helix	trans	-60.9	-41.1	174.4	-76.2	-172.1	-167.5	0	0	111.6	S973 A1003 R1006 G1007 Y1010	E969-S973 WeakPolarHBondContact O-CB 2.86Å; E969-S973 PolarHBondContact O-N 2.93Å; E969-A1003 HydrophobicContact CG-CB 4.36Å; E969-A1003 WeakPolarHBondContact CG-O 3.42Å; E969-R1006 HydrophobicContact CG-CB 4.05Å; E969-R1006 WeakPolarHBondContact OE1-CD 2.82Å; E969-R1006 IonicContact OE1-NH1 3.89Å; E969-G1007 WeakPolarHBondContact O-CA 3.19Å; E969-Y1010 VanDerWaalsContact OE2-CE2 3.24Å; E969-Y1010 WeakPolarHBondContact OE2-CE2 3.26Å
970	A	82.5	Confident	72.7	Confident	13 Å²	13	18.4 Å²	18.4	11%	0.107	11%	0.112	C	C	.	.	H	α-helix	trans	-66.8	-45.7	175.6	0	0	0	0	0	112.1	F928 E966 V967 V968 A972 S973 L974	F928-A970 HydrophobicContact CB-CB 4.11Å; F928-A970 HydrophobicContact CD2-CB 4Å; F928-A970 HydrophobicContact CG-CB 4.48Å; E966-A970 WeakPolarHBondContact O-CB 3.44Å; E966-A970 PolarHBondContact O-N 2.9Å; V967-A970 PolarHBondContact O-N 2.81Å; V968-A970 VanDerWaalsContact C-N 3.33Å; V968-A970 PolarHBondContact O-N 2.97Å; A970-A972 PolarHBondContact O-N 3Å; A970-S973 PolarHBondContact O-N 3.14Å; A970-S973 PolarHBondContact O-OG 2.84Å; A970-L974 PolarHBondContact O-N 2.77Å
971	A	80.5	Confident	70.8	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-59.7	-45.4	175.2	0	0	0	0	0	111.9	F872 Y911 F928 V967 V968 S973 L974 S975	F872-A971 HydrophobicContact CD1-CB 3.8Å; F872-A971 HydrophobicContact CE1-CB 3.34Å; F872-A971 HydrophobicContact CZ-CB 3.98Å; Y911-A971 HydrophobicContact CE1-CB 4.32Å; Y911-A971 PolarHBondContact OH-O 3.4Å; F928-A971 HydrophobicContact CD2-CB 4.23Å; F928-A971 HydrophobicContact CE2-CB 3.64Å; F928-A971 HydrophobicContact CZ-CB 3.86Å; V967-A971 WeakPolarHBondContact O-CB 3.17Å; V967-A971 PolarHBondContact O-N 3.17Å; V968-A971 PolarHBondContact O-N 2.93Å; A971-S973 VanDerWaalsContact C-N 3.31Å; A971-S973 PolarHBondContact O-N 2.7Å; A971-L974 WeakPolarHBondContact O-CB 3.48Å; A971-L974 PolarHBondContact O-N 2.9Å; A971-S975 PolarHBondContact O-N 3.3Å
972	A	77.3	Confident	68.9	Low	1 Å²	1	14.9 Å²	14.9	1%	0.008	9%	0.094	C	C	.	.	H	α-helix	trans	-68.4	-28.8	177.3	0	0	0	0	0	112.5	V968 A970 S975 V1004	V968-A972 VanDerWaalsContact O-CB 3.24Å; V968-A972 WeakPolarHBondContact O-CB 3.19Å; V968-A972 PolarHBondContact O-N 3.44Å; A970-A972 PolarHBondContact O-N 3Å; A972-S975 VanDerWaalsContact O-CB 3.25Å; A972-S975 WeakPolarHBondContact O-CB 3.35Å; A972-S975 PolarHBondContact O-N 3.49Å; A972-S975 PolarHBondContact O-OG 3.3Å; A972-V1004 HydrophobicContact CB-CB 4.44Å; A972-V1004 HydrophobicContact CB-CG1 4.33Å
973	S	76.7	Confident	67.2	Low	6 Å²	6	15.7 Å²	15.7	4%	0.042	11%	0.107	C	C	.	.	H	α-helix	trans	-67.1	-37.8	171.4	78.9	0	0	0	0	112.3	E969 A970 A971 S975 F976 G1007	E969-S973 WeakPolarHBondContact O-CB 2.86Å; E969-S973 PolarHBondContact O-N 2.93Å; A970-S973 PolarHBondContact O-N 3.14Å; A970-S973 PolarHBondContact O-OG 2.84Å; A971-S973 VanDerWaalsContact C-N 3.31Å; A971-S973 PolarHBondContact O-N 2.7Å; S973-S975 PolarHBondContact O-N 3.29Å; S973-F976 PolarHBondContact O-N 3.34Å; S973-G1007 VanDerWaalsContact CA-O 3.29Å; S973-G1007 WeakPolarHBondContact CA-O 3.49Å; S973-G1007 WeakPolarHBondContact CB-O 3.12Å
974	L	71	Confident	65.9	Low	6 Å²	6	15.7 Å²	15.7	3%	0.031	11%	0.107	C	C	.	.	H	α-helix	trans	-66.8	-24.8	172	-75.3	168.9	0	0	0	111.9	Y911 V921 R925 F928 A970 A971 F976 V977 M978	Y911-L974 HydrophobicContact CE1-CB 3.73Å; Y911-L974 HydrophobicContact CE1-CD1 4.08Å; Y911-L974 VanDerWaalsContact OH-C 3.23Å; V921-L974 HydrophobicContact CG1-CD2 4.49Å; R925-L974 HydrophobicContact CG-CD2 4.43Å; F928-L974 HydrophobicContact CB-CD1 3.79Å; F928-L974 HydrophobicContact CD1-CD1 3.8Å; F928-L974 HydrophobicContact CG-CD1 3.99Å; A970-L974 PolarHBondContact O-N 2.77Å; A971-L974 WeakPolarHBondContact O-CB 3.48Å; A971-L974 PolarHBondContact O-N 2.9Å; L974-F976 PolarHBondContact O-N 3.39Å; L974-V977 CarbonylContact O-C 3.58Å; L974-V977 WeakPolarHBondContact O-CA 3.23Å; L974-V977 PolarHBondContact O-N 2.76Å; L974-M978 PolarHBondContact O-N 3.25Å
975	S	63.7	Low	64.7	Low	2 Å²	2	16.9 Å²	16.9	1%	0.014	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-20.4	179.5	85.4	0	0	0	0	114.3	Y911 A971 A972 S973 V977 R1073	Y911-S975 VanDerWaalsContact OH-CA 3.23Å; Y911-S975 WeakPolarHBondContact OH-CA 3.37Å; Y911-S975 PolarHBondContact OH-N 3.3Å; A971-S975 PolarHBondContact O-N 3.3Å; A972-S975 VanDerWaalsContact O-CB 3.25Å; A972-S975 WeakPolarHBondContact O-CB 3.35Å; A972-S975 PolarHBondContact O-N 3.49Å; A972-S975 PolarHBondContact O-OG 3.3Å; S973-S975 PolarHBondContact O-N 3.29Å; S975-V977 VanDerWaalsContact C-N 3.31Å; S975-R1073 PolarHBondContact O-NE 2.95Å; S975-R1073 PolarHBondContact O-NH2 2.85Å; S975-R1073 VanDerWaalsContact O-NH2 3.08Å
976	F	58.6	Low	63.7	Low	10 Å²	10	15.7 Å²	15.7	4%	0.044	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-19.1	172.6	-81.1	-87.6	0	0	0	113	S973 L974 A1008 F1069 L1072 R1073 M1076	S973-F976 PolarHBondContact O-N 3.34Å; L974-F976 PolarHBondContact O-N 3.39Å; F976-A1008 HydrophobicContact CD2-CB 4.26Å; F976-A1008 HydrophobicContact CE2-CB 3.19Å; F976-A1008 HydrophobicContact CZ-CB 3.61Å; F976-F1069 HydrophobicContact CE2-CD2 4.36Å; F976-F1069 AromaticContact CE2-CE2 3.65Å; F976-F1069 HydrophobicContact CE2-CE2 3.65Å; F976-F1069 AromaticContact CZ-CD2 3.88Å; F976-F1069 HydrophobicContact CZ-CD2 3.88Å; F976-F1069 AromaticContact CZ-CE2 3.53Å; F976-F1069 HydrophobicContact CZ-CE2 3.53Å; F976-L1072 HydrophobicContact CE1-CD2 4.15Å; F976-L1072 HydrophobicContact CE1-CG 4.03Å; F976-L1072 HydrophobicContact CZ-CD2 4.13Å; F976-L1072 HydrophobicContact CZ-CG 4.42Å; F976-R1073 HydrophobicContact CD1-CG 4.19Å; F976-R1073 HydrophobicContact CE1-CB 3.86Å; F976-R1073 HydrophobicContact CE1-CG 3.87Å; F976-R1073 HydrophobicContact CZ-CB 4.2Å; F976-R1073 HydrophobicContact CZ-CG 4.28Å; F976-M1076 HydrophobicContact CD1-CB 3.95Å; F976-M1076 HydrophobicContact CD1-CG 3.96Å; F976-M1076 HydrophobicContact CE1-CB 4.32Å; F976-M1076 HydrophobicContact CE1-CG 4.06Å
977	V	49.7	Very low	62.4	Low	21 Å²	21	12.8 Å²	12.8	13%	0.127	9%	0.085	C	C	.	.	S	Bend	trans	-98.4	3.6	-180	-158.9	0	0	0	0	111.1	N916 M918 V921 L974 S975	N916-V977 WeakPolarHBondContact ND2-CG1 3.43Å; N916-V977 PolarHBondContact ND2-O 2.82Å; N916-V977 PolarHBondContact OD1-O 3.11Å; M918-V977 HydrophobicContact CB-CG1 3.31Å; M918-V977 HydrophobicContact CG-CG1 3.78Å; M918-V977 HydrophobicContact SD-CB 4.24Å; M918-V977 HydrophobicContact SD-CG1 3.27Å; M918-V977 WeakPolarHBondContact SD-CG1 3.46Å; M918-V977 HydrophobicContact SD-CG2 4.15Å; V921-V977 HydrophobicContact CG2-CB 4.27Å; V921-V977 HydrophobicContact CG2-CG1 3.29Å; L974-V977 CarbonylContact O-C 3.58Å; L974-V977 WeakPolarHBondContact O-CA 3.23Å; L974-V977 PolarHBondContact O-N 2.76Å; S975-V977 VanDerWaalsContact C-N 3.31Å
978	M	45.8	Very low	60.9	Low	15 Å²	15	14.5 Å²	14.5	7%	0.074	10%	0.095	C	C	.	.	S	Bend	trans	-146.1	158.1	-172.6	-84.1	-52.3	-163.2	0	0	112.7	Y914 P915 N916 L974 R1073	Y914-M978 HydrophobicContact CD1-CE 3.99Å; Y914-M978 HydrophobicContact CD1-SD 4.04Å; Y914-M978 WeakPolarHBondContact O-CE 3.22Å; P915-M978 WeakPolarHBondContact O-CE 3.46Å; N916-M978 VanDerWaalsContact CA-CE 3.43Å; N916-M978 HydrophobicContact CB-CE 3.17Å; N916-M978 HydrophobicContact CB-SD 4.26Å; N916-M978 VanDerWaalsContact CG-CE 3.4Å; N916-M978 WeakPolarHBondContact ND2-CE 3.37Å; N916-M978 WeakPolarHBondContact ND2-CG 3.37Å; N916-M978 PolarHBondContact ND2-SD 3.02Å; N916-M978 VanDerWaalsContact ND2-SD 3.43Å; L974-M978 PolarHBondContact O-N 3.25Å; M978-R1073 PolarHBondContact O-NH2 3.24Å
979	P	39.3	Very low	59.3	Low	11 Å²	11	19.2 Å²	19.2	7%	0.071	12%	0.12	C	C	.	.	S	Bend	trans	-82.7	-37.5	-131.2	-18	33.1	0	0	0	116.4	Y914 R1073 D1087 S1089	Y914-P979 HydrophobicContact CE1-CG 4.01Å; P979-R1073 PolarHBondContact O-NH2 2.9Å; P979-D1087 WeakPolarHBondContact CA-OD2 3.49Å; P979-D1087 WeakPolarHBondContact CB-OD2 3.31Å; P979-D1087 WeakPolarHBondContact CG-OD1 3.23Å; P979-D1087 WeakPolarHBondContact CG-OD2 3.33Å; P979-S1089 WeakPolarHBondContact CG-OG 3.46Å
980	S	42.6	Very low	58	Low	14 Å²	14	27.7 Å²	27.7	10%	0.098	15%	0.152	C	C	.	.			trans	-96.8	-30.3	-141.8	-74.1	0	0	0	0	124.7	M867 A982 G983	M867-S980 VanDerWaalsContact CE-CA 3.43Å; M867-S980 VanDerWaalsContact SD-C 3.56Å; M867-S980 WeakPolarHBondContact SD-CA 3.37Å; M867-S980 WeakPolarHBondContact SD-CB 3.04Å; S980-A982 VanDerWaalsContact C-N 3.32Å; S980-A982 PolarHBondContact O-N 2.86Å; S980-G983 PolarHBondContact O-N 3.23Å
981	V	42.2	Very low	56.9	Low	3 Å²	3	27.8 Å²	27.8	2%	0.018	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-68.1	-8	-153.8	-141.9	0	0	0	0	117.7	I869 G983 S984 L987 R1073	I869-V981 HydrophobicContact CD1-CG2 4.08Å; I869-V981 HydrophobicContact CG2-CG1 4.29Å; I869-V981 HydrophobicContact CG2-CG2 3.38Å; V981-G983 PolarHBondContact O-N 3.1Å; V981-S984 VanDerWaalsContact C-N 3.34Å; V981-S984 WeakPolarHBondContact O-CB 3.25Å; V981-S984 PolarHBondContact O-N 3.2Å; V981-L987 HydrophobicContact CB-CD1 3.79Å; V981-L987 HydrophobicContact CG1-CD1 3.16Å; V981-L987 HydrophobicContact CG1-CG 3.62Å; V981-R1073 VanDerWaalsContact C-NH1 3.26Å; V981-R1073 VanDerWaalsContact CB-CZ 3.5Å
982	A	43.6	Very low	56	Low	44 Å²	44	34.5 Å²	34.5	36%	0.364	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-69.8	-27.9	176.7	0	0	0	0	0	111.6	S980 P1074	S980-A982 VanDerWaalsContact C-N 3.32Å; S980-A982 PolarHBondContact O-N 2.86Å; A982-P1074 HydrophobicContact CB-CG 3.72Å
983	G	46.6	Very low	55.2	Low	36 Å²	36	39 Å²	39	37%	0.371	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-94.9	9.4	166.3	0	0	0	0	0	113.4	S980 V981 H985	S980-G983 PolarHBondContact O-N 3.23Å; V981-G983 PolarHBondContact O-N 3.1Å; G983-H985 PolarHBondContact O-N 3.45Å
984	S	56.2	Low	54.6	Low	0 Å²	0	39 Å²	39	0%	0	21%	0.21	C	C	.	.			trans	-68.1	123	173.6	171.4	0	0	0	0	108.5	D870 V981 L986 L987	D870-S984 VanDerWaalsContact CG-OG 3.25Å; D870-S984 WeakPolarHBondContact OD1-CB 3.17Å; D870-S984 PolarHBondContact OD1-OG 2.94Å; V981-S984 VanDerWaalsContact C-N 3.34Å; V981-S984 WeakPolarHBondContact O-CB 3.25Å; V981-S984 PolarHBondContact O-N 3.2Å; S984-L986 PolarHBondContact O-N 3.16Å; S984-L986 WeakPolarHBondContact OG-CB 3.43Å; S984-L986 PolarHBondContact OG-N 3.11Å; S984-L987 CarbonylContact O-C 3.52Å; S984-L987 PolarHBondContact O-N 3.33Å
985	H	59.1	Low	54.4	Low	50 Å²	50	41.7 Å²	41.7	23%	0.231	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-60.6	-26.6	176.2	-160.8	-108.6	0	0	0	112.9	C862 S864 G983 L987 T988 C991	C862-H985 PolarHBondContact SG-CE1 3.06Å; C862-H985 PolarHBondContact SG-ND1 3.09Å; S864-H985 WeakPolarHBondContact OG-CB 3.44Å; S864-H985 PolarHBondContact OG-ND1 3.41Å; G983-H985 PolarHBondContact O-N 3.45Å; H985-L987 VanDerWaalsContact C-N 3.28Å; H985-L987 PolarHBondContact O-N 3.06Å; H985-T988 PolarHBondContact O-N 3.39Å; H985-T988 VanDerWaalsContact O-N 3.17Å; H985-T988 VanDerWaalsContact O-O 3.13Å; H985-T988 PolarHBondContact O-OG1 2.97Å; H985-C991 WeakPolarHBondContact CE1-CB 3.41Å; H985-C991 PolarHBondContact CE1-SG 3.44Å; H985-C991 WeakPolarHBondContact ND1-CB 3.5Å
986	L	59.1	Low	55	Low	6 Å²	6	42.2 Å²	42.2	3%	0.031	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-70.2	-24.7	176	-75.8	134.1	0	0	0	113.4	D870 L874 S984 T988 C994 L996	D870-L986 VanDerWaalsContact CA-CD1 3.44Å; D870-L986 HydrophobicContact CB-CD1 3.29Å; L874-L986 HydrophobicContact CD1-CD1 4.21Å; L874-L986 HydrophobicContact CD2-CD1 4.39Å; L874-L986 HydrophobicContact CD2-CD2 3.39Å; L874-L986 HydrophobicContact CD2-CG 4.35Å; L874-L986 HydrophobicContact CG-CD1 3.9Å; L874-L986 HydrophobicContact CG-CD2 3.75Å; L874-L986 HydrophobicContact CG-CG 4.38Å; S984-L986 PolarHBondContact O-N 3.16Å; S984-L986 WeakPolarHBondContact OG-CB 3.43Å; S984-L986 PolarHBondContact OG-N 3.11Å; L986-T988 VanDerWaalsContact C-N 3.33Å; L986-C994 HydrophobicContact CD2-CB 4.06Å; L986-C994 WeakPolarHBondContact CD2-O 3.46Å; L986-C994 HydrophobicContact CG-CB 4.05Å; L986-L996 HydrophobicContact CD2-CD2 3.55Å; L986-L996 HydrophobicContact CD2-CG 4.18Å
987	L	58.7	Low	55.9	Low	6 Å²	6	43.2 Å²	43.2	3%	0.031	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-100.9	26	172.7	-57.6	-172.9	0	0	0	111.5	V981 S984 H985 L996 M1001 V1004 F1066 F1069	V981-L987 HydrophobicContact CB-CD1 3.79Å; V981-L987 HydrophobicContact CG1-CD1 3.16Å; V981-L987 HydrophobicContact CG1-CG 3.62Å; S984-L987 CarbonylContact O-C 3.52Å; S984-L987 PolarHBondContact O-N 3.33Å; H985-L987 VanDerWaalsContact C-N 3.28Å; H985-L987 PolarHBondContact O-N 3.06Å; L987-L996 HydrophobicContact CD2-CD1 4.46Å; L987-M1001 HydrophobicContact CD2-CE 4.1Å; L987-V1004 HydrophobicContact CD2-CG1 4.41Å; L987-F1066 HydrophobicContact CB-CE2 4.16Å; L987-F1066 HydrophobicContact CB-CZ 4.46Å; L987-F1066 WeakPolarHBondContact O-CE2 3.39Å; L987-F1066 WeakPolarHBondContact O-CZ 3.25Å; L987-F1069 HydrophobicContact CD1-CD1 3.91Å; L987-F1069 HydrophobicContact CD1-CE1 3.13Å; L987-F1069 HydrophobicContact CD1-CZ 3.79Å; L987-F1069 HydrophobicContact CD2-CD1 4.4Å; L987-F1069 HydrophobicContact CD2-CE1 3.75Å; L987-F1069 HydrophobicContact CG-CE1 4.06Å
988	T	55.3	Low	57.3	Low	37 Å²	37	46 Å²	46	23%	0.227	25%	0.252	C	S	.	.	S	Bend	trans	-123.5	136.3	163.4	62.4	0	0	0	0	107.7	H985 L986 R990	H985-T988 PolarHBondContact O-N 3.39Å; H985-T988 VanDerWaalsContact O-N 3.17Å; H985-T988 VanDerWaalsContact O-O 3.13Å; H985-T988 PolarHBondContact O-OG1 2.97Å; L986-T988 VanDerWaalsContact C-N 3.33Å; T988-R990 PolarHBondContact O-N 3.19Å
989	D	51.7	Low	59.1	Low	98 Å²	98	50.2 Å²	50.2	52%	0.524	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	14.1	173.1	46.6	-25.8	0	0	0	113.4
990	R	57	Low	61.1	Low	203 Å²	203	49.7 Å²	49.7	77%	0.766	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	2.8	-172.7	-60.5	-169	-175.8	-163.5	2.3	114.4	T988	T988-R990 PolarHBondContact O-N 3.19Å
991	C	60.7	Low	62.9	Low	14 Å²	14	49 Å²	49	10%	0.095	26%	0.264	C	S	.	.			trans	-144.1	107.7	-176.8	-175.1	0	0	0	0	113.4	H985 L993 C994 M995	H985-C991 WeakPolarHBondContact CE1-CB 3.41Å; H985-C991 PolarHBondContact CE1-SG 3.44Å; H985-C991 WeakPolarHBondContact ND1-CB 3.5Å; C991-L993 PolarHBondContact O-N 3.16Å; C991-C994 HydrophobicContact CB-CB 4.11Å; C991-C994 PolarHBondContact O-N 3.35Å; C991-C994 VanDerWaalsContact O-N 3.13Å; C991-C994 PolarHBondContact SG-N 2.84Å; C991-C994 VanDerWaalsContact SG-SG 3.68Å; C991-M995 WeakPolarHBondContact O-CG 3.24Å; C991-M995 PolarHBondContact O-N 3.48Å
992	D	61.4	Low	64.7	Low	141 Å²	141	52.5 Å²	52.5	75%	0.754	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-56.7	-31.6	175.1	-59.7	-30.7	0	0	0	112.3
993	L	59.3	Low	66.6	Low	96 Å²	96	50.6 Å²	50.6	50%	0.503	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-76.5	-27	-178	-57.5	168.5	0	0	0	113.6	I860 C991	I860-L993 WeakPolarHBondContact CD1-O 2.93Å; I860-L993 HydrophobicContact CG2-CB 3.31Å; I860-L993 HydrophobicContact CG2-CD1 4.03Å; I860-L993 HydrophobicContact CG2-CG 4.19Å; C991-L993 PolarHBondContact O-N 3.16Å
994	C	64.3	Low	68.3	Low	5 Å²	5	49 Å²	49	3%	0.034	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-103.8	9.7	-177.1	-65.4	0	0	0	0	112.6	L986 C991 L996	L986-C994 HydrophobicContact CD2-CB 4.06Å; L986-C994 WeakPolarHBondContact CD2-O 3.46Å; L986-C994 HydrophobicContact CG-CB 4.05Å; C991-C994 HydrophobicContact CB-CB 4.11Å; C991-C994 PolarHBondContact O-N 3.35Å; C991-C994 VanDerWaalsContact O-N 3.13Å; C991-C994 PolarHBondContact SG-N 2.84Å; C991-C994 VanDerWaalsContact SG-SG 3.68Å; C994-L996 PolarHBondContact O-N 3.35Å
995	M	68	Low	69.3	Low	63 Å²	63	49.1 Å²	49.1	31%	0.31	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-68.6	124.4	-177.2	-67.6	-140.3	179	0	0	111.7	C991 L1061	C991-M995 WeakPolarHBondContact O-CG 3.24Å; C991-M995 PolarHBondContact O-N 3.48Å; M995-L1061 HydrophobicContact CG-CD1 4.48Å; M995-L1061 HydrophobicContact SD-CD1 3.56Å; M995-L1061 VanDerWaalsContact SD-CD1 3.56Å
996	L	75.1	Confident	70.4	Confident	14 Å²	14	51 Å²	51	7%	0.073	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-72.8	149	170.7	-57.1	178.2	0	0	0	109.8	L873 L986 L987 C994 L1000 M1001 V1004	L873-L996 HydrophobicContact CB-CD2 4.13Å; L873-L996 HydrophobicContact CD1-CD1 4.27Å; L986-L996 HydrophobicContact CD2-CD2 3.55Å; L986-L996 HydrophobicContact CD2-CG 4.18Å; L987-L996 HydrophobicContact CD2-CD1 4.46Å; C994-L996 PolarHBondContact O-N 3.35Å; L996-L1000 HydrophobicContact CB-CB 4.39Å; L996-L1000 HydrophobicContact CB-CD2 4.28Å; L996-L1000 HydrophobicContact CD2-CD2 3.62Å; L996-L1000 HydrophobicContact CD2-CG 4.45Å; L996-L1000 HydrophobicContact CG-CD2 4.39Å; L996-M1001 HydrophobicContact CB-CE 4.38Å; L996-M1001 HydrophobicContact CD1-CE 3.99Å; L996-V1004 HydrophobicContact CD1-CG2 4.41Å
997	S	78.8	Confident	71.4	Confident	30 Å²	30	50.7 Å²	50.7	21%	0.21	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-61.8	155.1	171.1	77.4	0	0	0	0	110.5	E880 H999 L1000 M1001	E880-S997 PolarHBondContact OE1-OG 3.04Å; E880-S997 VanDerWaalsContact OE1-OG 3.08Å; E880-S997 VanDerWaalsContact OE2-CB 3.23Å; E880-S997 WeakPolarHBondContact OE2-CB 3.36Å; E880-S997 PolarHBondContact OE2-OG 3.01Å; S997-H999 PolarHBondContact O-N 3.26Å; S997-H999 VanDerWaalsContact O-N 3.17Å; S997-H999 PolarHBondContact OG-N 2.84Å; S997-L1000 PolarHBondContact O-N 3.29Å; S997-L1000 VanDerWaalsContact O-N 3.16Å; S997-L1000 WeakPolarHBondContact OG-CB 3.49Å; S997-L1000 PolarHBondContact OG-N 3.24Å; S997-M1001 WeakPolarHBondContact O-CB 3.44Å; S997-M1001 PolarHBondContact O-N 3.11Å
998	P	79.2	Confident	72.3	Confident	79 Å²	79	50.4 Å²	50.4	51%	0.513	25%	0.248	S	C	.	.	H	α-helix	trans	-56.6	-32	174.3	-26.1	34.8	0	0	0	113.1	K1002 G1059	P998-K1002 VanDerWaalsContact O-CB 3.22Å; P998-K1002 WeakPolarHBondContact O-CB 3.26Å; P998-K1002 PolarHBondContact O-N 3.5Å; P998-G1059 WeakPolarHBondContact CA-O 3.48Å; P998-G1059 WeakPolarHBondContact O-CA 3.34Å
999	H	82.7	Confident	73.5	Confident	105 Å²	105	50.2 Å²	50.2	49%	0.486	24%	0.244	S	C	.	.	H	α-helix	trans	-67.9	-47	177.5	-56.2	110	0	0	0	111.8	E880 L964 S997 K1002 A1003	E880-H999 WeakPolarHBondContact OE1-CB 3.21Å; E880-H999 IonicContact OE1-CG 3.78Å; E880-H999 IonicContact OE1-ND1 2.61Å; L964-H999 HydrophobicContact CD1-CB 3.77Å; L964-H999 HydrophobicContact CD2-CB 4.24Å; S997-H999 PolarHBondContact O-N 3.26Å; S997-H999 VanDerWaalsContact O-N 3.17Å; S997-H999 PolarHBondContact OG-N 2.84Å; H999-K1002 WeakPolarHBondContact O-CB 3.5Å; H999-K1002 PolarHBondContact O-N 3.44Å; H999-A1003 PolarHBondContact O-N 3.42Å
1000	L	81.4	Confident	74.8	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-67.5	-42	179.4	-166.5	65.6	0	0	0	110.8	A876 L964 V968 L996 S997 K1002 A1003 V1004	A876-L1000 HydrophobicContact CB-CD1 4.04Å; A876-L1000 HydrophobicContact CB-CD2 4.43Å; L964-L1000 HydrophobicContact CD2-CB 4.37Å; L964-L1000 HydrophobicContact CD2-CD1 3.94Å; V968-L1000 HydrophobicContact CB-CD1 4.23Å; V968-L1000 HydrophobicContact CG1-CD1 3.83Å; V968-L1000 HydrophobicContact CG2-CD1 3.52Å; L996-L1000 HydrophobicContact CB-CB 4.39Å; L996-L1000 HydrophobicContact CB-CD2 4.28Å; L996-L1000 HydrophobicContact CD2-CD2 3.62Å; L996-L1000 HydrophobicContact CD2-CG 4.45Å; L996-L1000 HydrophobicContact CG-CD2 4.39Å; S997-L1000 PolarHBondContact O-N 3.29Å; S997-L1000 VanDerWaalsContact O-N 3.16Å; S997-L1000 WeakPolarHBondContact OG-CB 3.49Å; S997-L1000 PolarHBondContact OG-N 3.24Å; L1000-K1002 VanDerWaalsContact C-N 3.34Å; L1000-K1002 PolarHBondContact O-N 2.91Å; L1000-A1003 WeakPolarHBondContact O-CB 3.29Å; L1000-A1003 PolarHBondContact O-N 2.82Å; L1000-V1004 WeakPolarHBondContact O-CG2 3.4Å; L1000-V1004 PolarHBondContact O-N 3.26Å
1001	M	79.8	Confident	75.8	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.6	-44.4	173.7	-177.2	54.6	71.3	0	0	111.7	L987 L996 S997 A1003 V1004 L1005 L1061 F1066	L987-M1001 HydrophobicContact CD2-CE 4.1Å; L996-M1001 HydrophobicContact CB-CE 4.38Å; L996-M1001 HydrophobicContact CD1-CE 3.99Å; S997-M1001 WeakPolarHBondContact O-CB 3.44Å; S997-M1001 PolarHBondContact O-N 3.11Å; M1001-A1003 VanDerWaalsContact C-N 3.33Å; M1001-A1003 PolarHBondContact O-N 3.4Å; M1001-V1004 PolarHBondContact O-N 2.85Å; M1001-L1005 HydrophobicContact CG-CD1 4.08Å; M1001-L1005 HydrophobicContact CG-CG 4.47Å; M1001-L1005 VanDerWaalsContact O-CG 3.28Å; M1001-L1005 WeakPolarHBondContact O-CG 3.36Å; M1001-L1005 PolarHBondContact O-N 3.24Å; M1001-L1005 HydrophobicContact SD-CD1 4.31Å; M1001-L1005 HydrophobicContact SD-CG 4.19Å; M1001-L1061 HydrophobicContact CE-CD2 3.69Å; M1001-F1066 HydrophobicContact CE-CD2 4.09Å; M1001-F1066 HydrophobicContact CE-CE2 3.86Å; M1001-F1066 HydrophobicContact SD-CD2 4.09Å; M1001-F1066 HydrophobicContact SD-CE2 4.39Å
1002	K	81	Confident	76.7	Confident	76 Å²	76	40.2 Å²	40.2	33%	0.33	20%	0.197	S	C	.	.	H	α-helix	trans	-59.8	-42.1	175	176	177.9	179.4	-171.2	0	112.3	P998 H999 L1000 L1005 R1006 A1057	P998-K1002 VanDerWaalsContact O-CB 3.22Å; P998-K1002 WeakPolarHBondContact O-CB 3.26Å; P998-K1002 PolarHBondContact O-N 3.5Å; H999-K1002 WeakPolarHBondContact O-CB 3.5Å; H999-K1002 PolarHBondContact O-N 3.44Å; L1000-K1002 VanDerWaalsContact C-N 3.34Å; L1000-K1002 PolarHBondContact O-N 2.91Å; K1002-L1005 PolarHBondContact O-N 2.98Å; K1002-R1006 WeakPolarHBondContact O-CG 3.41Å; K1002-R1006 PolarHBondContact O-N 3.35Å; K1002-A1057 WeakPolarHBondContact CG-O 3.29Å
1003	A	84.2	Confident	77.7	Confident	3 Å²	3	38.8 Å²	38.8	3%	0.025	19%	0.185	C	C	.	.	H	α-helix	trans	-63.8	-43.3	175.6	0	0	0	0	0	111.7	L964 V968 E969 H999 L1000 M1001 L1005 R1006 G1007	L964-A1003 HydrophobicContact CB-CB 4.35Å; L964-A1003 HydrophobicContact CD2-CB 4.4Å; L964-A1003 VanDerWaalsContact O-CB 3.22Å; L964-A1003 WeakPolarHBondContact O-CB 3.3Å; V968-A1003 HydrophobicContact CB-CB 4.03Å; V968-A1003 HydrophobicContact CG1-CB 3.68Å; E969-A1003 HydrophobicContact CG-CB 4.36Å; E969-A1003 WeakPolarHBondContact CG-O 3.42Å; H999-A1003 PolarHBondContact O-N 3.42Å; L1000-A1003 WeakPolarHBondContact O-CB 3.29Å; L1000-A1003 PolarHBondContact O-N 2.82Å; M1001-A1003 VanDerWaalsContact C-N 3.33Å; M1001-A1003 PolarHBondContact O-N 3.4Å; A1003-L1005 PolarHBondContact O-N 3.44Å; A1003-R1006 PolarHBondContact O-N 2.87Å; A1003-G1007 PolarHBondContact O-N 3.4Å
1004	V	80.7	Confident	78.5	Confident	4 Å²	4	36.6 Å²	36.6	2%	0.024	17%	0.172	C	C	.	.	H	α-helix	trans	-58.7	-47.5	175.2	171.6	0	0	0	0	111.2	L873 V968 A972 L987 L996 L1000 M1001 R1006 G1007 A1008 F1069	L873-V1004 HydrophobicContact CD1-CG2 4.21Å; L873-V1004 HydrophobicContact CD2-CG2 3.67Å; V968-V1004 HydrophobicContact CG1-CG2 3.89Å; A972-V1004 HydrophobicContact CB-CB 4.44Å; A972-V1004 HydrophobicContact CB-CG1 4.33Å; L987-V1004 HydrophobicContact CD2-CG1 4.41Å; L996-V1004 HydrophobicContact CD1-CG2 4.41Å; L1000-V1004 WeakPolarHBondContact O-CG2 3.4Å; L1000-V1004 PolarHBondContact O-N 3.26Å; M1001-V1004 PolarHBondContact O-N 2.85Å; V1004-R1006 VanDerWaalsContact C-N 3.3Å; V1004-R1006 PolarHBondContact O-N 2.74Å; V1004-G1007 PolarHBondContact O-N 3.42Å; V1004-A1008 WeakPolarHBondContact O-CB 3.39Å; V1004-A1008 PolarHBondContact O-N 3.36Å; V1004-F1069 HydrophobicContact CG1-CE1 3.7Å; V1004-F1069 HydrophobicContact CG1-CZ 3.78Å
1005	L	78.7	Confident	79	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-65.3	-30	178.9	-67.2	173.5	0	0	0	113.2	M1001 K1002 A1003 A1008 Y1009 C1054 A1057 F1069	M1001-L1005 HydrophobicContact CG-CD1 4.08Å; M1001-L1005 HydrophobicContact CG-CG 4.47Å; M1001-L1005 VanDerWaalsContact O-CG 3.28Å; M1001-L1005 WeakPolarHBondContact O-CG 3.36Å; M1001-L1005 PolarHBondContact O-N 3.24Å; M1001-L1005 HydrophobicContact SD-CD1 4.31Å; M1001-L1005 HydrophobicContact SD-CG 4.19Å; K1002-L1005 PolarHBondContact O-N 2.98Å; A1003-L1005 PolarHBondContact O-N 3.44Å; L1005-A1008 WeakPolarHBondContact O-CB 3.3Å; L1005-Y1009 PolarHBondContact O-N 2.81Å; L1005-C1054 HydrophobicContact CB-CB 4.45Å; L1005-C1054 WeakPolarHBondContact O-CB 3.48Å; L1005-A1057 HydrophobicContact CB-CB 4.01Å; L1005-A1057 HydrophobicContact CD1-CB 3.32Å; L1005-A1057 HydrophobicContact CG-CB 4.28Å; L1005-F1069 HydrophobicContact CD2-CB 3.31Å; L1005-F1069 HydrophobicContact CD2-CD1 3.82Å; L1005-F1069 HydrophobicContact CD2-CD2 4.32Å; L1005-F1069 HydrophobicContact CD2-CG 3.59Å
1006	R	81.9	Confident	79.5	Confident	89 Å²	89	34.7 Å²	34.7	34%	0.336	17%	0.165	S	C	.	.	H	α-helix	trans	-75.5	-47.5	173.8	-77.9	179.2	173.3	-172.8	-3.1	112.3	E969 K1002 A1003 V1004 A1008 Y1009 Y1010	E969-R1006 HydrophobicContact CG-CB 4.05Å; E969-R1006 WeakPolarHBondContact OE1-CD 2.82Å; E969-R1006 IonicContact OE1-NH1 3.89Å; K1002-R1006 WeakPolarHBondContact O-CG 3.41Å; K1002-R1006 PolarHBondContact O-N 3.35Å; A1003-R1006 PolarHBondContact O-N 2.87Å; V1004-R1006 VanDerWaalsContact C-N 3.3Å; V1004-R1006 PolarHBondContact O-N 2.74Å; R1006-A1008 PolarHBondContact O-N 3.31Å; R1006-Y1009 WeakPolarHBondContact O-CB 3.23Å; R1006-Y1009 PolarHBondContact O-N 3.41Å; R1006-Y1010 WeakPolarHBondContact O-CD2 3.31Å; R1006-Y1010 PolarHBondContact O-N 3.06Å; R1006-Y1010 VanDerWaalsContact O-N 3.13Å
1007	G	79.7	Confident	79.7	Confident	0 Å²	0	40 Å²	40	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-55	-36.7	173	0	0	0	0	0	111.3	E969 S973 A1003 V1004 Y1009 Y1010 G1011	E969-G1007 WeakPolarHBondContact O-CA 3.19Å; S973-G1007 VanDerWaalsContact CA-O 3.29Å; S973-G1007 WeakPolarHBondContact CA-O 3.49Å; S973-G1007 WeakPolarHBondContact CB-O 3.12Å; A1003-G1007 PolarHBondContact O-N 3.4Å; V1004-G1007 PolarHBondContact O-N 3.42Å; G1007-Y1009 PolarHBondContact O-N 2.91Å; G1007-Y1010 PolarHBondContact O-N 3.32Å; G1007-Y1010 VanDerWaalsContact O-N 3.13Å; G1007-G1011 PolarHBondContact O-N 2.9Å
1008	A	76.4	Confident	79.5	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-60.3	-45	174.6	0	0	0	0	0	114.8	F976 V1004 L1005 R1006 Y1010 G1011 Y1012 F1069	F976-A1008 HydrophobicContact CD2-CB 4.26Å; F976-A1008 HydrophobicContact CE2-CB 3.19Å; F976-A1008 HydrophobicContact CZ-CB 3.61Å; V1004-A1008 WeakPolarHBondContact O-CB 3.39Å; V1004-A1008 PolarHBondContact O-N 3.36Å; L1005-A1008 WeakPolarHBondContact O-CB 3.3Å; R1006-A1008 PolarHBondContact O-N 3.31Å; A1008-Y1010 VanDerWaalsContact C-N 3.28Å; A1008-Y1010 PolarHBondContact O-N 3.19Å; A1008-G1011 PolarHBondContact O-N 3.27Å; A1008-Y1012 PolarHBondContact O-N 3.5Å; A1008-F1069 HydrophobicContact CB-CD2 3.6Å; A1008-F1069 HydrophobicContact CB-CE2 3.42Å; A1008-F1069 VanDerWaalsContact CB-CE2 3.42Å; A1008-F1069 HydrophobicContact CB-CZ 4.37Å
1009	Y	80.9	Confident	79.3	Confident	33 Å²	33	36.4 Å²	36.4	13%	0.129	17%	0.165	C	C	.	.	H	α-helix	trans	-60.8	-38.4	173.2	167.5	-100.8	0	0	0	112.2	L1005 R1006 G1007 Y1012 K1013 A1051 K1052 K1055	L1005-Y1009 PolarHBondContact O-N 2.81Å; R1006-Y1009 WeakPolarHBondContact O-CB 3.23Å; R1006-Y1009 PolarHBondContact O-N 3.41Å; G1007-Y1009 PolarHBondContact O-N 2.91Å; Y1009-Y1012 HydrophobicContact CD2-CD1 4.45Å; Y1009-Y1012 WeakPolarHBondContact O-CB 3.49Å; Y1009-Y1012 PolarHBondContact O-N 3.18Å; Y1009-K1013 PolarHBondContact O-N 3.38Å; Y1009-A1051 HydrophobicContact CD2-CB 4.18Å; Y1009-A1051 VanDerWaalsContact CD2-O 3.27Å; Y1009-A1051 WeakPolarHBondContact CD2-O 3.28Å; Y1009-K1052 HydrophobicContact CE2-CG 4.28Å; Y1009-K1055 HydrophobicContact CD1-CB 4.01Å; Y1009-K1055 HydrophobicContact CD1-CD 3.79Å; Y1009-K1055 HydrophobicContact CD1-CG 3.75Å; Y1009-K1055 HydrophobicContact CD2-CB 4.08Å; Y1009-K1055 HydrophobicContact CE1-CD 3.54Å; Y1009-K1055 HydrophobicContact CE1-CG 4.06Å; Y1009-K1055 HydrophobicContact CE2-CD 4.37Å; Y1009-K1055 HydrophobicContact CG-CB 3.75Å; Y1009-K1055 HydrophobicContact CG-CD 4.3Å; Y1009-K1055 HydrophobicContact CG-CG 4.05Å
1010	Y	80.5	Confident	79.1	Confident	94 Å²	94	32.3 Å²	32.3	37%	0.369	15%	0.152	S	C	.	.	H	α-helix	trans	-69.5	-37.7	176.4	-65.9	-58.3	0	0	0	112.5	E969 R1006 G1007 A1008 K1013 Q1014	E969-Y1010 VanDerWaalsContact OE2-CE2 3.24Å; E969-Y1010 WeakPolarHBondContact OE2-CE2 3.26Å; R1006-Y1010 WeakPolarHBondContact O-CD2 3.31Å; R1006-Y1010 PolarHBondContact O-N 3.06Å; R1006-Y1010 VanDerWaalsContact O-N 3.13Å; G1007-Y1010 PolarHBondContact O-N 3.32Å; G1007-Y1010 VanDerWaalsContact O-N 3.13Å; A1008-Y1010 VanDerWaalsContact C-N 3.28Å; A1008-Y1010 PolarHBondContact O-N 3.19Å; Y1010-K1013 PolarHBondContact O-N 3.29Å; Y1010-Q1014 WeakPolarHBondContact O-CG 3.48Å; Y1010-Q1014 PolarHBondContact O-N 3.17Å
1011	G	76.8	Confident	78.7	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-57.9	-48.5	171.2	0	0	0	0	0	111.9	G1007 A1008 K1013 Q1014 L1015	G1007-G1011 PolarHBondContact O-N 2.9Å; A1008-G1011 PolarHBondContact O-N 3.27Å; G1011-K1013 VanDerWaalsContact C-N 3.33Å; G1011-K1013 PolarHBondContact O-N 2.9Å; G1011-Q1014 PolarHBondContact O-N 3.32Å; G1011-L1015 PolarHBondContact O-N 2.84Å
1012	Y	79.5	Confident	78.4	Confident	11 Å²	11	36.7 Å²	36.7	4%	0.043	18%	0.177	C	C	.	.	H	α-helix	trans	-54.3	-46.9	171.7	160.9	-96.8	0	0	0	112.4	A1008 Y1009 Q1014 L1015 A1016 L1044 K1048 A1051 M1076	A1008-Y1012 PolarHBondContact O-N 3.5Å; Y1009-Y1012 HydrophobicContact CD2-CD1 4.45Å; Y1009-Y1012 WeakPolarHBondContact O-CB 3.49Å; Y1009-Y1012 PolarHBondContact O-N 3.18Å; Y1012-Q1014 VanDerWaalsContact C-N 3.33Å; Y1012-Q1014 PolarHBondContact O-N 2.95Å; Y1012-L1015 PolarHBondContact O-N 2.8Å; Y1012-A1016 WeakPolarHBondContact O-CB 3.44Å; Y1012-A1016 PolarHBondContact O-N 3.45Å; Y1012-L1044 HydrophobicContact CD2-CD2 3.87Å; Y1012-L1044 HydrophobicContact CE2-CB 4.29Å; Y1012-L1044 HydrophobicContact CE2-CD2 3.75Å; Y1012-L1044 WeakPolarHBondContact CE2-O 3.17Å; Y1012-L1044 PolarHBondContact OH-O 3.1Å; Y1012-K1048 HydrophobicContact CE1-CG 4.49Å; Y1012-K1048 WeakPolarHBondContact OH-CA 3.28Å; Y1012-K1048 VanDerWaalsContact OH-CB 3.23Å; Y1012-K1048 WeakPolarHBondContact OH-CB 3.37Å; Y1012-K1048 WeakPolarHBondContact OH-CG 3.3Å; Y1012-A1051 HydrophobicContact CD1-CB 3.49Å; Y1012-A1051 VanDerWaalsContact CD1-CB 3.49Å; Y1012-A1051 HydrophobicContact CD2-CB 4.05Å; Y1012-A1051 HydrophobicContact CE1-CB 3.86Å; Y1012-A1051 HydrophobicContact CE2-CB 4.37Å; Y1012-A1051 HydrophobicContact CG-CB 3.59Å; Y1012-M1076 HydrophobicContact CD2-CE 4.35Å; Y1012-M1076 HydrophobicContact CD2-SD 4Å
1013	K	82.6	Confident	77.9	Confident	112 Å²	112	34.5 Å²	34.5	49%	0.487	17%	0.169	S	C	.	.	H	α-helix	trans	-64.4	-38.9	-178.5	-171.2	-176	178.3	-171.9	0	111.9	Y1009 Y1010 G1011 M1017	Y1009-K1013 PolarHBondContact O-N 3.38Å; Y1010-K1013 PolarHBondContact O-N 3.29Å; G1011-K1013 VanDerWaalsContact C-N 3.33Å; G1011-K1013 PolarHBondContact O-N 2.9Å; K1013-M1017 WeakPolarHBondContact O-CB 3.23Å; K1013-M1017 PolarHBondContact O-N 3.43Å
1014	Q	76.2	Confident	77.3	Confident	50 Å²	50	41.2 Å²	41.2	23%	0.234	21%	0.205	C	C	.	.	H	α-helix	trans	-64	-46.5	175	-73.4	-179.2	-1.1	0	0	110.8	S924 Y1010 G1011 Y1012 A1016 M1017 I1018	S924-Q1014 VanDerWaalsContact OG-CD 3.3Å; S924-Q1014 PolarHBondContact OG-NE2 2.61Å; S924-Q1014 PolarHBondContact OG-OE1 3.18Å; Y1010-Q1014 WeakPolarHBondContact O-CG 3.48Å; Y1010-Q1014 PolarHBondContact O-N 3.17Å; G1011-Q1014 PolarHBondContact O-N 3.32Å; Y1012-Q1014 VanDerWaalsContact C-N 3.33Å; Y1012-Q1014 PolarHBondContact O-N 2.95Å; Q1014-A1016 PolarHBondContact O-N 2.95Å; Q1014-M1017 WeakPolarHBondContact O-CB 3.22Å; Q1014-M1017 PolarHBondContact O-N 2.87Å; Q1014-I1018 WeakPolarHBondContact O-CD1 3.49Å; Q1014-I1018 VanDerWaalsContact O-CG1 3.26Å; Q1014-I1018 WeakPolarHBondContact O-CG1 3.34Å; Q1014-I1018 PolarHBondContact O-N 2.89Å
1015	L	75.3	Confident	76.5	Confident	6 Å²	6	45.6 Å²	45.6	3%	0.031	23%	0.225	C	C	.	.	H	α-helix	trans	-60.7	-46.1	176.6	179.2	60.8	0	0	0	111.6	M918 G1011 Y1012 M1017 I1018 T1019 L1044 M1076 C1080	M918-L1015 HydrophobicContact CE-CD1 3.2Å; M918-L1015 HydrophobicContact CE-CG 4.41Å; M918-L1015 HydrophobicContact SD-CD1 4.18Å; G1011-L1015 PolarHBondContact O-N 2.84Å; Y1012-L1015 PolarHBondContact O-N 2.8Å; L1015-M1017 VanDerWaalsContact C-N 3.28Å; L1015-M1017 PolarHBondContact O-N 3.29Å; L1015-I1018 PolarHBondContact O-N 3.36Å; L1015-I1018 VanDerWaalsContact O-N 3.16Å; L1015-T1019 WeakPolarHBondContact O-CB 3.41Å; L1015-T1019 PolarHBondContact O-N 2.88Å; L1015-T1019 PolarHBondContact O-OG1 2.95Å; L1015-L1044 HydrophobicContact CD2-CD2 3.88Å; L1015-L1044 HydrophobicContact CG-CD1 4.26Å; L1015-L1044 HydrophobicContact CG-CD2 3.98Å; L1015-M1076 HydrophobicContact CD2-CB 4.24Å; L1015-M1076 HydrophobicContact CD2-CG 4.39Å; L1015-M1076 HydrophobicContact CD2-SD 3.51Å; L1015-M1076 VanDerWaalsContact CD2-SD 3.51Å; L1015-C1080 WeakPolarHBondContact CD1-SG 3.27Å; L1015-C1080 VanDerWaalsContact CD2-SG 3.58Å
1016	A	78.7	Confident	75.1	Confident	21 Å²	21	52.9 Å²	52.9	17%	0.174	26%	0.259	C	S	.	.	H	α-helix	trans	-58.8	-38.9	175.1	0	0	0	0	0	112.5	Y1012 Q1014 G1020	Y1012-A1016 WeakPolarHBondContact O-CB 3.44Å; Y1012-A1016 PolarHBondContact O-N 3.45Å; Q1014-A1016 PolarHBondContact O-N 2.95Å; A1016-G1020 PolarHBondContact O-N 3.3Å
1017	M	78.8	Confident	73.6	Confident	126 Å²	126	50.2 Å²	50.2	62%	0.621	25%	0.25	S	C	*	.	H	α-helix	trans	-66.8	-43.6	175	-175.7	-175.5	-75.3	0	0	111.8	K1013 Q1014 L1015 G1020 T1021	K1013-M1017 WeakPolarHBondContact O-CB 3.23Å; K1013-M1017 PolarHBondContact O-N 3.43Å; Q1014-M1017 WeakPolarHBondContact O-CB 3.22Å; Q1014-M1017 PolarHBondContact O-N 2.87Å; L1015-M1017 VanDerWaalsContact C-N 3.28Å; L1015-M1017 PolarHBondContact O-N 3.29Å; M1017-G1020 PolarHBondContact O-N 3.48Å; M1017-T1021 WeakPolarHBondContact O-CB 3.46Å; M1017-T1021 PolarHBondContact O-N 2.94Å; M1017-T1021 PolarHBondContact O-OG1 3.3Å
1018	I	75.2	Confident	72.1	Confident	33 Å²	33	54.5 Å²	54.5	17%	0.169	28%	0.28	C	S	.	.	H	α-helix	trans	-66.8	-46	179.9	-67.5	160.4	0	0	0	110.4	M918 P919 Q1014 L1015 G1020 T1021 L1022 F1085	M918-I1018 HydrophobicContact CE-CB 4.09Å; M918-I1018 HydrophobicContact CE-CD1 3.58Å; M918-I1018 HydrophobicContact CE-CG1 4.44Å; M918-I1018 HydrophobicContact CE-CG2 3.88Å; P919-I1018 WeakPolarHBondContact O-CD1 3.37Å; Q1014-I1018 WeakPolarHBondContact O-CD1 3.49Å; Q1014-I1018 VanDerWaalsContact O-CG1 3.26Å; Q1014-I1018 WeakPolarHBondContact O-CG1 3.34Å; Q1014-I1018 PolarHBondContact O-N 2.89Å; L1015-I1018 PolarHBondContact O-N 3.36Å; L1015-I1018 VanDerWaalsContact O-N 3.16Å; I1018-G1020 PolarHBondContact O-N 3.37Å; I1018-T1021 CarbonylContact O-C 3.36Å; I1018-T1021 WeakPolarHBondContact O-CB 3.11Å; I1018-T1021 PolarHBondContact O-N 3.17Å; I1018-L1022 WeakPolarHBondContact O-CG 3.4Å; I1018-L1022 PolarHBondContact O-N 3.36Å; I1018-F1085 HydrophobicContact CG2-CZ 4.44Å
1019	T	74.9	Confident	70.5	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62.1	-42.6	175.3	-54.9	0	0	0	0	111.4	L1015 T1021 L1022 L1023 V1037 V1040 L1041 L1044	L1015-T1019 WeakPolarHBondContact O-CB 3.41Å; L1015-T1019 PolarHBondContact O-N 2.88Å; L1015-T1019 PolarHBondContact O-OG1 2.95Å; T1019-T1021 VanDerWaalsContact C-N 3.32Å; T1019-T1021 PolarHBondContact O-N 3.03Å; T1019-L1022 WeakPolarHBondContact O-CB 3.35Å; T1019-L1022 PolarHBondContact O-N 3.3Å; T1019-L1023 HydrophobicContact CG2-CD1 4.47Å; T1019-L1023 WeakPolarHBondContact O-CB 3.48Å; T1019-L1023 PolarHBondContact O-N 3.41Å; T1019-V1037 HydrophobicContact CG2-CG1 3.65Å; T1019-V1040 HydrophobicContact CG2-CB 4.44Å; T1019-V1040 HydrophobicContact CG2-CG1 3.81Å; T1019-L1041 HydrophobicContact CG2-CB 4.09Å; T1019-L1041 HydrophobicContact CG2-CD1 4.32Å; T1019-L1044 HydrophobicContact CG2-CD1 3.93Å; T1019-L1044 WeakPolarHBondContact OG1-CD1 3.03Å
1020	G	77.5	Confident	68.8	Low	20 Å²	20	66 Å²	66	21%	0.206	34%	0.339	C	S	.	.	H	α-helix	trans	-59.7	-43.7	173.2	0	0	0	0	0	111.9	A1016 M1017 I1018 L1022 L1023 D1024	A1016-G1020 PolarHBondContact O-N 3.3Å; M1017-G1020 PolarHBondContact O-N 3.48Å; I1018-G1020 PolarHBondContact O-N 3.37Å; G1020-L1022 VanDerWaalsContact C-N 3.34Å; G1020-L1022 PolarHBondContact O-N 3.43Å; G1020-L1023 WeakPolarHBondContact O-CB 3.37Å; G1020-L1023 PolarHBondContact O-N 2.71Å; G1020-L1023 VanDerWaalsContact O-N 3.13Å; G1020-D1024 PolarHBondContact O-N 3.31Å
1021	T	74.7	Confident	67.3	Low	67 Å²	67	70.5 Å²	70.5	41%	0.411	36%	0.361	S	S	.	.	H	α-helix	trans	-64.1	-38.7	176.2	-51.5	0	0	0	0	111.7	M1017 I1018 T1019 L1023 D1024 Q1025	M1017-T1021 WeakPolarHBondContact O-CB 3.46Å; M1017-T1021 PolarHBondContact O-N 2.94Å; M1017-T1021 PolarHBondContact O-OG1 3.3Å; I1018-T1021 CarbonylContact O-C 3.36Å; I1018-T1021 WeakPolarHBondContact O-CB 3.11Å; I1018-T1021 PolarHBondContact O-N 3.17Å; T1019-T1021 VanDerWaalsContact C-N 3.32Å; T1019-T1021 PolarHBondContact O-N 3.03Å; T1021-L1023 VanDerWaalsContact C-N 3.3Å; T1021-D1024 PolarHBondContact O-N 3.19Å; T1021-Q1025 VanDerWaalsContact O-CG 3.26Å; T1021-Q1025 WeakPolarHBondContact O-CG 3.43Å; T1021-Q1025 PolarHBondContact O-N 2.93Å
1022	L	72.4	Confident	66.3	Low	24 Å²	24	72.2 Å²	72.2	13%	0.126	37%	0.37	C	S	.	.	H	α-helix	trans	-65.9	-33.1	174.1	-77.1	179.3	0	0	0	112.5	I1018 T1019 G1020 Q1025 F1027 V1037 F1085	I1018-L1022 WeakPolarHBondContact O-CG 3.4Å; I1018-L1022 PolarHBondContact O-N 3.36Å; T1019-L1022 WeakPolarHBondContact O-CB 3.35Å; T1019-L1022 PolarHBondContact O-N 3.3Å; G1020-L1022 VanDerWaalsContact C-N 3.34Å; G1020-L1022 PolarHBondContact O-N 3.43Å; L1022-Q1025 WeakPolarHBondContact O-CB 3.31Å; L1022-Q1025 PolarHBondContact O-N 2.92Å; L1022-F1027 WeakPolarHBondContact O-CE2 3.43Å; L1022-F1027 WeakPolarHBondContact O-CZ 3.48Å; L1022-V1037 HydrophobicContact CB-CG1 4.25Å; L1022-F1085 HydrophobicContact CD1-CE1 4.41Å; L1022-F1085 HydrophobicContact CD1-CE2 4.06Å; L1022-F1085 HydrophobicContact CD1-CZ 3.49Å; L1022-F1085 VanDerWaalsContact CD1-CZ 3.49Å
1023	L	71.3	Confident	65.7	Low	31 Å²	31	73.9 Å²	73.9	16%	0.162	38%	0.383	C	S	.	.	H	α-helix	trans	-70.8	-37.6	175.4	-106.3	149.2	0	0	0	112.8	T1019 G1020 T1021 V1037 E1038 L1041	T1019-L1023 HydrophobicContact CG2-CD1 4.47Å; T1019-L1023 WeakPolarHBondContact O-CB 3.48Å; T1019-L1023 PolarHBondContact O-N 3.41Å; G1020-L1023 WeakPolarHBondContact O-CB 3.37Å; G1020-L1023 PolarHBondContact O-N 2.71Å; G1020-L1023 VanDerWaalsContact O-N 3.13Å; T1021-L1023 VanDerWaalsContact C-N 3.3Å; L1023-V1037 HydrophobicContact CD1-CG1 3.82Å; L1023-V1037 HydrophobicContact CG-CB 4.38Å; L1023-V1037 HydrophobicContact CG-CG1 3.79Å; L1023-E1038 HydrophobicContact CD2-CG 3.69Å; L1023-L1041 HydrophobicContact CD1-CB 3.51Å; L1023-L1041 HydrophobicContact CD1-CD2 3.45Å; L1023-L1041 VanDerWaalsContact CD1-CD2 3.45Å; L1023-L1041 HydrophobicContact CD1-CG 3.96Å
1024	D	70.3	Confident	65.2	Low	144 Å²	144	75.4 Å²	75.4	77%	0.77	39%	0.386	S	S	*	.	H	α-helix	trans	-69.9	-25.9	173.1	-68.9	-23.7	0	0	0	111.6	G1020 T1021	G1020-D1024 PolarHBondContact O-N 3.31Å; T1021-D1024 PolarHBondContact O-N 3.19Å
1025	Q	63.8	Low	65.1	Low	95 Å²	95	75.7 Å²	75.7	44%	0.444	39%	0.393	S	S	.	.	S	Bend	trans	-71.9	130.5	171.4	-72.9	172.8	17.2	0	0	110.4	T1021 L1022 F1027	T1021-Q1025 VanDerWaalsContact O-CG 3.26Å; T1021-Q1025 WeakPolarHBondContact O-CG 3.43Å; T1021-Q1025 PolarHBondContact O-N 2.93Å; L1022-Q1025 WeakPolarHBondContact O-CB 3.31Å; L1022-Q1025 PolarHBondContact O-N 2.92Å; Q1025-F1027 PolarHBondContact O-N 3.36Å
1026	Q	49.2	Very low	64.9	Low	154 Å²	154	79 Å²	79	72%	0.72	41%	0.407	S	S	*	.			trans	-64.2	109.6	174.6	-73.4	-171.9	-8.1	0	0	110	S1028	Q1026-S1028 PolarHBondContact O-N 2.76Å
1027	F	51.6	Low	64.8	Low	34 Å²	34	78 Å²	78	15%	0.149	40%	0.399	C	S	.	.			trans	-56.2	111.6	171.7	-66	-80.6	0	0	0	110.2	L1022 Q1025 I1032 R1034 V1037	L1022-F1027 WeakPolarHBondContact O-CE2 3.43Å; L1022-F1027 WeakPolarHBondContact O-CZ 3.48Å; Q1025-F1027 PolarHBondContact O-N 3.36Å; F1027-I1032 WeakPolarHBondContact CD1-O 3.38Å; F1027-I1032 HydrophobicContact CE1-CB 4.47Å; F1027-I1032 HydrophobicContact CE1-CG2 4.42Å; F1027-R1034 HydrophobicContact CB-CB 4.33Å; F1027-R1034 HydrophobicContact CD2-CB 3.5Å; F1027-R1034 VanDerWaalsContact CD2-CB 3.5Å; F1027-R1034 HydrophobicContact CD2-CG 3.62Å; F1027-R1034 HydrophobicContact CE2-CB 4Å; F1027-R1034 HydrophobicContact CE2-CG 3.81Å; F1027-R1034 HydrophobicContact CG-CB 3.94Å; F1027-V1037 HydrophobicContact CD1-CG2 4.45Å; F1027-V1037 HydrophobicContact CE1-CB 4Å; F1027-V1037 HydrophobicContact CE1-CG2 3.29Å; F1027-V1037 HydrophobicContact CE2-CB 4.33Å; F1027-V1037 HydrophobicContact CE2-CG2 4.48Å; F1027-V1037 HydrophobicContact CZ-CB 3.46Å; F1027-V1037 VanDerWaalsContact CZ-CB 3.46Å; F1027-V1037 HydrophobicContact CZ-CG1 3.84Å; F1027-V1037 HydrophobicContact CZ-CG2 3.32Å
1028	S	46.8	Very low	64.8	Low	90 Å²	90	75.9 Å²	75.9	63%	0.629	39%	0.387	S	S	*	.			trans	-75.9	119	157.2	51.8	0	0	0	0	107.2	Q1026 Q1030	Q1026-S1028 PolarHBondContact O-N 2.76Å; S1028-Q1030 PolarHBondContact O-N 3.34Å
1029	D	43	Very low	64.8	Low	142 Å²	142	75 Å²	75	76%	0.759	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	14.8	-167.5	-70.8	-45.8	0	0	0	118.4
1030	Q	45.1	Very low	64.8	Low	132 Å²	132	75 Å²	75	62%	0.617	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-13.6	-170.6	-71.9	-166.6	-38.9	0	0	117.2	R366 S1028	R366-Q1030 VanDerWaalsContact NH1-OE1 3.09Å; S1028-Q1030 PolarHBondContact O-N 3.34Å
1031	F	49.9	Very low	65	Low	188 Å²	188	76.6 Å²	76.6	83%	0.825	39%	0.389	S	S	*	.	S	Bend	trans	-135.5	-33.2	-179.1	-79.5	-79.5	0	0	0	116.1
1032	I	56.2	Low	65.4	Low	37 Å²	37	79 Å²	79	19%	0.19	39%	0.393	C	S	.	.	S	Bend	trans	-135.8	115.4	-178.4	-51.7	157.1	0	0	0	106.7	F1027 R1034 K1036 V1037 A1083	F1027-I1032 WeakPolarHBondContact CD1-O 3.38Å; F1027-I1032 HydrophobicContact CE1-CB 4.47Å; F1027-I1032 HydrophobicContact CE1-CG2 4.42Å; I1032-R1034 PolarHBondContact O-N 2.98Å; I1032-K1036 HydrophobicContact CG2-CB 4.26Å; I1032-V1037 HydrophobicContact CB-CG2 4.47Å; I1032-V1037 HydrophobicContact CG2-CG2 3.35Å; I1032-A1083 WeakPolarHBondContact CD1-O 3.35Å; I1032-A1083 WeakPolarHBondContact CG1-O 3.4Å
1033	S	65.5	Low	65.6	Low	45 Å²	45	77.8 Å²	77.8	32%	0.315	39%	0.387	S	S	.	.			trans	-64.7	135.2	174.5	71.3	0	0	0	0	107.9	S1035 K1036 V1037	S1033-S1035 WeakPolarHBondContact CB-OG 3.33Å; S1033-S1035 PolarHBondContact O-N 3.05Å; S1033-S1035 VanDerWaalsContact O-N 3.08Å; S1033-S1035 PolarHBondContact OG-OG 3.16Å; S1033-K1036 WeakPolarHBondContact O-CA 3.45Å; S1033-K1036 WeakPolarHBondContact O-CB 3.44Å; S1033-K1036 PolarHBondContact O-N 3.45Å; S1033-K1036 VanDerWaalsContact OG-CG 3.26Å; S1033-K1036 WeakPolarHBondContact OG-CG 3.35Å; S1033-K1036 PolarHBondContact OG-N 3.39Å; S1033-V1037 PolarHBondContact O-N 3.35Å
1034	R	73.2	Confident	66.1	Low	145 Å²	145	76.4 Å²	76.4	55%	0.547	38%	0.38	S	S	.	.	H	α-helix	trans	-48.6	-38.2	173.6	178	174.1	172.5	153	4.8	111.8	F1027 I1032 K1036 V1037 E1038	F1027-R1034 HydrophobicContact CB-CB 4.33Å; F1027-R1034 HydrophobicContact CD2-CB 3.5Å; F1027-R1034 VanDerWaalsContact CD2-CB 3.5Å; F1027-R1034 HydrophobicContact CD2-CG 3.62Å; F1027-R1034 HydrophobicContact CE2-CB 4Å; F1027-R1034 HydrophobicContact CE2-CG 3.81Å; F1027-R1034 HydrophobicContact CG-CB 3.94Å; I1032-R1034 PolarHBondContact O-N 2.98Å; R1034-K1036 VanDerWaalsContact C-N 3.29Å; R1034-K1036 PolarHBondContact O-N 3.43Å; R1034-V1037 PolarHBondContact O-N 2.77Å; R1034-V1037 VanDerWaalsContact O-N 3.14Å; R1034-E1038 HydrophobicContact CG-CG 4.23Å; R1034-E1038 WeakPolarHBondContact CG-OE1 3.48Å; R1034-E1038 IonicContact CZ-OE1 3.59Å; R1034-E1038 IonicContact NE-OE1 3.4Å; R1034-E1038 PolarHBondContact NE-OE1 3.09Å; R1034-E1038 IonicContact NH2-OE1 2.7Å; R1034-E1038 WeakPolarHBondContact O-CB 3.15Å; R1034-E1038 WeakPolarHBondContact O-CG 3.45Å; R1034-E1038 PolarHBondContact O-N 3.15Å
1035	S	73	Confident	66.7	Low	55 Å²	55	73.9 Å²	73.9	39%	0.385	36%	0.364	S	S	.	.	H	α-helix	trans	-58.7	-33.8	174.9	57.2	0	0	0	0	114.2	S1033 A1039	S1033-S1035 WeakPolarHBondContact CB-OG 3.33Å; S1033-S1035 PolarHBondContact O-N 3.05Å; S1033-S1035 VanDerWaalsContact O-N 3.08Å; S1033-S1035 PolarHBondContact OG-OG 3.16Å; S1035-A1039 VanDerWaalsContact O-CB 3.24Å; S1035-A1039 WeakPolarHBondContact O-CB 3.18Å; S1035-A1039 PolarHBondContact O-N 3.27Å
1036	K	72.5	Confident	67.5	Low	76 Å²	76	70.2 Å²	70.2	33%	0.33	35%	0.348	S	S	.	.	H	α-helix	trans	-68.3	-44.2	174	-78.1	173.3	-178.4	-168.1	0	110.9	I1032 S1033 R1034 A1039 V1040 V1082 Y1128	I1032-K1036 HydrophobicContact CG2-CB 4.26Å; S1033-K1036 WeakPolarHBondContact O-CA 3.45Å; S1033-K1036 WeakPolarHBondContact O-CB 3.44Å; S1033-K1036 PolarHBondContact O-N 3.45Å; S1033-K1036 VanDerWaalsContact OG-CG 3.26Å; S1033-K1036 WeakPolarHBondContact OG-CG 3.35Å; S1033-K1036 PolarHBondContact OG-N 3.39Å; R1034-K1036 VanDerWaalsContact C-N 3.29Å; R1034-K1036 PolarHBondContact O-N 3.43Å; K1036-A1039 PolarHBondContact O-N 3.49Å; K1036-V1040 WeakPolarHBondContact O-CB 3.37Å; K1036-V1040 WeakPolarHBondContact O-CG2 3.27Å; K1036-V1040 PolarHBondContact O-N 2.82Å; K1036-V1082 HydrophobicContact CB-CG1 3.85Å; K1036-V1082 HydrophobicContact CD-CG1 4.49Å; K1036-V1082 HydrophobicContact CG-CG1 3.95Å; K1036-Y1128 HydrophobicContact CD-CD1 4.49Å; K1036-Y1128 HydrophobicContact CG-CD1 3.79Å; K1036-Y1128 HydrophobicContact CG-CE1 3.84Å; K1036-Y1128 HydrophobicContact CG-CG 4.27Å
1037	V	76	Confident	68.9	Low	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-70.7	-36.8	178.9	-169.8	0	0	0	0	111.8	T1019 L1022 L1023 F1027 I1032 S1033 R1034 V1040 L1041	T1019-V1037 HydrophobicContact CG2-CG1 3.65Å; L1022-V1037 HydrophobicContact CB-CG1 4.25Å; L1023-V1037 HydrophobicContact CD1-CG1 3.82Å; L1023-V1037 HydrophobicContact CG-CB 4.38Å; L1023-V1037 HydrophobicContact CG-CG1 3.79Å; F1027-V1037 HydrophobicContact CD1-CG2 4.45Å; F1027-V1037 HydrophobicContact CE1-CB 4Å; F1027-V1037 HydrophobicContact CE1-CG2 3.29Å; F1027-V1037 HydrophobicContact CE2-CB 4.33Å; F1027-V1037 HydrophobicContact CE2-CG2 4.48Å; F1027-V1037 HydrophobicContact CZ-CB 3.46Å; F1027-V1037 VanDerWaalsContact CZ-CB 3.46Å; F1027-V1037 HydrophobicContact CZ-CG1 3.84Å; F1027-V1037 HydrophobicContact CZ-CG2 3.32Å; I1032-V1037 HydrophobicContact CB-CG2 4.47Å; I1032-V1037 HydrophobicContact CG2-CG2 3.35Å; S1033-V1037 PolarHBondContact O-N 3.35Å; R1034-V1037 PolarHBondContact O-N 2.77Å; R1034-V1037 VanDerWaalsContact O-N 3.14Å; V1037-V1040 PolarHBondContact O-N 3.3Å; V1037-L1041 PolarHBondContact O-N 2.92Å
1038	E	79.2	Confident	70.4	Confident	82 Å²	82	64.6 Å²	64.6	38%	0.383	32%	0.321	S	S	.	.	H	α-helix	trans	-61.7	-45.6	172.4	-74.8	174.5	173.6	0	0	111.6	L1023 R1034 V1040 L1041 F1042	L1023-E1038 HydrophobicContact CD2-CG 3.69Å; R1034-E1038 HydrophobicContact CG-CG 4.23Å; R1034-E1038 WeakPolarHBondContact CG-OE1 3.48Å; R1034-E1038 IonicContact CZ-OE1 3.59Å; R1034-E1038 IonicContact NE-OE1 3.4Å; R1034-E1038 PolarHBondContact NE-OE1 3.09Å; R1034-E1038 IonicContact NH2-OE1 2.7Å; R1034-E1038 WeakPolarHBondContact O-CB 3.15Å; R1034-E1038 WeakPolarHBondContact O-CG 3.45Å; R1034-E1038 PolarHBondContact O-N 3.15Å; E1038-V1040 VanDerWaalsContact C-N 3.27Å; E1038-V1040 PolarHBondContact O-N 3.17Å; E1038-L1041 PolarHBondContact O-N 2.95Å; E1038-F1042 WeakPolarHBondContact O-CB 3.48Å; E1038-F1042 PolarHBondContact O-N 3.31Å
1039	A	75.3	Confident	71.8	Confident	14 Å²	14	63.2 Å²	63.2	12%	0.116	31%	0.31	C	S	.	.	H	α-helix	trans	-59.1	-40.6	173.3	0	0	0	0	0	111.6	S1035 K1036 F1042 G1043 Y1128	S1035-A1039 VanDerWaalsContact O-CB 3.24Å; S1035-A1039 WeakPolarHBondContact O-CB 3.18Å; S1035-A1039 PolarHBondContact O-N 3.27Å; K1036-A1039 PolarHBondContact O-N 3.49Å; A1039-F1042 PolarHBondContact O-N 3.41Å; A1039-G1043 PolarHBondContact O-N 2.9Å; A1039-Y1128 HydrophobicContact CB-CD2 4.26Å; A1039-Y1128 HydrophobicContact CB-CE2 3.71Å
1040	V	75.4	Confident	73.3	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-66.6	-44.5	178	166.9	0	0	0	0	112.2	T1019 K1036 V1037 E1038 F1042 G1043 L1044 L1079 V1082 A1083	T1019-V1040 HydrophobicContact CG2-CB 4.44Å; T1019-V1040 HydrophobicContact CG2-CG1 3.81Å; K1036-V1040 WeakPolarHBondContact O-CB 3.37Å; K1036-V1040 WeakPolarHBondContact O-CG2 3.27Å; K1036-V1040 PolarHBondContact O-N 2.82Å; V1037-V1040 PolarHBondContact O-N 3.3Å; E1038-V1040 VanDerWaalsContact C-N 3.27Å; E1038-V1040 PolarHBondContact O-N 3.17Å; V1040-F1042 VanDerWaalsContact C-N 3.34Å; V1040-F1042 PolarHBondContact O-N 2.78Å; V1040-G1043 PolarHBondContact O-N 3.43Å; V1040-L1044 HydrophobicContact CG1-CD1 3.88Å; V1040-L1044 WeakPolarHBondContact O-CG 3.44Å; V1040-L1044 PolarHBondContact O-N 2.91Å; V1040-L1079 HydrophobicContact CB-CD2 3.85Å; V1040-L1079 HydrophobicContact CG1-CB 4.15Å; V1040-L1079 HydrophobicContact CG1-CD2 3.85Å; V1040-L1079 HydrophobicContact CG2-CB 4.48Å; V1040-L1079 HydrophobicContact CG2-CD2 3.81Å; V1040-L1079 WeakPolarHBondContact CG2-O 3.49Å; V1040-L1079 WeakPolarHBondContact O-CD2 3.47Å; V1040-V1082 HydrophobicContact CG2-CB 3.85Å; V1040-V1082 HydrophobicContact CG2-CG1 3.72Å; V1040-A1083 HydrophobicContact CG1-CB 4.46Å; V1040-A1083 HydrophobicContact CG2-CB 4.35Å
1041	L	81.5	Confident	74.8	Confident	54 Å²	54	50.4 Å²	50.4	28%	0.283	25%	0.246	S	C	.	.	H	α-helix	trans	-63.1	-41.6	176.5	-175.4	71.1	0	0	0	111.3	T1019 L1023 V1037 E1038 G1043 L1044 E1045	T1019-L1041 HydrophobicContact CG2-CB 4.09Å; T1019-L1041 HydrophobicContact CG2-CD1 4.32Å; L1023-L1041 HydrophobicContact CD1-CB 3.51Å; L1023-L1041 HydrophobicContact CD1-CD2 3.45Å; L1023-L1041 VanDerWaalsContact CD1-CD2 3.45Å; L1023-L1041 HydrophobicContact CD1-CG 3.96Å; V1037-L1041 PolarHBondContact O-N 2.92Å; E1038-L1041 PolarHBondContact O-N 2.95Å; L1041-G1043 VanDerWaalsContact C-N 3.32Å; L1041-G1043 PolarHBondContact O-N 2.86Å; L1041-L1044 WeakPolarHBondContact O-CB 3.41Å; L1041-L1044 PolarHBondContact O-N 3.24Å; L1041-E1045 PolarHBondContact O-N 3.3Å
1042	F	81.9	Confident	76.3	Confident	116 Å²	116	46.8 Å²	46.8	51%	0.509	23%	0.23	S	C	.	.	H	α-helix	trans	-62	-40.9	175.4	-177.8	-87.9	0	0	0	111.7	E1038 A1039 V1040 E1045 S1046 S1124	E1038-F1042 WeakPolarHBondContact O-CB 3.48Å; E1038-F1042 PolarHBondContact O-N 3.31Å; A1039-F1042 PolarHBondContact O-N 3.41Å; V1040-F1042 VanDerWaalsContact C-N 3.34Å; V1040-F1042 PolarHBondContact O-N 2.78Å; F1042-E1045 PolarHBondContact O-N 3.17Å; F1042-S1046 WeakPolarHBondContact O-CB 3.09Å; F1042-S1046 PolarHBondContact O-N 2.76Å; F1042-S1046 PolarHBondContact O-OG 2.69Å; F1042-S1124 VanDerWaalsContact CD1-CB 3.41Å
1043	G	77.3	Confident	77.2	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.4	-43.1	172.8	0	0	0	0	0	112.9	A1039 V1040 L1041 S1046 L1047	A1039-G1043 PolarHBondContact O-N 2.9Å; V1040-G1043 PolarHBondContact O-N 3.43Å; L1041-G1043 VanDerWaalsContact C-N 3.32Å; L1041-G1043 PolarHBondContact O-N 2.86Å; G1043-S1046 PolarHBondContact O-N 2.79Å; G1043-L1047 WeakPolarHBondContact O-CG 3.35Å; G1043-L1047 PolarHBondContact O-N 3.34Å
1044	L	80.7	Confident	77.7	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-62.4	-43.4	175.1	-78.4	160.3	0	0	0	112.8	Y1012 L1015 T1019 V1040 L1041 L1047 K1048 M1076 L1079	Y1012-L1044 HydrophobicContact CD2-CD2 3.87Å; Y1012-L1044 HydrophobicContact CE2-CB 4.29Å; Y1012-L1044 HydrophobicContact CE2-CD2 3.75Å; Y1012-L1044 WeakPolarHBondContact CE2-O 3.17Å; Y1012-L1044 PolarHBondContact OH-O 3.1Å; L1015-L1044 HydrophobicContact CD2-CD2 3.88Å; L1015-L1044 HydrophobicContact CG-CD1 4.26Å; L1015-L1044 HydrophobicContact CG-CD2 3.98Å; T1019-L1044 HydrophobicContact CG2-CD1 3.93Å; T1019-L1044 WeakPolarHBondContact OG1-CD1 3.03Å; V1040-L1044 HydrophobicContact CG1-CD1 3.88Å; V1040-L1044 WeakPolarHBondContact O-CG 3.44Å; V1040-L1044 PolarHBondContact O-N 2.91Å; L1041-L1044 WeakPolarHBondContact O-CB 3.41Å; L1041-L1044 PolarHBondContact O-N 3.24Å; L1044-L1047 PolarHBondContact O-N 3.12Å; L1044-K1048 PolarHBondContact O-N 2.9Å; L1044-M1076 HydrophobicContact CD2-CE 3.5Å; L1044-M1076 VanDerWaalsContact CD2-CE 3.5Å; L1044-M1076 HydrophobicContact CD2-SD 3.2Å; L1044-M1076 WeakPolarHBondContact CD2-SD 3.22Å; L1044-M1076 HydrophobicContact CG-CE 4.18Å; L1044-M1076 HydrophobicContact CG-SD 4.32Å; L1044-L1079 HydrophobicContact CG-CD1 4.48Å
1045	E	83.8	Confident	77.9	Confident	92 Å²	92	42.8 Å²	42.8	43%	0.43	21%	0.209	S	C	.	.	H	α-helix	trans	-67.6	-37.8	176.4	-81.6	-66.4	150.6	0	0	111.4	L1041 F1042 L1047 K1048	L1041-E1045 PolarHBondContact O-N 3.3Å; F1042-E1045 PolarHBondContact O-N 3.17Å; E1045-L1047 VanDerWaalsContact C-N 3.27Å; E1045-L1047 PolarHBondContact O-N 3.15Å; E1045-K1048 VanDerWaalsContact CD-NZ 3.33Å; E1045-K1048 WeakPolarHBondContact O-CB 3.22Å; E1045-K1048 PolarHBondContact O-N 3.26Å; E1045-K1048 IonicContact OE1-NZ 3.14Å; E1045-K1048 PolarHBondContact OE1-NZ 2.75Å; E1045-K1048 WeakPolarHBondContact OE2-CD 3.27Å; E1045-K1048 IonicContact OE2-NZ 3.7Å; E1045-K1048 PolarHBondContact OE2-NZ 3.24Å
1046	S	80.9	Confident	77.9	Confident	17 Å²	17	44.8 Å²	44.8	12%	0.119	22%	0.219	C	C	.	.	H	α-helix	trans	-62.2	-35.1	173.1	-59.9	0	0	0	0	111.7	F1042 G1043 K1048 P1049 A1117	F1042-S1046 WeakPolarHBondContact O-CB 3.09Å; F1042-S1046 PolarHBondContact O-N 2.76Å; F1042-S1046 PolarHBondContact O-OG 2.69Å; G1043-S1046 PolarHBondContact O-N 2.79Å; S1046-K1048 VanDerWaalsContact C-N 3.33Å; S1046-K1048 PolarHBondContact O-N 3.5Å; S1046-P1049 WeakPolarHBondContact O-CD 3.48Å; S1046-A1117 VanDerWaalsContact O-CB 3.28Å; S1046-A1117 WeakPolarHBondContact O-CB 3.3Å
1047	L	77.9	Confident	77.7	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-83.1	-5.6	179.8	-69.7	169.5	0	0	0	114.6	G1043 L1044 E1045 P1049 I1050 A1051 L1072 L1075 M1076 L1079 L1118 A1121	G1043-L1047 WeakPolarHBondContact O-CG 3.35Å; G1043-L1047 PolarHBondContact O-N 3.34Å; L1044-L1047 PolarHBondContact O-N 3.12Å; E1045-L1047 VanDerWaalsContact C-N 3.27Å; E1045-L1047 PolarHBondContact O-N 3.15Å; L1047-P1049 VanDerWaalsContact C-CD 3.44Å; L1047-I1050 HydrophobicContact CD2-CD1 3.84Å; L1047-I1050 WeakPolarHBondContact O-CB 3.33Å; L1047-I1050 PolarHBondContact O-N 3.26Å; L1047-I1050 VanDerWaalsContact O-N 3.1Å; L1047-A1051 PolarHBondContact O-N 3.39Å; L1047-L1072 HydrophobicContact CB-CD1 3.83Å; L1047-L1072 HydrophobicContact CD1-CD1 4.3Å; L1047-L1072 HydrophobicContact CD2-CD1 4.48Å; L1047-L1072 HydrophobicContact CG-CD1 4.4Å; L1047-L1075 HydrophobicContact CD1-CB 3.82Å; L1047-L1075 HydrophobicContact CD1-CD1 4.14Å; L1047-L1075 HydrophobicContact CD2-CD1 3.83Å; L1047-M1076 HydrophobicContact CB-CE 3.94Å; L1047-M1076 HydrophobicContact CD1-CE 3.06Å; L1047-M1076 HydrophobicContact CG-CE 4.08Å; L1047-L1079 HydrophobicContact CD1-CD1 3.95Å; L1047-L1118 HydrophobicContact CD2-CD1 3.94Å; L1047-A1121 HydrophobicContact CD1-CB 3.82Å; L1047-A1121 HydrophobicContact CD2-CB 3.76Å; L1047-A1121 HydrophobicContact CG-CB 3.52Å
1048	K	83.3	Confident	77.3	Confident	71 Å²	71	51.3 Å²	51.3	31%	0.309	24%	0.242	S	C	.	.	H	α-helix	trans	-54.7	-41.5	180	-167.7	168.9	-178.9	167.1	0	114.9	Y1012 L1044 E1045 S1046 I1050 A1051 K1052	Y1012-K1048 HydrophobicContact CE1-CG 4.49Å; Y1012-K1048 WeakPolarHBondContact OH-CA 3.28Å; Y1012-K1048 VanDerWaalsContact OH-CB 3.23Å; Y1012-K1048 WeakPolarHBondContact OH-CB 3.37Å; Y1012-K1048 WeakPolarHBondContact OH-CG 3.3Å; L1044-K1048 PolarHBondContact O-N 2.9Å; E1045-K1048 VanDerWaalsContact CD-NZ 3.33Å; E1045-K1048 WeakPolarHBondContact O-CB 3.22Å; E1045-K1048 PolarHBondContact O-N 3.26Å; E1045-K1048 IonicContact OE1-NZ 3.14Å; E1045-K1048 PolarHBondContact OE1-NZ 2.75Å; E1045-K1048 WeakPolarHBondContact OE2-CD 3.27Å; E1045-K1048 IonicContact OE2-NZ 3.7Å; E1045-K1048 PolarHBondContact OE2-NZ 3.24Å; S1046-K1048 VanDerWaalsContact C-N 3.33Å; S1046-K1048 PolarHBondContact O-N 3.5Å; K1048-I1050 VanDerWaalsContact C-N 3.31Å; K1048-I1050 PolarHBondContact O-N 2.88Å; K1048-A1051 PolarHBondContact O-N 3Å; K1048-K1052 WeakPolarHBondContact O-CB 3.42Å; K1048-K1052 WeakPolarHBondContact O-CG 3.05Å; K1048-K1052 PolarHBondContact O-N 3.09Å
1049	P	76.8	Confident	76.5	Confident	60 Å²	60	47.5 Å²	47.5	39%	0.39	23%	0.226	S	C	.	.	H	α-helix	trans	-61.3	-41.3	176.1	-21.4	34.8	0	0	0	111.7	S1046 L1047 K1052 F1053 A1117	S1046-P1049 WeakPolarHBondContact O-CD 3.48Å; L1047-P1049 VanDerWaalsContact C-CD 3.44Å; P1049-K1052 PolarHBondContact O-N 3.01Å; P1049-F1053 WeakPolarHBondContact O-CB 3.28Å; P1049-F1053 PolarHBondContact O-N 3.32Å; P1049-A1117 HydrophobicContact CG-CB 4.49Å
1050	I	73.2	Confident	75.9	Confident	5 Å²	5	51.1 Å²	51.1	3%	0.026	24%	0.243	C	C	.	.	H	α-helix	trans	-68.1	-44.2	179.6	-55.4	-174.3	0	0	0	110.7	L1047 K1048 K1052 F1053 C1054 A1068 I1113 L1118	L1047-I1050 HydrophobicContact CD2-CD1 3.84Å; L1047-I1050 WeakPolarHBondContact O-CB 3.33Å; L1047-I1050 PolarHBondContact O-N 3.26Å; L1047-I1050 VanDerWaalsContact O-N 3.1Å; K1048-I1050 VanDerWaalsContact C-N 3.31Å; K1048-I1050 PolarHBondContact O-N 2.88Å; I1050-K1052 PolarHBondContact O-N 3.47Å; I1050-F1053 WeakPolarHBondContact O-CA 3.28Å; I1050-F1053 VanDerWaalsContact O-CB 3.23Å; I1050-F1053 WeakPolarHBondContact O-CB 3.41Å; I1050-F1053 PolarHBondContact O-N 3.33Å; I1050-F1053 VanDerWaalsContact O-N 3.1Å; I1050-C1054 PolarHBondContact O-N 2.72Å; I1050-C1054 VanDerWaalsContact O-N 3.16Å; I1050-C1054 PolarHBondContact O-SG 3.42Å; I1050-C1054 VanDerWaalsContact O-SG 3.42Å; I1050-A1068 HydrophobicContact CG2-CB 3.57Å; I1050-I1113 HydrophobicContact CD1-CG2 4.22Å; I1050-L1118 HydrophobicContact CD1-CB 4.06Å; I1050-L1118 HydrophobicContact CD1-CD1 3.39Å; I1050-L1118 HydrophobicContact CD1-CG 4.37Å
1051	A	78.3	Confident	74.9	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.6	-43.1	175.1	0	0	0	0	0	111.9	Y1009 Y1012 L1047 K1048 F1053 C1054 K1055 L1072	Y1009-A1051 HydrophobicContact CD2-CB 4.18Å; Y1009-A1051 VanDerWaalsContact CD2-O 3.27Å; Y1009-A1051 WeakPolarHBondContact CD2-O 3.28Å; Y1012-A1051 HydrophobicContact CD1-CB 3.49Å; Y1012-A1051 VanDerWaalsContact CD1-CB 3.49Å; Y1012-A1051 HydrophobicContact CD2-CB 4.05Å; Y1012-A1051 HydrophobicContact CE1-CB 3.86Å; Y1012-A1051 HydrophobicContact CE2-CB 4.37Å; Y1012-A1051 HydrophobicContact CG-CB 3.59Å; L1047-A1051 PolarHBondContact O-N 3.39Å; K1048-A1051 PolarHBondContact O-N 3Å; A1051-F1053 PolarHBondContact O-N 2.94Å; A1051-C1054 WeakPolarHBondContact O-CB 3.3Å; A1051-C1054 PolarHBondContact O-N 2.86Å; A1051-K1055 PolarHBondContact O-N 3.2Å; A1051-L1072 HydrophobicContact CB-CD1 4.42Å; A1051-L1072 HydrophobicContact CB-CD2 3.98Å
1052	K	80.2	Confident	73.6	Confident	113 Å²	113	60.9 Å²	60.9	49%	0.491	28%	0.278	S	S	.	.	H	α-helix	trans	-60.7	-33.9	173.4	-77.9	179.9	177.6	-179	0	111.8	Y1009 K1048 P1049 I1050 K1055	Y1009-K1052 HydrophobicContact CE2-CG 4.28Å; K1048-K1052 WeakPolarHBondContact O-CB 3.42Å; K1048-K1052 WeakPolarHBondContact O-CG 3.05Å; K1048-K1052 PolarHBondContact O-N 3.09Å; P1049-K1052 PolarHBondContact O-N 3.01Å; I1050-K1052 PolarHBondContact O-N 3.47Å; K1052-K1055 WeakPolarHBondContact O-CB 3.46Å; K1052-K1055 PolarHBondContact O-N 3.26Å
1053	F	75.5	Confident	72.5	Confident	54 Å²	54	57 Å²	57	24%	0.237	26%	0.262	C	S	.	.	H	α-helix	trans	-64.2	-40	177	-157.5	-120.6	0	0	0	111.8	P1049 I1050 A1051 K1055 V1056 R1065 A1068 A1112	P1049-F1053 WeakPolarHBondContact O-CB 3.28Å; P1049-F1053 PolarHBondContact O-N 3.32Å; I1050-F1053 WeakPolarHBondContact O-CA 3.28Å; I1050-F1053 VanDerWaalsContact O-CB 3.23Å; I1050-F1053 WeakPolarHBondContact O-CB 3.41Å; I1050-F1053 PolarHBondContact O-N 3.33Å; I1050-F1053 VanDerWaalsContact O-N 3.1Å; A1051-F1053 PolarHBondContact O-N 2.94Å; F1053-K1055 VanDerWaalsContact C-N 3.34Å; F1053-K1055 PolarHBondContact O-N 2.72Å; F1053-V1056 PolarHBondContact O-N 3.46Å; F1053-R1065 HydrophobicContact CD1-CB 4.1Å; F1053-R1065 HydrophobicContact CD1-CG 3.27Å; F1053-R1065 HydrophobicContact CD2-CG 4.49Å; F1053-R1065 HydrophobicContact CE1-CB 4.06Å; F1053-R1065 HydrophobicContact CE1-CG 3.09Å; F1053-R1065 HydrophobicContact CE2-CG 4.36Å; F1053-R1065 HydrophobicContact CG-CG 3.96Å; F1053-R1065 HydrophobicContact CZ-CG 3.68Å; F1053-R1065 WeakPolarHBondContact O-CD 3.27Å; F1053-A1068 HydrophobicContact CD1-CB 4.21Å; F1053-A1112 HydrophobicContact CE1-CB 3.85Å; F1053-A1112 VanDerWaalsContact CE1-O 3.3Å; F1053-A1112 WeakPolarHBondContact CE1-O 2.99Å; F1053-A1112 HydrophobicContact CZ-CB 3.79Å; F1053-A1112 WeakPolarHBondContact CZ-O 3.36Å
1054	C	75.6	Confident	71.5	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62	-38.3	174.6	-60.4	0	0	0	0	112.5	L1005 I1050 A1051 V1056 A1057	L1005-C1054 HydrophobicContact CB-CB 4.45Å; L1005-C1054 WeakPolarHBondContact O-CB 3.48Å; I1050-C1054 PolarHBondContact O-N 2.72Å; I1050-C1054 VanDerWaalsContact O-N 3.16Å; I1050-C1054 PolarHBondContact O-SG 3.42Å; I1050-C1054 VanDerWaalsContact O-SG 3.42Å; A1051-C1054 WeakPolarHBondContact O-CB 3.3Å; A1051-C1054 PolarHBondContact O-N 2.86Å; C1054-V1056 VanDerWaalsContact C-N 3.26Å; C1054-V1056 PolarHBondContact O-N 2.92Å; C1054-A1057 VanDerWaalsContact O-CB 3.28Å; C1054-A1057 WeakPolarHBondContact O-CB 3.3Å; C1054-A1057 PolarHBondContact O-N 3.34Å
1055	K	77.9	Confident	70.6	Confident	88 Å²	88	59 Å²	59	38%	0.383	27%	0.271	S	S	.	.	H	α-helix	trans	-58.7	-35.4	178.6	-168.5	-169.2	-177	178.7	0	113.4	Y1009 A1051 K1052 F1053 A1057	Y1009-K1055 HydrophobicContact CD1-CB 4.01Å; Y1009-K1055 HydrophobicContact CD1-CD 3.79Å; Y1009-K1055 HydrophobicContact CD1-CG 3.75Å; Y1009-K1055 HydrophobicContact CD2-CB 4.08Å; Y1009-K1055 HydrophobicContact CE1-CD 3.54Å; Y1009-K1055 HydrophobicContact CE1-CG 4.06Å; Y1009-K1055 HydrophobicContact CE2-CD 4.37Å; Y1009-K1055 HydrophobicContact CG-CB 3.75Å; Y1009-K1055 HydrophobicContact CG-CD 4.3Å; Y1009-K1055 HydrophobicContact CG-CG 4.05Å; A1051-K1055 PolarHBondContact O-N 3.2Å; K1052-K1055 WeakPolarHBondContact O-CB 3.46Å; K1052-K1055 PolarHBondContact O-N 3.26Å; F1053-K1055 VanDerWaalsContact C-N 3.34Å; F1053-K1055 PolarHBondContact O-N 2.72Å; K1055-A1057 VanDerWaalsContact C-N 3.32Å
1056	V	73.4	Confident	69.5	Low	98 Å²	98	54.9 Å²	54.9	59%	0.594	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	7.3	-174.1	-169.2	0	0	0	0	111.6	F1053 C1054 R1065	F1053-V1056 PolarHBondContact O-N 3.46Å; C1054-V1056 VanDerWaalsContact C-N 3.26Å; C1054-V1056 PolarHBondContact O-N 2.92Å; V1056-R1065 PolarHBondContact O-NH1 2.89Å
1057	A	68.4	Low	68.6	Low	4 Å²	4	56.7 Å²	56.7	3%	0.033	26%	0.26	C	S	.	.			trans	-61.3	140.6	-177	0	0	0	0	0	114.3	K1002 L1005 C1054 K1055 R1065	K1002-A1057 WeakPolarHBondContact CG-O 3.29Å; L1005-A1057 HydrophobicContact CB-CB 4.01Å; L1005-A1057 HydrophobicContact CD1-CB 3.32Å; L1005-A1057 HydrophobicContact CG-CB 4.28Å; C1054-A1057 VanDerWaalsContact O-CB 3.28Å; C1054-A1057 WeakPolarHBondContact O-CB 3.3Å; C1054-A1057 PolarHBondContact O-N 3.34Å; K1055-A1057 VanDerWaalsContact C-N 3.32Å; A1057-R1065 HydrophobicContact CB-CB 4.1Å; A1057-R1065 HydrophobicContact CB-CG 4.33Å
1058	R	66.5	Low	67.9	Low	208 Å²	208	56.7 Å²	56.7	79%	0.785	26%	0.26	S	S	*	.			trans	-90.5	-2.9	173.1	-67.7	-173.2	-179.6	-175.7	0.4	112.9
1059	G	62	Low	67.1	Low	3 Å²	3	53.4 Å²	53.4	3%	0.031	25%	0.245	C	C	.	.			trans	84.3	15.1	178.6	0	0	0	0	0	114.8	P998	P998-G1059 WeakPolarHBondContact CA-O 3.48Å; P998-G1059 WeakPolarHBondContact O-CA 3.34Å
1060	D	63.8	Low	66.6	Low	90 Å²	90	52.3 Å²	52.3	48%	0.481	24%	0.239	S	C	.	.			trans	-82.2	126.3	174.4	-172.9	-9.9	0	0	0	109.6	R1062 D1063	D1060-R1062 VanDerWaalsContact C-N 3.26Å; D1060-R1062 PolarHBondContact O-N 2.66Å; D1060-R1062 PolarHBondContact OD1-N 3.03Å; D1060-D1063 HydrophobicContact CB-CB 4.16Å; D1060-D1063 WeakPolarHBondContact O-CB 3.2Å; D1060-D1063 PolarHBondContact O-N 2.88Å
1061	L	54	Low	66.1	Low	31 Å²	31	52.4 Å²	52.4	16%	0.162	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-29.5	179.7	-81.5	158.5	0	0	0	112.2	M995 M1001 D1063 F1066	M995-L1061 HydrophobicContact CG-CD1 4.48Å; M995-L1061 HydrophobicContact SD-CD1 3.56Å; M995-L1061 VanDerWaalsContact SD-CD1 3.56Å; M1001-L1061 HydrophobicContact CE-CD2 3.69Å; L1061-D1063 PolarHBondContact O-N 2.96Å; L1061-F1066 HydrophobicContact CD2-CD2 4.07Å; L1061-F1066 HydrophobicContact CD2-CE1 4.43Å; L1061-F1066 HydrophobicContact CD2-CE2 3.76Å; L1061-F1066 HydrophobicContact CD2-CG 4.45Å; L1061-F1066 HydrophobicContact CD2-CZ 3.87Å
1062	R	55.2	Low	65.6	Low	228 Å²	228	52.4 Å²	52.4	86%	0.86	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-2.2	177.4	-55	-174.8	-162.3	-171.9	4.8	112.7	D1060	D1060-R1062 VanDerWaalsContact C-N 3.26Å; D1060-R1062 PolarHBondContact O-N 2.66Å; D1060-R1062 PolarHBondContact OD1-N 3.03Å
1063	D	58.1	Low	65	Low	33 Å²	33	47.7 Å²	47.7	18%	0.176	22%	0.219	C	C	.	.	S	Bend	trans	-73.3	137	178.5	-162.1	-19.7	0	0	0	109.5	D1060 L1061 R1065 F1066	D1060-D1063 HydrophobicContact CB-CB 4.16Å; D1060-D1063 WeakPolarHBondContact O-CB 3.2Å; D1060-D1063 PolarHBondContact O-N 2.88Å; L1061-D1063 PolarHBondContact O-N 2.96Å; D1063-R1065 HydrophobicContact CB-CB 4.2Å; D1063-R1065 PolarHBondContact O-N 2.93Å; D1063-R1065 WeakPolarHBondContact OD1-CG 3.4Å; D1063-R1065 PolarHBondContact OD1-N 2.9Å; D1063-R1065 IonicContact OD1-NE 2.78Å; D1063-R1065 WeakPolarHBondContact OD2-CD 3.45Å; D1063-R1065 IonicContact OD2-CZ 3.69Å; D1063-R1065 IonicContact OD2-NE 2.96Å; D1063-R1065 PolarHBondContact OD2-NE 3.29Å; D1063-R1065 IonicContact OD2-NH1 3.72Å; D1063-R1065 PolarHBondContact OD2-NH1 3.4Å; D1063-F1066 PolarHBondContact O-N 3.35Å
1064	G	56.9	Low	64.5	Low	4 Å²	4	45.8 Å²	45.8	4%	0.041	21%	0.212	C	C	.	.	H	α-helix	trans	-55.6	-13.2	171.3	0	0	0	0	0	113.1	A1068 I1113	G1064-A1068 WeakPolarHBondContact O-CB 3.42Å; G1064-A1068 PolarHBondContact O-N 2.81Å; G1064-I1113 WeakPolarHBondContact O-CD1 3.48Å
1065	R	60.4	Low	64	Low	39 Å²	39	46.4 Å²	46.4	15%	0.147	22%	0.215	C	C	.	.	H	α-helix	trans	-66.1	-34.6	172.3	-66.8	-179.6	-167.9	139.8	-9	114.4	F1053 V1056 A1057 D1063 A1068 F1069	F1053-R1065 HydrophobicContact CD1-CB 4.1Å; F1053-R1065 HydrophobicContact CD1-CG 3.27Å; F1053-R1065 HydrophobicContact CD2-CG 4.49Å; F1053-R1065 HydrophobicContact CE1-CB 4.06Å; F1053-R1065 HydrophobicContact CE1-CG 3.09Å; F1053-R1065 HydrophobicContact CE2-CG 4.36Å; F1053-R1065 HydrophobicContact CG-CG 3.96Å; F1053-R1065 HydrophobicContact CZ-CG 3.68Å; F1053-R1065 WeakPolarHBondContact O-CD 3.27Å; V1056-R1065 PolarHBondContact O-NH1 2.89Å; A1057-R1065 HydrophobicContact CB-CB 4.1Å; A1057-R1065 HydrophobicContact CB-CG 4.33Å; D1063-R1065 HydrophobicContact CB-CB 4.2Å; D1063-R1065 PolarHBondContact O-N 2.93Å; D1063-R1065 WeakPolarHBondContact OD1-CG 3.4Å; D1063-R1065 PolarHBondContact OD1-N 2.9Å; D1063-R1065 IonicContact OD1-NE 2.78Å; D1063-R1065 WeakPolarHBondContact OD2-CD 3.45Å; D1063-R1065 IonicContact OD2-CZ 3.69Å; D1063-R1065 IonicContact OD2-NE 2.96Å; D1063-R1065 PolarHBondContact OD2-NE 3.29Å; D1063-R1065 IonicContact OD2-NH1 3.72Å; D1063-R1065 PolarHBondContact OD2-NH1 3.4Å; R1065-A1068 WeakPolarHBondContact O-CB 3.2Å; R1065-A1068 PolarHBondContact O-N 2.77Å; R1065-F1069 PolarHBondContact O-N 3.33Å; R1065-F1069 VanDerWaalsContact O-N 3.09Å
1066	F	61.2	Low	63.6	Low	7 Å²	7	42.2 Å²	42.2	3%	0.031	20%	0.197	C	C	.	.	H	α-helix	trans	-68.9	-45.9	176.1	172.8	-108.4	0	0	0	110.3	L987 M1001 L1061 D1063 A1068 F1069 C1070	L987-F1066 HydrophobicContact CB-CE2 4.16Å; L987-F1066 HydrophobicContact CB-CZ 4.46Å; L987-F1066 WeakPolarHBondContact O-CE2 3.39Å; L987-F1066 WeakPolarHBondContact O-CZ 3.25Å; M1001-F1066 HydrophobicContact CE-CD2 4.09Å; M1001-F1066 HydrophobicContact CE-CE2 3.86Å; M1001-F1066 HydrophobicContact SD-CD2 4.09Å; M1001-F1066 HydrophobicContact SD-CE2 4.39Å; L1061-F1066 HydrophobicContact CD2-CD2 4.07Å; L1061-F1066 HydrophobicContact CD2-CE1 4.43Å; L1061-F1066 HydrophobicContact CD2-CE2 3.76Å; L1061-F1066 HydrophobicContact CD2-CG 4.45Å; L1061-F1066 HydrophobicContact CD2-CZ 3.87Å; D1063-F1066 PolarHBondContact O-N 3.35Å; F1066-A1068 VanDerWaalsContact C-N 3.31Å; F1066-A1068 PolarHBondContact O-N 3.17Å; F1066-F1069 WeakPolarHBondContact O-CB 3.46Å; F1066-F1069 PolarHBondContact O-N 2.99Å; F1066-C1070 PolarHBondContact O-N 3.27Å; F1066-C1070 PolarHBondContact O-SG 3.3Å; F1066-C1070 VanDerWaalsContact O-SG 3.41Å
1067	I	62.6	Low	63.3	Low	54 Å²	54	38.5 Å²	38.5	28%	0.277	17%	0.173	S	C	.	.	H	α-helix	trans	-55.2	-52.4	172.4	-59.6	175.1	0	0	0	108.3	F1069 C1070 L1071 L1105 C1108 I1113	I1067-F1069 PolarHBondContact O-N 3.48Å; I1067-C1070 CarbonylContact O-C 3.56Å; I1067-C1070 WeakPolarHBondContact O-CA 2.91Å; I1067-C1070 WeakPolarHBondContact O-CB 3.25Å; I1067-C1070 PolarHBondContact O-N 3.19Å; I1067-L1071 HydrophobicContact CG2-CD1 4.15Å; I1067-L1071 HydrophobicContact CG2-CD2 4.12Å; I1067-L1071 HydrophobicContact CG2-CG 4.07Å; I1067-L1071 VanDerWaalsContact O-CG 3.23Å; I1067-L1071 WeakPolarHBondContact O-CG 3.36Å; I1067-L1071 PolarHBondContact O-N 2.85Å; I1067-L1105 HydrophobicContact CG2-CD2 4.46Å; I1067-C1108 WeakPolarHBondContact CD1-SG 3.31Å; I1067-I1113 HydrophobicContact CB-CD1 3.85Å; I1067-I1113 HydrophobicContact CG2-CD1 3.6Å
1068	A	63.3	Low	63.2	Low	0 Å²	0	38.5 Å²	38.5	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-48.9	-37.4	174.9	0	0	0	0	0	114.6	I1050 F1053 G1064 R1065 F1066 L1072 I1113	I1050-A1068 HydrophobicContact CG2-CB 3.57Å; F1053-A1068 HydrophobicContact CD1-CB 4.21Å; G1064-A1068 WeakPolarHBondContact O-CB 3.42Å; G1064-A1068 PolarHBondContact O-N 2.81Å; R1065-A1068 WeakPolarHBondContact O-CB 3.2Å; R1065-A1068 PolarHBondContact O-N 2.77Å; F1066-A1068 VanDerWaalsContact C-N 3.31Å; F1066-A1068 PolarHBondContact O-N 3.17Å; A1068-L1072 WeakPolarHBondContact O-CB 3Å; A1068-L1072 PolarHBondContact O-N 2.67Å; A1068-I1113 HydrophobicContact CB-CD1 4.46Å
1069	F	65.8	Low	63.2	Low	2 Å²	2	28.8 Å²	28.8	1%	0.009	14%	0.136	C	C	.	.	H	α-helix	trans	-72.6	-44.8	175	174.2	-126.1	0	0	0	113	F976 L987 V1004 L1005 A1008 R1065 F1066 I1067 L1071 L1072 R1073	F976-F1069 HydrophobicContact CE2-CD2 4.36Å; F976-F1069 AromaticContact CE2-CE2 3.65Å; F976-F1069 HydrophobicContact CE2-CE2 3.65Å; F976-F1069 AromaticContact CZ-CD2 3.88Å; F976-F1069 HydrophobicContact CZ-CD2 3.88Å; F976-F1069 AromaticContact CZ-CE2 3.53Å; F976-F1069 HydrophobicContact CZ-CE2 3.53Å; L987-F1069 HydrophobicContact CD1-CD1 3.91Å; L987-F1069 HydrophobicContact CD1-CE1 3.13Å; L987-F1069 HydrophobicContact CD1-CZ 3.79Å; L987-F1069 HydrophobicContact CD2-CD1 4.4Å; L987-F1069 HydrophobicContact CD2-CE1 3.75Å; L987-F1069 HydrophobicContact CG-CE1 4.06Å; V1004-F1069 HydrophobicContact CG1-CE1 3.7Å; V1004-F1069 HydrophobicContact CG1-CZ 3.78Å; L1005-F1069 HydrophobicContact CD2-CB 3.31Å; L1005-F1069 HydrophobicContact CD2-CD1 3.82Å; L1005-F1069 HydrophobicContact CD2-CD2 4.32Å; L1005-F1069 HydrophobicContact CD2-CG 3.59Å; A1008-F1069 HydrophobicContact CB-CD2 3.6Å; A1008-F1069 HydrophobicContact CB-CE2 3.42Å; A1008-F1069 VanDerWaalsContact CB-CE2 3.42Å; A1008-F1069 HydrophobicContact CB-CZ 4.37Å; R1065-F1069 PolarHBondContact O-N 3.33Å; R1065-F1069 VanDerWaalsContact O-N 3.09Å; F1066-F1069 WeakPolarHBondContact O-CB 3.46Å; F1066-F1069 PolarHBondContact O-N 2.99Å; I1067-F1069 PolarHBondContact O-N 3.48Å; F1069-L1071 PolarHBondContact O-N 3.17Å; F1069-L1072 PolarHBondContact O-N 3.04Å; F1069-R1073 PolarHBondContact O-N 3.09Å
1070	C	66.1	Low	63.4	Low	38 Å²	38	29 Å²	29	26%	0.257	14%	0.138	S	C	.	.	H	α-helix	trans	-58.2	-32.1	171.7	-63.3	0	0	0	0	111.7	F1066 I1067 P1074	F1066-C1070 PolarHBondContact O-N 3.27Å; F1066-C1070 PolarHBondContact O-SG 3.3Å; F1066-C1070 VanDerWaalsContact O-SG 3.41Å; I1067-C1070 CarbonylContact O-C 3.56Å; I1067-C1070 WeakPolarHBondContact O-CA 2.91Å; I1067-C1070 WeakPolarHBondContact O-CB 3.25Å; I1067-C1070 PolarHBondContact O-N 3.19Å; C1070-P1074 WeakPolarHBondContact O-CD 3.07Å; C1070-P1074 WeakPolarHBondContact O-CG 3.01Å
1071	L	63.2	Low	63.5	Low	6 Å²	6	26.2 Å²	26.2	3%	0.031	13%	0.125	C	C	.	.	H	α-helix	trans	-77.7	-45.5	173.8	-51.5	173.4	0	0	0	113	I1067 F1069 R1073 L1075 F1101 L1105 I1113 L1118	I1067-L1071 HydrophobicContact CG2-CD1 4.15Å; I1067-L1071 HydrophobicContact CG2-CD2 4.12Å; I1067-L1071 HydrophobicContact CG2-CG 4.07Å; I1067-L1071 VanDerWaalsContact O-CG 3.23Å; I1067-L1071 WeakPolarHBondContact O-CG 3.36Å; I1067-L1071 PolarHBondContact O-N 2.85Å; F1069-L1071 PolarHBondContact O-N 3.17Å; L1071-R1073 PolarHBondContact O-N 3.35Å; L1071-L1075 WeakPolarHBondContact O-CD1 3.39Å; L1071-L1075 WeakPolarHBondContact O-CG 3.49Å; L1071-F1101 HydrophobicContact CB-CE2 3.94Å; L1071-F1101 HydrophobicContact CB-CZ 3.73Å; L1071-F1101 HydrophobicContact CD2-CD1 4.38Å; L1071-F1101 HydrophobicContact CD2-CD2 3.56Å; L1071-F1101 HydrophobicContact CD2-CE1 3.92Å; L1071-F1101 HydrophobicContact CD2-CE2 3.02Å; L1071-F1101 HydrophobicContact CD2-CG 4.24Å; L1071-F1101 HydrophobicContact CD2-CZ 3.22Å; L1071-F1101 HydrophobicContact CG-CE2 3.97Å; L1071-F1101 HydrophobicContact CG-CZ 3.93Å; L1071-L1105 HydrophobicContact CD1-CD1 4.13Å; L1071-L1105 HydrophobicContact CD1-CD2 3.45Å; L1071-L1105 VanDerWaalsContact CD1-CD2 3.45Å; L1071-L1105 HydrophobicContact CD1-CG 4.1Å; L1071-L1105 HydrophobicContact CD2-CD1 4Å; L1071-L1105 HydrophobicContact CD2-CD2 4.22Å; L1071-L1105 HydrophobicContact CD2-CG 4.01Å; L1071-L1105 HydrophobicContact CG-CD2 4.47Å; L1071-I1113 HydrophobicContact CD1-CD1 3.99Å; L1071-I1113 HydrophobicContact CD1-CG2 3.89Å; L1071-L1118 HydrophobicContact CB-CD1 3.87Å; L1071-L1118 HydrophobicContact CD1-CD1 3.88Å; L1071-L1118 HydrophobicContact CD1-CD2 4.09Å; L1071-L1118 HydrophobicContact CG-CD1 4.44Å
1072	L	67.5	Low	63.9	Low	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-60.1	-37.3	-173.4	-176.4	64.4	0	0	0	110.6	F976 L1047 A1051 A1068 F1069 M1076	F976-L1072 HydrophobicContact CE1-CD2 4.15Å; F976-L1072 HydrophobicContact CE1-CG 4.03Å; F976-L1072 HydrophobicContact CZ-CD2 4.13Å; F976-L1072 HydrophobicContact CZ-CG 4.42Å; L1047-L1072 HydrophobicContact CB-CD1 3.83Å; L1047-L1072 HydrophobicContact CD1-CD1 4.3Å; L1047-L1072 HydrophobicContact CD2-CD1 4.48Å; L1047-L1072 HydrophobicContact CG-CD1 4.4Å; A1051-L1072 HydrophobicContact CB-CD1 4.42Å; A1051-L1072 HydrophobicContact CB-CD2 3.98Å; A1068-L1072 WeakPolarHBondContact O-CB 3Å; A1068-L1072 PolarHBondContact O-N 2.67Å; F1069-L1072 PolarHBondContact O-N 3.04Å; L1072-M1076 HydrophobicContact CD1-CE 4.12Å; L1072-M1076 HydrophobicContact CD1-CG 4.09Å; L1072-M1076 HydrophobicContact CG-CG 4.1Å; L1072-M1076 WeakPolarHBondContact O-CB 3.5Å; L1072-M1076 WeakPolarHBondContact O-CG 3.31Å; L1072-M1076 PolarHBondContact O-N 3.49Å
1073	R	67.3	Low	64.3	Low	15 Å²	15	14.2 Å²	14.2	6%	0.057	8%	0.078	C	C	.	.	H	α-helix	trans	-77	-49.2	-168	-164.5	160.8	164	-70.4	-12.9	115.6	S975 F976 M978 P979 V981 F1069 L1071 L1075 M1076 H1077	S975-R1073 PolarHBondContact O-NE 2.95Å; S975-R1073 PolarHBondContact O-NH2 2.85Å; S975-R1073 VanDerWaalsContact O-NH2 3.08Å; F976-R1073 HydrophobicContact CD1-CG 4.19Å; F976-R1073 HydrophobicContact CE1-CB 3.86Å; F976-R1073 HydrophobicContact CE1-CG 3.87Å; F976-R1073 HydrophobicContact CZ-CB 4.2Å; F976-R1073 HydrophobicContact CZ-CG 4.28Å; M978-R1073 PolarHBondContact O-NH2 3.24Å; P979-R1073 PolarHBondContact O-NH2 2.9Å; V981-R1073 VanDerWaalsContact C-NH1 3.26Å; V981-R1073 VanDerWaalsContact CB-CZ 3.5Å; F1069-R1073 PolarHBondContact O-N 3.09Å; L1071-R1073 PolarHBondContact O-N 3.35Å; R1073-L1075 PolarHBondContact O-N 3.13Å; R1073-M1076 PolarHBondContact O-N 3.17Å; R1073-H1077 WeakPolarHBondContact O-CB 3.44Å; R1073-H1077 PolarHBondContact O-N 3.05Å
1074	P	64.5	Low	64.5	Low	14 Å²	14	14.7 Å²	14.7	9%	0.091	9%	0.091	C	C	.	.	H	α-helix	trans	-57.2	-37.6	172.7	-22.6	31.7	0	0	0	112.6	A982 C1070 H1077 S1078 V1095	A982-P1074 HydrophobicContact CB-CG 3.72Å; C1070-P1074 WeakPolarHBondContact O-CD 3.07Å; C1070-P1074 WeakPolarHBondContact O-CG 3.01Å; P1074-H1077 PolarHBondContact O-N 3.4Å; P1074-S1078 WeakPolarHBondContact O-CB 3.45Å; P1074-S1078 PolarHBondContact O-N 2.92Å; P1074-S1078 PolarHBondContact O-OG 2.98Å; P1074-V1095 HydrophobicContact CB-CG1 4.01Å; P1074-V1095 HydrophobicContact CB-CG2 4.36Å
1075	L	66.6	Low	64.7	Low	12 Å²	12	15.7 Å²	15.7	6%	0.063	9%	0.094	C	C	.	.	H	α-helix	trans	-66.9	-45.7	177	-65.7	177.6	0	0	0	111.7	L1047 L1071 R1073 H1077 S1078 L1079 F1101 L1118 L1122	L1047-L1075 HydrophobicContact CD1-CB 3.82Å; L1047-L1075 HydrophobicContact CD1-CD1 4.14Å; L1047-L1075 HydrophobicContact CD2-CD1 3.83Å; L1071-L1075 WeakPolarHBondContact O-CD1 3.39Å; L1071-L1075 WeakPolarHBondContact O-CG 3.49Å; R1073-L1075 PolarHBondContact O-N 3.13Å; L1075-H1077 VanDerWaalsContact C-N 3.34Å; L1075-S1078 WeakPolarHBondContact O-CB 3.19Å; L1075-S1078 PolarHBondContact O-N 2.93Å; L1075-L1079 VanDerWaalsContact O-CB 3.3Å; L1075-L1079 WeakPolarHBondContact O-CB 3.42Å; L1075-L1079 VanDerWaalsContact O-CD1 3.31Å; L1075-L1079 WeakPolarHBondContact O-CD1 3.38Å; L1075-L1079 WeakPolarHBondContact O-CG 3.39Å; L1075-L1079 PolarHBondContact O-N 3.06Å; L1075-F1101 HydrophobicContact CD1-CZ 4.4Å; L1075-L1118 HydrophobicContact CD1-CD1 3.48Å; L1075-L1118 VanDerWaalsContact CD1-CD1 3.48Å; L1075-L1118 HydrophobicContact CD1-CG 3.94Å; L1075-L1122 HydrophobicContact CD2-CD1 4.31Å; L1075-L1122 HydrophobicContact CD2-CD2 3.32Å; L1075-L1122 HydrophobicContact CD2-CG 3.51Å
1076	M	68.4	Low	64.3	Low	0 Å²	0	19.4 Å²	19.4	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62.1	-41.1	174.7	-74	-64.2	110.9	0	0	112.3	F976 Y1012 L1015 L1044 L1047 L1072 R1073 L1079 C1080	F976-M1076 HydrophobicContact CD1-CB 3.95Å; F976-M1076 HydrophobicContact CD1-CG 3.96Å; F976-M1076 HydrophobicContact CE1-CB 4.32Å; F976-M1076 HydrophobicContact CE1-CG 4.06Å; Y1012-M1076 HydrophobicContact CD2-CE 4.35Å; Y1012-M1076 HydrophobicContact CD2-SD 4Å; L1015-M1076 HydrophobicContact CD2-CB 4.24Å; L1015-M1076 HydrophobicContact CD2-CG 4.39Å; L1015-M1076 HydrophobicContact CD2-SD 3.51Å; L1015-M1076 VanDerWaalsContact CD2-SD 3.51Å; L1044-M1076 HydrophobicContact CD2-CE 3.5Å; L1044-M1076 VanDerWaalsContact CD2-CE 3.5Å; L1044-M1076 HydrophobicContact CD2-SD 3.2Å; L1044-M1076 WeakPolarHBondContact CD2-SD 3.22Å; L1044-M1076 HydrophobicContact CG-CE 4.18Å; L1044-M1076 HydrophobicContact CG-SD 4.32Å; L1047-M1076 HydrophobicContact CB-CE 3.94Å; L1047-M1076 HydrophobicContact CD1-CE 3.06Å; L1047-M1076 HydrophobicContact CG-CE 4.08Å; L1072-M1076 HydrophobicContact CD1-CE 4.12Å; L1072-M1076 HydrophobicContact CD1-CG 4.09Å; L1072-M1076 HydrophobicContact CG-CG 4.1Å; L1072-M1076 WeakPolarHBondContact O-CB 3.5Å; L1072-M1076 WeakPolarHBondContact O-CG 3.31Å; L1072-M1076 PolarHBondContact O-N 3.49Å; R1073-M1076 PolarHBondContact O-N 3.17Å; M1076-L1079 HydrophobicContact CE-CD1 3.28Å; M1076-L1079 WeakPolarHBondContact O-CB 3.39Å; M1076-L1079 PolarHBondContact O-N 3.34Å; M1076-L1079 HydrophobicContact SD-CD1 4.28Å; M1076-C1080 PolarHBondContact O-N 3.36Å; M1076-C1080 PolarHBondContact O-SG 3.37Å
1077	H	67.7	Low	63.9	Low	20 Å²	20	20.9 Å²	20.9	9%	0.093	13%	0.125	C	C	.	.	H	α-helix	trans	-59.8	-52.5	176.6	178.9	77.4	0	0	0	111.3	R1073 P1074 L1075 L1079 C1080 C1081 D1087 F1090	R1073-H1077 WeakPolarHBondContact O-CB 3.44Å; R1073-H1077 PolarHBondContact O-N 3.05Å; P1074-H1077 PolarHBondContact O-N 3.4Å; L1075-H1077 VanDerWaalsContact C-N 3.34Å; H1077-L1079 VanDerWaalsContact C-N 3.27Å; H1077-L1079 PolarHBondContact O-N 2.88Å; H1077-C1080 WeakPolarHBondContact O-CA 3.41Å; H1077-C1080 WeakPolarHBondContact O-CB 3.15Å; H1077-C1080 PolarHBondContact O-N 3.32Å; H1077-C1081 PolarHBondContact NE2-SG 2.76Å; H1077-C1081 PolarHBondContact O-N 3.12Å; H1077-D1087 WeakPolarHBondContact CE1-CB 3.49Å; H1077-D1087 IonicContact CE1-OD2 2.68Å; H1077-D1087 PolarHBondContact CE1-OD2 3.01Å; H1077-D1087 IonicContact ND1-OD2 3.62Å; H1077-F1090 HydrophobicContact CB-CE2 4.4Å; H1077-F1090 AromaticContact CD2-CD1 3.68Å; H1077-F1090 AromaticContact CD2-CD2 3.09Å; H1077-F1090 WeakPolarHBondContact CD2-CD2 3.36Å; H1077-F1090 AromaticContact CD2-CE1 3.69Å; H1077-F1090 AromaticContact CD2-CE2 3.12Å; H1077-F1090 WeakPolarHBondContact CD2-CE2 2.85Å; H1077-F1090 AromaticContact CD2-CG 3.36Å; H1077-F1090 WeakPolarHBondContact CD2-CG 3.4Å; H1077-F1090 AromaticContact CD2-CZ 3.4Å; H1077-F1090 WeakPolarHBondContact CD2-CZ 3.34Å; H1077-F1090 VanDerWaalsContact CE1-CB 3.4Å; H1077-F1090 WeakPolarHBondContact CE1-CB 3.18Å; H1077-F1090 AromaticContact CE1-CD2 3.67Å; H1077-F1090 AromaticContact CE1-CG 3.56Å; H1077-F1090 AromaticContact CG-CD2 3.58Å; H1077-F1090 AromaticContact CG-CE2 3.69Å; H1077-F1090 AromaticContact ND1-CD2 3.88Å; H1077-F1090 WeakPolarHBondContact NE2-CB 3.41Å; H1077-F1090 AromaticContact NE2-CD1 3.31Å; H1077-F1090 VanDerWaalsContact NE2-CD1 3.31Å; H1077-F1090 WeakPolarHBondContact NE2-CD1 3.42Å; H1077-F1090 AromaticContact NE2-CD2 3.19Å; H1077-F1090 WeakPolarHBondContact NE2-CD2 3.39Å; H1077-F1090 AromaticContact NE2-CE1 3.81Å; H1077-F1090 AromaticContact NE2-CE2 3.71Å; H1077-F1090 AromaticContact NE2-CG 2.93Å; H1077-F1090 WeakPolarHBondContact NE2-CG 3.46Å; H1077-F1090 AromaticContact NE2-CZ 3.96Å
1078	S	65.3	Low	63.3	Low	5 Å²	5	24.8 Å²	24.8	4%	0.035	15%	0.151	C	C	.	.	H	α-helix	trans	-52.2	-47.9	175.2	-70.6	0	0	0	0	111.3	P1074 L1075 C1080 C1081 V1082 L1129	P1074-S1078 WeakPolarHBondContact O-CB 3.45Å; P1074-S1078 PolarHBondContact O-N 2.92Å; P1074-S1078 PolarHBondContact O-OG 2.98Å; L1075-S1078 WeakPolarHBondContact O-CB 3.19Å; L1075-S1078 PolarHBondContact O-N 2.93Å; S1078-C1080 PolarHBondContact O-N 3.31Å; S1078-C1081 PolarHBondContact O-N 2.89Å; S1078-V1082 WeakPolarHBondContact O-CG2 3.26Å; S1078-V1082 PolarHBondContact O-N 3.07Å; S1078-V1082 VanDerWaalsContact O-N 3.13Å; S1078-L1129 VanDerWaalsContact O-CD2 3.23Å; S1078-L1129 WeakPolarHBondContact O-CD2 3.23Å
1079	L	67.4	Low	62.5	Low	3 Å²	3	26.4 Å²	26.4	2%	0.016	16%	0.162	C	C	.	.	H	α-helix	trans	-57.9	-42.9	174.7	-80.3	163.7	0	0	0	113	V1040 L1044 L1047 L1075 M1076 H1077 V1082 A1083 V1125	V1040-L1079 HydrophobicContact CB-CD2 3.85Å; V1040-L1079 HydrophobicContact CG1-CB 4.15Å; V1040-L1079 HydrophobicContact CG1-CD2 3.85Å; V1040-L1079 HydrophobicContact CG2-CB 4.48Å; V1040-L1079 HydrophobicContact CG2-CD2 3.81Å; V1040-L1079 WeakPolarHBondContact CG2-O 3.49Å; V1040-L1079 WeakPolarHBondContact O-CD2 3.47Å; L1044-L1079 HydrophobicContact CG-CD1 4.48Å; L1047-L1079 HydrophobicContact CD1-CD1 3.95Å; L1075-L1079 VanDerWaalsContact O-CB 3.3Å; L1075-L1079 WeakPolarHBondContact O-CB 3.42Å; L1075-L1079 VanDerWaalsContact O-CD1 3.31Å; L1075-L1079 WeakPolarHBondContact O-CD1 3.38Å; L1075-L1079 WeakPolarHBondContact O-CG 3.39Å; L1075-L1079 PolarHBondContact O-N 3.06Å; M1076-L1079 HydrophobicContact CE-CD1 3.28Å; M1076-L1079 WeakPolarHBondContact O-CB 3.39Å; M1076-L1079 PolarHBondContact O-N 3.34Å; M1076-L1079 HydrophobicContact SD-CD1 4.28Å; H1077-L1079 VanDerWaalsContact C-N 3.27Å; H1077-L1079 PolarHBondContact O-N 2.88Å; L1079-V1082 PolarHBondContact O-N 2.83Å; L1079-A1083 PolarHBondContact O-N 3.38Å; L1079-A1083 VanDerWaalsContact O-N 3.09Å; L1079-V1125 HydrophobicContact CD2-CB 4.16Å; L1079-V1125 HydrophobicContact CD2-CG1 3.87Å; L1079-V1125 HydrophobicContact CD2-CG2 3.11Å; L1079-V1125 HydrophobicContact CG-CG1 4.2Å; L1079-V1125 HydrophobicContact CG-CG2 3.78Å
1080	C	65.3	Low	61.8	Low	9 Å²	9	27.8 Å²	27.8	6%	0.061	17%	0.168	C	C	.	.	H	α-helix	trans	-62.1	-45.9	176.5	-71	0	0	0	0	112	L1015 M1076 H1077 S1078 V1082 A1083 G1084 F1085	L1015-C1080 WeakPolarHBondContact CD1-SG 3.27Å; L1015-C1080 VanDerWaalsContact CD2-SG 3.58Å; M1076-C1080 PolarHBondContact O-N 3.36Å; M1076-C1080 PolarHBondContact O-SG 3.37Å; H1077-C1080 WeakPolarHBondContact O-CA 3.41Å; H1077-C1080 WeakPolarHBondContact O-CB 3.15Å; H1077-C1080 PolarHBondContact O-N 3.32Å; S1078-C1080 PolarHBondContact O-N 3.31Å; C1080-V1082 VanDerWaalsContact C-N 3.27Å; C1080-V1082 PolarHBondContact O-N 3.16Å; C1080-A1083 CarbonylContact O-C 3.45Å; C1080-A1083 WeakPolarHBondContact O-CA 3.03Å; C1080-A1083 WeakPolarHBondContact O-CB 3.37Å; C1080-A1083 PolarHBondContact O-N 3.44Å; C1080-A1083 VanDerWaalsContact O-N 3.08Å; C1080-G1084 PolarHBondContact O-N 3.42Å; C1080-F1085 HydrophobicContact CB-CB 4.14Å; C1080-F1085 HydrophobicContact CB-CD2 4.1Å; C1080-F1085 VanDerWaalsContact O-CB 3.3Å; C1080-F1085 WeakPolarHBondContact O-CB 3.37Å; C1080-F1085 WeakPolarHBondContact O-CD2 3.39Å; C1080-F1085 PolarHBondContact O-N 3.4Å
1081	C	65.9	Low	61.1	Low	31 Å²	31	31.7 Å²	31.7	21%	0.209	18%	0.181	C	C	.	.	H	α-helix	trans	-58.8	-39.5	176.8	-72.7	0	0	0	0	111.9	H1077 S1078 A1083 G1084 F1085	H1077-C1081 PolarHBondContact NE2-SG 2.76Å; H1077-C1081 PolarHBondContact O-N 3.12Å; S1078-C1081 PolarHBondContact O-N 2.89Å; C1081-A1083 VanDerWaalsContact C-N 3.33Å; C1081-A1083 PolarHBondContact O-N 2.85Å; C1081-G1084 WeakPolarHBondContact O-CA 3.37Å; C1081-G1084 PolarHBondContact O-N 3.33Å; C1081-F1085 WeakPolarHBondContact CA-O 3.21Å; C1081-F1085 PolarHBondContact SG-O 3.43Å
1082	V	63.6	Low	60.5	Low	7 Å²	7	32.7 Å²	32.7	4%	0.042	19%	0.19	C	C	.	.	H	α-helix	trans	-66.6	-34.9	176.5	173.9	0	0	0	0	112.4	K1036 V1040 S1078 L1079 C1080 G1084 V1125 Y1128 L1129	K1036-V1082 HydrophobicContact CB-CG1 3.85Å; K1036-V1082 HydrophobicContact CD-CG1 4.49Å; K1036-V1082 HydrophobicContact CG-CG1 3.95Å; V1040-V1082 HydrophobicContact CG2-CB 3.85Å; V1040-V1082 HydrophobicContact CG2-CG1 3.72Å; S1078-V1082 WeakPolarHBondContact O-CG2 3.26Å; S1078-V1082 PolarHBondContact O-N 3.07Å; S1078-V1082 VanDerWaalsContact O-N 3.13Å; L1079-V1082 PolarHBondContact O-N 2.83Å; C1080-V1082 VanDerWaalsContact C-N 3.27Å; C1080-V1082 PolarHBondContact O-N 3.16Å; V1082-G1084 PolarHBondContact O-N 3.5Å; V1082-G1084 VanDerWaalsContact O-N 3.17Å; V1082-V1125 HydrophobicContact CB-CG1 4.2Å; V1082-V1125 HydrophobicContact CG1-CG1 4.47Å; V1082-V1125 HydrophobicContact CG2-CG1 3.68Å; V1082-Y1128 HydrophobicContact CG1-CD2 4.05Å; V1082-Y1128 HydrophobicContact CG1-CG 3.86Å; V1082-Y1128 VanDerWaalsContact CG2-CB 3.43Å; V1082-L1129 HydrophobicContact CG2-CD2 3.48Å; V1082-L1129 VanDerWaalsContact CG2-CD2 3.48Å; V1082-L1129 HydrophobicContact CG2-CG 4.2Å
1083	A	64.1	Low	59.4	Low	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	3.8	170.5	0	0	0	0	0	113.3	I1032 V1040 L1079 C1080 C1081 F1085	I1032-A1083 WeakPolarHBondContact CD1-O 3.35Å; I1032-A1083 WeakPolarHBondContact CG1-O 3.4Å; V1040-A1083 HydrophobicContact CG1-CB 4.46Å; V1040-A1083 HydrophobicContact CG2-CB 4.35Å; L1079-A1083 PolarHBondContact O-N 3.38Å; L1079-A1083 VanDerWaalsContact O-N 3.09Å; C1080-A1083 CarbonylContact O-C 3.45Å; C1080-A1083 WeakPolarHBondContact O-CA 3.03Å; C1080-A1083 WeakPolarHBondContact O-CB 3.37Å; C1080-A1083 PolarHBondContact O-N 3.44Å; C1080-A1083 VanDerWaalsContact O-N 3.08Å; C1081-A1083 VanDerWaalsContact C-N 3.33Å; C1081-A1083 PolarHBondContact O-N 2.85Å; A1083-F1085 HydrophobicContact CB-CD2 3.78Å; A1083-F1085 HydrophobicContact CB-CE2 3.73Å
1084	G	60.7	Low	58.4	Low	43 Å²	43	45.7 Å²	45.7	44%	0.443	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.6	9.6	179.2	0	0	0	0	0	114.2	C1080 C1081 V1082 N1086	C1080-G1084 PolarHBondContact O-N 3.42Å; C1081-G1084 WeakPolarHBondContact O-CA 3.37Å; C1081-G1084 PolarHBondContact O-N 3.33Å; V1082-G1084 PolarHBondContact O-N 3.5Å; V1082-G1084 VanDerWaalsContact O-N 3.17Å; G1084-N1086 PolarHBondContact O-N 3.01Å
1085	F	61	Low	57.7	Low	24 Å²	24	46.3 Å²	46.3	11%	0.105	25%	0.25	C	C	.	.			trans	-86.7	88.5	173.7	-51.8	-53.6	0	0	0	109.3	M918 P919 I1018 L1022 C1080 C1081 A1083	M918-F1085 HydrophobicContact CE-CE2 4.2Å; M918-F1085 HydrophobicContact CG-CD1 4.24Å; M918-F1085 HydrophobicContact CG-CD2 4.28Å; M918-F1085 HydrophobicContact CG-CE1 4.38Å; M918-F1085 HydrophobicContact CG-CE2 4.36Å; M918-F1085 HydrophobicContact CG-CG 4.18Å; M918-F1085 HydrophobicContact CG-CZ 4.37Å; P919-F1085 HydrophobicContact CG-CD1 4.49Å; P919-F1085 HydrophobicContact CG-CE1 3.57Å; P919-F1085 HydrophobicContact CG-CZ 4.08Å; I1018-F1085 HydrophobicContact CG2-CZ 4.44Å; L1022-F1085 HydrophobicContact CD1-CE1 4.41Å; L1022-F1085 HydrophobicContact CD1-CE2 4.06Å; L1022-F1085 HydrophobicContact CD1-CZ 3.49Å; L1022-F1085 VanDerWaalsContact CD1-CZ 3.49Å; C1080-F1085 HydrophobicContact CB-CB 4.14Å; C1080-F1085 HydrophobicContact CB-CD2 4.1Å; C1080-F1085 VanDerWaalsContact O-CB 3.3Å; C1080-F1085 WeakPolarHBondContact O-CB 3.37Å; C1080-F1085 WeakPolarHBondContact O-CD2 3.39Å; C1080-F1085 PolarHBondContact O-N 3.4Å; C1081-F1085 WeakPolarHBondContact CA-O 3.21Å; C1081-F1085 PolarHBondContact SG-O 3.43Å; A1083-F1085 HydrophobicContact CB-CD2 3.78Å; A1083-F1085 HydrophobicContact CB-CE2 3.73Å
1086	N	53.5	Low	57	Low	118 Å²	118	50 Å²	50	63%	0.631	27%	0.267	S	S	*	.			trans	-74.5	132.5	178.1	-75.2	3.9	0	0	0	111.6	G1084	G1084-N1086 PolarHBondContact O-N 3.01Å
1087	D	53.4	Low	56.4	Low	38 Å²	38	52.4 Å²	52.4	20%	0.203	28%	0.279	C	S	.	.			trans	-108.5	116.3	171	-178.5	-10.9	0	0	0	109.2	P979 H1077 S1089 F1090	P979-D1087 WeakPolarHBondContact CA-OD2 3.49Å; P979-D1087 WeakPolarHBondContact CB-OD2 3.31Å; P979-D1087 WeakPolarHBondContact CG-OD1 3.23Å; P979-D1087 WeakPolarHBondContact CG-OD2 3.33Å; H1077-D1087 WeakPolarHBondContact CE1-CB 3.49Å; H1077-D1087 IonicContact CE1-OD2 2.68Å; H1077-D1087 PolarHBondContact CE1-OD2 3.01Å; H1077-D1087 IonicContact ND1-OD2 3.62Å; D1087-S1089 PolarHBondContact O-N 2.83Å; D1087-S1089 WeakPolarHBondContact OD1-CA 3.2Å; D1087-S1089 WeakPolarHBondContact OD1-CB 3.45Å; D1087-S1089 PolarHBondContact OD1-N 2.95Å; D1087-S1089 PolarHBondContact OD1-OG 2.81Å; D1087-F1090 HydrophobicContact CB-CB 3.93Å; D1087-F1090 PolarHBondContact OD1-N 2.78Å; D1087-F1090 VanDerWaalsContact OD1-N 3.1Å
1088	V	48.3	Very low	55.9	Low	135 Å²	135	51.7 Å²	51.7	82%	0.818	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-15.2	-178.2	-161.5	0	0	0	0	111.7
1089	S	47.3	Very low	55.7	Low	34 Å²	34	56.9 Å²	56.9	24%	0.238	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-7.1	-173.8	28.4	0	0	0	0	113.7	P979 D1087 K1091	P979-S1089 WeakPolarHBondContact CG-OG 3.46Å; D1087-S1089 PolarHBondContact O-N 2.83Å; D1087-S1089 WeakPolarHBondContact OD1-CA 3.2Å; D1087-S1089 WeakPolarHBondContact OD1-CB 3.45Å; D1087-S1089 PolarHBondContact OD1-N 2.95Å; D1087-S1089 PolarHBondContact OD1-OG 2.81Å; S1089-K1091 PolarHBondContact O-N 2.9Å
1090	F	50.6	Low	55.3	Low	32 Å²	32	59.8 Å²	59.8	14%	0.14	32%	0.317	C	S	.	.			trans	-68.4	129.3	171.3	175.8	-107.8	0	0	0	110.3	H1077 D1087 A1092 V1095 D1131	H1077-F1090 HydrophobicContact CB-CE2 4.4Å; H1077-F1090 AromaticContact CD2-CD1 3.68Å; H1077-F1090 AromaticContact CD2-CD2 3.09Å; H1077-F1090 WeakPolarHBondContact CD2-CD2 3.36Å; H1077-F1090 AromaticContact CD2-CE1 3.69Å; H1077-F1090 AromaticContact CD2-CE2 3.12Å; H1077-F1090 WeakPolarHBondContact CD2-CE2 2.85Å; H1077-F1090 AromaticContact CD2-CG 3.36Å; H1077-F1090 WeakPolarHBondContact CD2-CG 3.4Å; H1077-F1090 AromaticContact CD2-CZ 3.4Å; H1077-F1090 WeakPolarHBondContact CD2-CZ 3.34Å; H1077-F1090 VanDerWaalsContact CE1-CB 3.4Å; H1077-F1090 WeakPolarHBondContact CE1-CB 3.18Å; H1077-F1090 AromaticContact CE1-CD2 3.67Å; H1077-F1090 AromaticContact CE1-CG 3.56Å; H1077-F1090 AromaticContact CG-CD2 3.58Å; H1077-F1090 AromaticContact CG-CE2 3.69Å; H1077-F1090 AromaticContact ND1-CD2 3.88Å; H1077-F1090 WeakPolarHBondContact NE2-CB 3.41Å; H1077-F1090 AromaticContact NE2-CD1 3.31Å; H1077-F1090 VanDerWaalsContact NE2-CD1 3.31Å; H1077-F1090 WeakPolarHBondContact NE2-CD1 3.42Å; H1077-F1090 AromaticContact NE2-CD2 3.19Å; H1077-F1090 WeakPolarHBondContact NE2-CD2 3.39Å; H1077-F1090 AromaticContact NE2-CE1 3.81Å; H1077-F1090 AromaticContact NE2-CE2 3.71Å; H1077-F1090 AromaticContact NE2-CG 2.93Å; H1077-F1090 WeakPolarHBondContact NE2-CG 3.46Å; H1077-F1090 AromaticContact NE2-CZ 3.96Å; D1087-F1090 HydrophobicContact CB-CB 3.93Å; D1087-F1090 PolarHBondContact OD1-N 2.78Å; D1087-F1090 VanDerWaalsContact OD1-N 3.1Å; F1090-A1092 HydrophobicContact CE1-CB 4.06Å; F1090-V1095 HydrophobicContact CE1-CG2 4.47Å; F1090-V1095 HydrophobicContact CE2-CG2 3.55Å; F1090-V1095 HydrophobicContact CZ-CG2 3.33Å; F1090-D1131 HydrophobicContact CE1-CB 4.43Å
1091	K	52.1	Low	54.9	Low	120 Å²	120	60.1 Å²	60.1	52%	0.522	32%	0.317	S	S	.	.			trans	-110.4	104.6	172.2	-64.9	-168.3	176.4	-167.5	0	108.4	S1089 E1093 R1094	S1089-K1091 PolarHBondContact O-N 2.9Å; K1091-E1093 PolarHBondContact O-N 3.35Å; K1091-E1093 VanDerWaalsContact O-N 3.15Å; K1091-R1094 HydrophobicContact CB-CG 4.44Å; K1091-R1094 PolarHBondContact O-N 3.24Å
1092	A	49.9	Very low	54.7	Low	26 Å²	26	59.6 Å²	59.6	22%	0.215	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-47.6	-39	173.3	0	0	0	0	0	112.6	F1090 R1094 V1095 D1131	F1090-A1092 HydrophobicContact CE1-CB 4.06Å; A1092-R1094 PolarHBondContact O-N 3.25Å; A1092-R1094 VanDerWaalsContact O-N 3.1Å; A1092-V1095 WeakPolarHBondContact O-CB 3.33Å; A1092-V1095 PolarHBondContact O-N 2.92Å; A1092-D1131 HydrophobicContact CB-CB 3.52Å
1093	E	45.3	Very low	54.6	Low	178 Å²	178	62.2 Å²	62.2	83%	0.832	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-56	-25	178.3	-60.5	164.5	-173.9	0	0	114	K1091	K1091-E1093 PolarHBondContact O-N 3.35Å; K1091-E1093 VanDerWaalsContact O-N 3.15Å
1094	R	46.5	Very low	54.3	Low	111 Å²	111	65 Å²	65	42%	0.419	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-88.8	-9.2	176.2	-71.6	-170.2	175	-168.5	-2	113.3	K1091 A1092 Q1096	K1091-R1094 HydrophobicContact CB-CG 4.44Å; K1091-R1094 PolarHBondContact O-N 3.24Å; A1092-R1094 PolarHBondContact O-N 3.25Å; A1092-R1094 VanDerWaalsContact O-N 3.1Å; R1094-Q1096 PolarHBondContact O-N 2.94Å
1095	V	49.9	Very low	54	Low	26 Å²	26	63.4 Å²	63.4	16%	0.158	32%	0.322	C	S	.	.	S	Bend	trans	-75	117.1	168.9	-173	0	0	0	0	107.3	P1074 F1090 A1092 N1097 L1132	P1074-V1095 HydrophobicContact CB-CG1 4.01Å; P1074-V1095 HydrophobicContact CB-CG2 4.36Å; F1090-V1095 HydrophobicContact CE1-CG2 4.47Å; F1090-V1095 HydrophobicContact CE2-CG2 3.55Å; F1090-V1095 HydrophobicContact CZ-CG2 3.33Å; A1092-V1095 WeakPolarHBondContact O-CB 3.33Å; A1092-V1095 PolarHBondContact O-N 2.92Å; V1095-N1097 PolarHBondContact O-N 2.86Å; V1095-L1132 HydrophobicContact CB-CD2 4.12Å; V1095-L1132 HydrophobicContact CG1-CD2 3.69Å
1096	Q	50.9	Low	54	Low	90 Å²	90	69.5 Å²	69.5	42%	0.421	35%	0.348	S	S	.	.			trans	-47.4	139.2	176.9	-73.4	-180	-36.7	0	0	110.2	R1094 V1098 F1101 D1104	R1094-Q1096 PolarHBondContact O-N 2.94Å; Q1096-V1098 PolarHBondContact O-N 3.1Å; Q1096-F1101 HydrophobicContact CB-CB 4.27Å; Q1096-D1104 PolarHBondContact NE2-OD2 3.03Å
1097	N	56	Low	54.2	Low	50 Å²	50	70.7 Å²	70.7	27%	0.267	35%	0.354	S	S	.	.			trans	-45.1	126.5	165.4	176.5	-24.1	0	0	0	108.4	V1095 K1099 T1100 F1101 N1137	V1095-N1097 PolarHBondContact O-N 2.86Å; N1097-K1099 PolarHBondContact O-N 3.03Å; N1097-K1099 WeakPolarHBondContact OD1-CB 3.46Å; N1097-K1099 PolarHBondContact OD1-N 2.83Å; N1097-T1100 WeakPolarHBondContact CB-OG1 3.38Å; N1097-T1100 WeakPolarHBondContact O-CB 3.26Å; N1097-T1100 PolarHBondContact O-N 2.88Å; N1097-F1101 WeakPolarHBondContact O-CB 3.45Å; N1097-F1101 PolarHBondContact O-N 3.31Å; N1097-N1137 PolarHBondContact OD1-OD1 2.95Å
1098	V	58	Low	54.3	Low	5 Å²	5	69.4 Å²	69.4	3%	0.03	35%	0.348	C	S	.	.	H	α-helix	trans	-57.6	-29.1	-173	178.4	0	0	0	0	110.4	Q1096 F1101 L1102 L1122 L1132 N1137 M1140	Q1096-V1098 PolarHBondContact O-N 3.1Å; V1098-F1101 WeakPolarHBondContact O-CB 3.46Å; V1098-L1102 HydrophobicContact CG1-CD1 4.04Å; V1098-L1102 WeakPolarHBondContact O-CB 3.21Å; V1098-L1102 VanDerWaalsContact O-CG 3.31Å; V1098-L1102 WeakPolarHBondContact O-CG 3.39Å; V1098-L1102 PolarHBondContact O-N 3.21Å; V1098-L1122 HydrophobicContact CG1-CD1 4.09Å; V1098-L1132 HydrophobicContact CG2-CD2 4.34Å; V1098-N1137 VanDerWaalsContact CB-OD1 3.28Å; V1098-N1137 WeakPolarHBondContact CB-OD1 3.41Å; V1098-N1137 HydrophobicContact CG2-CB 4.44Å; V1098-N1137 PolarHBondContact N-OD1 2.81Å; V1098-M1140 HydrophobicContact CG1-SD 4.22Å
1099	K	59.6	Low	54.5	Low	115 Å²	115	67.4 Å²	67.4	50%	0.5	34%	0.337	S	S	.	.	H	α-helix	trans	-64.3	-53.1	172.4	-172.6	-177.4	176.2	-175.1	0	112.2	N1097 F1101 L1102 D1103	N1097-K1099 PolarHBondContact O-N 3.03Å; N1097-K1099 WeakPolarHBondContact OD1-CB 3.46Å; N1097-K1099 PolarHBondContact OD1-N 2.83Å; K1099-F1101 VanDerWaalsContact C-N 3.26Å; K1099-F1101 PolarHBondContact O-N 3.03Å; K1099-L1102 PolarHBondContact O-N 2.82Å; K1099-L1102 VanDerWaalsContact O-N 3.11Å; K1099-D1103 PolarHBondContact O-N 2.84Å
1100	T	59.4	Low	54.6	Low	64 Å²	64	76.3 Å²	76.3	39%	0.393	37%	0.372	S	S	.	.	H	α-helix	trans	-58.4	-42.7	178.3	-44.1	0	0	0	0	110.7	N1097 L1102 D1103 D1104	N1097-T1100 WeakPolarHBondContact CB-OG1 3.38Å; N1097-T1100 WeakPolarHBondContact O-CB 3.26Å; N1097-T1100 PolarHBondContact O-N 2.88Å; T1100-L1102 PolarHBondContact O-N 2.92Å; T1100-D1103 PolarHBondContact O-N 3.19Å; T1100-D1104 WeakPolarHBondContact O-CB 3.48Å; T1100-D1104 VanDerWaalsContact O-CG 3.26Å; T1100-D1104 PolarHBondContact O-N 3.34Å
1101	F	57.5	Low	54.5	Low	15 Å²	15	80.3 Å²	80.3	7%	0.066	40%	0.404	C	S	.	.	H	α-helix	trans	-59.2	-41.6	174.5	175.9	-97.9	0	0	0	113.6	L1071 L1075 Q1096 N1097 V1098 K1099 L1105 L1118 L1122	L1071-F1101 HydrophobicContact CB-CE2 3.94Å; L1071-F1101 HydrophobicContact CB-CZ 3.73Å; L1071-F1101 HydrophobicContact CD2-CD1 4.38Å; L1071-F1101 HydrophobicContact CD2-CD2 3.56Å; L1071-F1101 HydrophobicContact CD2-CE1 3.92Å; L1071-F1101 HydrophobicContact CD2-CE2 3.02Å; L1071-F1101 HydrophobicContact CD2-CG 4.24Å; L1071-F1101 HydrophobicContact CD2-CZ 3.22Å; L1071-F1101 HydrophobicContact CG-CE2 3.97Å; L1071-F1101 HydrophobicContact CG-CZ 3.93Å; L1075-F1101 HydrophobicContact CD1-CZ 4.4Å; Q1096-F1101 HydrophobicContact CB-CB 4.27Å; N1097-F1101 WeakPolarHBondContact O-CB 3.45Å; N1097-F1101 PolarHBondContact O-N 3.31Å; V1098-F1101 WeakPolarHBondContact O-CB 3.46Å; K1099-F1101 VanDerWaalsContact C-N 3.26Å; K1099-F1101 PolarHBondContact O-N 3.03Å; F1101-L1105 HydrophobicContact CD1-CD1 4.09Å; F1101-L1105 HydrophobicContact CE1-CD1 4.06Å; F1101-L1105 WeakPolarHBondContact O-CD1 3.37Å; F1101-L1105 WeakPolarHBondContact O-CG 3.42Å; F1101-L1105 PolarHBondContact O-N 3.34Å; F1101-L1105 VanDerWaalsContact O-N 3.11Å; F1101-L1118 HydrophobicContact CD1-CD2 4.32Å; F1101-L1118 HydrophobicContact CE1-CD2 3.34Å; F1101-L1118 HydrophobicContact CE1-CG 4.25Å; F1101-L1118 HydrophobicContact CZ-CD1 4.47Å; F1101-L1118 HydrophobicContact CZ-CD2 3.85Å; F1101-L1122 HydrophobicContact CE1-CD1 4.11Å
1102	L	60.5	Low	54.7	Low	20 Å²	20	75.5 Å²	75.5	11%	0.105	39%	0.387	C	S	.	.	H	α-helix	trans	-74.6	-29.9	175.5	-76	166.5	0	0	0	113.4	V1098 K1099 T1100 L1105 K1106 M1140	V1098-L1102 HydrophobicContact CG1-CD1 4.04Å; V1098-L1102 WeakPolarHBondContact O-CB 3.21Å; V1098-L1102 VanDerWaalsContact O-CG 3.31Å; V1098-L1102 WeakPolarHBondContact O-CG 3.39Å; V1098-L1102 PolarHBondContact O-N 3.21Å; K1099-L1102 PolarHBondContact O-N 2.82Å; K1099-L1102 VanDerWaalsContact O-N 3.11Å; T1100-L1102 PolarHBondContact O-N 2.92Å; L1102-L1105 HydrophobicContact CD2-CD1 3.98Å; L1102-L1105 WeakPolarHBondContact O-CB 3.23Å; L1102-L1105 PolarHBondContact O-N 3.24Å; L1102-K1106 WeakPolarHBondContact O-CG 3.37Å; L1102-K1106 PolarHBondContact O-N 3.07Å; L1102-K1106 VanDerWaalsContact O-N 3.11Å; L1102-M1140 HydrophobicContact CD1-CE 3.19Å; L1102-M1140 HydrophobicContact CD1-SD 3.34Å; L1102-M1140 WeakPolarHBondContact CD1-SD 3.33Å
1103	D	62.4	Low	55.2	Low	62 Å²	62	75.4 Å²	75.4	33%	0.332	38%	0.382	S	S	.	.	H	α-helix	trans	-72.2	-39.7	174.2	-69.9	-28.5	0	0	0	110.7	K1099 T1100 L1105 K1106 L1107	K1099-D1103 PolarHBondContact O-N 2.84Å; T1100-D1103 PolarHBondContact O-N 3.19Å; D1103-L1105 VanDerWaalsContact C-N 3.26Å; D1103-L1105 PolarHBondContact O-N 3.35Å; D1103-K1106 WeakPolarHBondContact O-CB 3.23Å; D1103-K1106 PolarHBondContact O-N 3.48Å; D1103-K1106 IonicContact OD1-NZ 3.5Å; D1103-K1106 PolarHBondContact OD1-NZ 3.47Å; D1103-L1107 PolarHBondContact O-N 3.5Å
1104	D	57.1	Low	56.4	Low	60 Å²	60	70.6 Å²	70.6	32%	0.321	36%	0.362	S	S	.	.	H	α-helix	trans	-59.6	-37.2	170	-71.1	-13.3	0	0	0	111.4	Q1096 T1100 L1107 C1108	Q1096-D1104 PolarHBondContact NE2-OD2 3.03Å; T1100-D1104 WeakPolarHBondContact O-CB 3.48Å; T1100-D1104 VanDerWaalsContact O-CG 3.26Å; T1100-D1104 PolarHBondContact O-N 3.34Å; D1104-L1107 WeakPolarHBondContact O-CB 3.45Å; D1104-L1107 PolarHBondContact O-N 3.06Å; D1104-C1108 PolarHBondContact O-N 3.23Å
1105	L	56.1	Low	57.3	Low	8 Å²	8	68.2 Å²	68.2	4%	0.042	36%	0.36	C	S	.	.	H	α-helix	trans	-66	-34.5	172.9	-87	163	0	0	0	114	I1067 L1071 F1101 L1102 D1103 L1107 C1108 I1113 T1115 L1118	I1067-L1105 HydrophobicContact CG2-CD2 4.46Å; L1071-L1105 HydrophobicContact CD1-CD1 4.13Å; L1071-L1105 HydrophobicContact CD1-CD2 3.45Å; L1071-L1105 VanDerWaalsContact CD1-CD2 3.45Å; L1071-L1105 HydrophobicContact CD1-CG 4.1Å; L1071-L1105 HydrophobicContact CD2-CD1 4Å; L1071-L1105 HydrophobicContact CD2-CD2 4.22Å; L1071-L1105 HydrophobicContact CD2-CG 4.01Å; L1071-L1105 HydrophobicContact CG-CD2 4.47Å; F1101-L1105 HydrophobicContact CD1-CD1 4.09Å; F1101-L1105 HydrophobicContact CE1-CD1 4.06Å; F1101-L1105 WeakPolarHBondContact O-CD1 3.37Å; F1101-L1105 WeakPolarHBondContact O-CG 3.42Å; F1101-L1105 PolarHBondContact O-N 3.34Å; F1101-L1105 VanDerWaalsContact O-N 3.11Å; L1102-L1105 HydrophobicContact CD2-CD1 3.98Å; L1102-L1105 WeakPolarHBondContact O-CB 3.23Å; L1102-L1105 PolarHBondContact O-N 3.24Å; D1103-L1105 VanDerWaalsContact C-N 3.26Å; D1103-L1105 PolarHBondContact O-N 3.35Å; L1105-L1107 PolarHBondContact O-N 3.49Å; L1105-C1108 WeakPolarHBondContact O-CB 3.28Å; L1105-C1108 PolarHBondContact O-N 3.38Å; L1105-C1108 VanDerWaalsContact O-N 3.15Å; L1105-I1113 HydrophobicContact CD2-CB 4.27Å; L1105-I1113 HydrophobicContact CD2-CD1 3.82Å; L1105-I1113 HydrophobicContact CD2-CG2 3.98Å; L1105-T1115 HydrophobicContact CD2-CG2 4.37Å; L1105-L1118 HydrophobicContact CD1-CD2 3.24Å
1106	K	60.1	Low	58.3	Low	152 Å²	152	71.3 Å²	71.3	66%	0.661	37%	0.373	S	S	*	.	H	α-helix	trans	-68.7	-26.3	175.7	-70.9	170.3	-167.5	158.3	0	112	L1102 D1103	L1102-K1106 WeakPolarHBondContact O-CG 3.37Å; L1102-K1106 PolarHBondContact O-N 3.07Å; L1102-K1106 VanDerWaalsContact O-N 3.11Å; D1103-K1106 WeakPolarHBondContact O-CB 3.23Å; D1103-K1106 PolarHBondContact O-N 3.48Å; D1103-K1106 IonicContact OD1-NZ 3.5Å; D1103-K1106 PolarHBondContact OD1-NZ 3.47Å
1107	L	58.2	Low	59.3	Low	143 Å²	143	67.4 Å²	67.4	75%	0.749	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-16.1	173.8	-67.6	165.5	0	0	0	112.2	D1103 D1104 L1105	D1103-L1107 PolarHBondContact O-N 3.5Å; D1104-L1107 WeakPolarHBondContact O-CB 3.45Å; D1104-L1107 PolarHBondContact O-N 3.06Å; L1105-L1107 PolarHBondContact O-N 3.49Å
1108	C	54.1	Low	59.9	Low	12 Å²	12	65 Å²	65	8%	0.081	34%	0.343	C	S	.	.	S	Bend	trans	-65.9	137.8	175.3	-65.4	0	0	0	0	111	I1067 D1104 L1105 K1110	I1067-C1108 WeakPolarHBondContact CD1-SG 3.31Å; D1104-C1108 PolarHBondContact O-N 3.23Å; L1105-C1108 WeakPolarHBondContact O-CB 3.28Å; L1105-C1108 PolarHBondContact O-N 3.38Å; L1105-C1108 VanDerWaalsContact O-N 3.15Å; C1108-K1110 PolarHBondContact O-N 2.82Å; C1108-K1110 VanDerWaalsContact O-N 3.16Å
1109	P	53.1	Low	60.5	Low	92 Å²	92	67.7 Å²	67.7	60%	0.597	36%	0.355	S	S	*	.			trans	-55.4	125.8	170.2	20.5	-28.7	0	0	0	109.6	S1111 A1112	P1109-S1111 PolarHBondContact O-N 3.38Å; P1109-A1112 PolarHBondContact O-N 3.03Å
1110	K	49.3	Very low	61.1	Low	221 Å²	221	67.1 Å²	67.1	96%	0.961	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	16.9	-161.9	-75.9	-176.6	173.8	177.6	0	118.1	C1108	C1108-K1110 PolarHBondContact O-N 2.82Å; C1108-K1110 VanDerWaalsContact O-N 3.16Å
1111	S	48.9	Very low	61.6	Low	117 Å²	117	64.2 Å²	64.2	82%	0.818	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.1	-9.1	-178	60.5	0	0	0	0	115.9	P1109	P1109-S1111 PolarHBondContact O-N 3.38Å
1112	A	56.4	Low	62.1	Low	19 Å²	19	63.8 Å²	63.8	16%	0.157	33%	0.333	C	S	.	.	S	Bend	trans	-92.8	-31.8	-167.3	0	0	0	0	0	115.2	F1053 P1109	F1053-A1112 HydrophobicContact CE1-CB 3.85Å; F1053-A1112 VanDerWaalsContact CE1-O 3.3Å; F1053-A1112 WeakPolarHBondContact CE1-O 2.99Å; F1053-A1112 HydrophobicContact CZ-CB 3.79Å; F1053-A1112 WeakPolarHBondContact CZ-O 3.36Å; P1109-A1112 PolarHBondContact O-N 3.03Å
1113	I	61	Low	62.6	Low	23 Å²	23	66.9 Å²	66.9	12%	0.118	35%	0.349	C	S	.	.			trans	-126.3	123.5	-169.5	-51.6	176	0	0	0	109.8	I1050 G1064 I1067 A1068 L1071 L1105 T1115	I1050-I1113 HydrophobicContact CD1-CG2 4.22Å; G1064-I1113 WeakPolarHBondContact O-CD1 3.48Å; I1067-I1113 HydrophobicContact CB-CD1 3.85Å; I1067-I1113 HydrophobicContact CG2-CD1 3.6Å; A1068-I1113 HydrophobicContact CB-CD1 4.46Å; L1071-I1113 HydrophobicContact CD1-CD1 3.99Å; L1071-I1113 HydrophobicContact CD1-CG2 3.89Å; L1105-I1113 HydrophobicContact CD2-CB 4.27Å; L1105-I1113 HydrophobicContact CD2-CD1 3.82Å; L1105-I1113 HydrophobicContact CD2-CG2 3.98Å; I1113-T1115 VanDerWaalsContact C-N 3.26Å; I1113-T1115 PolarHBondContact O-N 2.66Å
1114	D	69.1	Low	63	Low	78 Å²	78	64.9 Å²	64.9	42%	0.417	34%	0.339	S	S	.	.			trans	-69.7	86	171.5	-172.9	-12.8	0	0	0	109.1	E1116 A1117 L1118	D1114-E1116 PolarHBondContact O-N 3.09Å; D1114-E1116 WeakPolarHBondContact OD1-CB 3.46Å; D1114-E1116 PolarHBondContact OD1-N 2.81Å; D1114-E1116 VanDerWaalsContact OD1-N 3.16Å; D1114-A1117 HydrophobicContact CB-CB 3.75Å; D1114-A1117 WeakPolarHBondContact O-CB 3.44Å; D1114-A1117 PolarHBondContact O-N 3.38Å; D1114-A1117 PolarHBondContact OD1-N 3.25Å; D1114-A1117 WeakPolarHBondContact OD2-CB 3.11Å; D1114-L1118 PolarHBondContact O-N 2.97Å; D1114-L1118 VanDerWaalsContact O-N 3.15Å
1115	T	66.5	Low	63.3	Low	60 Å²	60	62.2 Å²	62.2	37%	0.368	33%	0.325	S	S	.	.	H	α-helix	trans	-59	-25.9	178.3	53.9	0	0	0	0	111.9	L1105 I1113 K1119	L1105-T1115 HydrophobicContact CD2-CG2 4.37Å; I1113-T1115 VanDerWaalsContact C-N 3.26Å; I1113-T1115 PolarHBondContact O-N 2.66Å; T1115-K1119 VanDerWaalsContact O-CG 3.25Å; T1115-K1119 WeakPolarHBondContact O-CG 3.48Å; T1115-K1119 PolarHBondContact O-N 2.81Å
1116	E	71.3	Confident	63.9	Low	92 Å²	92	62.7 Å²	62.7	43%	0.43	33%	0.326	S	S	.	.	H	α-helix	trans	-76	-42.8	178.9	-166.2	58.9	-155.8	0	0	111.5	D1114 L1118 K1119 K1120	D1114-E1116 PolarHBondContact O-N 3.09Å; D1114-E1116 WeakPolarHBondContact OD1-CB 3.46Å; D1114-E1116 PolarHBondContact OD1-N 2.81Å; D1114-E1116 VanDerWaalsContact OD1-N 3.16Å; E1116-L1118 VanDerWaalsContact C-N 3.27Å; E1116-L1118 PolarHBondContact O-N 3.14Å; E1116-K1119 PolarHBondContact O-N 3.26Å; E1116-K1119 IonicContact OE2-NZ 3.9Å; E1116-K1120 WeakPolarHBondContact O-CB 3.44Å; E1116-K1120 WeakPolarHBondContact O-CG 3.19Å; E1116-K1120 PolarHBondContact O-N 2.77Å
1117	A	71.6	Confident	64.2	Low	8 Å²	8	58.5 Å²	58.5	7%	0.066	32%	0.315	C	S	.	.	H	α-helix	trans	-55.9	-42.8	169.9	0	0	0	0	0	112.3	S1046 P1049 D1114 K1120 A1121	S1046-A1117 VanDerWaalsContact O-CB 3.28Å; S1046-A1117 WeakPolarHBondContact O-CB 3.3Å; P1049-A1117 HydrophobicContact CG-CB 4.49Å; D1114-A1117 HydrophobicContact CB-CB 3.75Å; D1114-A1117 WeakPolarHBondContact O-CB 3.44Å; D1114-A1117 PolarHBondContact O-N 3.38Å; D1114-A1117 PolarHBondContact OD1-N 3.25Å; D1114-A1117 WeakPolarHBondContact OD2-CB 3.11Å; A1117-K1120 PolarHBondContact O-N 3.17Å; A1117-A1121 WeakPolarHBondContact O-CB 3.2Å; A1117-A1121 PolarHBondContact O-N 3.41Å
1118	L	68.3	Low	64.4	Low	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-65.9	-44.4	177.8	-160.9	91.1	0	0	0	112.4	L1047 I1050 L1071 L1075 F1101 L1105 D1114 E1116 A1121 L1122	L1047-L1118 HydrophobicContact CD2-CD1 3.94Å; I1050-L1118 HydrophobicContact CD1-CB 4.06Å; I1050-L1118 HydrophobicContact CD1-CD1 3.39Å; I1050-L1118 HydrophobicContact CD1-CG 4.37Å; L1071-L1118 HydrophobicContact CB-CD1 3.87Å; L1071-L1118 HydrophobicContact CD1-CD1 3.88Å; L1071-L1118 HydrophobicContact CD1-CD2 4.09Å; L1071-L1118 HydrophobicContact CG-CD1 4.44Å; L1075-L1118 HydrophobicContact CD1-CD1 3.48Å; L1075-L1118 VanDerWaalsContact CD1-CD1 3.48Å; L1075-L1118 HydrophobicContact CD1-CG 3.94Å; F1101-L1118 HydrophobicContact CD1-CD2 4.32Å; F1101-L1118 HydrophobicContact CE1-CD2 3.34Å; F1101-L1118 HydrophobicContact CE1-CG 4.25Å; F1101-L1118 HydrophobicContact CZ-CD1 4.47Å; F1101-L1118 HydrophobicContact CZ-CD2 3.85Å; L1105-L1118 HydrophobicContact CD1-CD2 3.24Å; D1114-L1118 PolarHBondContact O-N 2.97Å; D1114-L1118 VanDerWaalsContact O-N 3.15Å; E1116-L1118 VanDerWaalsContact C-N 3.27Å; E1116-L1118 PolarHBondContact O-N 3.14Å; L1118-A1121 WeakPolarHBondContact O-CB 3.34Å; L1118-A1121 PolarHBondContact O-N 2.85Å; L1118-L1122 PolarHBondContact O-N 2.76Å
1119	K	69.6	Low	64.8	Low	61 Å²	61	55.8 Å²	55.8	27%	0.265	29%	0.294	S	S	.	.	H	α-helix	trans	-60.3	-45.4	174.9	-76.5	172.3	-171.4	173.9	0	111.5	T1115 E1116 A1121 L1122 I1123	T1115-K1119 VanDerWaalsContact O-CG 3.25Å; T1115-K1119 WeakPolarHBondContact O-CG 3.48Å; T1115-K1119 PolarHBondContact O-N 2.81Å; E1116-K1119 PolarHBondContact O-N 3.26Å; E1116-K1119 IonicContact OE2-NZ 3.9Å; K1119-A1121 VanDerWaalsContact C-N 3.31Å; K1119-A1121 PolarHBondContact O-N 2.83Å; K1119-L1122 PolarHBondContact O-N 2.94Å; K1119-I1123 WeakPolarHBondContact O-CB 3.18Å; K1119-I1123 WeakPolarHBondContact O-CD1 3.44Å; K1119-I1123 VanDerWaalsContact O-CG1 3.22Å; K1119-I1123 WeakPolarHBondContact O-CG1 3.35Å; K1119-I1123 PolarHBondContact O-N 2.9Å
1120	K	73.5	Confident	65.2	Low	103 Å²	103	59.2 Å²	59.2	45%	0.448	30%	0.302	S	S	.	.	H	α-helix	trans	-59.3	-43.2	176.5	-75.8	174.3	-179.4	174.9	0	111.7	E1116 A1117 S1124	E1116-K1120 WeakPolarHBondContact O-CB 3.44Å; E1116-K1120 WeakPolarHBondContact O-CG 3.19Å; E1116-K1120 PolarHBondContact O-N 2.77Å; A1117-K1120 PolarHBondContact O-N 3.17Å; K1120-S1124 WeakPolarHBondContact O-CB 3.47Å; K1120-S1124 PolarHBondContact O-N 2.73Å; K1120-S1124 VanDerWaalsContact O-N 3.08Å; K1120-S1124 PolarHBondContact O-OG 3.17Å
1121	A	68.7	Low	65.4	Low	2 Å²	2	53.3 Å²	53.3	2%	0.017	28%	0.282	C	S	.	.	H	α-helix	trans	-61	-51.3	175.2	0	0	0	0	0	111.4	L1047 A1117 L1118 K1119 I1123 S1124 V1125	L1047-A1121 HydrophobicContact CD1-CB 3.82Å; L1047-A1121 HydrophobicContact CD2-CB 3.76Å; L1047-A1121 HydrophobicContact CG-CB 3.52Å; A1117-A1121 WeakPolarHBondContact O-CB 3.2Å; A1117-A1121 PolarHBondContact O-N 3.41Å; L1118-A1121 WeakPolarHBondContact O-CB 3.34Å; L1118-A1121 PolarHBondContact O-N 2.85Å; K1119-A1121 VanDerWaalsContact C-N 3.31Å; K1119-A1121 PolarHBondContact O-N 2.83Å; A1121-I1123 PolarHBondContact O-N 2.93Å; A1121-S1124 PolarHBondContact O-N 3.32Å; A1121-S1124 PolarHBondContact O-OG 2.93Å; A1121-V1125 VanDerWaalsContact O-CG2 3.29Å; A1121-V1125 WeakPolarHBondContact O-CG2 3.41Å; A1121-V1125 PolarHBondContact O-N 3.13Å
1122	L	68.1	Low	65.9	Low	7 Å²	7	48.3 Å²	48.3	4%	0.037	25%	0.245	C	C	.	.	H	α-helix	trans	-57	-51.8	177.2	-87.7	163.3	0	0	0	112.2	L1075 V1098 F1101 L1118 K1119 S1124 V1125 Y1126	L1075-L1122 HydrophobicContact CD2-CD1 4.31Å; L1075-L1122 HydrophobicContact CD2-CD2 3.32Å; L1075-L1122 HydrophobicContact CD2-CG 3.51Å; V1098-L1122 HydrophobicContact CG1-CD1 4.09Å; F1101-L1122 HydrophobicContact CE1-CD1 4.11Å; L1118-L1122 PolarHBondContact O-N 2.76Å; K1119-L1122 PolarHBondContact O-N 2.94Å; L1122-S1124 PolarHBondContact O-N 2.85Å; L1122-V1125 PolarHBondContact O-N 3.49Å; L1122-V1125 VanDerWaalsContact O-N 3.17Å; L1122-Y1126 WeakPolarHBondContact O-CB 3.22Å; L1122-Y1126 PolarHBondContact O-N 3.14Å
1123	I	71.9	Confident	66.2	Low	85 Å²	85	51.4 Å²	51.4	44%	0.436	26%	0.256	S	S	.	.	H	α-helix	trans	-58.9	-37.5	-177.7	-69.9	165.7	0	0	0	111.6	K1119 A1121 V1125 P1127 L1141	K1119-I1123 WeakPolarHBondContact O-CB 3.18Å; K1119-I1123 WeakPolarHBondContact O-CD1 3.44Å; K1119-I1123 VanDerWaalsContact O-CG1 3.22Å; K1119-I1123 WeakPolarHBondContact O-CG1 3.35Å; K1119-I1123 PolarHBondContact O-N 2.9Å; A1121-I1123 PolarHBondContact O-N 2.93Å; I1123-V1125 VanDerWaalsContact C-N 3.3Å; I1123-V1125 PolarHBondContact O-N 2.72Å; I1123-P1127 WeakPolarHBondContact O-CD 3.37Å; I1123-L1141 HydrophobicContact CG1-CD2 4.05Å
1124	S	69.2	Low	66.2	Low	20 Å²	20	51.8 Å²	51.8	14%	0.14	26%	0.261	C	S	.	.	H	α-helix	trans	-67.3	-29.7	-178.4	67.5	0	0	0	0	113.9	F1042 K1120 A1121 L1122	F1042-S1124 VanDerWaalsContact CD1-CB 3.41Å; K1120-S1124 WeakPolarHBondContact O-CB 3.47Å; K1120-S1124 PolarHBondContact O-N 2.73Å; K1120-S1124 VanDerWaalsContact O-N 3.08Å; K1120-S1124 PolarHBondContact O-OG 3.17Å; A1121-S1124 PolarHBondContact O-N 3.32Å; A1121-S1124 PolarHBondContact O-OG 2.93Å; L1122-S1124 PolarHBondContact O-N 2.85Å
1125	V	64.2	Low	65.7	Low	4 Å²	4	56.5 Å²	56.5	2%	0.024	28%	0.278	C	S	.	.	H	α-helix	trans	-108.4	-27.7	-171	-162.6	0	0	0	0	111.6	L1079 V1082 A1121 L1122 I1123 P1127 Y1128 L1129	L1079-V1125 HydrophobicContact CD2-CB 4.16Å; L1079-V1125 HydrophobicContact CD2-CG1 3.87Å; L1079-V1125 HydrophobicContact CD2-CG2 3.11Å; L1079-V1125 HydrophobicContact CG-CG1 4.2Å; L1079-V1125 HydrophobicContact CG-CG2 3.78Å; V1082-V1125 HydrophobicContact CB-CG1 4.2Å; V1082-V1125 HydrophobicContact CG1-CG1 4.47Å; V1082-V1125 HydrophobicContact CG2-CG1 3.68Å; A1121-V1125 VanDerWaalsContact O-CG2 3.29Å; A1121-V1125 WeakPolarHBondContact O-CG2 3.41Å; A1121-V1125 PolarHBondContact O-N 3.13Å; L1122-V1125 PolarHBondContact O-N 3.49Å; L1122-V1125 VanDerWaalsContact O-N 3.17Å; I1123-V1125 VanDerWaalsContact C-N 3.3Å; I1123-V1125 PolarHBondContact O-N 2.72Å; V1125-P1127 VanDerWaalsContact C-N 3.29Å; V1125-P1127 WeakPolarHBondContact O-CD 3.48Å; V1125-P1127 VanDerWaalsContact O-N 3.09Å; V1125-Y1128 WeakPolarHBondContact O-CA 3.42Å; V1125-Y1128 WeakPolarHBondContact O-CB 3.2Å; V1125-Y1128 PolarHBondContact O-N 2.9Å; V1125-L1129 HydrophobicContact CB-CD1 3.94Å; V1125-L1129 HydrophobicContact CB-CG 4.39Å; V1125-L1129 HydrophobicContact CG1-CD1 3.74Å; V1125-L1129 HydrophobicContact CG1-CD2 3.96Å; V1125-L1129 HydrophobicContact CG1-CG 3.8Å; V1125-L1129 PolarHBondContact O-N 3.03Å
1126	Y	68.3	Low	65.4	Low	17 Å²	17	58.4 Å²	58.4	7%	0.067	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-46.3	-40.7	-176.7	-172.9	-98.5	0	0	0	115.2	L1122 Y1128 L1129 L1132 H1133 N1137 N1138 L1141	L1122-Y1126 WeakPolarHBondContact O-CB 3.22Å; L1122-Y1126 PolarHBondContact O-N 3.14Å; Y1126-Y1128 PolarHBondContact O-N 2.85Å; Y1126-L1129 PolarHBondContact O-N 3.36Å; Y1126-L1129 VanDerWaalsContact O-N 3.11Å; Y1126-L1132 HydrophobicContact CD2-CB 4.46Å; Y1126-L1132 HydrophobicContact CE2-CB 4.17Å; Y1126-H1133 AromaticContact CZ-CD2 3.87Å; Y1126-H1133 PolarHBondContact O-NE2 3.27Å; Y1126-N1137 HydrophobicContact CE2-CB 4.14Å; Y1126-N1137 WeakPolarHBondContact OH-CB 3.36Å; Y1126-N1138 VanDerWaalsContact CE1-OD1 3.3Å; Y1126-N1138 WeakPolarHBondContact CE1-OD1 3.32Å; Y1126-N1138 VanDerWaalsContact OH-CG 3.25Å; Y1126-N1138 PolarHBondContact OH-N 3.14Å; Y1126-N1138 PolarHBondContact OH-OD1 2.98Å; Y1126-L1141 HydrophobicContact CD1-CD1 3.46Å; Y1126-L1141 VanDerWaalsContact CD1-CD1 3.46Å; Y1126-L1141 HydrophobicContact CD2-CD1 3.25Å; Y1126-L1141 HydrophobicContact CE1-CD1 3.45Å; Y1126-L1141 VanDerWaalsContact CE1-CD1 3.45Å; Y1126-L1141 HydrophobicContact CE2-CD1 3.24Å; Y1126-L1141 HydrophobicContact CG-CD1 3.34Å
1127	P	67	Low	65	Low	65 Å²	65	54.4 Å²	54.4	42%	0.422	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-56.5	-21.9	176.2	-25.8	35.9	0	0	0	114.5	I1123 V1125	I1123-P1127 WeakPolarHBondContact O-CD 3.37Å; V1125-P1127 VanDerWaalsContact C-N 3.29Å; V1125-P1127 WeakPolarHBondContact O-CD 3.48Å; V1125-P1127 VanDerWaalsContact O-N 3.09Å
1128	Y	63.3	Low	64.8	Low	87 Å²	87	56 Å²	56	34%	0.341	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-107.5	-2.4	-175.8	-50.9	-72.4	0	0	0	113.4	K1036 A1039 V1082 V1125 Y1126 Q1130	K1036-Y1128 HydrophobicContact CD-CD1 4.49Å; K1036-Y1128 HydrophobicContact CG-CD1 3.79Å; K1036-Y1128 HydrophobicContact CG-CE1 3.84Å; K1036-Y1128 HydrophobicContact CG-CG 4.27Å; A1039-Y1128 HydrophobicContact CB-CD2 4.26Å; A1039-Y1128 HydrophobicContact CB-CE2 3.71Å; V1082-Y1128 HydrophobicContact CG1-CD2 4.05Å; V1082-Y1128 HydrophobicContact CG1-CG 3.86Å; V1082-Y1128 VanDerWaalsContact CG2-CB 3.43Å; V1125-Y1128 WeakPolarHBondContact O-CA 3.42Å; V1125-Y1128 WeakPolarHBondContact O-CB 3.2Å; V1125-Y1128 PolarHBondContact O-N 2.9Å; Y1126-Y1128 PolarHBondContact O-N 2.85Å; Y1128-Q1130 PolarHBondContact O-N 3.49Å
1129	L	62.1	Low	64.5	Low	10 Å²	10	58.3 Å²	58.3	5%	0.052	29%	0.291	C	S	.	.			trans	-99.7	72	-178	-61.6	174	0	0	0	110.9	S1078 V1082 V1125 Y1126 D1131 L1132 H1133	S1078-L1129 VanDerWaalsContact O-CD2 3.23Å; S1078-L1129 WeakPolarHBondContact O-CD2 3.23Å; V1082-L1129 HydrophobicContact CG2-CD2 3.48Å; V1082-L1129 VanDerWaalsContact CG2-CD2 3.48Å; V1082-L1129 HydrophobicContact CG2-CG 4.2Å; V1125-L1129 HydrophobicContact CB-CD1 3.94Å; V1125-L1129 HydrophobicContact CB-CG 4.39Å; V1125-L1129 HydrophobicContact CG1-CD1 3.74Å; V1125-L1129 HydrophobicContact CG1-CD2 3.96Å; V1125-L1129 HydrophobicContact CG1-CG 3.8Å; V1125-L1129 PolarHBondContact O-N 3.03Å; Y1126-L1129 PolarHBondContact O-N 3.36Å; Y1126-L1129 VanDerWaalsContact O-N 3.11Å; L1129-D1131 PolarHBondContact O-N 3.35Å; L1129-D1131 VanDerWaalsContact O-N 3.11Å; L1129-L1132 HydrophobicContact CB-CB 4.13Å; L1129-L1132 HydrophobicContact CB-CD1 4.15Å; L1129-L1132 HydrophobicContact CB-CG 4.43Å; L1129-L1132 HydrophobicContact CD1-CD1 3.67Å; L1129-L1132 HydrophobicContact CG-CD1 4.49Å; L1129-L1132 PolarHBondContact O-N 3.09Å; L1129-H1133 PolarHBondContact O-CD2 2.9Å; L1129-H1133 PolarHBondContact O-NE2 3.12Å
1130	Q	60.7	Low	64.2	Low	164 Å²	164	57.3 Å²	57.3	77%	0.766	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-51.1	-37.7	179.9	-69.6	-177.4	-21.7	0	0	112	Y1128 L1132 H1133	Y1128-Q1130 PolarHBondContact O-N 3.49Å; Q1130-L1132 PolarHBondContact O-N 3.48Å; Q1130-H1133 WeakPolarHBondContact O-CB 3.37Å; Q1130-H1133 PolarHBondContact O-N 3.44Å
1131	D	54.8	Low	63.7	Low	98 Å²	98	53.5 Å²	53.5	52%	0.524	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-58.4	-25.8	176.6	-70.1	-4.8	0	0	0	115.1	F1090 A1092 L1129	F1090-D1131 HydrophobicContact CE1-CB 4.43Å; A1092-D1131 HydrophobicContact CB-CB 3.52Å; L1129-D1131 PolarHBondContact O-N 3.35Å; L1129-D1131 VanDerWaalsContact O-N 3.11Å
1132	L	58.4	Low	63.2	Low	11 Å²	11	59.2 Å²	59.2	6%	0.058	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-98.4	-1	178.3	-77.3	175.4	0	0	0	113.2	V1095 V1098 Y1126 L1129 Q1130 S1134 N1137	V1095-L1132 HydrophobicContact CB-CD2 4.12Å; V1095-L1132 HydrophobicContact CG1-CD2 3.69Å; V1098-L1132 HydrophobicContact CG2-CD2 4.34Å; Y1126-L1132 HydrophobicContact CD2-CB 4.46Å; Y1126-L1132 HydrophobicContact CE2-CB 4.17Å; L1129-L1132 HydrophobicContact CB-CB 4.13Å; L1129-L1132 HydrophobicContact CB-CD1 4.15Å; L1129-L1132 HydrophobicContact CB-CG 4.43Å; L1129-L1132 HydrophobicContact CD1-CD1 3.67Å; L1129-L1132 HydrophobicContact CG-CD1 4.49Å; L1129-L1132 PolarHBondContact O-N 3.09Å; Q1130-L1132 PolarHBondContact O-N 3.48Å; L1132-S1134 PolarHBondContact O-N 3.35Å; L1132-N1137 WeakPolarHBondContact O-CB 3.28Å; L1132-N1137 PolarHBondContact O-ND2 3.23Å
1133	H	63.1	Low	62.8	Low	84 Å²	84	62.3 Å²	62.3	39%	0.389	32%	0.319	S	S	.	.			trans	-76.5	90.8	-178.2	-72.2	-155.2	0	0	0	109.7	Y1126 L1129 Q1130	Y1126-H1133 AromaticContact CZ-CD2 3.87Å; Y1126-H1133 PolarHBondContact O-NE2 3.27Å; L1129-H1133 PolarHBondContact O-CD2 2.9Å; L1129-H1133 PolarHBondContact O-NE2 3.12Å; Q1130-H1133 WeakPolarHBondContact O-CB 3.37Å; Q1130-H1133 PolarHBondContact O-N 3.44Å
1134	S	60.3	Low	61.7	Low	32 Å²	32	62.9 Å²	62.9	22%	0.224	32%	0.32	C	S	.	.			trans	-108.7	161.6	166	89.8	0	0	0	0	110.5	L1132 E1136 N1137 N1138	L1132-S1134 PolarHBondContact O-N 3.35Å; S1134-E1136 VanDerWaalsContact C-N 3.27Å; S1134-E1136 PolarHBondContact O-N 3.16Å; S1134-E1136 PolarHBondContact OG-N 3.16Å; S1134-E1136 PolarHBondContact OG-OE2 2.95Å; S1134-N1137 PolarHBondContact O-N 2.91Å; S1134-N1137 PolarHBondContact OG-N 2.71Å; S1134-N1138 WeakPolarHBondContact O-CB 3.41Å; S1134-N1138 VanDerWaalsContact O-CG 3.27Å; S1134-N1138 PolarHBondContact O-N 3.25Å; S1134-N1138 PolarHBondContact O-ND2 2.81Å; S1134-N1138 VanDerWaalsContact O-ND2 3.13Å
1135	F	59.7	Low	60.5	Low	176 Å²	176	68.2 Å²	68.2	77%	0.772	34%	0.337	S	S	*	.	H	α-helix	trans	-57.7	-41.2	173	-178.5	-96	0	0	0	111.4	A1139	F1135-A1139 WeakPolarHBondContact O-CB 3.31Å; F1135-A1139 PolarHBondContact O-N 3.26Å
1136	E	59.1	Low	59.5	Low	100 Å²	100	76.6 Å²	76.6	47%	0.467	37%	0.373	S	S	.	.	H	α-helix	trans	-67.6	-43.8	178.1	-53.6	98	168.1	0	0	112.7	S1134 A1139 M1140	S1134-E1136 VanDerWaalsContact C-N 3.27Å; S1134-E1136 PolarHBondContact O-N 3.16Å; S1134-E1136 PolarHBondContact OG-N 3.16Å; S1134-E1136 PolarHBondContact OG-OE2 2.95Å; E1136-A1139 PolarHBondContact O-N 3.24Å; E1136-M1140 WeakPolarHBondContact O-CB 3.4Å; E1136-M1140 PolarHBondContact O-N 3.41Å
1137	N	63.3	Low	58.2	Low	8 Å²	8	83.3 Å²	83.3	4%	0.043	41%	0.405	C	S	.	.	H	α-helix	trans	-64.7	-43.3	179.6	-68.6	-17.7	0	0	0	110.9	N1097 V1098 Y1126 L1132 S1134 M1140 L1141	N1097-N1137 PolarHBondContact OD1-OD1 2.95Å; V1098-N1137 VanDerWaalsContact CB-OD1 3.28Å; V1098-N1137 WeakPolarHBondContact CB-OD1 3.41Å; V1098-N1137 HydrophobicContact CG2-CB 4.44Å; V1098-N1137 PolarHBondContact N-OD1 2.81Å; Y1126-N1137 HydrophobicContact CE2-CB 4.14Å; Y1126-N1137 WeakPolarHBondContact OH-CB 3.36Å; L1132-N1137 WeakPolarHBondContact O-CB 3.28Å; L1132-N1137 PolarHBondContact O-ND2 3.23Å; S1134-N1137 PolarHBondContact O-N 2.91Å; S1134-N1137 PolarHBondContact OG-N 2.71Å; N1137-M1140 PolarHBondContact O-N 3.41Å; N1137-L1141 WeakPolarHBondContact O-CB 3.39Å; N1137-L1141 WeakPolarHBondContact O-CG 3.36Å; N1137-L1141 PolarHBondContact O-N 3.04Å
1138	N	66.9	Low	56.6	Low	43 Å²	43	84 Å²	84	23%	0.23	41%	0.412	C	S	.	.	H	α-helix	trans	-62.2	-52.5	174.2	-77.3	-35	0	0	0	110.7	Y1126 S1134 M1140 L1141 F1142	Y1126-N1138 VanDerWaalsContact CE1-OD1 3.3Å; Y1126-N1138 WeakPolarHBondContact CE1-OD1 3.32Å; Y1126-N1138 VanDerWaalsContact OH-CG 3.25Å; Y1126-N1138 PolarHBondContact OH-N 3.14Å; Y1126-N1138 PolarHBondContact OH-OD1 2.98Å; S1134-N1138 WeakPolarHBondContact O-CB 3.41Å; S1134-N1138 VanDerWaalsContact O-CG 3.27Å; S1134-N1138 PolarHBondContact O-N 3.25Å; S1134-N1138 PolarHBondContact O-ND2 2.81Å; S1134-N1138 VanDerWaalsContact O-ND2 3.13Å; N1138-M1140 VanDerWaalsContact C-N 3.25Å; N1138-M1140 PolarHBondContact O-N 2.86Å; N1138-L1141 PolarHBondContact O-N 2.99Å; N1138-F1142 HydrophobicContact CB-CD2 4.02Å; N1138-F1142 HydrophobicContact CB-CE2 4.22Å; N1138-F1142 VanDerWaalsContact O-CB 3.29Å; N1138-F1142 WeakPolarHBondContact O-CB 3.08Å; N1138-F1142 WeakPolarHBondContact O-CD2 3.31Å; N1138-F1142 PolarHBondContact O-N 3.44Å
1139	A	61.9	Low	55	Low	48 Å²	48	86 Å²	86	40%	0.397	43%	0.432	S	S	.	.	H	α-helix	trans	-56.9	-40.2	-180	0	0	0	0	0	111.9	F1135 E1136 S1143	F1135-A1139 WeakPolarHBondContact O-CB 3.31Å; F1135-A1139 PolarHBondContact O-N 3.26Å; E1136-A1139 PolarHBondContact O-N 3.24Å; A1139-S1143 WeakPolarHBondContact O-CB 3.13Å; A1139-S1143 PolarHBondContact O-N 3.33Å; A1139-S1143 PolarHBondContact O-OG 3.36Å; A1139-S1143 VanDerWaalsContact O-OG 3.07Å
1140	M	63.9	Low	53.4	Low	39 Å²	39	93.8 Å²	93.8	19%	0.192	48%	0.48	C	S	.	.	H	α-helix	trans	-66.1	-49.5	176.6	-169.7	-140.3	121.8	0	0	112.2	V1098 L1102 E1136 N1137 N1138 S1143 Q1144	V1098-M1140 HydrophobicContact CG1-SD 4.22Å; L1102-M1140 HydrophobicContact CD1-CE 3.19Å; L1102-M1140 HydrophobicContact CD1-SD 3.34Å; L1102-M1140 WeakPolarHBondContact CD1-SD 3.33Å; E1136-M1140 WeakPolarHBondContact O-CB 3.4Å; E1136-M1140 PolarHBondContact O-N 3.41Å; N1137-M1140 PolarHBondContact O-N 3.41Å; N1138-M1140 VanDerWaalsContact C-N 3.25Å; N1138-M1140 PolarHBondContact O-N 2.86Å; M1140-S1143 PolarHBondContact O-OG 3.1Å; M1140-Q1144 PolarHBondContact O-N 3.23Å
1141	L	62	Low	53.1	Low	24 Å²	24	90.3 Å²	90.3	13%	0.126	47%	0.466	C	S	.	.	H	α-helix	trans	-70.7	-35.8	-178.5	-72	163	0	0	0	112.6	I1123 Y1126 N1137 N1138 Q1144 R1145	I1123-L1141 HydrophobicContact CG1-CD2 4.05Å; Y1126-L1141 HydrophobicContact CD1-CD1 3.46Å; Y1126-L1141 VanDerWaalsContact CD1-CD1 3.46Å; Y1126-L1141 HydrophobicContact CD2-CD1 3.25Å; Y1126-L1141 HydrophobicContact CE1-CD1 3.45Å; Y1126-L1141 VanDerWaalsContact CE1-CD1 3.45Å; Y1126-L1141 HydrophobicContact CE2-CD1 3.24Å; Y1126-L1141 HydrophobicContact CG-CD1 3.34Å; N1137-L1141 WeakPolarHBondContact O-CB 3.39Å; N1137-L1141 WeakPolarHBondContact O-CG 3.36Å; N1137-L1141 PolarHBondContact O-N 3.04Å; N1138-L1141 PolarHBondContact O-N 2.99Å; L1141-Q1144 PolarHBondContact O-N 3.1Å; L1141-R1145 PolarHBondContact O-N 3.07Å
1142	F	60	Low	53	Low	122 Å²	122	89.9 Å²	89.9	54%	0.535	46%	0.463	S	S	.	.	H	α-helix	trans	-75.2	-35.1	176.1	-78	-69.7	0	0	0	112.9	N1138 Q1144 R1145	N1138-F1142 HydrophobicContact CB-CD2 4.02Å; N1138-F1142 HydrophobicContact CB-CE2 4.22Å; N1138-F1142 VanDerWaalsContact O-CB 3.29Å; N1138-F1142 WeakPolarHBondContact O-CB 3.08Å; N1138-F1142 WeakPolarHBondContact O-CD2 3.31Å; N1138-F1142 PolarHBondContact O-N 3.44Å; F1142-Q1144 PolarHBondContact O-N 2.87Å; F1142-R1145 PolarHBondContact O-N 3.1Å
1143	S	57.9	Low	52.7	Low	71 Å²	71	94.3 Å²	94.3	50%	0.497	49%	0.485	S	S	.	.	H	α-helix	trans	-59.9	-26.8	173.6	67.7	0	0	0	0	112.2	A1139 M1140	A1139-S1143 WeakPolarHBondContact O-CB 3.13Å; A1139-S1143 PolarHBondContact O-N 3.33Å; A1139-S1143 PolarHBondContact O-OG 3.36Å; A1139-S1143 VanDerWaalsContact O-OG 3.07Å; M1140-S1143 PolarHBondContact O-OG 3.1Å
1144	Q	50.5	Low	52.1	Low	97 Å²	97	94.9 Å²	94.9	45%	0.453	49%	0.491	S	S	.	.	H	α-helix	trans	-98.4	-14.2	179.8	-62.7	-154.2	-7.7	0	0	115.5	M1140 L1141 F1142 K1146 H1147 S1148	M1140-Q1144 PolarHBondContact O-N 3.23Å; L1141-Q1144 PolarHBondContact O-N 3.1Å; F1142-Q1144 PolarHBondContact O-N 2.87Å; Q1144-K1146 PolarHBondContact O-N 2.86Å; Q1144-H1147 PolarHBondContact O-N 3.4Å; Q1144-S1148 PolarHBondContact O-N 2.93Å; Q1144-S1148 PolarHBondContact O-OG 3.02Å
1145	R	43.8	Very low	51.5	Low	133 Å²	133	98.8 Å²	98.8	50%	0.502	51%	0.507	S	S	.	.	H	α-helix	trans	-61	-26.5	165.9	-90.5	-170.7	176.9	-177.7	1	112.2	L1141 F1142 H1147 S1148 V1149	L1141-R1145 PolarHBondContact O-N 3.07Å; F1142-R1145 PolarHBondContact O-N 3.1Å; R1145-H1147 PolarHBondContact O-N 3.45Å; R1145-S1148 PolarHBondContact O-N 2.95Å; R1145-V1149 PolarHBondContact O-N 3.39Å
1146	K	42.6	Very low	51	Low	180 Å²	180	93.7 Å²	93.7	78%	0.783	49%	0.49	S	S	*	.	H	α-helix	trans	-63	-18.2	170.8	-80.8	-170.6	175.4	-177.7	0	114.1	Q1144	Q1144-K1146 PolarHBondContact O-N 2.86Å
1147	H	40.2	Very low	50.4	Low	157 Å²	157	93.2 Å²	93.2	73%	0.727	49%	0.491	S	S	*	.	H	α-helix	trans	-105.7	-7.1	178.4	-78	-67.1	0	0	0	115	Q1144 R1145	Q1144-H1147 PolarHBondContact O-N 3.4Å; R1145-H1147 PolarHBondContact O-N 3.45Å
1148	S	33.8	Very low	49.4	Very low	81 Å²	81	99.8 Å²	99.8	57%	0.566	53%	0.526	S	S	*	.	H	α-helix	trans	-114.7	-3.2	-179.2	45.9	0	0	0	0	114.4	Q1144 R1145 V1150	Q1144-S1148 PolarHBondContact O-N 2.93Å; Q1144-S1148 PolarHBondContact O-OG 3.02Å; R1145-S1148 PolarHBondContact O-N 2.95Å; S1148-V1150 VanDerWaalsContact C-N 3.27Å
1149	V	29.6	Very low	48	Very low	128 Å²	128	104.5 Å²	104.5	78%	0.776	55%	0.551	S	S	*	*			trans	-89.9	1.6	164.9	-176.7	0	0	0	0	111.2	R1145	R1145-V1149 PolarHBondContact O-N 3.39Å
1150	V	29.5	Very low	46.7	Very low	174 Å²	174	109.6 Å²	109.6	100%	1.055	57%	0.565	S	S	*	*			trans	-100.5	0	158	-172.8	0	0	0	0	106.9	S1148	S1148-V1150 VanDerWaalsContact C-N 3.27Å

Retrieved 1,150 of 1,150 residues in 868.4 ms (Link to these results)

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