A0A087XRP5_POEFO Loading...

PPFIA binding protein 2

May regulate the disassembly of focal adhesions. Did not bind receptor-like tyrosine phosphatases type 2A.

AlphaFold DB , UniProt , Accession A0A087XRP5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 972 aa.

						>A0A087XRP5_POEFO|A0A087XRP5
MLPALTMETEASHMLEAALEQMDGIIAGSRAAAMEFSSTAYDLGSPVSAGPLQVVQLAEELKLALEVQPNREERDNLRAQLPPETAQALIDWLQTGSVSLCTPANNETYQERLLRLEGDKESLVLQVSVLTDQVEAQGEKIRDLETSLEEHRQKLASTEEMLQQELRSRTSLETQKLDLMDEVSYLKLKLVTMEETRTNTNPQDAANAKNNKAECVVNLISELQEQMCKFQEEISTRIQEKRALEEKEAQQGDPSGNPVQSADPNAGSNPSSASLKHSGERQTVHDLLHEVKQLTSKVQELEGEKSQYERKLRATKAEISELQQLLVSKDTEIECLQTQLLARGGTANNNAERDQEYQRLKVGMESLLASNDEKDRRIEELTILLGQYRKVREMMSLTHGSSEEELSGSLKLKAITHKAHSDIIKSEMSSRGSSPLMLCPSPFQRELDSSFQNSMETSLVTTGDASFLNGSLHRHRLLSSSLEELQSGCFQKSPQMEPSKYQTLPGKLSKKKESKDELNGTRGRETEYLSPVQLSPAHHHSKDYTLDHAGKLEECMLSDQSPLSSGVDSGQQSPVSPEKRKSHRGMKKFWGRIRRSQSGSPVQVHDPEMGDFKRGGFRATAGPRLARSGKARDLKLPFSKWSTEQVCDWLEDIGLGQYGVLAHHWVSSGQTLLAATPHDLEKELAIKNPLHRKKLQLSLKSICSKRPDKSAELDYVWVTRWLDDIGLPQYKDQFNDGRVDGHMLQYLTVSDLLFLKVTSQLHHLSIKCAIHVLHVNRFNPNCLKRRPGNENEFNPSEVVQWSNHRVMEWLRSVDLAEYAPNLRGSGVHGGLIMLEPRFNSDTMAMLLNISPQKTLLRRHLNTNFNNLVGVQAQQEKREYTEAAGYSPLSITAKVKPKKLGFSQLTNLRRRRPDESTDYVCPIETSSPESGQSMANGVQMCPYAGFRGLSPILDREPTRDQVGHKESKADTSP
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.1	Very low	48.2	Very low	238 Å²	238	120.4 Å²	120.4	100%	1.172	67%	0.672	S	S	*	*				0	137.6	0	-70.3	171.3	168.3	0	0	108.4
2	L	40.9	Very low	49.3	Very low	124 Å²	124	116.6 Å²	116.6	65%	0.649	66%	0.659	S	S	*	*			cis	-167.7	109.5	-29.4	-127.2	176.1	0	0	0	108.3	L5	L2-L5 HydrophobicContact CD2-CB 4.29Å; L2-L5 HydrophobicContact CD2-CD1 4Å; L2-L5 HydrophobicContact CD2-CG 4.36Å
3	P	44	Very low	50.7	Low	112 Å²	112	117.8 Å²	117.8	73%	0.727	66%	0.656	S	S	*	*	S	Bend	trans	-131.4	-2.8	169.5	39	-27.2	0	0	0	115.2	T6	P3-T6 PolarHBondContact O-OG1 3.35Å
4	A	43.8	Very low	51.8	Low	74 Å²	74	119.3 Å²	119.3	61%	0.612	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-76.2	-30.8	-175	0	0	0	0	0	114	T6	A4-T6 PolarHBondContact O-N 2.85Å; A4-T6 VanDerWaalsContact O-N 3.13Å
5	L	45.5	Very low	52.9	Low	115 Å²	115	119 Å²	119	60%	0.602	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-74.2	1.8	-170.6	-94.3	169.9	0	0	0	115.7	L2	L2-L5 HydrophobicContact CD2-CB 4.29Å; L2-L5 HydrophobicContact CD2-CD1 4Å; L2-L5 HydrophobicContact CD2-CG 4.36Å
6	T	48.7	Very low	54.1	Low	98 Å²	98	119.1 Å²	119.1	60%	0.601	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-103.2	-14.1	-176.7	50.6	0	0	0	0	114.7	P3 A4 T9	P3-T6 PolarHBondContact O-OG1 3.35Å; A4-T6 PolarHBondContact O-N 2.85Å; A4-T6 VanDerWaalsContact O-N 3.13Å; T6-T9 PolarHBondContact O-OG1 2.75Å
7	M	48.4	Very low	54.9	Low	139 Å²	139	114.6 Å²	114.6	69%	0.685	63%	0.632	S	S	*	*	H	α-helix	trans	-90.8	-32.3	-180	-68	-169	71.7	0	0	113.3	T9 E10 A11	M7-T9 VanDerWaalsContact C-N 3.31Å; M7-T9 PolarHBondContact O-N 3.48Å; M7-E10 PolarHBondContact O-N 2.75Å; M7-A11 PolarHBondContact O-N 2.88Å; M7-A11 VanDerWaalsContact O-N 3.09Å
8	E	49	Very low	55.6	Low	139 Å²	139	110.8 Å²	110.8	65%	0.65	62%	0.618	S	S	*	*	H	α-helix	trans	-67	-33.8	178.9	-63.8	-178.1	133.8	0	0	112	S12	E8-S12 WeakPolarHBondContact O-CB 3.36Å; E8-S12 PolarHBondContact O-N 2.91Å; E8-S12 VanDerWaalsContact O-N 3.1Å; E8-S12 PolarHBondContact O-OG 3.32Å
9	T	55.9	Low	56.2	Low	91 Å²	91	110.3 Å²	110.3	56%	0.558	61%	0.613	S	S	*	*	H	α-helix	trans	-70.9	-41.9	175	42.9	0	0	0	0	112.5	T6 M7 S12 H13	T6-T9 PolarHBondContact O-OG1 2.75Å; M7-T9 VanDerWaalsContact C-N 3.31Å; M7-T9 PolarHBondContact O-N 3.48Å; T9-S12 PolarHBondContact O-N 2.88Å; T9-H13 WeakPolarHBondContact O-CB 3.31Å; T9-H13 PolarHBondContact O-N 3.07Å
10	E	56	Low	56.6	Low	131 Å²	131	112.1 Å²	112.1	61%	0.612	62%	0.616	S	S	*	*	H	α-helix	trans	-65.4	-43.2	178.7	-167.4	167.6	-136.1	0	0	111.4	M7 S12 H13 M14	M7-E10 PolarHBondContact O-N 2.75Å; E10-S12 PolarHBondContact O-N 2.93Å; E10-H13 PolarHBondContact O-N 2.87Å; E10-M14 WeakPolarHBondContact O-CG 3.38Å; E10-M14 PolarHBondContact O-N 3.28Å; E10-M14 VanDerWaalsContact O-N 3.12Å
11	A	61.5	Low	56.7	Low	63 Å²	63	113.8 Å²	113.8	52%	0.521	62%	0.62	S	S	.	*	H	α-helix	trans	-63.4	-39.5	173.7	0	0	0	0	0	112.9	M7 L15	M7-A11 PolarHBondContact O-N 2.88Å; M7-A11 VanDerWaalsContact O-N 3.09Å; A11-L15 PolarHBondContact O-N 3.01Å
12	S	62.1	Low	57.4	Low	75 Å²	75	107.5 Å²	107.5	52%	0.524	59%	0.589	S	S	.	*	H	α-helix	trans	-65.2	-44.1	177.1	-60	0	0	0	0	111.8	E8 T9 E10 M14 L15 E16	E8-S12 WeakPolarHBondContact O-CB 3.36Å; E8-S12 PolarHBondContact O-N 2.91Å; E8-S12 VanDerWaalsContact O-N 3.1Å; E8-S12 PolarHBondContact O-OG 3.32Å; T9-S12 PolarHBondContact O-N 2.88Å; E10-S12 PolarHBondContact O-N 2.93Å; S12-M14 VanDerWaalsContact C-N 3.31Å; S12-M14 PolarHBondContact O-N 3.01Å; S12-L15 WeakPolarHBondContact O-CB 3.42Å; S12-L15 PolarHBondContact O-N 2.83Å; S12-L15 VanDerWaalsContact O-N 3.11Å; S12-E16 PolarHBondContact O-N 2.83Å
13	H	67.6	Low	58	Low	132 Å²	132	106.9 Å²	106.9	61%	0.611	59%	0.586	S	S	*	*	H	α-helix	trans	-68.2	-30.4	-179	-158	-26.4	0	0	0	112.5	T9 E10 A17	T9-H13 WeakPolarHBondContact O-CB 3.31Å; T9-H13 PolarHBondContact O-N 3.07Å; E10-H13 PolarHBondContact O-N 2.87Å; H13-A17 PolarHBondContact O-N 3.04Å
14	M	65.9	Low	58.4	Low	139 Å²	139	103.9 Å²	103.9	69%	0.685	58%	0.575	S	S	*	*	H	α-helix	trans	-68.7	-35.5	170.1	-74.8	-176.6	64.9	0	0	113	E10 S12 A18	E10-M14 WeakPolarHBondContact O-CG 3.38Å; E10-M14 PolarHBondContact O-N 3.28Å; E10-M14 VanDerWaalsContact O-N 3.12Å; S12-M14 VanDerWaalsContact C-N 3.31Å; S12-M14 PolarHBondContact O-N 3.01Å; M14-A18 WeakPolarHBondContact O-CB 3.47Å; M14-A18 PolarHBondContact O-N 3.27Å
15	L	68.9	Low	58.9	Low	115 Å²	115	106.1 Å²	106.1	60%	0.602	58%	0.576	S	S	*	*	H	α-helix	trans	-69.7	-41.6	177	-178.1	62.4	0	0	0	111.4	A11 S12 A18 L19	A11-L15 PolarHBondContact O-N 3.01Å; S12-L15 WeakPolarHBondContact O-CB 3.42Å; S12-L15 PolarHBondContact O-N 2.83Å; S12-L15 VanDerWaalsContact O-N 3.11Å; L15-A18 PolarHBondContact O-N 3.14Å; L15-L19 HydrophobicContact CG-CD1 4.29Å; L15-L19 WeakPolarHBondContact O-CG 3.47Å; L15-L19 PolarHBondContact O-N 2.96Å
16	E	71.6	Confident	59	Low	120 Å²	120	105.5 Å²	105.5	56%	0.561	57%	0.572	S	S	*	*	H	α-helix	trans	-59.2	-50.8	175.8	-171.3	166.5	-146.9	0	0	111.6	S12 A18 L19 E20	S12-E16 PolarHBondContact O-N 2.83Å; E16-A18 VanDerWaalsContact C-N 3.26Å; E16-A18 PolarHBondContact O-N 3.29Å; E16-L19 WeakPolarHBondContact O-CB 3.28Å; E16-L19 PolarHBondContact O-N 3.35Å; E16-E20 PolarHBondContact O-N 2.98Å
17	A	68.1	Low	59.1	Low	44 Å²	44	103.9 Å²	103.9	36%	0.364	57%	0.569	S	S	.	*	H	α-helix	trans	-62	-30.6	176.4	0	0	0	0	0	113.5	H13 Q21	H13-A17 PolarHBondContact O-N 3.04Å; A17-Q21 PolarHBondContact O-N 3.16Å
18	A	66.2	Low	58.7	Low	46 Å²	46	99.4 Å²	99.4	38%	0.38	56%	0.558	S	S	.	*	H	α-helix	trans	-73	-30.6	174.8	0	0	0	0	0	112.8	M14 L15 E16 M22	M14-A18 WeakPolarHBondContact O-CB 3.47Å; M14-A18 PolarHBondContact O-N 3.27Å; L15-A18 PolarHBondContact O-N 3.14Å; E16-A18 VanDerWaalsContact C-N 3.26Å; E16-A18 PolarHBondContact O-N 3.29Å; A18-M22 WeakPolarHBondContact O-CE 3.47Å; A18-M22 PolarHBondContact O-N 3.32Å
19	L	68.2	Low	58.5	Low	100 Å²	100	96.5 Å²	96.5	52%	0.524	55%	0.553	S	S	.	*	H	α-helix	trans	-72.1	-45	174.8	-70.2	162.9	0	0	0	111.1	L15 E16 Q21 M22 D23	L15-L19 HydrophobicContact CG-CD1 4.29Å; L15-L19 WeakPolarHBondContact O-CG 3.47Å; L15-L19 PolarHBondContact O-N 2.96Å; E16-L19 WeakPolarHBondContact O-CB 3.28Å; E16-L19 PolarHBondContact O-N 3.35Å; L19-Q21 VanDerWaalsContact C-N 3.31Å; L19-Q21 PolarHBondContact O-N 3.12Å; L19-M22 HydrophobicContact CD2-CE 3.93Å; L19-M22 PolarHBondContact O-N 2.68Å; L19-M22 VanDerWaalsContact O-N 3.07Å; L19-D23 PolarHBondContact O-N 3.09Å
20	E	63.5	Low	57.7	Low	146 Å²	146	102.1 Å²	102.1	68%	0.682	56%	0.564	S	S	*	*	H	α-helix	trans	-57.8	-41.4	174.8	-69.1	-168.4	131	0	0	112.4	E16 M22 D23 G24	E16-E20 PolarHBondContact O-N 2.98Å; E20-M22 VanDerWaalsContact C-N 3.28Å; E20-M22 PolarHBondContact O-N 3.31Å; E20-D23 PolarHBondContact O-N 3.12Å; E20-G24 PolarHBondContact O-N 3.19Å
21	Q	58	Low	57	Low	148 Å²	148	99 Å²	99	69%	0.692	56%	0.561	S	S	*	*	H	α-helix	trans	-63.3	-31	176.1	-78.8	-165.9	0.9	0	0	113.5	A17 L19 I25	A17-Q21 PolarHBondContact O-N 3.16Å; L19-Q21 VanDerWaalsContact C-N 3.31Å; L19-Q21 PolarHBondContact O-N 3.12Å; Q21-I25 WeakPolarHBondContact O-CD1 3.38Å; Q21-I25 WeakPolarHBondContact O-CG1 3.24Å
22	M	50.9	Low	55.9	Low	107 Å²	107	98.6 Å²	98.6	53%	0.527	56%	0.558	S	S	.	*	H	α-helix	trans	-75.2	-37.8	177.7	-73.5	-172.8	-71.8	0	0	112.2	A18 L19 E20 I25 I26	A18-M22 WeakPolarHBondContact O-CE 3.47Å; A18-M22 PolarHBondContact O-N 3.32Å; L19-M22 HydrophobicContact CD2-CE 3.93Å; L19-M22 PolarHBondContact O-N 2.68Å; L19-M22 VanDerWaalsContact O-N 3.07Å; E20-M22 VanDerWaalsContact C-N 3.28Å; E20-M22 PolarHBondContact O-N 3.31Å; M22-I25 PolarHBondContact O-N 3.28Å; M22-I26 WeakPolarHBondContact O-CG1 3.37Å; M22-I26 PolarHBondContact O-N 3.2Å
23	D	53.9	Low	54.9	Low	110 Å²	110	99 Å²	99	59%	0.588	57%	0.565	S	S	*	*	H	α-helix	trans	-69.2	-37.8	179.4	-154.8	44.3	0	0	0	111.8	L19 E20 I25 I26 A27	L19-D23 PolarHBondContact O-N 3.09Å; E20-D23 PolarHBondContact O-N 3.12Å; D23-I25 VanDerWaalsContact C-N 3.27Å; D23-I25 PolarHBondContact O-N 3.08Å; D23-I26 PolarHBondContact O-N 3.12Å; D23-I26 VanDerWaalsContact O-N 3.07Å; D23-A27 PolarHBondContact O-N 2.9Å
24	G	52	Low	53.5	Low	49 Å²	49	100.4 Å²	100.4	51%	0.505	57%	0.574	S	S	.	*	H	α-helix	trans	-58.5	-34	172.7	0	0	0	0	0	114.3	E20 G28	E20-G24 PolarHBondContact O-N 3.19Å; G24-G28 PolarHBondContact O-N 2.99Å
25	I	54.5	Low	52	Low	122 Å²	122	101.4 Å²	101.4	63%	0.626	58%	0.577	S	S	*	*	H	α-helix	trans	-71.6	-34.6	176.2	-67.4	165.9	0	0	0	111.3	Q21 M22 D23 S29	Q21-I25 WeakPolarHBondContact O-CD1 3.38Å; Q21-I25 WeakPolarHBondContact O-CG1 3.24Å; M22-I25 PolarHBondContact O-N 3.28Å; D23-I25 VanDerWaalsContact C-N 3.27Å; D23-I25 PolarHBondContact O-N 3.08Å; I25-S29 PolarHBondContact O-N 3.3Å; I25-S29 PolarHBondContact O-OG 2.9Å
26	I	48.1	Very low	50.3	Low	102 Å²	102	105 Å²	105	52%	0.523	59%	0.588	S	S	.	*	H	α-helix	trans	-74.4	-35.9	177.1	-63.9	168.6	0	0	0	110.9	M22 D23 S29	M22-I26 WeakPolarHBondContact O-CG1 3.37Å; M22-I26 PolarHBondContact O-N 3.2Å; D23-I26 PolarHBondContact O-N 3.12Å; D23-I26 VanDerWaalsContact O-N 3.07Å; I26-S29 PolarHBondContact O-OG 2.63Å
27	A	50.1	Low	48.4	Very low	64 Å²	64	104.5 Å²	104.5	53%	0.529	60%	0.598	S	S	.	*	H	α-helix	trans	-67	-50.6	173.7	0	0	0	0	0	112.2	D23 S29 R30	D23-A27 PolarHBondContact O-N 2.9Å; A27-S29 VanDerWaalsContact C-N 3.26Å; A27-S29 PolarHBondContact O-N 2.99Å; A27-R30 PolarHBondContact O-N 3.24Å; A27-R30 VanDerWaalsContact O-N 3.1Å
28	G	40.4	Very low	46.7	Very low	44 Å²	44	107 Å²	107	45%	0.454	61%	0.613	S	S	.	*	H	α-helix	trans	-61	-31.8	-177.3	0	0	0	0	0	114	G24 R30 A31 A32	G24-G28 PolarHBondContact O-N 2.99Å; G28-R30 VanDerWaalsContact C-N 3.27Å; G28-R30 PolarHBondContact O-N 3.08Å; G28-A31 PolarHBondContact O-N 2.93Å; G28-A32 PolarHBondContact O-N 3.34Å
29	S	44.4	Very low	45	Very low	79 Å²	79	111.2 Å²	111.2	55%	0.552	63%	0.634	S	S	*	*	H	α-helix	trans	-74.4	-8.7	178.5	46.8	0	0	0	0	114.8	I25 I26 A27	I25-S29 PolarHBondContact O-N 3.3Å; I25-S29 PolarHBondContact O-OG 2.9Å; I26-S29 PolarHBondContact O-OG 2.63Å; A27-S29 VanDerWaalsContact C-N 3.26Å; A27-S29 PolarHBondContact O-N 2.99Å
30	R	40.5	Very low	43.3	Very low	209 Å²	209	110.3 Å²	110.3	79%	0.789	64%	0.641	S	S	*	*	H	α-helix	trans	-85.5	-32	165.9	-72.6	-169.4	179.6	-171.8	2.2	113.5	A27 G28 A33	A27-R30 PolarHBondContact O-N 3.24Å; A27-R30 VanDerWaalsContact O-N 3.1Å; G28-R30 VanDerWaalsContact C-N 3.27Å; G28-R30 PolarHBondContact O-N 3.08Å; R30-A33 PolarHBondContact O-N 3.28Å
31	A	40.1	Very low	41.9	Very low	65 Å²	65	112.3 Å²	112.3	54%	0.537	64%	0.644	S	S	.	*	H	α-helix	trans	-66.4	-47.5	179.3	0	0	0	0	0	111.4	G28 A33 M34	G28-A31 PolarHBondContact O-N 2.93Å; A31-A33 PolarHBondContact O-N 2.95Å; A31-M34 PolarHBondContact O-N 3.14Å
32	A	39.6	Very low	40.4	Very low	55 Å²	55	113 Å²	113	46%	0.455	65%	0.652	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.4	-13.7	179.4	0	0	0	0	0	114.7	G28 F36	G28-A32 PolarHBondContact O-N 3.34Å; A32-F36 WeakPolarHBondContact O-CD2 3.36Å
33	A	39.9	Very low	39.9	Very low	83 Å²	83	114.9 Å²	114.9	69%	0.686	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-9.2	177.2	0	0	0	0	0	113.9	R30 A31	R30-A33 PolarHBondContact O-N 3.28Å; A31-A33 PolarHBondContact O-N 2.95Å
34	M	38	Very low	38.7	Very low	161 Å²	161	113.3 Å²	113.3	79%	0.793	67%	0.673	S	S	*	*	S	Bend	trans	-107.5	-12.1	-170.1	-161.4	162.4	179.1	0	0	114.6	A31	A31-M34 PolarHBondContact O-N 3.14Å
35	E	35.5	Very low	37.6	Very low	161 Å²	161	116.9 Å²	116.9	75%	0.752	69%	0.69	S	S	*	*	S	Bend	trans	-94.6	-14.4	-174	-62.7	-171.3	141.9	0	0	114.7	S37	E35-S37 PolarHBondContact O-N 3.37Å
36	F	32.9	Very low	37.3	Very low	189 Å²	189	116.7 Å²	116.7	83%	0.829	70%	0.697	S	S	*	*			trans	-76.2	40.1	-176.7	-77.2	-78.5	0	0	0	115	A32	A32-F36 WeakPolarHBondContact O-CD2 3.36Å
37	S	31.3	Very low	36.8	Very low	110 Å²	110	118.5 Å²	118.5	77%	0.769	71%	0.713	S	S	*	*	S	Bend	trans	-133.5	33.7	-179.7	65.5	0	0	0	0	115.3	E35	E35-S37 PolarHBondContact O-N 3.37Å
38	S	33.4	Very low	36.4	Very low	97 Å²	97	120.6 Å²	120.6	68%	0.678	72%	0.724	S	S	*	*			trans	-154.6	165.3	160.9	72.9	0	0	0	0	112.9
39	T	30.6	Very low	36.6	Very low	135 Å²	135	122 Å²	122	83%	0.828	73%	0.731	S	S	*	*			trans	65.8	126	-173.1	70.5	0	0	0	0	114.4
40	A	31.4	Very low	36.8	Very low	81 Å²	81	119.7 Å²	119.7	67%	0.669	72%	0.719	S	S	*	*			cis	101.4	93	21.8	0	0	0	0	0	114.7
41	Y	33.4	Very low	37.5	Very low	187 Å²	187	113.3 Å²	113.3	73%	0.733	71%	0.705	S	S	*	*			trans	40.2	124.2	154.3	-49.4	-79	0	0	0	121.4
42	D	27.3	Very low	38.2	Very low	162 Å²	162	117.3 Å²	117.3	87%	0.866	72%	0.716	S	S	*	*				-149.5	166	120.6	-153.3	-4.7	0	0	0	110.9
43	L	39.6	Very low	39.2	Very low	148 Å²	148	119.6 Å²	119.6	78%	0.775	72%	0.718	S	S	*	*			trans	-118.9	132.4	-168.7	-74.8	161.4	0	0	0	112.6
44	G	29.2	Very low	40.1	Very low	77 Å²	77	118.3 Å²	118.3	79%	0.794	70%	0.701	S	S	*	*			trans	-159.6	74.2	-172.7	0	0	0	0	0	118.7
45	S	29.7	Very low	41.3	Very low	123 Å²	123	113.2 Å²	113.2	86%	0.86	68%	0.679	S	S	*	*			trans	69.9	163.3	157.1	-102.2	0	0	0	0	118
46	P	48.5	Very low	42.8	Very low	118 Å²	118	110.8 Å²	110.8	77%	0.766	67%	0.668	S	S	*	*				-135.1	106	-124.3	35.1	-13.5	0	0	0	115.2
47	V	37.1	Very low	44.7	Very low	140 Å²	140	106.1 Å²	106.1	85%	0.848	65%	0.651	S	S	*	*	S	Bend	trans	-139.1	124	169	-176	0	0	0	0	111.1
48	S	41.3	Very low	46.5	Very low	109 Å²	109	102.7 Å²	102.7	76%	0.762	63%	0.629	S	S	*	*			trans	57.4	71.8	168.1	-173.6	0	0	0	0	116.5	G50	S48-G50 PolarHBondContact O-N 2.84Å
49	A	44.3	Very low	48.3	Very low	73 Å²	73	103.6 Å²	103.6	60%	0.603	62%	0.623	S	S	*	*			trans	-58.3	111.1	170.6	0	0	0	0	0	111.9
50	G	49.3	Very low	50.4	Low	30 Å²	30	99.7 Å²	99.7	31%	0.309	60%	0.595	S	S	.	*			trans	-76.6	161.3	173.7	0	0	0	0	0	112	S48 L52 Q53	S48-G50 PolarHBondContact O-N 2.84Å; G50-L52 PolarHBondContact O-N 3.17Å; G50-L52 VanDerWaalsContact O-N 3.08Å; G50-Q53 WeakPolarHBondContact O-CB 3.44Å; G50-Q53 PolarHBondContact O-N 3.42Å
51	P	54.8	Low	52.3	Low	76 Å²	76	99 Å²	99	49%	0.494	58%	0.58	S	S	.	*	H	α-helix	trans	-54.2	-34.4	-176.7	-27.7	35.2	0	0	0	114.4	Q53 V54 V55	P51-Q53 VanDerWaalsContact C-N 3.34Å; P51-Q53 PolarHBondContact O-N 3.29Å; P51-V54 PolarHBondContact O-N 3.15Å; P51-V55 PolarHBondContact O-N 3.29Å
52	L	54.1	Low	54.2	Low	148 Å²	148	95.3 Å²	95.3	78%	0.775	57%	0.568	S	S	*	*	H	α-helix	trans	-65.5	-33.5	177.5	-67.1	167.9	0	0	0	113.1	G50 V54 V55 Q56	G50-L52 PolarHBondContact O-N 3.17Å; G50-L52 VanDerWaalsContact O-N 3.08Å; L52-V54 VanDerWaalsContact C-N 3.32Å; L52-V55 WeakPolarHBondContact O-CB 3.36Å; L52-V55 PolarHBondContact O-N 3.33Å; L52-Q56 PolarHBondContact O-N 3.41Å
53	Q	61.1	Low	56.4	Low	103 Å²	103	92.2 Å²	92.2	48%	0.481	55%	0.551	S	S	.	*	H	α-helix	trans	-72.6	-30.1	-179.8	-159.5	170.7	23	0	0	111.3	G50 P51 L57	G50-Q53 WeakPolarHBondContact O-CB 3.44Å; G50-Q53 PolarHBondContact O-N 3.42Å; P51-Q53 VanDerWaalsContact C-N 3.34Å; P51-Q53 PolarHBondContact O-N 3.29Å; Q53-L57 HydrophobicContact CG-CD1 4.34Å; Q53-L57 WeakPolarHBondContact O-CB 3.15Å; Q53-L57 WeakPolarHBondContact O-CD1 3.5Å; Q53-L57 VanDerWaalsContact O-CG 3.26Å; Q53-L57 WeakPolarHBondContact O-CG 3.41Å; Q53-L57 PolarHBondContact O-N 3.33Å
54	V	60.3	Low	57.8	Low	56 Å²	56	87.8 Å²	87.8	34%	0.339	54%	0.535	S	S	.	.	H	α-helix	trans	-69.8	-40.1	172.1	-177.4	0	0	0	0	111.2	P51 L52 A58 W92	P51-V54 PolarHBondContact O-N 3.15Å; L52-V54 VanDerWaalsContact C-N 3.32Å; V54-A58 WeakPolarHBondContact O-CB 3.34Å; V54-A58 PolarHBondContact O-N 2.94Å; V54-A58 VanDerWaalsContact O-N 3.09Å; V54-W92 HydrophobicContact CG1-CH2 4.22Å; V54-W92 HydrophobicContact CG1-CZ2 4.4Å; V54-W92 HydrophobicContact CG1-CZ3 4.39Å
55	V	62	Low	59.6	Low	55 Å²	55	85.7 Å²	85.7	33%	0.333	51%	0.505	S	S	.	.	H	α-helix	trans	-58.5	-52.1	172.2	176.6	0	0	0	0	110.4	P51 L52 L57 A58 E59 W92	P51-V55 PolarHBondContact O-N 3.29Å; L52-V55 WeakPolarHBondContact O-CB 3.36Å; L52-V55 PolarHBondContact O-N 3.33Å; V55-L57 PolarHBondContact O-N 2.79Å; V55-A58 WeakPolarHBondContact O-CB 3.29Å; V55-A58 PolarHBondContact O-N 3.15Å; V55-A58 VanDerWaalsContact O-N 3.15Å; V55-E59 PolarHBondContact O-N 2.92Å; V55-W92 HydrophobicContact CG2-CH2 3.79Å
56	Q	68	Low	61.6	Low	109 Å²	109	85.1 Å²	85.1	51%	0.509	49%	0.489	S	S	.	.	H	α-helix	trans	-62.1	-47.1	-175.9	-173	-178.7	-25.7	0	0	112.1	L52 A58 E59 E60	L52-Q56 PolarHBondContact O-N 3.41Å; Q56-A58 PolarHBondContact O-N 2.65Å; Q56-E59 PolarHBondContact O-N 3.37Å; Q56-E59 VanDerWaalsContact O-N 3.15Å; Q56-E60 WeakPolarHBondContact CG-OE1 3.49Å; Q56-E60 PolarHBondContact NE2-OE1 3.41Å; Q56-E60 WeakPolarHBondContact O-CG 3.47Å; Q56-E60 PolarHBondContact O-N 3.13Å
57	L	72.2	Confident	62.6	Low	92 Å²	92	84.9 Å²	84.9	48%	0.482	49%	0.486	S	S	.	.	H	α-helix	trans	-63.9	-28.8	176.9	-70.2	168.3	0	0	0	112.6	Q53 V55 L61	Q53-L57 HydrophobicContact CG-CD1 4.34Å; Q53-L57 WeakPolarHBondContact O-CB 3.15Å; Q53-L57 WeakPolarHBondContact O-CD1 3.5Å; Q53-L57 VanDerWaalsContact O-CG 3.26Å; Q53-L57 WeakPolarHBondContact O-CG 3.41Å; Q53-L57 PolarHBondContact O-N 3.33Å; V55-L57 PolarHBondContact O-N 2.79Å; L57-L61 VanDerWaalsContact O-CB 3.3Å; L57-L61 WeakPolarHBondContact O-CB 3.36Å; L57-L61 PolarHBondContact O-N 2.96Å
58	A	68.3	Low	64	Low	37 Å²	37	82 Å²	82	31%	0.306	46%	0.463	S	S	.	.	H	α-helix	trans	-73.8	-36.1	173.8	0	0	0	0	0	112.6	V54 V55 Q56 K62	V54-A58 WeakPolarHBondContact O-CB 3.34Å; V54-A58 PolarHBondContact O-N 2.94Å; V54-A58 VanDerWaalsContact O-N 3.09Å; V55-A58 WeakPolarHBondContact O-CB 3.29Å; V55-A58 PolarHBondContact O-N 3.15Å; V55-A58 VanDerWaalsContact O-N 3.15Å; Q56-A58 PolarHBondContact O-N 2.65Å; A58-K62 WeakPolarHBondContact O-CB 3.41Å; A58-K62 PolarHBondContact O-N 3.02Å
59	E	71.3	Confident	64.7	Low	117 Å²	117	82.7 Å²	82.7	55%	0.547	47%	0.465	S	S	.	.	H	α-helix	trans	-69.5	-40.1	171.6	-69.8	-162.2	118.2	0	0	112	V55 Q56 K62 L63	V55-E59 PolarHBondContact O-N 2.92Å; Q56-E59 PolarHBondContact O-N 3.37Å; Q56-E59 VanDerWaalsContact O-N 3.15Å; E59-K62 WeakPolarHBondContact O-CB 3.5Å; E59-K62 PolarHBondContact O-N 3.49Å; E59-L63 WeakPolarHBondContact O-CB 3.36Å; E59-L63 WeakPolarHBondContact O-CG 3.17Å; E59-L63 PolarHBondContact O-N 2.88Å
60	E	75.3	Confident	65.9	Low	52 Å²	52	82.9 Å²	82.9	24%	0.243	46%	0.456	C	S	.	.	H	α-helix	trans	-62.2	-43.3	173.8	-72.1	171.6	-167.7	0	0	111.5	Q56 L63 A64	Q56-E60 WeakPolarHBondContact CG-OE1 3.49Å; Q56-E60 PolarHBondContact NE2-OE1 3.41Å; Q56-E60 WeakPolarHBondContact O-CG 3.47Å; Q56-E60 PolarHBondContact O-N 3.13Å; E60-L63 PolarHBondContact O-N 3.26Å; E60-A64 WeakPolarHBondContact O-CB 3.16Å; E60-A64 PolarHBondContact O-N 3.47Å
61	L	71.6	Confident	66.8	Low	68 Å²	68	90.5 Å²	90.5	36%	0.356	48%	0.475	S	S	.	.	H	α-helix	trans	-63	-41.5	173.3	178.7	62.4	0	0	0	112.3	L57 A64 L65 L81	L57-L61 VanDerWaalsContact O-CB 3.3Å; L57-L61 WeakPolarHBondContact O-CB 3.36Å; L57-L61 PolarHBondContact O-N 2.96Å; L61-A64 PolarHBondContact O-N 3.43Å; L61-L65 HydrophobicContact CD1-CD1 4.43Å; L61-L65 HydrophobicContact CG-CD1 4.36Å; L61-L65 WeakPolarHBondContact O-CG 3.4Å; L61-L65 PolarHBondContact O-N 3.27Å; L61-L81 HydrophobicContact CD2-CD1 4.21Å
62	K	73.1	Confident	67.5	Low	109 Å²	109	93.9 Å²	93.9	47%	0.474	48%	0.484	S	S	.	.	H	α-helix	trans	-61.1	-48.7	175.3	178.5	-166	166.1	-160	0	110.8	A58 E59 L65 E66	A58-K62 WeakPolarHBondContact O-CB 3.41Å; A58-K62 PolarHBondContact O-N 3.02Å; E59-K62 WeakPolarHBondContact O-CB 3.5Å; E59-K62 PolarHBondContact O-N 3.49Å; K62-L65 PolarHBondContact O-N 3.41Å; K62-E66 WeakPolarHBondContact CE-OE1 3.29Å; K62-E66 VanDerWaalsContact CE-OE2 3.23Å; K62-E66 WeakPolarHBondContact CE-OE2 3.5Å; K62-E66 HydrophobicContact CG-CG 4.43Å; K62-E66 IonicContact NZ-OE2 3.29Å; K62-E66 WeakPolarHBondContact O-CB 3.4Å; K62-E66 WeakPolarHBondContact O-CG 3.24Å; K62-E66 PolarHBondContact O-N 3.49Å
63	L	72.6	Confident	68.1	Low	97 Å²	97	91 Å²	91	51%	0.508	47%	0.467	S	S	.	.	H	α-helix	trans	-62.3	-44.3	178.4	-74.3	166.2	0	0	0	111.4	E59 E60 L65 E66 V67	E59-L63 WeakPolarHBondContact O-CB 3.36Å; E59-L63 WeakPolarHBondContact O-CG 3.17Å; E59-L63 PolarHBondContact O-N 2.88Å; E60-L63 PolarHBondContact O-N 3.26Å; L63-L65 VanDerWaalsContact C-N 3.26Å; L63-L65 PolarHBondContact O-N 3.33Å; L63-E66 PolarHBondContact O-N 3.21Å; L63-E66 VanDerWaalsContact O-N 3.12Å; L63-V67 WeakPolarHBondContact O-CB 2.77Å; L63-V67 VanDerWaalsContact O-CG2 3.27Å; L63-V67 WeakPolarHBondContact O-CG2 3.39Å; L63-V67 PolarHBondContact O-N 2.77Å
64	A	70.8	Confident	68.4	Low	54 Å²	54	89.8 Å²	89.8	45%	0.446	46%	0.458	S	S	.	.	H	α-helix	trans	-59.8	-35.1	175.8	0	0	0	0	0	112.7	E60 L61 Q68	E60-A64 WeakPolarHBondContact O-CB 3.16Å; E60-A64 PolarHBondContact O-N 3.47Å; L61-A64 PolarHBondContact O-N 3.43Å; A64-Q68 WeakPolarHBondContact O-CG 3.46Å
65	L	67	Low	68.8	Low	33 Å²	33	89.9 Å²	89.9	17%	0.173	46%	0.456	C	S	.	.	H	α-helix	trans	-73.8	-40.9	172.2	-71.9	168.5	0	0	0	112.4	L61 K62 L63 R74 L77 R78	L61-L65 HydrophobicContact CD1-CD1 4.43Å; L61-L65 HydrophobicContact CG-CD1 4.36Å; L61-L65 WeakPolarHBondContact O-CG 3.4Å; L61-L65 PolarHBondContact O-N 3.27Å; K62-L65 PolarHBondContact O-N 3.41Å; L63-L65 VanDerWaalsContact C-N 3.26Å; L63-L65 PolarHBondContact O-N 3.33Å; L65-R74 VanDerWaalsContact O-CD 3.3Å; L65-R74 WeakPolarHBondContact O-CD 3.38Å; L65-R74 VanDerWaalsContact O-CG 3.31Å; L65-R74 WeakPolarHBondContact O-CG 3.24Å; L65-R74 PolarHBondContact O-NH1 3.37Å; L65-L77 HydrophobicContact CD2-CB 3.76Å; L65-L77 HydrophobicContact CD2-CD2 4.16Å; L65-R78 HydrophobicContact CD2-CG 4.41Å
66	E	71.3	Confident	69.2	Low	111 Å²	111	91.8 Å²	91.8	52%	0.519	47%	0.465	S	S	.	.	H	α-helix	trans	-74	-28.7	-176.7	-75.6	178.3	173.4	0	0	114.1	K62 L63 Q68	K62-E66 WeakPolarHBondContact CE-OE1 3.29Å; K62-E66 VanDerWaalsContact CE-OE2 3.23Å; K62-E66 WeakPolarHBondContact CE-OE2 3.5Å; K62-E66 HydrophobicContact CG-CG 4.43Å; K62-E66 IonicContact NZ-OE2 3.29Å; K62-E66 WeakPolarHBondContact O-CB 3.4Å; K62-E66 WeakPolarHBondContact O-CG 3.24Å; K62-E66 PolarHBondContact O-N 3.49Å; L63-E66 PolarHBondContact O-N 3.21Å; L63-E66 VanDerWaalsContact O-N 3.12Å; E66-Q68 VanDerWaalsContact C-N 3.31Å; E66-Q68 PolarHBondContact O-N 2.89Å
67	V	69.9	Low	69.2	Low	114 Å²	114	89.9 Å²	89.9	69%	0.691	46%	0.458	S	S	*	.	S	Bend	trans	-72.4	-22.1	177	168.3	0	0	0	0	112.8	L63 P69	L63-V67 WeakPolarHBondContact O-CB 2.77Å; L63-V67 VanDerWaalsContact O-CG2 3.27Å; L63-V67 WeakPolarHBondContact O-CG2 3.39Å; L63-V67 PolarHBondContact O-N 2.77Å; V67-P69 WeakPolarHBondContact O-CD 3.41Å
68	Q	65.2	Low	68.9	Low	78 Å²	78	90.9 Å²	90.9	36%	0.364	46%	0.455	S	S	.	.			trans	-76.9	117	-178.7	-70.6	-66.2	4.6	0	0	112.2	A64 E66 R74	A64-Q68 WeakPolarHBondContact O-CG 3.46Å; E66-Q68 VanDerWaalsContact C-N 3.31Å; E66-Q68 PolarHBondContact O-N 2.89Å; Q68-R74 HydrophobicContact CB-CG 3.86Å; Q68-R74 WeakPolarHBondContact O-CD 3.24Å
69	P	57	Low	68.8	Low	124 Å²	124	93 Å²	93	81%	0.805	47%	0.473	S	S	*	.			trans	-78.8	-22.1	-173.5	32.2	-35.9	0	0	0	113.2	V67	V67-P69 WeakPolarHBondContact O-CD 3.41Å
70	N	68.8	Low	68.7	Low	78 Å²	78	94.4 Å²	94.4	42%	0.417	48%	0.48	S	S	.	.			trans	-91.6	124.8	-171.4	-149.6	7.3	0	0	0	111.1	E72 E73 R74	N70-E72 PolarHBondContact O-N 3.12Å; N70-E73 HydrophobicContact CB-CB 4.26Å; N70-E73 HydrophobicContact CB-CG 4.22Å; N70-E73 PolarHBondContact ND2-OE1 2.95Å; N70-E73 PolarHBondContact O-N 2.86Å; N70-R74 PolarHBondContact O-N 2.9Å; N70-R74 VanDerWaalsContact O-N 3.07Å
71	R	68.4	Low	68.3	Low	190 Å²	190	94.9 Å²	94.9	72%	0.717	48%	0.483	S	S	*	.	H	α-helix	trans	-65.5	-43.6	-170.7	-178.9	177	174.5	177.1	1.2	112.5	E73 R74 D75	R71-E73 VanDerWaalsContact C-N 3.28Å; R71-E73 PolarHBondContact O-N 3.35Å; R71-R74 PolarHBondContact O-N 2.79Å; R71-D75 WeakPolarHBondContact CG-OD2 3.5Å; R71-D75 IonicContact NE-OD2 2.71Å; R71-D75 PolarHBondContact NE-OD2 3.27Å; R71-D75 WeakPolarHBondContact O-CB 3.46Å; R71-D75 VanDerWaalsContact O-CG 3.31Å; R71-D75 PolarHBondContact O-N 2.85Å
72	E	69	Low	68.6	Low	146 Å²	146	94.6 Å²	94.6	68%	0.682	49%	0.486	S	S	*	.	H	α-helix	trans	-66.5	-32.3	-178	-62.5	-176.4	163.6	0	0	111.7	N70 N76	N70-E72 PolarHBondContact O-N 3.12Å; E72-N76 WeakPolarHBondContact O-CB 3.49Å; E72-N76 PolarHBondContact O-N 3.09Å; E72-N76 PolarHBondContact O-ND2 2.93Å
73	E	66.8	Low	68.4	Low	88 Å²	88	93.9 Å²	93.9	41%	0.411	49%	0.492	S	S	.	.	H	α-helix	trans	-71.1	-44.6	173.7	-70	159.6	-145.3	0	0	111.3	N70 R71 D75 N76 L77	N70-E73 HydrophobicContact CB-CB 4.26Å; N70-E73 HydrophobicContact CB-CG 4.22Å; N70-E73 PolarHBondContact ND2-OE1 2.95Å; N70-E73 PolarHBondContact O-N 2.86Å; R71-E73 VanDerWaalsContact C-N 3.28Å; R71-E73 PolarHBondContact O-N 3.35Å; E73-D75 VanDerWaalsContact C-N 3.27Å; E73-D75 PolarHBondContact O-N 3.34Å; E73-N76 PolarHBondContact O-N 3.03Å; E73-L77 WeakPolarHBondContact O-CD1 3.43Å; E73-L77 PolarHBondContact O-N 2.92Å
74	R	68.6	Low	68.3	Low	77 Å²	77	95.8 Å²	95.8	29%	0.291	50%	0.498	S	S	.	.	H	α-helix	trans	-58.2	-37.2	171.9	-93.2	-179.9	55.1	98	-8	113.2	L65 Q68 N70 R71 R78	L65-R74 VanDerWaalsContact O-CD 3.3Å; L65-R74 WeakPolarHBondContact O-CD 3.38Å; L65-R74 VanDerWaalsContact O-CG 3.31Å; L65-R74 WeakPolarHBondContact O-CG 3.24Å; L65-R74 PolarHBondContact O-NH1 3.37Å; Q68-R74 HydrophobicContact CB-CG 3.86Å; Q68-R74 WeakPolarHBondContact O-CD 3.24Å; N70-R74 PolarHBondContact O-N 2.9Å; N70-R74 VanDerWaalsContact O-N 3.07Å; R71-R74 PolarHBondContact O-N 2.79Å; R74-R78 PolarHBondContact O-N 3.4Å; R74-R78 PolarHBondContact O-NH2 3.13Å
75	D	67	Low	68.2	Low	58 Å²	58	96.3 Å²	96.3	31%	0.31	50%	0.496	S	S	.	.	H	α-helix	trans	-78.6	-33.4	179.3	-68.4	-18.3	0	0	0	110.9	R71 E73 R78 A79	R71-D75 WeakPolarHBondContact CG-OD2 3.5Å; R71-D75 IonicContact NE-OD2 2.71Å; R71-D75 PolarHBondContact NE-OD2 3.27Å; R71-D75 WeakPolarHBondContact O-CB 3.46Å; R71-D75 VanDerWaalsContact O-CG 3.31Å; R71-D75 PolarHBondContact O-N 2.85Å; E73-D75 VanDerWaalsContact C-N 3.27Å; E73-D75 PolarHBondContact O-N 3.34Å; D75-R78 PolarHBondContact O-N 3.28Å; D75-R78 IonicContact OD1-CZ 2.64Å; D75-R78 IonicContact OD1-NH1 2.69Å; D75-R78 PolarHBondContact OD1-NH1 3.09Å; D75-R78 IonicContact OD1-NH2 3.25Å; D75-R78 PolarHBondContact OD1-NH2 2.6Å; D75-A79 PolarHBondContact O-N 2.81Å
76	N	71.6	Confident	68.3	Low	96 Å²	96	96.4 Å²	96.4	51%	0.513	50%	0.501	S	S	.	.	H	α-helix	trans	-66.3	-43.5	169.4	-89.7	-83.6	0	0	0	113.2	E72 E73 R78 A79 Q80	E72-N76 WeakPolarHBondContact O-CB 3.49Å; E72-N76 PolarHBondContact O-N 3.09Å; E72-N76 PolarHBondContact O-ND2 2.93Å; E73-N76 PolarHBondContact O-N 3.03Å; N76-R78 VanDerWaalsContact C-N 3.28Å; N76-R78 PolarHBondContact O-N 3.21Å; N76-A79 CarbonylContact O-C 3.6Å; N76-A79 WeakPolarHBondContact O-CB 3.48Å; N76-A79 PolarHBondContact O-N 3.22Å; N76-A79 VanDerWaalsContact O-N 3.09Å; N76-Q80 WeakPolarHBondContact O-CG 3.5Å; N76-Q80 PolarHBondContact O-N 3.16Å
77	L	66.8	Low	68.2	Low	69 Å²	69	95.8 Å²	95.8	36%	0.361	50%	0.499	S	S	.	.	H	α-helix	trans	-62	-37	175.8	-97	69.7	0	0	0	111.4	L65 E73 Q80	L65-L77 HydrophobicContact CD2-CB 3.76Å; L65-L77 HydrophobicContact CD2-CD2 4.16Å; E73-L77 WeakPolarHBondContact O-CD1 3.43Å; E73-L77 PolarHBondContact O-N 2.92Å; L77-Q80 PolarHBondContact O-N 3.3Å
78	R	66.1	Low	68.1	Low	112 Å²	112	93.2 Å²	93.2	42%	0.423	49%	0.489	S	S	.	.	H	α-helix	trans	-68.8	-32.1	172.2	-89.2	-175.9	-90.1	103.3	10.8	113.2	L65 R74 D75 N76 Q80 L81	L65-R78 HydrophobicContact CD2-CG 4.41Å; R74-R78 PolarHBondContact O-N 3.4Å; R74-R78 PolarHBondContact O-NH2 3.13Å; D75-R78 PolarHBondContact O-N 3.28Å; D75-R78 IonicContact OD1-CZ 2.64Å; D75-R78 IonicContact OD1-NH1 2.69Å; D75-R78 PolarHBondContact OD1-NH1 3.09Å; D75-R78 IonicContact OD1-NH2 3.25Å; D75-R78 PolarHBondContact OD1-NH2 2.6Å; N76-R78 VanDerWaalsContact C-N 3.28Å; N76-R78 PolarHBondContact O-N 3.21Å; R78-Q80 VanDerWaalsContact C-N 3.29Å; R78-Q80 PolarHBondContact O-N 3.35Å; R78-L81 PolarHBondContact O-N 2.87Å
79	A	66.9	Low	68.2	Low	83 Å²	83	91.9 Å²	91.9	69%	0.686	49%	0.485	S	S	*	.	H	α-helix	trans	-72.8	-17.7	173.5	0	0	0	0	0	114	D75 N76	D75-A79 PolarHBondContact O-N 2.81Å; N76-A79 CarbonylContact O-C 3.6Å; N76-A79 WeakPolarHBondContact O-CB 3.48Å; N76-A79 PolarHBondContact O-N 3.22Å; N76-A79 VanDerWaalsContact O-N 3.09Å
80	Q	68.9	Low	68.8	Low	146 Å²	146	89.5 Å²	89.5	68%	0.682	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-11.7	173.7	-70.6	173.8	36.9	0	0	113.5	N76 L77 R78	N76-Q80 WeakPolarHBondContact O-CG 3.5Å; N76-Q80 PolarHBondContact O-N 3.16Å; L77-Q80 PolarHBondContact O-N 3.3Å; R78-Q80 VanDerWaalsContact C-N 3.29Å; R78-Q80 PolarHBondContact O-N 3.35Å
81	L	67.8	Low	68.7	Low	61 Å²	61	89.4 Å²	89.4	32%	0.319	46%	0.463	S	S	.	.	S	Bend	trans	-79.7	124.2	174.9	-148	81.5	0	0	0	109.5	L61 R78 A86	L61-L81 HydrophobicContact CD2-CD1 4.21Å; R78-L81 PolarHBondContact O-N 2.87Å; L81-A86 HydrophobicContact CD2-CB 4.25Å
82	P	76.8	Confident	68.6	Low	62 Å²	62	84.1 Å²	84.1	40%	0.403	44%	0.444	S	S	.	.			trans	-60	137.1	178.2	-23.5	33.7	0	0	0	111.3	E84 T85 A86	P82-E84 PolarHBondContact O-N 3.31Å; P82-T85 WeakPolarHBondContact O-CB 3.27Å; P82-T85 PolarHBondContact O-N 3.18Å; P82-A86 PolarHBondContact O-N 3.15Å
83	P	69.6	Low	68.3	Low	94 Å²	94	83.1 Å²	83.1	61%	0.61	44%	0.443	S	S	*	.	H	α-helix	trans	-62.5	-30.1	-176.7	25.1	-33.5	0	0	0	112.3	A86 Q87	P83-A86 PolarHBondContact O-N 2.92Å; P83-Q87 WeakPolarHBondContact O-CB 3.37Å; P83-Q87 PolarHBondContact O-N 3.34Å
84	E	70.1	Confident	67.9	Low	137 Å²	137	86.2 Å²	86.2	64%	0.64	46%	0.457	S	S	*	.	H	α-helix	trans	-65.1	-38.8	173.6	-55.3	80.4	-177.5	0	0	111.6	P82 A88	P82-E84 PolarHBondContact O-N 3.31Å; E84-A88 VanDerWaalsContact O-CB 3.24Å; E84-A88 WeakPolarHBondContact O-CB 3.2Å; E84-A88 PolarHBondContact O-N 3.35Å
85	T	69.5	Low	67.3	Low	66 Å²	66	86.8 Å²	86.8	41%	0.405	47%	0.469	S	S	.	.	H	α-helix	trans	-70.7	-41	176.8	-51.5	0	0	0	0	111.3	P82 A88 L89	P82-T85 WeakPolarHBondContact O-CB 3.27Å; P82-T85 PolarHBondContact O-N 3.18Å; T85-A88 PolarHBondContact O-N 2.79Å; T85-L89 HydrophobicContact CG2-CD1 4.39Å; T85-L89 WeakPolarHBondContact O-CG 3.38Å; T85-L89 PolarHBondContact O-N 3.43Å; T85-L89 VanDerWaalsContact O-N 3.11Å
86	A	68.8	Low	66.6	Low	34 Å²	34	87 Å²	87	28%	0.281	49%	0.485	S	S	.	.	H	α-helix	trans	-60.6	-47.7	173.7	0	0	0	0	0	111.3	L81 P82 P83 L89 I90	L81-A86 HydrophobicContact CD2-CB 4.25Å; P82-A86 PolarHBondContact O-N 3.15Å; P83-A86 PolarHBondContact O-N 2.92Å; A86-L89 PolarHBondContact O-N 3.11Å; A86-I90 VanDerWaalsContact O-CG1 3.27Å; A86-I90 WeakPolarHBondContact O-CG1 3.35Å; A86-I90 PolarHBondContact O-N 2.91Å; A86-I90 VanDerWaalsContact O-N 3.09Å
87	Q	68.9	Low	65.5	Low	99 Å²	99	86.8 Å²	86.8	46%	0.463	49%	0.491	S	S	.	.	H	α-helix	trans	-65.6	-42.6	178.8	-167.9	63.8	48.1	0	0	111.8	P83 L89 I90 D91	P83-Q87 WeakPolarHBondContact O-CB 3.37Å; P83-Q87 PolarHBondContact O-N 3.34Å; Q87-L89 VanDerWaalsContact C-N 3.32Å; Q87-L89 PolarHBondContact O-N 2.97Å; Q87-I90 PolarHBondContact O-N 2.87Å; Q87-I90 VanDerWaalsContact O-N 3.14Å; Q87-D91 PolarHBondContact NE2-OD1 3.17Å; Q87-D91 WeakPolarHBondContact O-CB 3.21Å; Q87-D91 PolarHBondContact O-N 3.33Å
88	A	68.3	Low	64.5	Low	59 Å²	59	88 Å²	88	49%	0.488	50%	0.501	S	S	.	.	H	α-helix	trans	-61.3	-37.4	178.1	0	0	0	0	0	113	E84 T85 W92	E84-A88 VanDerWaalsContact O-CB 3.24Å; E84-A88 WeakPolarHBondContact O-CB 3.2Å; E84-A88 PolarHBondContact O-N 3.35Å; T85-A88 PolarHBondContact O-N 2.79Å; A88-W92 WeakPolarHBondContact O-CB 3.45Å; A88-W92 PolarHBondContact O-N 3.17Å
89	L	66.4	Low	63.3	Low	51 Å²	51	86.5 Å²	86.5	27%	0.267	51%	0.508	S	S	.	.	H	α-helix	trans	-69.5	-37.8	174.3	-72.8	169	0	0	0	112.2	T85 A86 Q87 L93	T85-L89 HydrophobicContact CG2-CD1 4.39Å; T85-L89 WeakPolarHBondContact O-CG 3.38Å; T85-L89 PolarHBondContact O-N 3.43Å; T85-L89 VanDerWaalsContact O-N 3.11Å; A86-L89 PolarHBondContact O-N 3.11Å; Q87-L89 VanDerWaalsContact C-N 3.32Å; Q87-L89 PolarHBondContact O-N 2.97Å; L89-L93 WeakPolarHBondContact O-CB 3.46Å; L89-L93 VanDerWaalsContact O-CG 3.3Å; L89-L93 WeakPolarHBondContact O-CG 3.19Å; L89-L93 PolarHBondContact O-N 3.41Å
90	I	69.8	Low	61.9	Low	73 Å²	73	88.8 Å²	88.8	37%	0.374	51%	0.508	S	S	.	.	H	α-helix	trans	-66	-48.2	175.4	-68.9	167.3	0	0	0	110.7	A86 Q87 W92 L93 Q94	A86-I90 VanDerWaalsContact O-CG1 3.27Å; A86-I90 WeakPolarHBondContact O-CG1 3.35Å; A86-I90 PolarHBondContact O-N 2.91Å; A86-I90 VanDerWaalsContact O-N 3.09Å; Q87-I90 PolarHBondContact O-N 2.87Å; Q87-I90 VanDerWaalsContact O-N 3.14Å; I90-W92 VanDerWaalsContact C-N 3.32Å; I90-W92 PolarHBondContact O-N 3.3Å; I90-L93 PolarHBondContact O-N 3.07Å; I90-Q94 HydrophobicContact CG2-CG 4.45Å; I90-Q94 VanDerWaalsContact CG2-NE2 3.31Å; I90-Q94 WeakPolarHBondContact O-CB 3.39Å; I90-Q94 VanDerWaalsContact O-CG 3.31Å; I90-Q94 WeakPolarHBondContact O-CG 3.46Å; I90-Q94 PolarHBondContact O-N 2.78Å
91	D	67.6	Low	60.3	Low	76 Å²	76	87 Å²	87	41%	0.406	51%	0.51	S	S	.	.	H	α-helix	trans	-62.7	-38.8	178	-71.4	5.1	0	0	0	111.2	Q87 Q94 T95	Q87-D91 PolarHBondContact NE2-OD1 3.17Å; Q87-D91 WeakPolarHBondContact O-CB 3.21Å; Q87-D91 PolarHBondContact O-N 3.33Å; D91-Q94 PolarHBondContact O-N 3.2Å; D91-T95 WeakPolarHBondContact O-CB 3.33Å; D91-T95 VanDerWaalsContact O-CG2 3.28Å; D91-T95 WeakPolarHBondContact O-CG2 3.28Å; D91-T95 PolarHBondContact O-N 3.21Å; D91-T95 PolarHBondContact O-OG1 3.04Å
92	W	66.4	Low	58.8	Low	79 Å²	79	88.5 Å²	88.5	30%	0.299	52%	0.522	S	S	.	.	H	α-helix	trans	-65.5	-42.9	175.5	179.2	74.5	0	0	0	112.6	V54 V55 A88 I90 T95	V54-W92 HydrophobicContact CG1-CH2 4.22Å; V54-W92 HydrophobicContact CG1-CZ2 4.4Å; V54-W92 HydrophobicContact CG1-CZ3 4.39Å; V55-W92 HydrophobicContact CG2-CH2 3.79Å; A88-W92 WeakPolarHBondContact O-CB 3.45Å; A88-W92 PolarHBondContact O-N 3.17Å; I90-W92 VanDerWaalsContact C-N 3.32Å; I90-W92 PolarHBondContact O-N 3.3Å; W92-T95 PolarHBondContact O-OG1 3.45Å
93	L	62.1	Low	57.1	Low	126 Å²	126	89.1 Å²	89.1	66%	0.66	53%	0.526	S	S	*	.	H	α-helix	trans	-65.3	-37.7	173.6	-74.1	168.4	0	0	0	112.2	L89 I90	L89-L93 WeakPolarHBondContact O-CB 3.46Å; L89-L93 VanDerWaalsContact O-CG 3.3Å; L89-L93 WeakPolarHBondContact O-CG 3.19Å; L89-L93 PolarHBondContact O-N 3.41Å; I90-L93 PolarHBondContact O-N 3.07Å
94	Q	57.4	Low	56.1	Low	152 Å²	152	89.1 Å²	89.1	71%	0.71	53%	0.534	S	S	*	.	H	α-helix	trans	-76.9	-30.2	180	-71.9	-177.7	18.5	0	0	113.7	I90 D91 G96	I90-Q94 HydrophobicContact CG2-CG 4.45Å; I90-Q94 VanDerWaalsContact CG2-NE2 3.31Å; I90-Q94 WeakPolarHBondContact O-CB 3.39Å; I90-Q94 VanDerWaalsContact O-CG 3.31Å; I90-Q94 WeakPolarHBondContact O-CG 3.46Å; I90-Q94 PolarHBondContact O-N 2.78Å; D91-Q94 PolarHBondContact O-N 3.2Å; Q94-G96 PolarHBondContact O-N 2.63Å
95	T	56.4	Low	55.2	Low	90 Å²	90	86.5 Å²	86.5	55%	0.552	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-4	178.9	48.4	0	0	0	0	113.9	D91 W92 S97	D91-T95 WeakPolarHBondContact O-CB 3.33Å; D91-T95 VanDerWaalsContact O-CG2 3.28Å; D91-T95 WeakPolarHBondContact O-CG2 3.28Å; D91-T95 PolarHBondContact O-N 3.21Å; D91-T95 PolarHBondContact O-OG1 3.04Å; W92-T95 PolarHBondContact O-OG1 3.45Å; T95-S97 PolarHBondContact O-N 3.37Å; T95-S97 PolarHBondContact O-OG 3.43Å
96	G	53	Low	54.3	Low	63 Å²	63	90.2 Å²	90.2	65%	0.649	54%	0.542	S	S	*	.			trans	60.8	8.6	163.9	0	0	0	0	0	116.2	Q94 V98	Q94-G96 PolarHBondContact O-N 2.63Å; G96-V98 VanDerWaalsContact C-N 3.32Å; G96-V98 PolarHBondContact O-N 3.26Å; G96-V98 VanDerWaalsContact O-N 3.14Å
97	S	48.4	Very low	53.8	Low	91 Å²	91	92.5 Å²	92.5	64%	0.636	55%	0.547	S	S	*	.			trans	-95.3	52.7	-163.9	-66	0	0	0	0	112.1	T95 S99	T95-S97 PolarHBondContact O-N 3.37Å; T95-S97 PolarHBondContact O-OG 3.43Å; S97-S99 PolarHBondContact O-N 3.12Å
98	V	46.4	Very low	54.2	Low	94 Å²	94	91.4 Å²	91.4	57%	0.57	55%	0.547	S	S	*	.			trans	-66.5	102.3	166.8	179.7	0	0	0	0	107.5	G96 L100	G96-V98 VanDerWaalsContact C-N 3.32Å; G96-V98 PolarHBondContact O-N 3.26Å; G96-V98 VanDerWaalsContact O-N 3.14Å; V98-L100 PolarHBondContact O-N 2.92Å
99	S	39.2	Very low	54.3	Low	81 Å²	81	97.2 Å²	97.2	57%	0.566	56%	0.558	S	S	*	*			trans	-69.6	75.8	-175.7	-179.2	0	0	0	0	112.3	S97 C101	S97-S99 PolarHBondContact O-N 3.12Å; S99-C101 VanDerWaalsContact C-N 3.3Å; S99-C101 PolarHBondContact O-N 3.01Å
100	L	39.2	Very low	54.4	Low	131 Å²	131	101.6 Å²	101.6	69%	0.686	58%	0.577	S	S	*	*			trans	-57.7	97.9	152.3	-81.7	164.9	0	0	0	107.8	V98 T102	V98-L100 PolarHBondContact O-N 2.92Å; L100-T102 PolarHBondContact O-N 3.01Å
101	C	33.9	Very low	54.4	Low	108 Å²	108	102.9 Å²	102.9	73%	0.73	58%	0.581	S	S	*	*			trans	-66.8	80	169.5	-70.1	0	0	0	0	109.1	S99 P103	S99-C101 VanDerWaalsContact C-N 3.3Å; S99-C101 PolarHBondContact O-N 3.01Å; C101-P103 WeakPolarHBondContact O-CD 3.37Å
102	T	36.6	Very low	54.8	Low	93 Å²	93	105.5 Å²	105.5	57%	0.571	59%	0.585	S	S	*	*			trans	-57.9	124.5	175.2	32.1	0	0	0	0	109.6	L100	L100-T102 PolarHBondContact O-N 3.01Å
103	P	41.3	Very low	55.2	Low	74 Å²	74	107.2 Å²	107.2	48%	0.481	60%	0.6	S	S	.	*			trans	-55.6	159.4	157.7	-19.8	33.2	0	0	0	109.2	C101 N105	C101-P103 WeakPolarHBondContact O-CD 3.37Å; P103-N105 CarbonylContact O-C 3.57Å; P103-N105 PolarHBondContact O-N 3.12Å; P103-N105 VanDerWaalsContact O-O 3.06Å
104	A	48	Very low	56	Low	95 Å²	95	106.7 Å²	106.7	79%	0.785	60%	0.597	S	S	*	*	S	Bend	trans	-71	25	-175.5	0	0	0	0	0	115.7	K507	A104-K507 PolarHBondContact O-NZ 3.48Å
105	N	52.5	Low	57.2	Low	81 Å²	81	104.6 Å²	104.6	43%	0.433	58%	0.583	S	S	.	*	S	Bend	trans	-139.5	132.9	160.7	-80.2	-4.7	0	0	0	106.5	P103 E107 K507	P103-N105 CarbonylContact O-C 3.57Å; P103-N105 PolarHBondContact O-N 3.12Å; P103-N105 VanDerWaalsContact O-O 3.06Å; N105-E107 PolarHBondContact O-N 3.44Å; N105-K507 PolarHBondContact OD1-NZ 2.9Å
106	N	50	Low	58.6	Low	144 Å²	144	104.7 Å²	104.7	77%	0.77	58%	0.579	S	S	*	*			trans	-75.8	67.4	175.2	-64.1	-3.2	0	0	0	111.4
107	E	58.6	Low	59.9	Low	82 Å²	82	105.9 Å²	105.9	38%	0.383	57%	0.568	S	S	.	*			trans	-89.6	128.1	163.2	-79.5	172.2	-143.7	0	0	108.5	N105 R115	N105-E107 PolarHBondContact O-N 3.44Å; E107-R115 IonicContact OE2-CZ 3.32Å; E107-R115 IonicContact OE2-NE 3.12Å; E107-R115 IonicContact OE2-NH2 2.68Å; E107-R115 PolarHBondContact OE2-NH2 2.88Å
108	T	77.7	Confident	61.6	Low	77 Å²	77	103.1 Å²	103.1	47%	0.472	55%	0.554	S	S	.	*			trans	-71.8	157.6	171.1	63.1	0	0	0	0	111.1	Q110 E111 R112	T108-Q110 PolarHBondContact O-N 3.39Å; T108-E111 VanDerWaalsContact CB-OE2 3.32Å; T108-E111 WeakPolarHBondContact CB-OE2 3.38Å; T108-E111 WeakPolarHBondContact CG2-OE2 3.45Å; T108-E111 PolarHBondContact N-OE2 2.75Å; T108-E111 PolarHBondContact O-N 3.32Å; T108-E111 VanDerWaalsContact OG1-CG 3.31Å; T108-E111 WeakPolarHBondContact OG1-CG 3.37Å; T108-E111 PolarHBondContact OG1-N 2.83Å; T108-E111 PolarHBondContact OG1-OE2 3.4Å; T108-R112 PolarHBondContact O-N 3.35Å
109	Y	69.1	Low	63.5	Low	180 Å²	180	102.6 Å²	102.6	71%	0.706	55%	0.548	S	S	*	.	H	α-helix	trans	-57.9	-34.2	175	-79.7	-91.6	0	0	0	112.3	R112 L113	Y109-R112 PolarHBondContact O-N 3.18Å; Y109-L113 WeakPolarHBondContact O-CB 3.48Å; Y109-L113 PolarHBondContact O-N 2.85Å
110	Q	69.2	Low	65.9	Low	143 Å²	143	104.3 Å²	104.3	67%	0.668	55%	0.545	S	S	*	.	H	α-helix	trans	-61.8	-49.2	175.5	-155.3	83.8	12.4	0	0	111.8	T108 R112 L113 L114	T108-Q110 PolarHBondContact O-N 3.39Å; Q110-R112 VanDerWaalsContact C-N 3.34Å; Q110-R112 PolarHBondContact O-N 2.94Å; Q110-L113 PolarHBondContact O-N 3.3Å; Q110-L114 PolarHBondContact O-N 3.32Å
111	E	69.2	Low	68.2	Low	101 Å²	101	104.2 Å²	104.2	47%	0.472	54%	0.541	S	S	.	.	H	α-helix	trans	-65.7	-36.9	178.7	-70.2	163.1	122.5	0	0	111.9	T108 R115	T108-E111 VanDerWaalsContact CB-OE2 3.32Å; T108-E111 WeakPolarHBondContact CB-OE2 3.38Å; T108-E111 WeakPolarHBondContact CG2-OE2 3.45Å; T108-E111 PolarHBondContact N-OE2 2.75Å; T108-E111 PolarHBondContact O-N 3.32Å; T108-E111 VanDerWaalsContact OG1-CG 3.31Å; T108-E111 WeakPolarHBondContact OG1-CG 3.37Å; T108-E111 PolarHBondContact OG1-N 2.83Å; T108-E111 PolarHBondContact OG1-OE2 3.4Å; E111-R115 WeakPolarHBondContact O-CB 3.37Å; E111-R115 PolarHBondContact O-N 2.89Å
112	R	77.3	Confident	70.7	Confident	130 Å²	130	102.7 Å²	102.7	49%	0.491	53%	0.532	S	S	.	.	H	α-helix	trans	-66.6	-36.8	174.9	-174.9	173.8	177.4	172.4	-0.6	112.2	T108 Y109 Q110 L116	T108-R112 PolarHBondContact O-N 3.35Å; Y109-R112 PolarHBondContact O-N 3.18Å; Q110-R112 VanDerWaalsContact C-N 3.34Å; Q110-R112 PolarHBondContact O-N 2.94Å; R112-L116 HydrophobicContact CG-CD1 4.2Å; R112-L116 WeakPolarHBondContact O-CB 3.46Å; R112-L116 VanDerWaalsContact O-CG 3.27Å; R112-L116 WeakPolarHBondContact O-CG 3.37Å; R112-L116 PolarHBondContact O-N 3.49Å
113	L	73.6	Confident	73.2	Confident	115 Å²	115	103 Å²	103	60%	0.602	53%	0.53	S	S	*	.	H	α-helix	trans	-65.9	-51.5	173.7	-111.8	161.8	0	0	0	111	Y109 Q110 R115 L116 E117	Y109-L113 WeakPolarHBondContact O-CB 3.48Å; Y109-L113 PolarHBondContact O-N 2.85Å; Q110-L113 PolarHBondContact O-N 3.3Å; L113-R115 VanDerWaalsContact C-N 3.28Å; L113-R115 PolarHBondContact O-N 3.13Å; L113-L116 PolarHBondContact O-N 3.26Å; L113-L116 VanDerWaalsContact O-N 3.12Å; L113-E117 WeakPolarHBondContact O-CB 3.48Å; L113-E117 PolarHBondContact O-N 2.98Å
114	L	79.4	Confident	75.5	Confident	115 Å²	115	104.2 Å²	104.2	60%	0.602	54%	0.535	S	S	*	.	H	α-helix	trans	-56.3	-40.6	176.2	-78.4	162.2	0	0	0	112.5	Q110 E117 G118	Q110-L114 PolarHBondContact O-N 3.32Å; L114-E117 PolarHBondContact O-N 3.32Å; L114-G118 PolarHBondContact O-N 3.07Å
115	R	82.8	Confident	77.5	Confident	109 Å²	109	105.2 Å²	105.2	41%	0.411	53%	0.527	S	S	.	.	H	α-helix	trans	-67.4	-43.8	175.7	-174.1	171.2	53.4	66.7	-4.8	112.1	E107 E111 L113 E117 G118 D119	E107-R115 IonicContact OE2-CZ 3.32Å; E107-R115 IonicContact OE2-NE 3.12Å; E107-R115 IonicContact OE2-NH2 2.68Å; E107-R115 PolarHBondContact OE2-NH2 2.88Å; E111-R115 WeakPolarHBondContact O-CB 3.37Å; E111-R115 PolarHBondContact O-N 2.89Å; L113-R115 VanDerWaalsContact C-N 3.28Å; L113-R115 PolarHBondContact O-N 3.13Å; R115-E117 VanDerWaalsContact C-N 3.26Å; R115-E117 PolarHBondContact O-N 3.05Å; R115-G118 PolarHBondContact O-N 3.25Å; R115-D119 IonicContact NH1-OD2 2.72Å; R115-D119 PolarHBondContact NH1-OD2 2.55Å; R115-D119 WeakPolarHBondContact O-CB 3.39Å; R115-D119 PolarHBondContact O-N 3.05Å
116	L	85.4	Confident	79	Confident	91 Å²	91	106.9 Å²	106.9	48%	0.476	53%	0.532	S	S	.	.	H	α-helix	trans	-66.3	-28.5	176.6	-73.9	170.6	0	0	0	112.7	R112 L113 K120	R112-L116 HydrophobicContact CG-CD1 4.2Å; R112-L116 WeakPolarHBondContact O-CB 3.46Å; R112-L116 VanDerWaalsContact O-CG 3.27Å; R112-L116 WeakPolarHBondContact O-CG 3.37Å; R112-L116 PolarHBondContact O-N 3.49Å; L113-L116 PolarHBondContact O-N 3.26Å; L113-L116 VanDerWaalsContact O-N 3.12Å; L116-K120 VanDerWaalsContact O-CB 3.23Å; L116-K120 WeakPolarHBondContact O-CB 3.29Å; L116-K120 PolarHBondContact O-N 2.83Å
117	E	80.4	Confident	80.7	Confident	88 Å²	88	103.9 Å²	103.9	41%	0.411	52%	0.519	S	S	.	.	H	α-helix	trans	-69.9	-45.2	172.4	-170.5	128.5	-114	0	0	111.4	L113 L114 R115 K120 E121	L113-E117 WeakPolarHBondContact O-CB 3.48Å; L113-E117 PolarHBondContact O-N 2.98Å; L114-E117 PolarHBondContact O-N 3.32Å; R115-E117 VanDerWaalsContact C-N 3.26Å; R115-E117 PolarHBondContact O-N 3.05Å; E117-K120 WeakPolarHBondContact O-CB 3.42Å; E117-K120 PolarHBondContact O-N 3.24Å; E117-K120 IonicContact OE1-NZ 2.98Å; E117-K120 PolarHBondContact OE1-NZ 3.4Å; E117-E121 WeakPolarHBondContact O-CG 3.44Å; E117-E121 PolarHBondContact O-N 3.25Å
118	G	85	Confident	82	Confident	34 Å²	34	102.7 Å²	102.7	35%	0.351	52%	0.519	S	S	.	.	H	α-helix	trans	-64.3	-38.2	171.4	0	0	0	0	0	113.7	L114 R115 K120 E121 S122	L114-G118 PolarHBondContact O-N 3.07Å; R115-G118 PolarHBondContact O-N 3.25Å; G118-K120 VanDerWaalsContact C-N 3.31Å; G118-K120 PolarHBondContact O-N 2.78Å; G118-E121 PolarHBondContact O-N 3.03Å; G118-S122 WeakPolarHBondContact O-CB 3.26Å; G118-S122 PolarHBondContact O-N 3.06Å
119	D	85.8	Confident	82.6	Confident	83 Å²	83	102 Å²	102	44%	0.444	52%	0.515	S	S	.	.	H	α-helix	trans	-62.2	-39.8	173.4	-68.5	-31.7	0	0	0	110.4	R115 L123	R115-D119 IonicContact NH1-OD2 2.72Å; R115-D119 PolarHBondContact NH1-OD2 2.55Å; R115-D119 WeakPolarHBondContact O-CB 3.39Å; R115-D119 PolarHBondContact O-N 3.05Å; D119-L123 WeakPolarHBondContact O-CB 3.45Å; D119-L123 PolarHBondContact O-N 3.21Å
120	K	89.4	Confident	83.3	Confident	117 Å²	117	97.9 Å²	97.9	51%	0.509	51%	0.505	S	S	.	.	H	α-helix	trans	-65.4	-47.3	173.9	160.2	-164.9	162.4	-156.4	0	112	L116 E117 G118 L123 V124	L116-K120 VanDerWaalsContact O-CB 3.23Å; L116-K120 WeakPolarHBondContact O-CB 3.29Å; L116-K120 PolarHBondContact O-N 2.83Å; E117-K120 WeakPolarHBondContact O-CB 3.42Å; E117-K120 PolarHBondContact O-N 3.24Å; E117-K120 IonicContact OE1-NZ 2.98Å; E117-K120 PolarHBondContact OE1-NZ 3.4Å; G118-K120 VanDerWaalsContact C-N 3.31Å; G118-K120 PolarHBondContact O-N 2.78Å; K120-L123 PolarHBondContact O-N 3.1Å; K120-V124 WeakPolarHBondContact O-CG2 3.27Å; K120-V124 PolarHBondContact O-N 3.21Å
121	E	87	Confident	84.2	Confident	129 Å²	129	94.9 Å²	94.9	60%	0.603	50%	0.496	S	S	*	.	H	α-helix	trans	-61.9	-43.1	176.7	-73.2	-179.3	165.2	0	0	111.7	E117 G118 L123 V124 L125	E117-E121 WeakPolarHBondContact O-CG 3.44Å; E117-E121 PolarHBondContact O-N 3.25Å; G118-E121 PolarHBondContact O-N 3.03Å; E121-L123 VanDerWaalsContact C-N 3.31Å; E121-L123 PolarHBondContact O-N 3.46Å; E121-V124 PolarHBondContact O-N 3.41Å; E121-L125 PolarHBondContact O-N 3.5Å
122	S	87.3	Confident	85.2	Confident	76 Å²	76	94.1 Å²	94.1	53%	0.531	50%	0.495	S	S	.	.	H	α-helix	trans	-62.3	-37.1	174.5	-173.4	0	0	0	0	112.3	G118 Q126	G118-S122 WeakPolarHBondContact O-CB 3.26Å; G118-S122 PolarHBondContact O-N 3.06Å; S122-Q126 WeakPolarHBondContact O-CB 3.37Å; S122-Q126 PolarHBondContact O-N 2.96Å
123	L	88.8	Confident	85.2	Confident	100 Å²	100	92.8 Å²	92.8	52%	0.524	50%	0.495	S	S	.	.	H	α-helix	trans	-71.6	-39.9	176.6	-175.4	63.3	0	0	0	111.9	D119 K120 E121 L125 Q126 V127	D119-L123 WeakPolarHBondContact O-CB 3.45Å; D119-L123 PolarHBondContact O-N 3.21Å; K120-L123 PolarHBondContact O-N 3.1Å; E121-L123 VanDerWaalsContact C-N 3.31Å; E121-L123 PolarHBondContact O-N 3.46Å; L123-L125 VanDerWaalsContact C-N 3.35Å; L123-Q126 PolarHBondContact O-N 3.1Å; L123-V127 WeakPolarHBondContact O-CG2 3.25Å; L123-V127 PolarHBondContact O-N 3.04Å
124	V	88.5	Confident	85.7	Confident	98 Å²	98	92.1 Å²	92.1	59%	0.594	50%	0.495	S	S	*	.	H	α-helix	trans	-60.7	-44.3	173.4	168.1	0	0	0	0	110.8	K120 E121 Q126 V127 S128	K120-V124 WeakPolarHBondContact O-CG2 3.27Å; K120-V124 PolarHBondContact O-N 3.21Å; E121-V124 PolarHBondContact O-N 3.41Å; V124-Q126 PolarHBondContact O-N 2.74Å; V124-V127 PolarHBondContact O-N 3.47Å; V124-S128 PolarHBondContact O-N 3.14Å
125	L	89.8	Confident	86	Confident	117 Å²	117	92.4 Å²	92.4	61%	0.613	49%	0.493	S	S	*	.	H	α-helix	trans	-62.9	-41.4	175	-175.7	64	0	0	0	111.8	E121 L123 S128 V129	E121-L125 PolarHBondContact O-N 3.5Å; L123-L125 VanDerWaalsContact C-N 3.35Å; L125-S128 PolarHBondContact O-N 2.92Å; L125-V129 WeakPolarHBondContact O-CG2 3.48Å; L125-V129 PolarHBondContact O-N 2.9Å
126	Q	84.9	Confident	86.1	Confident	116 Å²	116	89.7 Å²	89.7	54%	0.542	50%	0.495	S	S	.	.	H	α-helix	trans	-64.2	-40	176.2	-173.5	173.7	38.7	0	0	112.2	S122 L123 V124 L130	S122-Q126 WeakPolarHBondContact O-CB 3.37Å; S122-Q126 PolarHBondContact O-N 2.96Å; L123-Q126 PolarHBondContact O-N 3.1Å; V124-Q126 PolarHBondContact O-N 2.74Å; Q126-L130 HydrophobicContact CG-CD1 4.29Å; Q126-L130 VanDerWaalsContact O-CG 3.31Å; Q126-L130 WeakPolarHBondContact O-CG 3.44Å; Q126-L130 PolarHBondContact O-N 3.25Å; Q126-L130 VanDerWaalsContact O-N 3.07Å
127	V	86.1	Confident	85.5	Confident	80 Å²	80	91 Å²	91	49%	0.485	50%	0.498	S	S	.	.	H	α-helix	trans	-64.7	-45.1	174.3	169.7	0	0	0	0	110.6	L123 V124 V129 L130 T131	L123-V127 WeakPolarHBondContact O-CG2 3.25Å; L123-V127 PolarHBondContact O-N 3.04Å; V124-V127 PolarHBondContact O-N 3.47Å; V127-V129 PolarHBondContact O-N 3.49Å; V127-L130 PolarHBondContact O-N 3.28Å; V127-T131 PolarHBondContact O-N 2.76Å; V127-T131 PolarHBondContact O-OG1 2.84Å; V127-T131 VanDerWaalsContact O-OG1 3.11Å
128	S	86.3	Confident	85.5	Confident	57 Å²	57	87.9 Å²	87.9	40%	0.399	49%	0.489	S	S	.	.	H	α-helix	trans	-57.1	-50.5	175.8	-162.6	0	0	0	0	111.4	V124 L125 L130 T131 D132	V124-S128 PolarHBondContact O-N 3.14Å; L125-S128 PolarHBondContact O-N 2.92Å; S128-L130 PolarHBondContact O-N 3.44Å; S128-T131 WeakPolarHBondContact O-CB 3.44Å; S128-T131 PolarHBondContact O-N 3.45Å; S128-D132 PolarHBondContact O-N 2.84Å
129	V	88.5	Confident	85.5	Confident	63 Å²	63	91.2 Å²	91.2	38%	0.382	50%	0.496	S	S	.	.	H	α-helix	trans	-61.9	-30.8	179.4	170.1	0	0	0	0	112.5	L125 V127 Q133	L125-V129 WeakPolarHBondContact O-CG2 3.48Å; L125-V129 PolarHBondContact O-N 2.9Å; V127-V129 PolarHBondContact O-N 3.49Å; V129-Q133 VanDerWaalsContact CG1-NE2 3.35Å; V129-Q133 WeakPolarHBondContact O-CB 3.31Å; V129-Q133 WeakPolarHBondContact O-CG 3.39Å; V129-Q133 PolarHBondContact O-N 3.25Å
130	L	85.3	Confident	85.2	Confident	94 Å²	94	93.9 Å²	93.9	49%	0.492	50%	0.503	S	S	.	.	H	α-helix	trans	-74.8	-38.5	173.2	-72.9	170	0	0	0	112.2	Q126 V127 S128 Q133 V134	Q126-L130 HydrophobicContact CG-CD1 4.29Å; Q126-L130 VanDerWaalsContact O-CG 3.31Å; Q126-L130 WeakPolarHBondContact O-CG 3.44Å; Q126-L130 PolarHBondContact O-N 3.25Å; Q126-L130 VanDerWaalsContact O-N 3.07Å; V127-L130 PolarHBondContact O-N 3.28Å; S128-L130 PolarHBondContact O-N 3.44Å; L130-Q133 PolarHBondContact O-N 2.88Å; L130-V134 WeakPolarHBondContact O-CG2 3.38Å; L130-V134 PolarHBondContact O-N 3.02Å
131	T	87.6	Confident	84.6	Confident	79 Å²	79	92.5 Å²	92.5	49%	0.485	50%	0.501	S	S	.	.	H	α-helix	trans	-60.3	-52.2	172.5	-59.7	0	0	0	0	110.7	V127 S128 Q133 V134 E135	V127-T131 PolarHBondContact O-N 2.76Å; V127-T131 PolarHBondContact O-OG1 2.84Å; V127-T131 VanDerWaalsContact O-OG1 3.11Å; S128-T131 WeakPolarHBondContact O-CB 3.44Å; S128-T131 PolarHBondContact O-N 3.45Å; T131-Q133 PolarHBondContact O-N 3.25Å; T131-V134 PolarHBondContact O-N 3.22Å; T131-E135 PolarHBondContact O-N 3.33Å
132	D	89.9	Confident	84.3	Confident	85 Å²	85	92.6 Å²	92.6	46%	0.455	50%	0.496	S	S	.	.	H	α-helix	trans	-55	-40.2	177.1	-58.6	-2.6	0	0	0	111.5	S128 A136	S128-D132 PolarHBondContact O-N 2.84Å; D132-A136 VanDerWaalsContact O-CB 3.29Å; D132-A136 WeakPolarHBondContact O-CB 3.47Å; D132-A136 PolarHBondContact O-N 2.97Å
133	Q	77.1	Confident	84	Confident	102 Å²	102	94.5 Å²	94.5	48%	0.477	50%	0.5	S	S	.	.	H	α-helix	trans	-71.2	-31.2	177.8	-78.5	176	32.7	0	0	113.7	V129 L130 T131 Q137	V129-Q133 VanDerWaalsContact CG1-NE2 3.35Å; V129-Q133 WeakPolarHBondContact O-CB 3.31Å; V129-Q133 WeakPolarHBondContact O-CG 3.39Å; V129-Q133 PolarHBondContact O-N 3.25Å; L130-Q133 PolarHBondContact O-N 2.88Å; T131-Q133 PolarHBondContact O-N 3.25Å; Q133-Q137 WeakPolarHBondContact O-CB 3.35Å; Q133-Q137 VanDerWaalsContact O-CG 3.23Å; Q133-Q137 WeakPolarHBondContact O-CG 3.24Å; Q133-Q137 PolarHBondContact O-N 2.97Å; Q133-Q137 PolarHBondContact O-NE2 3.39Å
134	V	84.9	Confident	83.1	Confident	102 Å²	102	95 Å²	95	62%	0.618	50%	0.502	S	S	*	.	H	α-helix	trans	-75.5	-41.5	174.3	168.7	0	0	0	0	110.2	L130 T131 Q137 G138	L130-V134 WeakPolarHBondContact O-CG2 3.38Å; L130-V134 PolarHBondContact O-N 3.02Å; T131-V134 PolarHBondContact O-N 3.22Å; V134-Q137 PolarHBondContact O-N 3.05Å; V134-G138 PolarHBondContact O-N 3.41Å
135	E	85.9	Confident	82.4	Confident	120 Å²	120	95.7 Å²	95.7	56%	0.561	50%	0.499	S	S	*	.	H	α-helix	trans	-63.7	-48.9	177.3	-176.4	164.6	-150.1	0	0	111.8	T131 Q137 G138 E139	T131-E135 PolarHBondContact O-N 3.33Å; E135-Q137 VanDerWaalsContact C-N 3.25Å; E135-Q137 PolarHBondContact O-N 3.29Å; E135-G138 CarbonylContact O-C 3.28Å; E135-G138 WeakPolarHBondContact O-CA 3.28Å; E135-G138 PolarHBondContact O-N 3.36Å; E135-E139 PolarHBondContact O-N 3.08Å
136	A	83.9	Confident	81.9	Confident	53 Å²	53	94.1 Å²	94.1	44%	0.438	50%	0.495	S	S	.	.	H	α-helix	trans	-65.1	-26.6	175.9	0	0	0	0	0	113.3	D132 K140	D132-A136 VanDerWaalsContact O-CB 3.29Å; D132-A136 WeakPolarHBondContact O-CB 3.47Å; D132-A136 PolarHBondContact O-N 2.97Å; A136-K140 WeakPolarHBondContact O-CB 3.33Å; A136-K140 PolarHBondContact O-N 2.86Å
137	Q	73.9	Confident	81.3	Confident	119 Å²	119	91.1 Å²	91.1	56%	0.556	49%	0.486	S	S	*	.	H	α-helix	trans	-73.7	-35.9	168.7	-80.3	175.8	73.8	0	0	111.9	Q133 V134 E135 K140 I141	Q133-Q137 WeakPolarHBondContact O-CB 3.35Å; Q133-Q137 VanDerWaalsContact O-CG 3.23Å; Q133-Q137 WeakPolarHBondContact O-CG 3.24Å; Q133-Q137 PolarHBondContact O-N 2.97Å; Q133-Q137 PolarHBondContact O-NE2 3.39Å; V134-Q137 PolarHBondContact O-N 3.05Å; E135-Q137 VanDerWaalsContact C-N 3.25Å; E135-Q137 PolarHBondContact O-N 3.29Å; Q137-K140 PolarHBondContact O-N 3.29Å; Q137-I141 WeakPolarHBondContact O-CD1 3.46Å; Q137-I141 VanDerWaalsContact O-CG1 3.26Å; Q137-I141 WeakPolarHBondContact O-CG1 3.27Å; Q137-I141 PolarHBondContact O-N 3.04Å
138	G	78.7	Confident	80.7	Confident	21 Å²	21	91.5 Å²	91.5	22%	0.216	49%	0.485	C	S	.	.	H	α-helix	trans	-62.7	-46.5	172.4	0	0	0	0	0	112.8	V134 E135 K140 I141 R142	V134-G138 PolarHBondContact O-N 3.41Å; E135-G138 CarbonylContact O-C 3.28Å; E135-G138 WeakPolarHBondContact O-CA 3.28Å; E135-G138 PolarHBondContact O-N 3.36Å; G138-K140 PolarHBondContact O-N 3.43Å; G138-I141 PolarHBondContact O-N 3.33Å; G138-R142 WeakPolarHBondContact O-CG 3.41Å; G138-R142 PolarHBondContact O-N 3.23Å
139	E	85.1	Confident	80.3	Confident	104 Å²	104	93.4 Å²	93.4	49%	0.486	49%	0.488	S	S	.	.	H	α-helix	trans	-54.5	-51.8	171.3	-75	-172.5	144.8	0	0	111.4	E135 I141 R142 D143	E135-E139 PolarHBondContact O-N 3.08Å; E139-I141 PolarHBondContact O-N 2.94Å; E139-R142 WeakPolarHBondContact O-CB 3.48Å; E139-R142 PolarHBondContact O-N 3.01Å; E139-D143 PolarHBondContact O-N 3.26Å
140	K	80.6	Confident	79.8	Confident	139 Å²	139	95.3 Å²	95.3	60%	0.604	49%	0.492	S	S	*	.	H	α-helix	trans	-62.6	-27.7	179.9	-174.3	172.4	-178.8	175.8	0	113.7	A136 Q137 G138 L144	A136-K140 WeakPolarHBondContact O-CB 3.33Å; A136-K140 PolarHBondContact O-N 2.86Å; Q137-K140 PolarHBondContact O-N 3.29Å; G138-K140 PolarHBondContact O-N 3.43Å; K140-L144 HydrophobicContact CG-CD1 4.42Å; K140-L144 WeakPolarHBondContact O-CB 3.43Å; K140-L144 WeakPolarHBondContact O-CD1 3.46Å; K140-L144 VanDerWaalsContact O-CG 3.22Å; K140-L144 WeakPolarHBondContact O-CG 3.49Å; K140-L144 PolarHBondContact O-N 3.3Å
141	I	75.9	Confident	78.9	Confident	89 Å²	89	96.4 Å²	96.4	46%	0.456	50%	0.495	S	S	.	.	H	α-helix	trans	-71	-48.2	171.9	-73.6	164.2	0	0	0	109.8	Q137 G138 E139 D143 L144 E145	Q137-I141 WeakPolarHBondContact O-CD1 3.46Å; Q137-I141 VanDerWaalsContact O-CG1 3.26Å; Q137-I141 WeakPolarHBondContact O-CG1 3.27Å; Q137-I141 PolarHBondContact O-N 3.04Å; G138-I141 PolarHBondContact O-N 3.33Å; E139-I141 PolarHBondContact O-N 2.94Å; I141-D143 VanDerWaalsContact C-N 3.32Å; I141-D143 PolarHBondContact O-N 3.13Å; I141-L144 PolarHBondContact O-N 3.37Å; I141-L144 VanDerWaalsContact O-N 3.1Å; I141-E145 VanDerWaalsContact CG2-CD 3.49Å; I141-E145 HydrophobicContact CG2-CG 4.28Å; I141-E145 WeakPolarHBondContact CG2-OE1 3.41Å; I141-E145 WeakPolarHBondContact O-CG 3.37Å; I141-E145 PolarHBondContact O-N 2.88Å
142	R	80.9	Confident	78.1	Confident	131 Å²	131	98.9 Å²	98.9	49%	0.494	50%	0.495	S	S	.	.	H	α-helix	trans	-58.5	-39.8	176.7	-66.6	-174.3	-66.5	-101.4	13.2	112.8	G138 E139 E145 T146	G138-R142 WeakPolarHBondContact O-CG 3.41Å; G138-R142 PolarHBondContact O-N 3.23Å; E139-R142 WeakPolarHBondContact O-CB 3.48Å; E139-R142 PolarHBondContact O-N 3.01Å; R142-E145 PolarHBondContact O-N 2.75Å; R142-T146 WeakPolarHBondContact O-CB 3.29Å; R142-T146 PolarHBondContact O-N 2.74Å; R142-T146 PolarHBondContact O-OG1 2.94Å
143	D	81	Confident	77.7	Confident	115 Å²	115	101.1 Å²	101.1	62%	0.615	50%	0.503	S	S	*	.	H	α-helix	trans	-61.7	-45.1	174.6	-75.9	-13.3	0	0	0	111.9	E139 I141 S147	E139-D143 PolarHBondContact O-N 3.26Å; I141-D143 VanDerWaalsContact C-N 3.32Å; I141-D143 PolarHBondContact O-N 3.13Å; D143-S147 VanDerWaalsContact O-CB 3.28Å; D143-S147 WeakPolarHBondContact O-CB 3.46Å; D143-S147 PolarHBondContact O-N 3.26Å
144	L	70.1	Confident	77.5	Confident	110 Å²	110	101.3 Å²	101.3	58%	0.576	50%	0.502	S	S	*	.	H	α-helix	trans	-69.9	-36	179.8	-74	170.8	0	0	0	112.1	K140 I141 L148	K140-L144 HydrophobicContact CG-CD1 4.42Å; K140-L144 WeakPolarHBondContact O-CB 3.43Å; K140-L144 WeakPolarHBondContact O-CD1 3.46Å; K140-L144 VanDerWaalsContact O-CG 3.22Å; K140-L144 WeakPolarHBondContact O-CG 3.49Å; K140-L144 PolarHBondContact O-N 3.3Å; I141-L144 PolarHBondContact O-N 3.37Å; I141-L144 VanDerWaalsContact O-N 3.1Å; L144-L148 WeakPolarHBondContact O-CB 3.43Å; L144-L148 PolarHBondContact O-N 3.48Å
145	E	74.8	Confident	76.6	Confident	113 Å²	113	102 Å²	102	53%	0.528	50%	0.502	S	S	.	.	H	α-helix	trans	-67.4	-45.9	174.7	-72.2	168	161	0	0	111.1	I141 R142 S147 L148 E149	I141-E145 VanDerWaalsContact CG2-CD 3.49Å; I141-E145 HydrophobicContact CG2-CG 4.28Å; I141-E145 WeakPolarHBondContact CG2-OE1 3.41Å; I141-E145 WeakPolarHBondContact O-CG 3.37Å; I141-E145 PolarHBondContact O-N 2.88Å; R142-E145 PolarHBondContact O-N 2.75Å; E145-S147 PolarHBondContact O-N 2.69Å; E145-L148 PolarHBondContact O-N 3.05Å; E145-E149 PolarHBondContact O-N 3.41Å
146	T	79.1	Confident	76	Confident	85 Å²	85	98.7 Å²	98.7	52%	0.521	50%	0.495	S	S	.	.	H	α-helix	trans	-59.7	-47.2	174.5	-54.7	0	0	0	0	111.4	R142 L148 E149 E150	R142-T146 WeakPolarHBondContact O-CB 3.29Å; R142-T146 PolarHBondContact O-N 2.74Å; R142-T146 PolarHBondContact O-OG1 2.94Å; T146-L148 VanDerWaalsContact C-N 3.34Å; T146-L148 PolarHBondContact O-N 3.14Å; T146-E149 PolarHBondContact O-N 3.35Å; T146-E150 PolarHBondContact O-N 3.32Å
147	S	72.2	Confident	75.7	Confident	53 Å²	53	99 Å²	99	37%	0.371	49%	0.494	S	S	.	.	H	α-helix	trans	-63.6	-38.1	177	-175.6	0	0	0	0	112.6	D143 E145 H151	D143-S147 VanDerWaalsContact O-CB 3.28Å; D143-S147 WeakPolarHBondContact O-CB 3.46Å; D143-S147 PolarHBondContact O-N 3.26Å; E145-S147 PolarHBondContact O-N 2.69Å; S147-H151 WeakPolarHBondContact O-CB 3.3Å; S147-H151 PolarHBondContact O-CD2 3Å; S147-H151 PolarHBondContact O-N 2.73Å
148	L	72.3	Confident	75.4	Confident	88 Å²	88	97.2 Å²	97.2	46%	0.461	49%	0.491	S	S	.	.	H	α-helix	trans	-64.5	-40.9	175.7	-178.9	62.2	0	0	0	111.5	L144 E145 T146 H151 R152	L144-L148 WeakPolarHBondContact O-CB 3.43Å; L144-L148 PolarHBondContact O-N 3.48Å; E145-L148 PolarHBondContact O-N 3.05Å; T146-L148 VanDerWaalsContact C-N 3.34Å; T146-L148 PolarHBondContact O-N 3.14Å; L148-H151 PolarHBondContact O-N 2.67Å; L148-R152 PolarHBondContact O-N 2.97Å
149	E	79.1	Confident	75.4	Confident	97 Å²	97	101.1 Å²	101.1	45%	0.453	50%	0.504	S	S	.	.	H	α-helix	trans	-70.9	-40.5	178.5	-158	56	-134.7	0	0	112.3	E145 T146 H151 R152 Q153	E145-E149 PolarHBondContact O-N 3.41Å; T146-E149 PolarHBondContact O-N 3.35Å; E149-H151 PolarHBondContact O-N 2.91Å; E149-R152 PolarHBondContact O-N 3.38Å; E149-R152 VanDerWaalsContact O-N 3.12Å; E149-R152 WeakPolarHBondContact OE2-CD 3.4Å; E149-R152 IonicContact OE2-CZ 2.71Å; E149-R152 IonicContact OE2-NE 2.62Å; E149-R152 IonicContact OE2-NH1 3.94Å; E149-R152 PolarHBondContact OE2-NH1 2.88Å; E149-Q153 PolarHBondContact O-N 3.2Å
150	E	77.4	Confident	75.2	Confident	102 Å²	102	102.9 Å²	102.9	48%	0.477	51%	0.512	S	S	.	.	H	α-helix	trans	-53.1	-41.7	167.1	-88.3	-165.7	-129.6	0	0	112	T146 K154	T146-E150 PolarHBondContact O-N 3.32Å; E150-K154 WeakPolarHBondContact O-CB 3.45Å; E150-K154 VanDerWaalsContact O-CD 3.24Å; E150-K154 WeakPolarHBondContact O-CD 3.44Å; E150-K154 WeakPolarHBondContact O-CG 3.43Å; E150-K154 PolarHBondContact O-N 2.93Å; E150-K154 IonicContact OE2-NZ 3.81Å; E150-K154 PolarHBondContact OE2-NZ 2.91Å
151	H	66.3	Low	75	Confident	118 Å²	118	101.9 Å²	101.9	55%	0.546	51%	0.511	S	S	.	.	H	α-helix	trans	-71.2	-34.3	178.1	-85.7	-64.5	0	0	0	113	S147 L148 E149 L155	S147-H151 WeakPolarHBondContact O-CB 3.3Å; S147-H151 PolarHBondContact O-CD2 3Å; S147-H151 PolarHBondContact O-N 2.73Å; L148-H151 PolarHBondContact O-N 2.67Å; E149-H151 PolarHBondContact O-N 2.91Å; H151-L155 WeakPolarHBondContact O-CB 3.42Å; H151-L155 PolarHBondContact O-N 2.8Å
152	R	70.4	Confident	74.9	Confident	131 Å²	131	103.5 Å²	103.5	49%	0.494	52%	0.52	S	S	.	.	H	α-helix	trans	-64.2	-48.1	170.6	-72.3	-176	-175.9	118.1	-0.5	111.6	L148 E149 K154 L155 A156	L148-R152 PolarHBondContact O-N 2.97Å; E149-R152 PolarHBondContact O-N 3.38Å; E149-R152 VanDerWaalsContact O-N 3.12Å; E149-R152 WeakPolarHBondContact OE2-CD 3.4Å; E149-R152 IonicContact OE2-CZ 2.71Å; E149-R152 IonicContact OE2-NE 2.62Å; E149-R152 IonicContact OE2-NH1 3.94Å; E149-R152 PolarHBondContact OE2-NH1 2.88Å; R152-K154 VanDerWaalsContact C-N 3.32Å; R152-K154 PolarHBondContact O-N 3.37Å; R152-L155 WeakPolarHBondContact O-CB 3.41Å; R152-L155 PolarHBondContact O-N 2.97Å; R152-L155 VanDerWaalsContact O-N 3.14Å; R152-A156 PolarHBondContact O-N 3.18Å
153	Q	81.1	Confident	74.5	Confident	132 Å²	132	101.1 Å²	101.1	62%	0.617	51%	0.514	S	S	*	.	H	α-helix	trans	-62.9	-39.5	-180	-173.5	59.4	25	0	0	111.9	E149 S157	E149-Q153 PolarHBondContact O-N 3.2Å; Q153-S157 WeakPolarHBondContact O-CB 3.49Å; Q153-S157 PolarHBondContact O-N 3.25Å
154	K	74.9	Confident	74.2	Confident	106 Å²	106	102.2 Å²	102.2	46%	0.461	52%	0.516	S	S	.	.	H	α-helix	trans	-63.6	-43.6	173	-71	161.4	-162.9	167.9	0	111.4	E150 R152 S157 T158	E150-K154 WeakPolarHBondContact O-CB 3.45Å; E150-K154 VanDerWaalsContact O-CD 3.24Å; E150-K154 WeakPolarHBondContact O-CD 3.44Å; E150-K154 WeakPolarHBondContact O-CG 3.43Å; E150-K154 PolarHBondContact O-N 2.93Å; E150-K154 IonicContact OE2-NZ 3.81Å; E150-K154 PolarHBondContact OE2-NZ 2.91Å; R152-K154 VanDerWaalsContact C-N 3.32Å; R152-K154 PolarHBondContact O-N 3.37Å; K154-S157 PolarHBondContact O-N 3.01Å; K154-T158 WeakPolarHBondContact O-CG2 3.23Å; K154-T158 PolarHBondContact O-N 2.88Å; K154-T158 PolarHBondContact O-OG1 3.27Å
155	L	65.3	Low	74.2	Confident	116 Å²	116	102 Å²	102	61%	0.607	51%	0.512	S	S	*	.	H	α-helix	trans	-60.7	-50.9	176.5	-179	63.9	0	0	0	111.4	H151 R152 S157 T158 E159	H151-L155 WeakPolarHBondContact O-CB 3.42Å; H151-L155 PolarHBondContact O-N 2.8Å; R152-L155 WeakPolarHBondContact O-CB 3.41Å; R152-L155 PolarHBondContact O-N 2.97Å; R152-L155 VanDerWaalsContact O-N 3.14Å; L155-S157 VanDerWaalsContact C-N 3.35Å; L155-S157 PolarHBondContact O-N 3.14Å; L155-T158 PolarHBondContact O-N 2.89Å; L155-T158 VanDerWaalsContact O-N 3.12Å; L155-T158 PolarHBondContact O-OG1 2.97Å; L155-E159 PolarHBondContact O-N 3.25Å
156	A	72.9	Confident	74	Confident	50 Å²	50	101.9 Å²	101.9	41%	0.413	51%	0.514	S	S	.	.	H	α-helix	trans	-57.9	-44.4	178.7	0	0	0	0	0	112.2	R152 T158 E159 E160	R152-A156 PolarHBondContact O-N 3.18Å; A156-T158 PolarHBondContact O-N 3.31Å; A156-E159 PolarHBondContact O-N 2.72Å; A156-E160 PolarHBondContact O-N 2.72Å
157	S	77.8	Confident	73.7	Confident	60 Å²	60	106.1 Å²	106.1	42%	0.42	52%	0.521	S	S	.	.	H	α-helix	trans	-62.8	-39	175.2	-179.6	0	0	0	0	112.7	Q153 K154 L155 M161	Q153-S157 WeakPolarHBondContact O-CB 3.49Å; Q153-S157 PolarHBondContact O-N 3.25Å; K154-S157 PolarHBondContact O-N 3.01Å; L155-S157 VanDerWaalsContact C-N 3.35Å; L155-S157 PolarHBondContact O-N 3.14Å; S157-M161 WeakPolarHBondContact O-CB 3.45Å; S157-M161 PolarHBondContact O-N 2.87Å; S157-M161 VanDerWaalsContact O-N 3.1Å
158	T	68.6	Low	73.4	Confident	81 Å²	81	106.1 Å²	106.1	50%	0.497	52%	0.521	S	S	.	.	H	α-helix	trans	-70.6	-29.8	173.5	57.8	0	0	0	0	113.6	K154 L155 A156 L162	K154-T158 WeakPolarHBondContact O-CG2 3.23Å; K154-T158 PolarHBondContact O-N 2.88Å; K154-T158 PolarHBondContact O-OG1 3.27Å; L155-T158 PolarHBondContact O-N 2.89Å; L155-T158 VanDerWaalsContact O-N 3.12Å; L155-T158 PolarHBondContact O-OG1 2.97Å; A156-T158 PolarHBondContact O-N 3.31Å; T158-L162 WeakPolarHBondContact O-CB 3.39Å; T158-L162 PolarHBondContact O-N 3.39Å
159	E	77	Confident	73.4	Confident	103 Å²	103	108.6 Å²	108.6	48%	0.481	52%	0.524	S	S	.	.	H	α-helix	trans	-71.6	-44	174.5	-165.7	-172.6	147.8	0	0	111.2	L155 A156 M161 L162 Q163	L155-E159 PolarHBondContact O-N 3.25Å; A156-E159 PolarHBondContact O-N 2.72Å; E159-M161 VanDerWaalsContact C-N 3.34Å; E159-M161 PolarHBondContact O-N 3.37Å; E159-L162 CarbonylContact O-C 3.54Å; E159-L162 WeakPolarHBondContact O-CB 3.47Å; E159-L162 PolarHBondContact O-N 2.91Å; E159-L162 VanDerWaalsContact O-N 3.13Å; E159-Q163 WeakPolarHBondContact O-CG 3.27Å; E159-Q163 PolarHBondContact O-N 3.43Å; E159-Q163 PolarHBondContact OE1-NE2 2.97Å
160	E	80.8	Confident	73.1	Confident	142 Å²	142	107.7 Å²	107.7	66%	0.664	53%	0.525	S	S	*	.	H	α-helix	trans	-58.2	-46.1	174.9	-177	173.4	-149.9	0	0	111.3	A156 L162 Q163 Q164	A156-E160 PolarHBondContact O-N 2.72Å; E160-L162 VanDerWaalsContact C-N 3.33Å; E160-L162 PolarHBondContact O-N 3.49Å; E160-Q163 PolarHBondContact O-N 2.85Å; E160-Q164 WeakPolarHBondContact O-CB 3.37Å; E160-Q164 PolarHBondContact O-N 3.07Å
161	M	77.2	Confident	73	Confident	118 Å²	118	106.5 Å²	106.5	58%	0.581	53%	0.528	S	S	*	.	H	α-helix	trans	-59.6	-41.8	174	-173.5	-175.9	-64.4	0	0	112.1	S157 E159 Q164 E165	S157-M161 WeakPolarHBondContact O-CB 3.45Å; S157-M161 PolarHBondContact O-N 2.87Å; S157-M161 VanDerWaalsContact O-N 3.1Å; E159-M161 VanDerWaalsContact C-N 3.34Å; E159-M161 PolarHBondContact O-N 3.37Å; M161-Q164 PolarHBondContact O-N 3.21Å; M161-E165 WeakPolarHBondContact O-CB 3.42Å; M161-E165 PolarHBondContact O-N 3.4Å
162	L	73.3	Confident	73.3	Confident	122 Å²	122	105.7 Å²	105.7	64%	0.639	53%	0.528	S	S	*	.	H	α-helix	trans	-66.1	-39.4	176.4	-175.4	69.2	0	0	0	112	T158 E159 E160 L166	T158-L162 WeakPolarHBondContact O-CB 3.39Å; T158-L162 PolarHBondContact O-N 3.39Å; E159-L162 CarbonylContact O-C 3.54Å; E159-L162 WeakPolarHBondContact O-CB 3.47Å; E159-L162 PolarHBondContact O-N 2.91Å; E159-L162 VanDerWaalsContact O-N 3.13Å; E160-L162 VanDerWaalsContact C-N 3.33Å; E160-L162 PolarHBondContact O-N 3.49Å; L162-L166 VanDerWaalsContact O-CB 3.31Å; L162-L166 WeakPolarHBondContact O-CB 3.35Å; L162-L166 PolarHBondContact O-N 2.91Å
163	Q	73.5	Confident	73.5	Confident	81 Å²	81	103.7 Å²	103.7	38%	0.379	52%	0.524	S	S	.	.	H	α-helix	trans	-67.4	-38.3	175.1	-70.4	-171	30.1	0	0	111.7	E159 E160 L166 R167	E159-Q163 WeakPolarHBondContact O-CG 3.27Å; E159-Q163 PolarHBondContact O-N 3.43Å; E159-Q163 PolarHBondContact OE1-NE2 2.97Å; E160-Q163 PolarHBondContact O-N 2.85Å; Q163-L166 PolarHBondContact O-N 2.86Å; Q163-R167 VanDerWaalsContact O-CG 3.26Å; Q163-R167 WeakPolarHBondContact O-CG 3.41Å; Q163-R167 PolarHBondContact O-N 2.91Å
164	Q	75.1	Confident	73.5	Confident	138 Å²	138	100.8 Å²	100.8	65%	0.645	52%	0.515	S	S	*	.	H	α-helix	trans	-64.4	-47.1	174.8	-174.5	178.4	6.1	0	0	111.2	E160 M161 L166 R167 S168	E160-Q164 WeakPolarHBondContact O-CB 3.37Å; E160-Q164 PolarHBondContact O-N 3.07Å; M161-Q164 PolarHBondContact O-N 3.21Å; Q164-L166 VanDerWaalsContact C-N 3.32Å; Q164-L166 PolarHBondContact O-N 3.42Å; Q164-R167 PolarHBondContact O-N 2.69Å; Q164-S168 WeakPolarHBondContact O-CB 3.34Å; Q164-S168 PolarHBondContact O-N 3.35Å
165	E	70.3	Confident	73.5	Confident	107 Å²	107	100.9 Å²	100.9	50%	0.5	52%	0.517	S	S	.	.	H	α-helix	trans	-63.4	-37.5	176.5	-176.9	60.4	-166.3	0	0	111.7	M161 S168 R169	M161-E165 WeakPolarHBondContact O-CB 3.42Å; M161-E165 PolarHBondContact O-N 3.4Å; E165-S168 PolarHBondContact O-N 2.92Å; E165-R169 VanDerWaalsContact O-CB 3.31Å; E165-R169 WeakPolarHBondContact O-CB 3.32Å; E165-R169 PolarHBondContact O-N 2.76Å
166	L	70.1	Confident	74.1	Confident	109 Å²	109	101.6 Å²	101.6	57%	0.571	52%	0.515	S	S	*	.	H	α-helix	trans	-63.4	-44.8	174.4	-175.4	63.6	0	0	0	111.8	L162 Q163 Q164 R169 T170	L162-L166 VanDerWaalsContact O-CB 3.31Å; L162-L166 WeakPolarHBondContact O-CB 3.35Å; L162-L166 PolarHBondContact O-N 2.91Å; Q163-L166 PolarHBondContact O-N 2.86Å; Q164-L166 VanDerWaalsContact C-N 3.32Å; Q164-L166 PolarHBondContact O-N 3.42Å; L166-R169 PolarHBondContact O-N 3.21Å; L166-T170 PolarHBondContact O-N 3.01Å; L166-T170 PolarHBondContact O-OG1 3.32Å; L166-T170 VanDerWaalsContact O-OG1 3.14Å
167	R	71.5	Confident	74.3	Confident	174 Å²	174	104.3 Å²	104.3	66%	0.657	52%	0.522	S	S	*	.	H	α-helix	trans	-62.7	-45.2	175.6	-68.4	170	-159.4	-170.6	9.9	111.4	Q163 Q164 T170 S171	Q163-R167 VanDerWaalsContact O-CG 3.26Å; Q163-R167 WeakPolarHBondContact O-CG 3.41Å; Q163-R167 PolarHBondContact O-N 2.91Å; Q164-R167 PolarHBondContact O-N 2.69Å; R167-T170 PolarHBondContact O-N 2.65Å; R167-S171 PolarHBondContact O-N 3.3Å
168	S	67.3	Low	74.6	Confident	54 Å²	54	106.2 Å²	106.2	38%	0.378	53%	0.528	S	S	.	.	H	α-helix	trans	-56.4	-52	175.1	179.3	0	0	0	0	111.3	Q164 E165 T170 S171 L172	Q164-S168 WeakPolarHBondContact O-CB 3.34Å; Q164-S168 PolarHBondContact O-N 3.35Å; E165-S168 PolarHBondContact O-N 2.92Å; S168-T170 PolarHBondContact O-N 3.42Å; S168-S171 WeakPolarHBondContact O-CB 3.29Å; S168-S171 PolarHBondContact O-N 3.45Å; S168-L172 WeakPolarHBondContact O-CG 3.49Å; S168-L172 PolarHBondContact O-N 3.01Å
169	R	71.7	Confident	75.2	Confident	139 Å²	139	106.8 Å²	106.8	53%	0.525	53%	0.527	S	S	.	.	H	α-helix	trans	-59.6	-46.8	177.2	-178.4	-173.4	154.8	-167.6	-9.8	111.9	E165 L166 S171 L172 E173	E165-R169 VanDerWaalsContact O-CB 3.31Å; E165-R169 WeakPolarHBondContact O-CB 3.32Å; E165-R169 PolarHBondContact O-N 2.76Å; L166-R169 PolarHBondContact O-N 3.21Å; R169-S171 VanDerWaalsContact C-N 3.28Å; R169-S171 PolarHBondContact O-N 3.3Å; R169-L172 PolarHBondContact O-N 3.4Å; R169-E173 IonicContact CZ-OE2 2.89Å; R169-E173 VanDerWaalsContact CZ-OE2 3.28Å; R169-E173 IonicContact NE-OE2 3Å; R169-E173 PolarHBondContact NE-OE2 3.02Å; R169-E173 IonicContact NH2-OE1 2.95Å; R169-E173 IonicContact NH2-OE2 3.51Å; R169-E173 PolarHBondContact NH2-OE2 3.16Å; R169-E173 VanDerWaalsContact O-CB 3.27Å; R169-E173 WeakPolarHBondContact O-CB 3.3Å; R169-E173 PolarHBondContact O-N 3.17Å
170	T	73.1	Confident	74.9	Confident	78 Å²	78	106.7 Å²	106.7	48%	0.479	53%	0.528	S	S	.	.	H	α-helix	trans	-60	-40.2	178.6	-64.5	0	0	0	0	111.4	L166 R167 S168 E173 T174	L166-T170 PolarHBondContact O-N 3.01Å; L166-T170 PolarHBondContact O-OG1 3.32Å; L166-T170 VanDerWaalsContact O-OG1 3.14Å; R167-T170 PolarHBondContact O-N 2.65Å; S168-T170 PolarHBondContact O-N 3.42Å; T170-E173 PolarHBondContact O-N 3.4Å; T170-T174 PolarHBondContact O-N 2.68Å; T170-T174 PolarHBondContact O-OG1 2.7Å; T170-T174 VanDerWaalsContact O-OG1 3.11Å
171	S	76	Confident	75	Confident	78 Å²	78	105.6 Å²	105.6	55%	0.545	53%	0.527	S	S	.	.	H	α-helix	trans	-61	-46.3	174.5	-167.4	0	0	0	0	112.5	R167 S168 R169 E173 T174 Q175	R167-S171 PolarHBondContact O-N 3.3Å; S168-S171 WeakPolarHBondContact O-CB 3.29Å; S168-S171 PolarHBondContact O-N 3.45Å; R169-S171 VanDerWaalsContact C-N 3.28Å; R169-S171 PolarHBondContact O-N 3.3Å; S171-E173 VanDerWaalsContact C-N 3.35Å; S171-T174 PolarHBondContact O-N 3.32Å; S171-Q175 PolarHBondContact O-N 2.76Å
172	L	72.3	Confident	75.4	Confident	101 Å²	101	105.3 Å²	105.3	53%	0.529	52%	0.524	S	S	.	.	H	α-helix	trans	-68.4	-32.6	178.1	-69.1	169.8	0	0	0	112.6	S168 R169 K176	S168-L172 WeakPolarHBondContact O-CG 3.49Å; S168-L172 PolarHBondContact O-N 3.01Å; R169-L172 PolarHBondContact O-N 3.4Å; L172-K176 VanDerWaalsContact O-CB 3.28Å; L172-K176 WeakPolarHBondContact O-CB 3.4Å; L172-K176 PolarHBondContact O-N 2.94Å
173	E	73.7	Confident	75.5	Confident	89 Å²	89	102.9 Å²	102.9	42%	0.416	51%	0.514	S	S	.	.	H	α-helix	trans	-71.7	-34.8	177.4	-163.9	154.4	-176.6	0	0	111.1	R169 T170 S171 L177	R169-E173 IonicContact CZ-OE2 2.89Å; R169-E173 VanDerWaalsContact CZ-OE2 3.28Å; R169-E173 IonicContact NE-OE2 3Å; R169-E173 PolarHBondContact NE-OE2 3.02Å; R169-E173 IonicContact NH2-OE1 2.95Å; R169-E173 IonicContact NH2-OE2 3.51Å; R169-E173 PolarHBondContact NH2-OE2 3.16Å; R169-E173 VanDerWaalsContact O-CB 3.27Å; R169-E173 WeakPolarHBondContact O-CB 3.3Å; R169-E173 PolarHBondContact O-N 3.17Å; T170-E173 PolarHBondContact O-N 3.4Å; S171-E173 VanDerWaalsContact C-N 3.35Å; E173-L177 WeakPolarHBondContact O-CG 3.32Å; E173-L177 PolarHBondContact O-N 3.31Å
174	T	82.1	Confident	75.8	Confident	70 Å²	70	102.1 Å²	102.1	43%	0.429	52%	0.518	S	S	.	.	H	α-helix	trans	-65.3	-54.3	167	-57.6	0	0	0	0	111.8	T170 S171 K176 L177 D178	T170-T174 PolarHBondContact O-N 2.68Å; T170-T174 PolarHBondContact O-OG1 2.7Å; T170-T174 VanDerWaalsContact O-OG1 3.11Å; S171-T174 PolarHBondContact O-N 3.32Å; T174-K176 PolarHBondContact O-N 3Å; T174-K176 VanDerWaalsContact O-N 3.12Å; T174-L177 WeakPolarHBondContact O-CA 3.3Å; T174-L177 WeakPolarHBondContact O-CB 2.89Å; T174-L177 PolarHBondContact O-N 2.97Å; T174-D178 PolarHBondContact O-N 3.22Å
175	Q	74.9	Confident	76.2	Confident	108 Å²	108	102.4 Å²	102.4	51%	0.505	51%	0.514	S	S	.	.	H	α-helix	trans	-57.6	-33.8	-178.9	-170.5	-177.2	18	0	0	112.5	S171 L179	S171-Q175 PolarHBondContact O-N 2.76Å; Q175-L179 HydrophobicContact CG-CD1 4.49Å; Q175-L179 WeakPolarHBondContact O-CG 3.32Å; Q175-L179 PolarHBondContact O-N 2.96Å; Q175-L179 VanDerWaalsContact O-N 3.08Å
176	K	76.4	Confident	76.6	Confident	131 Å²	131	101.7 Å²	101.7	57%	0.57	51%	0.513	S	S	*	.	H	α-helix	trans	-65.7	-39.5	172.6	-177.7	-162.8	167.1	-158.9	0	112.4	L172 T174 M180	L172-K176 VanDerWaalsContact O-CB 3.28Å; L172-K176 WeakPolarHBondContact O-CB 3.4Å; L172-K176 PolarHBondContact O-N 2.94Å; T174-K176 PolarHBondContact O-N 3Å; T174-K176 VanDerWaalsContact O-N 3.12Å; K176-M180 HydrophobicContact CG-SD 4.4Å; K176-M180 WeakPolarHBondContact O-CB 3.39Å; K176-M180 VanDerWaalsContact O-CG 3.31Å; K176-M180 WeakPolarHBondContact O-CG 3.22Å; K176-M180 PolarHBondContact O-N 3Å
177	L	78	Confident	76.7	Confident	108 Å²	108	102.8 Å²	102.8	57%	0.565	51%	0.513	S	S	*	.	H	α-helix	trans	-65.5	-43.2	176.1	-74.1	163.9	0	0	0	110.8	E173 T174 L179 M180 D181	E173-L177 WeakPolarHBondContact O-CG 3.32Å; E173-L177 PolarHBondContact O-N 3.31Å; T174-L177 WeakPolarHBondContact O-CA 3.3Å; T174-L177 WeakPolarHBondContact O-CB 2.89Å; T174-L177 PolarHBondContact O-N 2.97Å; L177-L179 PolarHBondContact O-N 3.43Å; L177-M180 WeakPolarHBondContact O-CB 3.48Å; L177-M180 PolarHBondContact O-N 2.83Å; L177-M180 VanDerWaalsContact O-N 3.08Å; L177-D181 PolarHBondContact O-N 3.5Å
178	D	83.1	Confident	76.8	Confident	99 Å²	99	100 Å²	100	53%	0.529	51%	0.51	S	S	.	.	H	α-helix	trans	-58.9	-47.1	176.6	-53.9	-34.1	0	0	0	111.1	T174 M180 D181 E182	T174-D178 PolarHBondContact O-N 3.22Å; D178-M180 VanDerWaalsContact C-N 3.32Å; D178-M180 PolarHBondContact O-N 3.16Å; D178-D181 PolarHBondContact O-N 2.93Å; D178-E182 PolarHBondContact O-N 3.33Å
179	L	81.5	Confident	77.4	Confident	93 Å²	93	102.6 Å²	102.6	49%	0.487	52%	0.515	S	S	.	.	H	α-helix	trans	-65.2	-31.4	174.6	-72.1	169.6	0	0	0	113.2	Q175 L177 V183	Q175-L179 HydrophobicContact CG-CD1 4.49Å; Q175-L179 WeakPolarHBondContact O-CG 3.32Å; Q175-L179 PolarHBondContact O-N 2.96Å; Q175-L179 VanDerWaalsContact O-N 3.08Å; L177-L179 PolarHBondContact O-N 3.43Å; L179-V183 WeakPolarHBondContact O-CB 3.5Å; L179-V183 VanDerWaalsContact O-CG2 3.24Å; L179-V183 WeakPolarHBondContact O-CG2 3.26Å; L179-V183 PolarHBondContact O-N 3.41Å
180	M	71	Confident	77.2	Confident	102 Å²	102	100.7 Å²	100.7	50%	0.502	52%	0.515	S	S	.	.	H	α-helix	trans	-71.2	-32.5	174.3	-80.5	-179.2	55.8	0	0	112.3	K176 L177 D178 S184	K176-M180 HydrophobicContact CG-SD 4.4Å; K176-M180 WeakPolarHBondContact O-CB 3.39Å; K176-M180 VanDerWaalsContact O-CG 3.31Å; K176-M180 WeakPolarHBondContact O-CG 3.22Å; K176-M180 PolarHBondContact O-N 3Å; L177-M180 WeakPolarHBondContact O-CB 3.48Å; L177-M180 PolarHBondContact O-N 2.83Å; L177-M180 VanDerWaalsContact O-N 3.08Å; D178-M180 VanDerWaalsContact C-N 3.32Å; D178-M180 PolarHBondContact O-N 3.16Å; M180-S184 WeakPolarHBondContact O-CB 3.22Å; M180-S184 PolarHBondContact O-N 3.11Å; M180-S184 VanDerWaalsContact O-N 3.13Å; M180-S184 PolarHBondContact O-OG 3.28Å
181	D	82.5	Confident	77.1	Confident	118 Å²	118	100.4 Å²	100.4	63%	0.631	51%	0.513	S	S	*	.	H	α-helix	trans	-71.8	-45.7	173	-164.4	56	0	0	0	111	L177 D178 V183 S184 Y185	L177-D181 PolarHBondContact O-N 3.5Å; D178-D181 PolarHBondContact O-N 2.93Å; D181-V183 PolarHBondContact O-N 2.82Å; D181-S184 CarbonylContact O-C 3.49Å; D181-S184 WeakPolarHBondContact O-CA 3.28Å; D181-S184 WeakPolarHBondContact O-CB 3.35Å; D181-S184 PolarHBondContact O-N 2.77Å; D181-Y185 PolarHBondContact O-N 3.46Å
182	E	86.7	Confident	76.8	Confident	113 Å²	113	100 Å²	100	53%	0.528	51%	0.508	S	S	.	.	H	α-helix	trans	-59.5	-43.5	175.4	-174.2	174.1	-150.1	0	0	112	D178 S184 Y185 L186	D178-E182 PolarHBondContact O-N 3.33Å; E182-S184 PolarHBondContact O-N 3.34Å; E182-Y185 PolarHBondContact O-N 2.94Å; E182-L186 HydrophobicContact CG-CD1 4.14Å; E182-L186 HydrophobicContact CG-CG 4.46Å; E182-L186 WeakPolarHBondContact O-CB 3.33Å; E182-L186 VanDerWaalsContact O-CG 3.29Å; E182-L186 WeakPolarHBondContact O-CG 3.42Å; E182-L186 PolarHBondContact O-N 3.06Å
183	V	74.3	Confident	76.3	Confident	71 Å²	71	100.8 Å²	100.8	43%	0.43	51%	0.51	S	S	.	.	H	α-helix	trans	-62.4	-31.9	173	165.9	0	0	0	0	112	L179 D181 K187	L179-V183 WeakPolarHBondContact O-CB 3.5Å; L179-V183 VanDerWaalsContact O-CG2 3.24Å; L179-V183 WeakPolarHBondContact O-CG2 3.26Å; L179-V183 PolarHBondContact O-N 3.41Å; D181-V183 PolarHBondContact O-N 2.82Å; V183-K187 HydrophobicContact CG1-CD 4.26Å; V183-K187 WeakPolarHBondContact O-CB 3.24Å; V183-K187 VanDerWaalsContact O-CG 3.23Å; V183-K187 WeakPolarHBondContact O-CG 3.47Å; V183-K187 PolarHBondContact O-N 2.61Å
184	S	79.5	Confident	75.6	Confident	65 Å²	65	102 Å²	102	46%	0.455	52%	0.515	S	S	.	.	H	α-helix	trans	-74.9	-40.8	177.4	-60.1	0	0	0	0	111.8	M180 D181 E182 K187 L188	M180-S184 WeakPolarHBondContact O-CB 3.22Å; M180-S184 PolarHBondContact O-N 3.11Å; M180-S184 VanDerWaalsContact O-N 3.13Å; M180-S184 PolarHBondContact O-OG 3.28Å; D181-S184 CarbonylContact O-C 3.49Å; D181-S184 WeakPolarHBondContact O-CA 3.28Å; D181-S184 WeakPolarHBondContact O-CB 3.35Å; D181-S184 PolarHBondContact O-N 2.77Å; E182-S184 PolarHBondContact O-N 3.34Å; S184-K187 PolarHBondContact O-N 3.43Å; S184-L188 PolarHBondContact O-N 2.81Å
185	Y	84.4	Confident	74.4	Confident	144 Å²	144	104.2 Å²	104.2	57%	0.565	52%	0.521	S	S	*	.	H	α-helix	trans	-61.4	-44.9	171.3	174.2	-107	0	0	0	112.1	D181 E182 K187 L188 K189	D181-Y185 PolarHBondContact O-N 3.46Å; E182-Y185 PolarHBondContact O-N 2.94Å; Y185-K187 PolarHBondContact O-N 3.45Å; Y185-L188 PolarHBondContact O-N 2.95Å; Y185-K189 WeakPolarHBondContact O-CB 3.35Å; Y185-K189 PolarHBondContact O-N 3.29Å
186	L	78.3	Confident	73.4	Confident	91 Å²	91	103.6 Å²	103.6	48%	0.476	53%	0.525	S	S	.	.	H	α-helix	trans	-64.4	-37.3	176	-71.9	172.6	0	0	0	112.4	E182 L190	E182-L186 HydrophobicContact CG-CD1 4.14Å; E182-L186 HydrophobicContact CG-CG 4.46Å; E182-L186 WeakPolarHBondContact O-CB 3.33Å; E182-L186 VanDerWaalsContact O-CG 3.29Å; E182-L186 WeakPolarHBondContact O-CG 3.42Å; E182-L186 PolarHBondContact O-N 3.06Å; L186-L190 WeakPolarHBondContact O-CB 3.28Å; L186-L190 PolarHBondContact O-N 3.45Å
187	K	72.6	Confident	72.1	Confident	132 Å²	132	106.9 Å²	106.9	57%	0.574	53%	0.533	S	S	*	.	H	α-helix	trans	-64.3	-45.2	172.1	-78.9	169.2	-178.9	174.8	0	112.3	V183 S184 Y185 K189 L190 V191	V183-K187 HydrophobicContact CG1-CD 4.26Å; V183-K187 WeakPolarHBondContact O-CB 3.24Å; V183-K187 VanDerWaalsContact O-CG 3.23Å; V183-K187 WeakPolarHBondContact O-CG 3.47Å; V183-K187 PolarHBondContact O-N 2.61Å; S184-K187 PolarHBondContact O-N 3.43Å; Y185-K187 PolarHBondContact O-N 3.45Å; K187-K189 VanDerWaalsContact C-N 3.33Å; K187-K189 PolarHBondContact O-N 2.71Å; K187-L190 WeakPolarHBondContact O-CB 3.48Å; K187-L190 PolarHBondContact O-N 3.15Å; K187-V191 WeakPolarHBondContact O-CG2 3.42Å; K187-V191 PolarHBondContact O-N 3.48Å
188	L	74.7	Confident	70.6	Confident	115 Å²	115	107.1 Å²	107.1	60%	0.602	54%	0.54	S	S	*	.	H	α-helix	trans	-60.3	-46.1	177.1	-177.6	61.5	0	0	0	110.6	S184 Y185 L190 V191 T192	S184-L188 PolarHBondContact O-N 2.81Å; Y185-L188 PolarHBondContact O-N 2.95Å; L188-L190 VanDerWaalsContact C-N 3.33Å; L188-L190 PolarHBondContact O-N 2.89Å; L188-V191 PolarHBondContact O-N 3.16Å; L188-T192 PolarHBondContact O-N 3.3Å; L188-T192 PolarHBondContact O-OG1 2.95Å; L188-T192 VanDerWaalsContact O-OG1 3.12Å
189	K	77.8	Confident	68.9	Low	109 Å²	109	109.1 Å²	109.1	47%	0.474	55%	0.55	S	S	.	.	H	α-helix	trans	-60.4	-39	175.4	-173.1	175.5	-179.3	178.6	0	112.7	Y185 K187 T192 M193	Y185-K189 WeakPolarHBondContact O-CB 3.35Å; Y185-K189 PolarHBondContact O-N 3.29Å; K187-K189 VanDerWaalsContact C-N 3.33Å; K187-K189 PolarHBondContact O-N 2.71Å; K189-T192 PolarHBondContact O-N 3.13Å; K189-M193 HydrophobicContact CG-SD 4.47Å; K189-M193 WeakPolarHBondContact O-CB 3.34Å; K189-M193 VanDerWaalsContact O-CG 3.31Å; K189-M193 WeakPolarHBondContact O-CG 3.48Å; K189-M193 PolarHBondContact O-N 3.28Å
190	L	68.3	Low	67.2	Low	99 Å²	99	109.8 Å²	109.8	52%	0.518	56%	0.558	S	S	.	*	H	α-helix	trans	-61.9	-47.3	174.3	-179.5	63.8	0	0	0	111.2	L186 K187 L188 T192 M193 E194	L186-L190 WeakPolarHBondContact O-CB 3.28Å; L186-L190 PolarHBondContact O-N 3.45Å; K187-L190 WeakPolarHBondContact O-CB 3.48Å; K187-L190 PolarHBondContact O-N 3.15Å; L188-L190 VanDerWaalsContact C-N 3.33Å; L188-L190 PolarHBondContact O-N 2.89Å; L190-T192 PolarHBondContact O-N 2.86Å; L190-M193 CarbonylContact O-C 3.46Å; L190-M193 WeakPolarHBondContact O-CA 3.46Å; L190-M193 WeakPolarHBondContact O-CB 3.41Å; L190-M193 PolarHBondContact O-N 3.18Å; L190-M193 VanDerWaalsContact O-N 3.09Å; L190-E194 WeakPolarHBondContact O-CG 3.49Å; L190-E194 PolarHBondContact O-N 3Å
191	V	71.9	Confident	65.7	Low	72 Å²	72	112.4 Å²	112.4	44%	0.436	57%	0.574	S	S	.	*	H	α-helix	trans	-60	-45.9	177.4	173.5	0	0	0	0	111.2	K187 L188 M193 E194 E195	K187-V191 WeakPolarHBondContact O-CG2 3.42Å; K187-V191 PolarHBondContact O-N 3.48Å; L188-V191 PolarHBondContact O-N 3.16Å; V191-M193 VanDerWaalsContact C-N 3.25Å; V191-M193 PolarHBondContact O-N 3.17Å; V191-E194 WeakPolarHBondContact O-CA 3.42Å; V191-E194 PolarHBondContact O-N 3.47Å; V191-E195 HydrophobicContact CG1-CG 4.46Å; V191-E195 PolarHBondContact O-N 3.25Å
192	T	68.6	Low	64.2	Low	71 Å²	71	112 Å²	112	44%	0.436	58%	0.578	S	S	.	*	H	α-helix	trans	-61.7	-33.1	175.3	-49.4	0	0	0	0	112.5	L188 K189 L190 E194 T196	L188-T192 PolarHBondContact O-N 3.3Å; L188-T192 PolarHBondContact O-OG1 2.95Å; L188-T192 VanDerWaalsContact O-OG1 3.12Å; K189-T192 PolarHBondContact O-N 3.13Å; L190-T192 PolarHBondContact O-N 2.86Å; T192-E194 VanDerWaalsContact C-N 3.35Å; T192-T196 WeakPolarHBondContact O-CG2 3.5Å; T192-T196 PolarHBondContact O-N 3.42Å; T192-T196 PolarHBondContact O-OG1 3.45Å
193	M	62.4	Low	62.1	Low	116 Å²	116	115 Å²	115	57%	0.571	59%	0.592	S	S	*	*	H	α-helix	trans	-74.9	-19.8	173.1	-73.6	-175.5	68.8	0	0	113.8	K189 L190 V191 T196 R197	K189-M193 HydrophobicContact CG-SD 4.47Å; K189-M193 WeakPolarHBondContact O-CB 3.34Å; K189-M193 VanDerWaalsContact O-CG 3.31Å; K189-M193 WeakPolarHBondContact O-CG 3.48Å; K189-M193 PolarHBondContact O-N 3.28Å; L190-M193 CarbonylContact O-C 3.46Å; L190-M193 WeakPolarHBondContact O-CA 3.46Å; L190-M193 WeakPolarHBondContact O-CB 3.41Å; L190-M193 PolarHBondContact O-N 3.18Å; L190-M193 VanDerWaalsContact O-N 3.09Å; V191-M193 VanDerWaalsContact C-N 3.25Å; V191-M193 PolarHBondContact O-N 3.17Å; M193-T196 WeakPolarHBondContact CA-OG1 3.5Å; M193-T196 PolarHBondContact O-OG1 3.1Å; M193-R197 WeakPolarHBondContact O-CB 3.36Å
194	E	58.5	Low	60.8	Low	114 Å²	114	118.3 Å²	118.3	53%	0.533	61%	0.607	S	S	.	*	H	α-helix	trans	-84.6	-42.2	172.3	-71.1	-174.1	146.6	0	0	111.6	L190 V191 T192 T196 R197 T198	L190-E194 WeakPolarHBondContact O-CG 3.49Å; L190-E194 PolarHBondContact O-N 3Å; V191-E194 WeakPolarHBondContact O-CA 3.42Å; V191-E194 PolarHBondContact O-N 3.47Å; T192-E194 VanDerWaalsContact C-N 3.35Å; E194-T196 VanDerWaalsContact C-N 3.34Å; E194-T196 PolarHBondContact O-N 3.4Å; E194-R197 CarbonylContact O-C 3.54Å; E194-R197 WeakPolarHBondContact O-CA 3.43Å; E194-R197 WeakPolarHBondContact O-CB 3.32Å; E194-R197 PolarHBondContact O-N 3.42Å; E194-T198 PolarHBondContact O-N 2.91Å; E194-T198 PolarHBondContact O-OG1 3.13Å
195	E	57.2	Low	59.3	Low	118 Å²	118	118.2 Å²	118.2	55%	0.551	61%	0.611	S	S	*	*	H	α-helix	trans	-59.7	-42.1	174.7	-70.5	-179	129.2	0	0	112.3	V191 R197 T198	V191-E195 HydrophobicContact CG1-CG 4.46Å; V191-E195 PolarHBondContact O-N 3.25Å; E195-R197 PolarHBondContact O-N 2.92Å; E195-T198 WeakPolarHBondContact CA-OG1 3.23Å; E195-T198 PolarHBondContact O-N 2.8Å; E195-T198 PolarHBondContact O-OG1 2.83Å
196	T	54.8	Low	57.6	Low	95 Å²	95	115 Å²	115	58%	0.583	61%	0.613	S	S	*	*	H	α-helix	trans	-66.7	-18.7	173.6	45.7	0	0	0	0	113.2	T192 M193 E194	T192-T196 WeakPolarHBondContact O-CG2 3.5Å; T192-T196 PolarHBondContact O-N 3.42Å; T192-T196 PolarHBondContact O-OG1 3.45Å; M193-T196 WeakPolarHBondContact CA-OG1 3.5Å; M193-T196 PolarHBondContact O-OG1 3.1Å; E194-T196 VanDerWaalsContact C-N 3.34Å; E194-T196 PolarHBondContact O-N 3.4Å
197	R	48.8	Very low	56.1	Low	200 Å²	200	116.8 Å²	116.8	76%	0.755	62%	0.624	S	S	*	*	H	α-helix	trans	-93.9	-20.8	179.3	-154.8	171.8	-163.9	157.1	5.3	113.4	M193 E194 E195 N199	M193-R197 WeakPolarHBondContact O-CB 3.36Å; E194-R197 CarbonylContact O-C 3.54Å; E194-R197 WeakPolarHBondContact O-CA 3.43Å; E194-R197 WeakPolarHBondContact O-CB 3.32Å; E194-R197 PolarHBondContact O-N 3.42Å; E195-R197 PolarHBondContact O-N 2.92Å; R197-N199 VanDerWaalsContact C-N 3.27Å; R197-N199 PolarHBondContact O-N 2.85Å
198	T	46.8	Very low	55	Low	113 Å²	113	112.9 Å²	112.9	69%	0.693	62%	0.616	S	S	*	*	H	α-helix	trans	-73.5	-14.2	173.7	39.2	0	0	0	0	114.3	E194 E195 T200	E194-T198 PolarHBondContact O-N 2.91Å; E194-T198 PolarHBondContact O-OG1 3.13Å; E195-T198 WeakPolarHBondContact CA-OG1 3.23Å; E195-T198 PolarHBondContact O-N 2.8Å; E195-T198 PolarHBondContact O-OG1 2.83Å; T198-T200 VanDerWaalsContact C-N 3.35Å; T198-T200 PolarHBondContact O-N 2.62Å
199	N	46.6	Very low	53.9	Low	140 Å²	140	114.8 Å²	114.8	75%	0.749	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	8.2	-177.4	-78.7	-32.2	0	0	0	115.3	R197	R197-N199 VanDerWaalsContact C-N 3.27Å; R197-N199 PolarHBondContact O-N 2.85Å
200	T	45.2	Very low	52.5	Low	108 Å²	108	115.3 Å²	115.3	66%	0.663	63%	0.627	S	S	*	*	S	Bend	trans	-122.4	93.5	179.6	56.5	0	0	0	0	113.8	T198	T198-T200 VanDerWaalsContact C-N 3.35Å; T198-T200 PolarHBondContact O-N 2.62Å
201	N	40.4	Very low	51.7	Low	157 Å²	157	115.7 Å²	115.7	84%	0.84	63%	0.63	S	S	*	*			trans	58	117.5	155.6	-140.6	21.9	0	0	0	119.5
202	P	49.5	Very low	50.9	Low	110 Å²	110	119.5 Å²	119.5	71%	0.714	64%	0.641	S	S	*	*			trans	-101.3	100.6	-173.7	36.8	-31.7	0	0	0	114.6
203	Q	44	Very low	50.2	Low	175 Å²	175	118.8 Å²	118.8	82%	0.818	64%	0.642	S	S	*	*	S	Bend	trans	-141	-28.8	169.2	-151.3	71.8	39.8	0	0	116
204	D	46.3	Very low	49.9	Very low	140 Å²	140	118.6 Å²	118.6	75%	0.749	64%	0.64	S	S	*	*			trans	-97.7	18.8	-173.6	-68.5	-63.3	0	0	0	115.8	A206	D204-A206 VanDerWaalsContact C-N 3.27Å; D204-A206 PolarHBondContact O-N 3.43Å; D204-A206 VanDerWaalsContact O-N 3.13Å
205	A	48.8	Very low	49.9	Very low	64 Å²	64	117.2 Å²	117.2	53%	0.529	64%	0.642	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.1	-9.2	-166.8	0	0	0	0	0	116.4	K209	A205-K209 WeakPolarHBondContact O-CD 3.31Å; A205-K209 WeakPolarHBondContact O-CG 3.49Å
206	A	48.4	Very low	50.1	Low	75 Å²	75	115.5 Å²	115.5	62%	0.62	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-65	-178.9	0	0	0	0	0	112.2	D204 A208 K209	D204-A206 VanDerWaalsContact C-N 3.27Å; D204-A206 PolarHBondContact O-N 3.43Å; D204-A206 VanDerWaalsContact O-N 3.13Å; A206-A208 VanDerWaalsContact C-N 3.29Å; A206-A208 PolarHBondContact O-N 3.2Å; A206-K209 PolarHBondContact O-N 3.45Å; A206-K209 VanDerWaalsContact O-N 3.11Å
207	N	47.1	Very low	50.6	Low	129 Å²	129	115 Å²	115	69%	0.69	64%	0.636	S	S	*	*	H	α-helix	trans	-64.6	-34	-173.6	-63.6	-7.4	0	0	0	112.2	K209 N210 N211	N207-K209 PolarHBondContact O-N 3.09Å; N207-N210 PolarHBondContact O-N 2.73Å; N207-N211 PolarHBondContact O-OD1 2.76Å
208	A	49.9	Very low	51.4	Low	50 Å²	50	110 Å²	110	41%	0.413	62%	0.624	S	S	.	*	H	α-helix	trans	-66.9	-16.3	178	0	0	0	0	0	114.4	A206 K212	A206-A208 VanDerWaalsContact C-N 3.29Å; A206-A208 PolarHBondContact O-N 3.2Å; A208-K212 WeakPolarHBondContact O-CB 3.4Å; A208-K212 WeakPolarHBondContact O-CD 3.46Å; A208-K212 VanDerWaalsContact O-CG 3.24Å; A208-K212 WeakPolarHBondContact O-CG 3.26Å
209	K	49.7	Very low	52.6	Low	156 Å²	156	109.6 Å²	109.6	68%	0.678	62%	0.617	S	S	*	*	H	α-helix	trans	-84.3	-41.1	176.9	-73.6	-178.2	-179.9	-179.1	0	112.4	A205 A206 N207 K212 A213	A205-K209 WeakPolarHBondContact O-CD 3.31Å; A205-K209 WeakPolarHBondContact O-CG 3.49Å; A206-K209 PolarHBondContact O-N 3.45Å; A206-K209 VanDerWaalsContact O-N 3.11Å; N207-K209 PolarHBondContact O-N 3.09Å; K209-K212 PolarHBondContact O-N 3.16Å; K209-A213 PolarHBondContact O-N 3.32Å
210	N	48.6	Very low	53.6	Low	119 Å²	119	107 Å²	107	64%	0.636	60%	0.602	S	S	*	*	H	α-helix	trans	-64.5	-52.4	-178.3	-136.4	49.6	0	0	0	110.7	N207 K212 A213 E214	N207-N210 PolarHBondContact O-N 2.73Å; N210-K212 PolarHBondContact O-N 2.92Å; N210-A213 PolarHBondContact O-N 3Å; N210-A213 VanDerWaalsContact O-N 3.09Å; N210-E214 PolarHBondContact O-N 3.23Å
211	N	52.1	Low	54.6	Low	108 Å²	108	104.7 Å²	104.7	58%	0.578	59%	0.59	S	S	*	*	H	α-helix	trans	-63.5	-27.3	-179.3	-59.5	25.4	0	0	0	112.7	N207 C215	N207-N211 PolarHBondContact O-OD1 2.76Å; N211-C215 WeakPolarHBondContact O-CB 3.45Å; N211-C215 PolarHBondContact O-N 3.07Å
212	K	54.2	Low	55.8	Low	152 Å²	152	103 Å²	103	66%	0.661	58%	0.578	S	S	*	*	H	α-helix	trans	-75.6	-40.2	173.6	-80.1	-177.2	178.7	-176.1	0	112.6	A208 K209 N210 V216	A208-K212 WeakPolarHBondContact O-CB 3.4Å; A208-K212 WeakPolarHBondContact O-CD 3.46Å; A208-K212 VanDerWaalsContact O-CG 3.24Å; A208-K212 WeakPolarHBondContact O-CG 3.26Å; K209-K212 PolarHBondContact O-N 3.16Å; N210-K212 PolarHBondContact O-N 2.92Å; K212-V216 WeakPolarHBondContact O-CG2 3.26Å; K212-V216 PolarHBondContact O-N 3.27Å
213	A	55.2	Low	56.5	Low	56 Å²	56	102.8 Å²	102.8	46%	0.463	57%	0.57	S	S	.	*	H	α-helix	trans	-62.8	-45.5	174.4	0	0	0	0	0	110.9	K209 N210 V216 V217	K209-A213 PolarHBondContact O-N 3.32Å; N210-A213 PolarHBondContact O-N 3Å; N210-A213 VanDerWaalsContact O-N 3.09Å; A213-V216 PolarHBondContact O-N 3.15Å; A213-V217 WeakPolarHBondContact O-CG2 3.26Å; A213-V217 PolarHBondContact O-N 3.47Å
214	E	55.3	Low	57.2	Low	112 Å²	112	100.2 Å²	100.2	52%	0.523	56%	0.558	S	S	.	*	H	α-helix	trans	-62.2	-44.6	176.8	-170.3	169.5	-145.9	0	0	112.1	N210 V216 V217 N218	N210-E214 PolarHBondContact O-N 3.23Å; E214-V216 PolarHBondContact O-N 2.96Å; E214-V217 PolarHBondContact O-N 3.39Å; E214-N218 WeakPolarHBondContact O-CB 3.41Å; E214-N218 PolarHBondContact O-N 3.16Å; E214-N218 PolarHBondContact O-ND2 3.41Å
215	C	58.5	Low	58.1	Low	84 Å²	84	98.7 Å²	98.7	57%	0.568	55%	0.546	S	S	*	.	H	α-helix	trans	-61.2	-40.3	174.9	-174.3	0	0	0	0	112.7	N211 L219	N211-C215 WeakPolarHBondContact O-CB 3.45Å; N211-C215 PolarHBondContact O-N 3.07Å; C215-L219 WeakPolarHBondContact O-CB 3.29Å; C215-L219 PolarHBondContact O-N 2.89Å
216	V	62.4	Low	58.6	Low	82 Å²	82	100.9 Å²	100.9	50%	0.497	55%	0.545	S	S	.	.	H	α-helix	trans	-69.4	-40.3	176.1	169.6	0	0	0	0	111.8	K212 A213 E214 L219 I220	K212-V216 WeakPolarHBondContact O-CG2 3.26Å; K212-V216 PolarHBondContact O-N 3.27Å; A213-V216 PolarHBondContact O-N 3.15Å; E214-V216 PolarHBondContact O-N 2.96Å; V216-L219 PolarHBondContact O-N 3.12Å; V216-I220 HydrophobicContact CG1-CD1 3.8Å; V216-I220 HydrophobicContact CG1-CG1 4.5Å; V216-I220 WeakPolarHBondContact O-CB 3.3Å; V216-I220 VanDerWaalsContact O-CG1 3.27Å; V216-I220 WeakPolarHBondContact O-CG1 3.49Å; V216-I220 PolarHBondContact O-N 3.03Å
217	V	65.2	Low	59	Low	85 Å²	85	103.5 Å²	103.5	52%	0.515	55%	0.546	S	S	.	.	H	α-helix	trans	-64.7	-41.2	175.7	169	0	0	0	0	111.2	A213 E214 I220 S221	A213-V217 WeakPolarHBondContact O-CG2 3.26Å; A213-V217 PolarHBondContact O-N 3.47Å; E214-V217 PolarHBondContact O-N 3.39Å; V217-I220 PolarHBondContact O-N 2.83Å; V217-S221 WeakPolarHBondContact O-CB 3.37Å; V217-S221 PolarHBondContact O-N 2.89Å; V217-S221 PolarHBondContact O-OG 3.48Å
218	N	65	Low	59.7	Low	96 Å²	96	100.5 Å²	100.5	51%	0.513	54%	0.535	S	S	.	.	H	α-helix	trans	-65.9	-43.7	176.2	-68.6	-11.2	0	0	0	111	E214 I220 S221 E222	E214-N218 WeakPolarHBondContact O-CB 3.41Å; E214-N218 PolarHBondContact O-N 3.16Å; E214-N218 PolarHBondContact O-ND2 3.41Å; N218-I220 PolarHBondContact O-N 3.32Å; N218-S221 PolarHBondContact O-N 2.97Å; N218-E222 WeakPolarHBondContact O-CB 3.36Å; N218-E222 PolarHBondContact O-N 2.9Å
219	L	71.5	Confident	60	Low	104 Å²	104	103 Å²	103	55%	0.545	54%	0.537	S	S	.	.	H	α-helix	trans	-62.2	-39.8	176.2	-179.8	62.6	0	0	0	112.6	C215 V216 L223	C215-L219 WeakPolarHBondContact O-CB 3.29Å; C215-L219 PolarHBondContact O-N 2.89Å; V216-L219 PolarHBondContact O-N 3.12Å; L219-L223 HydrophobicContact CD1-CD1 4.42Å; L219-L223 HydrophobicContact CG-CD1 4.26Å; L219-L223 WeakPolarHBondContact O-CB 3.31Å; L219-L223 WeakPolarHBondContact O-CG 3.31Å; L219-L223 PolarHBondContact O-N 3.46Å
220	I	67.9	Low	60.3	Low	86 Å²	86	102 Å²	102	44%	0.441	53%	0.532	S	S	.	.	H	α-helix	trans	-66	-41.4	173.9	-70.9	166.6	0	0	0	110.8	V216 V217 N218 L223 Q224	V216-I220 HydrophobicContact CG1-CD1 3.8Å; V216-I220 HydrophobicContact CG1-CG1 4.5Å; V216-I220 WeakPolarHBondContact O-CB 3.3Å; V216-I220 VanDerWaalsContact O-CG1 3.27Å; V216-I220 WeakPolarHBondContact O-CG1 3.49Å; V216-I220 PolarHBondContact O-N 3.03Å; V217-I220 PolarHBondContact O-N 2.83Å; N218-I220 PolarHBondContact O-N 3.32Å; I220-L223 PolarHBondContact O-N 2.88Å; I220-Q224 WeakPolarHBondContact O-CB 3.46Å; I220-Q224 WeakPolarHBondContact O-CG 3.29Å; I220-Q224 PolarHBondContact O-N 3.3Å
221	S	67.5	Low	60.6	Low	58 Å²	58	102.8 Å²	102.8	41%	0.406	53%	0.532	S	S	.	.	H	α-helix	trans	-64.7	-43.4	178.4	-55.7	0	0	0	0	111.6	V217 N218 Q224 E225	V217-S221 WeakPolarHBondContact O-CB 3.37Å; V217-S221 PolarHBondContact O-N 2.89Å; V217-S221 PolarHBondContact O-OG 3.48Å; N218-S221 PolarHBondContact O-N 2.97Å; S221-Q224 PolarHBondContact O-N 2.77Å; S221-E225 PolarHBondContact O-N 2.79Å
222	E	65.6	Low	60.8	Low	123 Å²	123	103.9 Å²	103.9	58%	0.575	53%	0.534	S	S	*	.	H	α-helix	trans	-69.6	-36.4	177.9	-172	156.2	-156.1	0	0	111.8	N218 Q224 E225 Q226	N218-E222 WeakPolarHBondContact O-CB 3.36Å; N218-E222 PolarHBondContact O-N 2.9Å; E222-Q224 VanDerWaalsContact C-N 3.34Å; E222-Q224 PolarHBondContact O-N 2.72Å; E222-E225 PolarHBondContact O-N 2.94Å; E222-Q226 WeakPolarHBondContact O-CB 3.48Å; E222-Q226 WeakPolarHBondContact O-CG 3.47Å; E222-Q226 PolarHBondContact O-N 3.5Å
223	L	63.7	Low	61.1	Low	104 Å²	104	100.8 Å²	100.8	55%	0.545	52%	0.522	S	S	.	.	H	α-helix	trans	-62.8	-38.4	169.3	-80.5	166.7	0	0	0	112.5	L219 I220 M227	L219-L223 HydrophobicContact CD1-CD1 4.42Å; L219-L223 HydrophobicContact CG-CD1 4.26Å; L219-L223 WeakPolarHBondContact O-CB 3.31Å; L219-L223 WeakPolarHBondContact O-CG 3.31Å; L219-L223 PolarHBondContact O-N 3.46Å; I220-L223 PolarHBondContact O-N 2.88Å; L223-M227 WeakPolarHBondContact O-CB 3.45Å; L223-M227 WeakPolarHBondContact O-CG 3.16Å; L223-M227 PolarHBondContact O-N 3.13Å
224	Q	58.1	Low	61.3	Low	121 Å²	121	102 Å²	102	57%	0.565	52%	0.519	S	S	*	.	H	α-helix	trans	-67.8	-41.1	174.3	-76.4	177.1	-16.4	0	0	111.8	I220 S221 E222 M227 C228	I220-Q224 WeakPolarHBondContact O-CB 3.46Å; I220-Q224 WeakPolarHBondContact O-CG 3.29Å; I220-Q224 PolarHBondContact O-N 3.3Å; S221-Q224 PolarHBondContact O-N 2.77Å; E222-Q224 VanDerWaalsContact C-N 3.34Å; E222-Q224 PolarHBondContact O-N 2.72Å; Q224-M227 PolarHBondContact O-N 3.4Å; Q224-C228 PolarHBondContact O-N 3.25Å; Q224-C228 PolarHBondContact O-SG 3.13Å; Q224-C228 VanDerWaalsContact O-SG 3.37Å
225	E	65.9	Low	61.2	Low	109 Å²	109	99.6 Å²	99.6	51%	0.509	52%	0.515	S	S	.	.	H	α-helix	trans	-66.6	-39.1	176.5	-162.7	-176.8	150.4	0	0	111.9	S221 E222 C228 K229	S221-E225 PolarHBondContact O-N 2.79Å; E222-E225 PolarHBondContact O-N 2.94Å; E225-C228 PolarHBondContact O-N 3.44Å; E225-K229 HydrophobicContact CG-CD 4.45Å; E225-K229 WeakPolarHBondContact O-CB 3.28Å; E225-K229 WeakPolarHBondContact O-CG 3.37Å; E225-K229 PolarHBondContact O-N 3.11Å; E225-K229 WeakPolarHBondContact OE1-CE 3.32Å; E225-K229 IonicContact OE1-NZ 3.51Å; E225-K229 PolarHBondContact OE1-NZ 3.23Å
226	Q	58	Low	61.4	Low	109 Å²	109	98.9 Å²	98.9	51%	0.509	51%	0.508	S	S	.	.	H	α-helix	trans	-61.3	-44.4	170.7	-71.4	-72.5	-23.9	0	0	111.6	E222 K229 F230	E222-Q226 WeakPolarHBondContact O-CB 3.48Å; E222-Q226 WeakPolarHBondContact O-CG 3.47Å; E222-Q226 PolarHBondContact O-N 3.5Å; Q226-K229 PolarHBondContact O-N 3.24Å; Q226-F230 WeakPolarHBondContact O-CB 3.46Å; Q226-F230 PolarHBondContact O-N 3.38Å
227	M	56.9	Low	61.3	Low	130 Å²	130	102.2 Å²	102.2	64%	0.64	51%	0.512	S	S	*	.	H	α-helix	trans	-63.1	-41.6	175.8	-79	-169.7	67.7	0	0	112.8	L223 Q224 F230 Q231	L223-M227 WeakPolarHBondContact O-CB 3.45Å; L223-M227 WeakPolarHBondContact O-CG 3.16Å; L223-M227 PolarHBondContact O-N 3.13Å; Q224-M227 PolarHBondContact O-N 3.4Å; M227-F230 PolarHBondContact O-N 3.33Å; M227-Q231 WeakPolarHBondContact O-CG 3.45Å; M227-Q231 PolarHBondContact O-N 3.31Å
228	C	61.6	Low	61.2	Low	67 Å²	67	102.3 Å²	102.3	45%	0.453	51%	0.508	S	S	.	.	H	α-helix	trans	-61.9	-48.8	175	-72	0	0	0	0	111.4	Q224 E225 F230 Q231 E232	Q224-C228 PolarHBondContact O-N 3.25Å; Q224-C228 PolarHBondContact O-SG 3.13Å; Q224-C228 VanDerWaalsContact O-SG 3.37Å; E225-C228 PolarHBondContact O-N 3.44Å; C228-F230 VanDerWaalsContact C-N 3.28Å; C228-F230 PolarHBondContact O-N 3.07Å; C228-Q231 PolarHBondContact O-N 3.32Å; C228-Q231 VanDerWaalsContact O-N 3.12Å; C228-E232 WeakPolarHBondContact O-CG 3.49Å; C228-E232 PolarHBondContact O-N 3.22Å
229	K	57.6	Low	60.6	Low	103 Å²	103	103.4 Å²	103.4	45%	0.448	51%	0.511	S	S	.	.	H	α-helix	trans	-59.3	-37.8	176.2	-73.2	169.8	-176.1	167.3	0	112.3	E225 Q226 E232 E233	E225-K229 HydrophobicContact CG-CD 4.45Å; E225-K229 WeakPolarHBondContact O-CB 3.28Å; E225-K229 WeakPolarHBondContact O-CG 3.37Å; E225-K229 PolarHBondContact O-N 3.11Å; E225-K229 WeakPolarHBondContact OE1-CE 3.32Å; E225-K229 IonicContact OE1-NZ 3.51Å; E225-K229 PolarHBondContact OE1-NZ 3.23Å; Q226-K229 PolarHBondContact O-N 3.24Å; K229-E232 PolarHBondContact O-N 2.96Å; K229-E233 WeakPolarHBondContact O-CB 3.4Å; K229-E233 PolarHBondContact O-N 3.28Å
230	F	56.5	Low	60.1	Low	134 Å²	134	103.4 Å²	103.4	59%	0.588	51%	0.508	S	S	*	.	H	α-helix	trans	-70.2	-35.8	176.5	-155.3	-107.5	0	0	0	112.3	Q226 M227 C228 I234	Q226-F230 WeakPolarHBondContact O-CB 3.46Å; Q226-F230 PolarHBondContact O-N 3.38Å; M227-F230 PolarHBondContact O-N 3.33Å; C228-F230 VanDerWaalsContact C-N 3.28Å; C228-F230 PolarHBondContact O-N 3.07Å; F230-I234 HydrophobicContact CD1-CD1 3.65Å; F230-I234 HydrophobicContact CD1-CG1 4.47Å; F230-I234 HydrophobicContact CE1-CD1 3.68Å; F230-I234 HydrophobicContact CE1-CG1 4.49Å; F230-I234 WeakPolarHBondContact O-CB 3.49Å; F230-I234 WeakPolarHBondContact O-CD1 3.44Å; F230-I234 VanDerWaalsContact O-CG1 3.23Å; F230-I234 WeakPolarHBondContact O-CG1 3.34Å; F230-I234 PolarHBondContact O-N 2.98Å
231	Q	53.3	Low	59.7	Low	136 Å²	136	105.4 Å²	105.4	64%	0.636	51%	0.513	S	S	*	.	H	α-helix	trans	-67.5	-39.8	170.9	-73.9	-167.9	-67	0	0	112.4	M227 C228 I234 S235	M227-Q231 WeakPolarHBondContact O-CG 3.45Å; M227-Q231 PolarHBondContact O-N 3.31Å; C228-Q231 PolarHBondContact O-N 3.32Å; C228-Q231 VanDerWaalsContact O-N 3.12Å; Q231-I234 PolarHBondContact O-N 3.32Å; Q231-S235 WeakPolarHBondContact O-CB 3.31Å; Q231-S235 PolarHBondContact O-N 2.91Å
232	E	56.5	Low	59.5	Low	130 Å²	130	109.5 Å²	109.5	61%	0.607	52%	0.52	S	S	*	.	H	α-helix	trans	-67.1	-41.8	175.7	-72.6	-176.9	154.4	0	0	111.8	C228 K229 S235 T236	C228-E232 WeakPolarHBondContact O-CG 3.49Å; C228-E232 PolarHBondContact O-N 3.22Å; K229-E232 PolarHBondContact O-N 2.96Å; E232-S235 PolarHBondContact O-N 3.49Å; E232-T236 WeakPolarHBondContact O-CB 3.34Å; E232-T236 PolarHBondContact O-N 2.93Å; E232-T236 PolarHBondContact O-OG1 3.4Å
233	E	61.3	Low	59.1	Low	88 Å²	88	105.8 Å²	105.8	41%	0.411	51%	0.51	S	S	.	.	H	α-helix	trans	-62.9	-48	173.2	-174.2	173.8	-175.9	0	0	110.8	K229 S235 T236 R237	K229-E233 WeakPolarHBondContact O-CB 3.4Å; K229-E233 PolarHBondContact O-N 3.28Å; E233-S235 VanDerWaalsContact C-N 3.31Å; E233-S235 PolarHBondContact O-N 3.27Å; E233-T236 PolarHBondContact O-N 2.94Å; E233-T236 VanDerWaalsContact O-N 3.15Å; E233-R237 HydrophobicContact CG-CG 4.02Å; E233-R237 WeakPolarHBondContact O-CB 3.43Å; E233-R237 WeakPolarHBondContact O-CG 3.19Å; E233-R237 PolarHBondContact O-N 3.42Å; E233-R237 IonicContact OE1-CZ 3.12Å; E233-R237 VanDerWaalsContact OE1-CZ 3.32Å; E233-R237 IonicContact OE1-NE 2.73Å; E233-R237 PolarHBondContact OE1-NE 3.22Å; E233-R237 VanDerWaalsContact OE1-NE 3.12Å; E233-R237 IonicContact OE1-NH2 2.7Å; E233-R237 PolarHBondContact OE1-NH2 3.39Å
234	I	59.6	Low	58.9	Low	81 Å²	81	105.6 Å²	105.6	42%	0.415	51%	0.509	S	S	.	.	H	α-helix	trans	-56.7	-45.3	175.8	-73.8	168.3	0	0	0	111.1	F230 Q231 T236 I238	F230-I234 HydrophobicContact CD1-CD1 3.65Å; F230-I234 HydrophobicContact CD1-CG1 4.47Å; F230-I234 HydrophobicContact CE1-CD1 3.68Å; F230-I234 HydrophobicContact CE1-CG1 4.49Å; F230-I234 WeakPolarHBondContact O-CB 3.49Å; F230-I234 WeakPolarHBondContact O-CD1 3.44Å; F230-I234 VanDerWaalsContact O-CG1 3.23Å; F230-I234 WeakPolarHBondContact O-CG1 3.34Å; F230-I234 PolarHBondContact O-N 2.98Å; Q231-I234 PolarHBondContact O-N 3.32Å; I234-T236 PolarHBondContact O-N 3.33Å; I234-I238 HydrophobicContact CG2-CD1 3.66Å; I234-I238 WeakPolarHBondContact O-CB 3.02Å; I234-I238 WeakPolarHBondContact O-CD1 3.49Å; I234-I238 WeakPolarHBondContact O-CG1 3.36Å; I234-I238 PolarHBondContact O-N 3.44Å
235	S	53.2	Low	58.9	Low	61 Å²	61	103.9 Å²	103.9	43%	0.427	50%	0.501	S	S	.	.	H	α-helix	trans	-62.4	-42.8	177.6	-172.8	0	0	0	0	111.9	Q231 E232 E233 I238 Q239	Q231-S235 WeakPolarHBondContact O-CB 3.31Å; Q231-S235 PolarHBondContact O-N 2.91Å; E232-S235 PolarHBondContact O-N 3.49Å; E233-S235 VanDerWaalsContact C-N 3.31Å; E233-S235 PolarHBondContact O-N 3.27Å; S235-I238 PolarHBondContact O-N 3.05Å; S235-Q239 PolarHBondContact O-N 3.35Å
236	T	62.4	Low	58.3	Low	70 Å²	70	104.8 Å²	104.8	43%	0.429	51%	0.506	S	S	.	.	H	α-helix	trans	-64.4	-49.7	178.8	-55.8	0	0	0	0	110.7	E232 E233 I234 I238 Q239 E240	E232-T236 WeakPolarHBondContact O-CB 3.34Å; E232-T236 PolarHBondContact O-N 2.93Å; E232-T236 PolarHBondContact O-OG1 3.4Å; E233-T236 PolarHBondContact O-N 2.94Å; E233-T236 VanDerWaalsContact O-N 3.15Å; I234-T236 PolarHBondContact O-N 3.33Å; T236-I238 VanDerWaalsContact C-N 3.26Å; T236-I238 PolarHBondContact O-N 3.1Å; T236-Q239 CarbonylContact O-C 3.59Å; T236-Q239 WeakPolarHBondContact O-CA 3.47Å; T236-Q239 WeakPolarHBondContact O-CB 3.46Å; T236-Q239 PolarHBondContact O-N 2.85Å; T236-E240 HydrophobicContact CG2-CG 4.4Å; T236-E240 WeakPolarHBondContact O-CG 3.46Å; T236-E240 PolarHBondContact O-N 3.25Å
237	R	60.8	Low	58	Low	151 Å²	151	106.3 Å²	106.3	57%	0.57	51%	0.51	S	S	*	.	H	α-helix	trans	-60	-34.3	176.4	-61.6	-72	-164.8	126.5	10.4	112.2	E233 K241	E233-R237 HydrophobicContact CG-CG 4.02Å; E233-R237 WeakPolarHBondContact O-CB 3.43Å; E233-R237 WeakPolarHBondContact O-CG 3.19Å; E233-R237 PolarHBondContact O-N 3.42Å; E233-R237 IonicContact OE1-CZ 3.12Å; E233-R237 VanDerWaalsContact OE1-CZ 3.32Å; E233-R237 IonicContact OE1-NE 2.73Å; E233-R237 PolarHBondContact OE1-NE 3.22Å; E233-R237 VanDerWaalsContact OE1-NE 3.12Å; E233-R237 IonicContact OE1-NH2 2.7Å; E233-R237 PolarHBondContact OE1-NH2 3.39Å; R237-K241 VanDerWaalsContact O-CB 3.24Å; R237-K241 WeakPolarHBondContact O-CB 3.45Å; R237-K241 PolarHBondContact O-N 3.19Å
238	I	62.3	Low	57.7	Low	87 Å²	87	107.1 Å²	107.1	45%	0.446	51%	0.513	S	S	.	.	H	α-helix	trans	-73.2	-25.4	175	-71.9	169.7	0	0	0	112.4	I234 S235 T236 R242	I234-I238 HydrophobicContact CG2-CD1 3.66Å; I234-I238 WeakPolarHBondContact O-CB 3.02Å; I234-I238 WeakPolarHBondContact O-CD1 3.49Å; I234-I238 WeakPolarHBondContact O-CG1 3.36Å; I234-I238 PolarHBondContact O-N 3.44Å; S235-I238 PolarHBondContact O-N 3.05Å; T236-I238 VanDerWaalsContact C-N 3.26Å; T236-I238 PolarHBondContact O-N 3.1Å; I238-R242 PolarHBondContact O-N 2.93Å; I238-R242 PolarHBondContact O-NE 2.98Å; I238-R242 VanDerWaalsContact O-NE 3.17Å
239	Q	53	Low	57.2	Low	119 Å²	119	108.1 Å²	108.1	56%	0.556	53%	0.525	S	S	*	.	H	α-helix	trans	-80.8	-43.9	170.3	-74.1	-178.6	-60.6	0	0	111.6	S235 T236 K241 R242 A243	S235-Q239 PolarHBondContact O-N 3.35Å; T236-Q239 CarbonylContact O-C 3.59Å; T236-Q239 WeakPolarHBondContact O-CA 3.47Å; T236-Q239 WeakPolarHBondContact O-CB 3.46Å; T236-Q239 PolarHBondContact O-N 2.85Å; Q239-K241 PolarHBondContact O-N 2.64Å; Q239-R242 PolarHBondContact O-N 2.64Å; Q239-A243 WeakPolarHBondContact O-CB 3.48Å; Q239-A243 PolarHBondContact O-N 3.23Å
240	E	59.9	Low	56.7	Low	105 Å²	105	110.7 Å²	110.7	49%	0.491	54%	0.539	S	S	.	.	H	α-helix	trans	-58	-46	173.6	-70.6	-179.2	140.4	0	0	111.6	T236 R242 A243 L244	T236-E240 HydrophobicContact CG2-CG 4.4Å; T236-E240 WeakPolarHBondContact O-CG 3.46Å; T236-E240 PolarHBondContact O-N 3.25Å; E240-R242 VanDerWaalsContact C-N 3.33Å; E240-R242 PolarHBondContact O-N 2.92Å; E240-A243 PolarHBondContact O-N 2.9Å; E240-L244 WeakPolarHBondContact O-CG 3.46Å; E240-L244 PolarHBondContact O-N 3.03Å
241	K	60.4	Low	56.2	Low	127 Å²	127	112.4 Å²	112.4	55%	0.552	55%	0.549	S	S	*	.	H	α-helix	trans	-61.3	-40.5	177.1	-169.9	172.1	-169.2	-71	0	112	R237 Q239 L244 E245	R237-K241 VanDerWaalsContact O-CB 3.24Å; R237-K241 WeakPolarHBondContact O-CB 3.45Å; R237-K241 PolarHBondContact O-N 3.19Å; Q239-K241 PolarHBondContact O-N 2.64Å; K241-L244 PolarHBondContact O-N 3.48Å; K241-E245 IonicContact NZ-OE1 3.66Å; K241-E245 PolarHBondContact NZ-OE1 3.06Å; K241-E245 WeakPolarHBondContact O-CB 3.39Å; K241-E245 VanDerWaalsContact O-CG 3.25Å; K241-E245 WeakPolarHBondContact O-CG 3.48Å; K241-E245 PolarHBondContact O-N 3.12Å
242	R	61.9	Low	55.2	Low	145 Å²	145	109.5 Å²	109.5	55%	0.547	56%	0.556	S	S	.	*	H	α-helix	trans	-70.5	-35.3	175.3	-79.3	-174.1	-74.1	176.2	-1.5	113.1	I238 Q239 E240 L244 E245 E246	I238-R242 PolarHBondContact O-N 2.93Å; I238-R242 PolarHBondContact O-NE 2.98Å; I238-R242 VanDerWaalsContact O-NE 3.17Å; Q239-R242 PolarHBondContact O-N 2.64Å; E240-R242 VanDerWaalsContact C-N 3.33Å; E240-R242 PolarHBondContact O-N 2.92Å; R242-L244 VanDerWaalsContact C-N 3.28Å; R242-L244 PolarHBondContact O-N 3.12Å; R242-E245 PolarHBondContact O-N 3.3Å; R242-E246 WeakPolarHBondContact O-CB 3.38Å; R242-E246 WeakPolarHBondContact O-CG 3.39Å; R242-E246 PolarHBondContact O-N 3.47Å
243	A	59.1	Low	54.3	Low	45 Å²	45	110.6 Å²	110.6	37%	0.372	57%	0.566	S	S	.	*	H	α-helix	trans	-71.3	-22.6	173.8	0	0	0	0	0	113.1	Q239 E240 K247	Q239-A243 WeakPolarHBondContact O-CB 3.48Å; Q239-A243 PolarHBondContact O-N 3.23Å; E240-A243 PolarHBondContact O-N 2.9Å; A243-K247 VanDerWaalsContact O-CG 3.31Å; A243-K247 WeakPolarHBondContact O-CG 3.29Å; A243-K247 PolarHBondContact O-N 3.1Å
244	L	58	Low	53.3	Low	100 Å²	100	112.1 Å²	112.1	52%	0.524	58%	0.583	S	S	.	*	H	α-helix	trans	-77.5	-46.6	167.9	-74.9	163.3	0	0	0	110.9	E240 K241 R242 E246 K247 E248	E240-L244 WeakPolarHBondContact O-CG 3.46Å; E240-L244 PolarHBondContact O-N 3.03Å; K241-L244 PolarHBondContact O-N 3.48Å; R242-L244 VanDerWaalsContact C-N 3.28Å; R242-L244 PolarHBondContact O-N 3.12Å; L244-E246 VanDerWaalsContact C-N 3.3Å; L244-E246 PolarHBondContact O-N 3.37Å; L244-K247 WeakPolarHBondContact O-CA 3.48Å; L244-K247 WeakPolarHBondContact O-CB 3.16Å; L244-K247 PolarHBondContact O-N 3.02Å; L244-E248 PolarHBondContact O-N 2.89Å
245	E	57.9	Low	52.2	Low	84 Å²	84	114.5 Å²	114.5	39%	0.393	61%	0.607	S	S	.	*	H	α-helix	trans	-58.6	-38.2	174.8	-72.3	163.9	172.4	0	0	112.1	K241 R242 A249	K241-E245 IonicContact NZ-OE1 3.66Å; K241-E245 PolarHBondContact NZ-OE1 3.06Å; K241-E245 WeakPolarHBondContact O-CB 3.39Å; K241-E245 VanDerWaalsContact O-CG 3.25Å; K241-E245 WeakPolarHBondContact O-CG 3.48Å; K241-E245 PolarHBondContact O-N 3.12Å; R242-E245 PolarHBondContact O-N 3.3Å; E245-A249 VanDerWaalsContact O-CB 3.26Å; E245-A249 WeakPolarHBondContact O-CB 3.49Å; E245-A249 PolarHBondContact O-N 2.84Å
246	E	53.3	Low	51	Low	129 Å²	129	115 Å²	115	60%	0.603	62%	0.622	S	S	*	*	H	α-helix	trans	-68.6	-30.7	173	-77.4	-175	147.1	0	0	113.4	R242 L244 Q250	R242-E246 WeakPolarHBondContact O-CB 3.38Å; R242-E246 WeakPolarHBondContact O-CG 3.39Å; R242-E246 PolarHBondContact O-N 3.47Å; L244-E246 VanDerWaalsContact C-N 3.3Å; L244-E246 PolarHBondContact O-N 3.37Å; E246-Q250 VanDerWaalsContact O-CD 3.25Å; E246-Q250 VanDerWaalsContact O-CG 3.26Å; E246-Q250 WeakPolarHBondContact O-CG 3.35Å; E246-Q250 PolarHBondContact O-N 3.3Å; E246-Q250 PolarHBondContact O-NE2 3.08Å
247	K	52.7	Low	49.4	Very low	141 Å²	141	119.4 Å²	119.4	61%	0.613	64%	0.643	S	S	*	*	H	α-helix	trans	-75.8	-41.5	174.9	-79.7	175.2	178.2	179.4	0	112.2	A243 L244 A249 Q250 Q251	A243-K247 VanDerWaalsContact O-CG 3.31Å; A243-K247 WeakPolarHBondContact O-CG 3.29Å; A243-K247 PolarHBondContact O-N 3.1Å; L244-K247 WeakPolarHBondContact O-CA 3.48Å; L244-K247 WeakPolarHBondContact O-CB 3.16Å; L244-K247 PolarHBondContact O-N 3.02Å; K247-A249 VanDerWaalsContact C-N 3.3Å; K247-A249 PolarHBondContact O-N 2.91Å; K247-Q250 CarbonylContact O-C 3.54Å; K247-Q250 PolarHBondContact O-N 2.74Å; K247-Q251 PolarHBondContact O-N 2.86Å
248	E	51.2	Low	48.4	Very low	147 Å²	147	117.6 Å²	117.6	69%	0.687	65%	0.65	S	S	*	*	H	α-helix	trans	-63.2	-38.6	173.9	-70.1	179	162.6	0	0	110.7	L244 Q250 Q251	L244-E248 PolarHBondContact O-N 2.89Å; E248-Q250 PolarHBondContact O-N 3.49Å; E248-Q250 VanDerWaalsContact O-N 3.12Å; E248-Q251 PolarHBondContact O-N 3.38Å
249	A	49.7	Very low	46.9	Very low	87 Å²	87	119.7 Å²	119.7	72%	0.719	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-9	172.1	0	0	0	0	0	114.8	E245 K247	E245-A249 VanDerWaalsContact O-CB 3.26Å; E245-A249 WeakPolarHBondContact O-CB 3.49Å; E245-A249 PolarHBondContact O-N 2.84Å; K247-A249 VanDerWaalsContact C-N 3.3Å; K247-A249 PolarHBondContact O-N 2.91Å
250	Q	47.1	Very low	45.8	Very low	158 Å²	158	123 Å²	123	74%	0.738	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.2	8.7	179.3	-68.6	167.9	24.4	0	0	112.6	E246 K247 E248	E246-Q250 VanDerWaalsContact O-CD 3.25Å; E246-Q250 VanDerWaalsContact O-CG 3.26Å; E246-Q250 WeakPolarHBondContact O-CG 3.35Å; E246-Q250 PolarHBondContact O-N 3.3Å; E246-Q250 PolarHBondContact O-NE2 3.08Å; K247-Q250 CarbonylContact O-C 3.54Å; K247-Q250 PolarHBondContact O-N 2.74Å; E248-Q250 PolarHBondContact O-N 3.49Å; E248-Q250 VanDerWaalsContact O-N 3.12Å
251	Q	45.6	Very low	44.2	Very low	170 Å²	170	123.1 Å²	123.1	79%	0.794	70%	0.695	S	S	*	*			trans	-138	59	-177.3	-166.3	148.6	86.7	0	0	112	K247 E248	K247-Q251 PolarHBondContact O-N 2.86Å; E248-Q251 PolarHBondContact O-N 3.38Å
252	G	34	Very low	42.7	Very low	75 Å²	75	120.9 Å²	120.9	77%	0.773	70%	0.7	S	S	*	*			trans	-132.8	101.1	170.9	0	0	0	0	0	110.7
253	D	36.8	Very low	41.2	Very low	153 Å²	153	121.2 Å²	121.2	82%	0.818	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-81.3	160.4	-161.3	-94.1	-39.1	0	0	0	116.6
254	P	41.2	Very low	40.9	Very low	119 Å²	119	123.9 Å²	123.9	77%	0.773	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-77.1	160.1	167.8	34.6	-34.8	0	0	0	112.5
255	S	34.8	Very low	39.4	Very low	132 Å²	132	126.3 Å²	126.3	92%	0.923	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-96.8	135.1	-175.7	-170.8	0	0	0	0	113.7
256	G	28.6	Very low	38.1	Very low	72 Å²	72	126.8 Å²	126.8	74%	0.742	76%	0.758	S	S	*	*			trans	-178.4	115.4	172.3	0	0	0	0	0	115.8
257	N	28.5	Very low	37	Very low	162 Å²	162	124.1 Å²	124.1	87%	0.866	77%	0.765	S	S	*	*			trans	-63.7	173.4	172.7	-72.1	-38.8	0	0	0	113.7
258	P	39.8	Very low	35.9	Very low	112 Å²	112	123.1 Å²	123.1	73%	0.727	78%	0.776	S	S	*	*			cis	-141.3	164.9	12.5	41.3	-22.2	0	0	0	119.5
259	V	31.3	Very low	35	Very low	132 Å²	132	124 Å²	124	80%	0.8	79%	0.785	S	S	*	*			trans	13.4	123.7	141.4	-175.8	0	0	0	0	120.5
260	Q	29.6	Very low	35	Very low	189 Å²	189	124.8 Å²	124.8	88%	0.883	78%	0.783	S	S	*	*				-163.2	159.9	126.5	-111.2	173.6	29.4	0	0	115.7
261	S	26.6	Very low	34.3	Very low	106 Å²	106	122.6 Å²	122.6	74%	0.741	79%	0.785	S	S	*	*			trans	-59.5	165.3	178.1	38.9	0	0	0	0	117.2
262	A	29.5	Very low	33.6	Very low	81 Å²	81	119.9 Å²	119.9	67%	0.669	79%	0.785	S	S	*	*			cis	-172.6	176	-9.8	0	0	0	0	0	112.2
263	D	30.4	Very low	33.5	Very low	152 Å²	152	120.7 Å²	120.7	81%	0.813	78%	0.784	S	S	*	*			trans	70.8	158.2	151.4	-75.4	-3.2	0	0	0	121.7
264	P	51.5	Low	33.4	Very low	101 Å²	101	118 Å²	118	66%	0.656	78%	0.777	S	S	*	*			cis	-142.3	-161.3	-47	42.3	-24.6	0	0	0	113.6
265	N	28	Very low	33.1	Very low	150 Å²	150	118.9 Å²	118.9	80%	0.802	78%	0.775	S	S	*	*			trans	71.6	119.4	173.2	-74.8	-17.6	0	0	0	116.8
266	A	29.5	Very low	33.3	Very low	95 Å²	95	120.1 Å²	120.1	79%	0.785	76%	0.764	S	S	*	*				83.2	139.6	59.4	0	0	0	0	0	113.2
267	G	29.9	Very low	33.8	Very low	72 Å²	72	126.5 Å²	126.5	74%	0.742	77%	0.774	S	S	*	*			cis	149.3	88.3	-1.2	0	0	0	0	0	110.9
268	S	29.9	Very low	34.5	Very low	121 Å²	121	123 Å²	123	85%	0.846	76%	0.762	S	S	*	*			trans	-148.4	116.1	-172.5	-56	0	0	0	0	114.3
269	N	32.3	Very low	34.7	Very low	164 Å²	164	120.1 Å²	120.1	88%	0.877	75%	0.753	S	S	*	*			trans	-113.1	171	146.7	-103	-31	0	0	0	105.8
270	P	50.3	Low	35.3	Very low	104 Å²	104	122 Å²	122	68%	0.675	75%	0.753	S	S	*	*			cis	-142.3	-167.8	21.9	43	-23.7	0	0	0	115.9
271	S	32.3	Very low	36.2	Very low	112 Å²	112	123.5 Å²	123.5	78%	0.783	75%	0.751	S	S	*	*			trans	75.4	144.5	152.6	-66.2	0	0	0	0	118.6
272	S	30.5	Very low	37.2	Very low	113 Å²	113	123.7 Å²	123.7	79%	0.79	74%	0.739	S	S	*	*			cis	-155.3	171.1	-5.2	45.4	0	0	0	0	112.2
273	A	32.8	Very low	38.3	Very low	92 Å²	92	123.6 Å²	123.6	76%	0.76	73%	0.731	S	S	*	*			trans	-49.2	159	177.2	0	0	0	0	0	114.2
274	S	33.9	Very low	39.3	Very low	96 Å²	96	120.7 Å²	120.7	67%	0.671	72%	0.718	S	S	*	*				-178.4	146.9	59.7	-165.6	0	0	0	0	113.8
275	L	35.9	Very low	39.5	Very low	138 Å²	138	121.8 Å²	121.8	72%	0.723	72%	0.715	S	S	*	*			trans	34.6	145.2	144.5	-82.9	60.7	0	0	0	121.2
276	K	38.5	Very low	40.8	Very low	159 Å²	159	118.6 Å²	118.6	69%	0.691	70%	0.698	S	S	*	*			cis	-172.8	122.9	-9	-127.8	176.1	-163.4	175.2	0	108.1
277	H	38.1	Very low	41.9	Very low	205 Å²	205	118.8 Å²	118.8	95%	0.949	69%	0.685	S	S	*	*			trans	-159	53.8	165.1	-112.7	52.9	0	0	0	110.6
278	S	44.6	Very low	43.3	Very low	89 Å²	89	119.9 Å²	119.9	62%	0.622	67%	0.673	S	S	*	*			trans	-123.6	62.9	-166.6	58.7	0	0	0	0	111.8
279	G	43.8	Very low	44.8	Very low	51 Å²	51	119 Å²	119	53%	0.526	66%	0.655	S	S	.	*	S	Bend	trans	-114.8	-68.9	175.3	0	0	0	0	0	111.9
280	E	44.4	Very low	46.3	Very low	172 Å²	172	116.1 Å²	116.1	80%	0.804	64%	0.637	S	S	*	*	H	α-helix	trans	-88.1	-17.4	-164.9	-60.2	173	141.3	0	0	114.9	T283 V284	E280-T283 PolarHBondContact O-OG1 3.25Å; E280-V284 WeakPolarHBondContact O-CG2 3.43Å
281	R	47	Very low	46.6	Very low	221 Å²	221	115.2 Å²	115.2	83%	0.834	63%	0.629	S	S	*	*	H	α-helix	trans	-82.7	-22	177	-72.1	-171.2	179.4	-174.3	0.6	113.8	H285	R281-H285 PolarHBondContact O-N 3.14Å
282	Q	47.8	Very low	48	Very low	109 Å²	109	116.3 Å²	116.3	51%	0.509	62%	0.62	S	S	.	*	H	α-helix	trans	-70.7	-55.4	-179.5	-144.8	73.9	29.8	0	0	109.7	V284 H285 D286	Q282-V284 VanDerWaalsContact C-N 3.3Å; Q282-V284 PolarHBondContact O-N 2.85Å; Q282-H285 WeakPolarHBondContact O-CA 3.45Å; Q282-H285 WeakPolarHBondContact O-CB 3.4Å; Q282-H285 PolarHBondContact O-N 3.27Å; Q282-D286 PolarHBondContact O-N 3.16Å; Q282-D286 VanDerWaalsContact O-OD2 3.14Å
283	T	53	Low	49.4	Very low	79 Å²	79	116.6 Å²	116.6	49%	0.485	61%	0.608	S	S	.	*	H	α-helix	trans	-55.7	-40.5	-179.9	51.4	0	0	0	0	113.2	E280 D286 L287	E280-T283 PolarHBondContact O-OG1 3.25Å; T283-D286 PolarHBondContact O-N 3.34Å; T283-L287 VanDerWaalsContact O-CB 3.32Å; T283-L287 WeakPolarHBondContact O-CB 3.33Å; T283-L287 WeakPolarHBondContact O-CD1 3.33Å; T283-L287 VanDerWaalsContact O-CG 3.22Å; T283-L287 WeakPolarHBondContact O-CG 3.4Å; T283-L287 PolarHBondContact O-N 3.4Å
284	V	51.8	Low	50.4	Low	91 Å²	91	117.1 Å²	117.1	55%	0.552	60%	0.598	S	S	*	*	H	α-helix	trans	-65.4	-39.6	176.2	176.2	0	0	0	0	111.6	E280 Q282 L288	E280-V284 WeakPolarHBondContact O-CG2 3.43Å; Q282-V284 VanDerWaalsContact C-N 3.3Å; Q282-V284 PolarHBondContact O-N 2.85Å; V284-L288 WeakPolarHBondContact O-CB 3.29Å; V284-L288 PolarHBondContact O-N 3Å
285	H	54.8	Low	51.6	Low	125 Å²	125	116.6 Å²	116.6	58%	0.579	59%	0.591	S	S	*	*	H	α-helix	trans	-69.2	-41.1	177.1	-176.9	-84.1	0	0	0	111.9	R281 Q282 L288 H289	R281-H285 PolarHBondContact O-N 3.14Å; Q282-H285 WeakPolarHBondContact O-CA 3.45Å; Q282-H285 WeakPolarHBondContact O-CB 3.4Å; Q282-H285 PolarHBondContact O-N 3.27Å; H285-L288 PolarHBondContact O-N 3.25Å; H285-H289 PolarHBondContact O-N 3.17Å
286	D	55.3	Low	52.8	Low	83 Å²	83	113.6 Å²	113.6	44%	0.444	58%	0.582	S	S	.	*	H	α-helix	trans	-66.4	-43.6	179.4	-58.7	-30.1	0	0	0	110.9	Q282 T283 L288 H289 E290	Q282-D286 PolarHBondContact O-N 3.16Å; Q282-D286 VanDerWaalsContact O-OD2 3.14Å; T283-D286 PolarHBondContact O-N 3.34Å; D286-L288 VanDerWaalsContact C-N 3.3Å; D286-L288 PolarHBondContact O-N 3.07Å; D286-H289 WeakPolarHBondContact O-CB 3.48Å; D286-H289 PolarHBondContact O-N 2.96Å; D286-H289 VanDerWaalsContact O-N 3.15Å; D286-E290 PolarHBondContact O-N 3.22Å
287	L	53.6	Low	54.1	Low	98 Å²	98	110.6 Å²	110.6	51%	0.513	57%	0.568	S	S	.	*	H	α-helix	trans	-60.3	-36.8	170.1	-73.9	167.9	0	0	0	112.4	T283 H289 E290 V291	T283-L287 VanDerWaalsContact O-CB 3.32Å; T283-L287 WeakPolarHBondContact O-CB 3.33Å; T283-L287 WeakPolarHBondContact O-CD1 3.33Å; T283-L287 VanDerWaalsContact O-CG 3.22Å; T283-L287 WeakPolarHBondContact O-CG 3.4Å; T283-L287 PolarHBondContact O-N 3.4Å; L287-H289 VanDerWaalsContact C-N 3.29Å; L287-H289 PolarHBondContact O-N 2.97Å; L287-E290 PolarHBondContact O-N 3.36Å; L287-V291 WeakPolarHBondContact O-CB 3.39Å; L287-V291 VanDerWaalsContact O-CG2 3.26Å; L287-V291 WeakPolarHBondContact O-CG2 3.49Å; L287-V291 PolarHBondContact O-N 3.29Å
288	L	58.5	Low	55.1	Low	95 Å²	95	104.6 Å²	104.6	50%	0.497	55%	0.546	S	S	.	.	H	α-helix	trans	-71.6	-25.8	177.8	-140.2	136.8	0	0	0	112.3	V284 H285 D286 K292	V284-L288 WeakPolarHBondContact O-CB 3.29Å; V284-L288 PolarHBondContact O-N 3Å; H285-L288 PolarHBondContact O-N 3.25Å; D286-L288 VanDerWaalsContact C-N 3.3Å; D286-L288 PolarHBondContact O-N 3.07Å; L288-K292 WeakPolarHBondContact O-CD 3.35Å; L288-K292 VanDerWaalsContact O-CG 3.29Å; L288-K292 WeakPolarHBondContact O-CG 3.44Å; L288-K292 PolarHBondContact O-N 3.28Å
289	H	61.5	Low	56.2	Low	102 Å²	102	106.8 Å²	106.8	47%	0.472	55%	0.546	S	S	.	.	H	α-helix	trans	-78	-42.7	171.5	-174.6	-94.6	0	0	0	111.6	H285 D286 L287 K292 Q293	H285-H289 PolarHBondContact O-N 3.17Å; D286-H289 WeakPolarHBondContact O-CB 3.48Å; D286-H289 PolarHBondContact O-N 2.96Å; D286-H289 VanDerWaalsContact O-N 3.15Å; L287-H289 VanDerWaalsContact C-N 3.29Å; L287-H289 PolarHBondContact O-N 2.97Å; H289-K292 WeakPolarHBondContact O-CB 3.26Å; H289-K292 PolarHBondContact O-N 2.67Å; H289-Q293 PolarHBondContact CE1-NE2 3.26Å; H289-Q293 VanDerWaalsContact CE1-NE2 3.31Å; H289-Q293 PolarHBondContact O-N 3.15Å
290	E	63.2	Low	57.2	Low	105 Å²	105	109 Å²	109	49%	0.491	54%	0.543	S	S	.	.	H	α-helix	trans	-60.6	-46.8	173.7	-174.1	173.4	-161.4	0	0	111.5	D286 L287 K292 Q293 L294	D286-E290 PolarHBondContact O-N 3.22Å; L287-E290 PolarHBondContact O-N 3.36Å; E290-K292 VanDerWaalsContact C-N 3.3Å; E290-K292 PolarHBondContact O-N 3.39Å; E290-Q293 PolarHBondContact O-N 2.97Å; E290-Q293 VanDerWaalsContact O-N 3.13Å; E290-L294 HydrophobicContact CG-CD1 4.11Å; E290-L294 WeakPolarHBondContact O-CB 3.37Å; E290-L294 WeakPolarHBondContact O-CG 3.43Å; E290-L294 PolarHBondContact O-N 2.81Å
291	V	56.3	Low	58.1	Low	85 Å²	85	105 Å²	105	52%	0.515	53%	0.526	S	S	.	.	H	α-helix	trans	-57.2	-41.4	173.2	167	0	0	0	0	111.4	L287 L294 T295	L287-V291 WeakPolarHBondContact O-CB 3.39Å; L287-V291 VanDerWaalsContact O-CG2 3.26Å; L287-V291 WeakPolarHBondContact O-CG2 3.49Å; L287-V291 PolarHBondContact O-N 3.29Å; V291-L294 PolarHBondContact O-N 3Å; V291-T295 WeakPolarHBondContact O-CB 3.44Å; V291-T295 PolarHBondContact O-N 3.35Å; V291-T295 PolarHBondContact O-OG1 3.5Å
292	K	63.5	Low	58.6	Low	134 Å²	134	99.8 Å²	99.8	58%	0.583	51%	0.512	S	S	*	.	H	α-helix	trans	-64.4	-41.6	175.3	-78.2	169.9	178.4	174.4	0	112.8	L288 H289 E290 T295 S296	L288-K292 WeakPolarHBondContact O-CD 3.35Å; L288-K292 VanDerWaalsContact O-CG 3.29Å; L288-K292 WeakPolarHBondContact O-CG 3.44Å; L288-K292 PolarHBondContact O-N 3.28Å; H289-K292 WeakPolarHBondContact O-CB 3.26Å; H289-K292 PolarHBondContact O-N 2.67Å; E290-K292 VanDerWaalsContact C-N 3.3Å; E290-K292 PolarHBondContact O-N 3.39Å; K292-T295 PolarHBondContact O-N 2.84Å; K292-S296 PolarHBondContact O-N 2.93Å
293	Q	58.6	Low	59.5	Low	119 Å²	119	96.5 Å²	96.5	56%	0.556	51%	0.507	S	S	*	.	H	α-helix	trans	-64.7	-43.7	175.5	-72.7	-172.2	-21.6	0	0	111.5	H289 E290 S296 K297	H289-Q293 PolarHBondContact CE1-NE2 3.26Å; H289-Q293 VanDerWaalsContact CE1-NE2 3.31Å; H289-Q293 PolarHBondContact O-N 3.15Å; E290-Q293 PolarHBondContact O-N 2.97Å; E290-Q293 VanDerWaalsContact O-N 3.13Å; Q293-S296 PolarHBondContact O-N 3.09Å; Q293-K297 PolarHBondContact O-N 3.13Å
294	L	53.7	Low	60.2	Low	104 Å²	104	96.9 Å²	96.9	55%	0.545	50%	0.504	S	S	.	.	H	α-helix	trans	-62.3	-43.3	174.7	-69.5	171	0	0	0	111.7	E290 V291 S296 K297 V298	E290-L294 HydrophobicContact CG-CD1 4.11Å; E290-L294 WeakPolarHBondContact O-CB 3.37Å; E290-L294 WeakPolarHBondContact O-CG 3.43Å; E290-L294 PolarHBondContact O-N 2.81Å; V291-L294 PolarHBondContact O-N 3Å; L294-S296 PolarHBondContact O-N 2.7Å; L294-K297 PolarHBondContact O-N 3.03Å; L294-V298 WeakPolarHBondContact O-CG2 3.07Å; L294-V298 PolarHBondContact O-N 3.35Å
295	T	60.3	Low	60.7	Low	85 Å²	85	98.5 Å²	98.5	52%	0.521	50%	0.503	S	S	.	.	H	α-helix	trans	-60	-44.7	173.9	-58.7	0	0	0	0	111.5	V291 K292 K297 V298 Q299	V291-T295 WeakPolarHBondContact O-CB 3.44Å; V291-T295 PolarHBondContact O-N 3.35Å; V291-T295 PolarHBondContact O-OG1 3.5Å; K292-T295 PolarHBondContact O-N 2.84Å; T295-K297 VanDerWaalsContact C-N 3.33Å; T295-K297 PolarHBondContact O-N 3.33Å; T295-V298 PolarHBondContact O-N 3.06Å; T295-Q299 PolarHBondContact O-N 2.99Å
296	S	60.1	Low	61.1	Low	75 Å²	75	95.1 Å²	95.1	52%	0.524	49%	0.494	S	S	.	.	H	α-helix	trans	-62	-40.3	176.2	-169.1	0	0	0	0	112.1	K292 Q293 L294 Q299 E300	K292-S296 PolarHBondContact O-N 2.93Å; Q293-S296 PolarHBondContact O-N 3.09Å; L294-S296 PolarHBondContact O-N 2.7Å; S296-Q299 PolarHBondContact O-N 3.5Å; S296-E300 PolarHBondContact O-N 3.17Å
297	K	66.1	Low	61.5	Low	95 Å²	95	95.5 Å²	95.5	41%	0.413	49%	0.493	S	S	.	.	H	α-helix	trans	-71.5	-36.7	178.4	-169	70.5	-150.9	168.2	0	112	Q293 L294 T295 E300 L301	Q293-K297 PolarHBondContact O-N 3.13Å; L294-K297 PolarHBondContact O-N 3.03Å; T295-K297 VanDerWaalsContact C-N 3.33Å; T295-K297 PolarHBondContact O-N 3.33Å; K297-E300 VanDerWaalsContact CD-OE2 3.31Å; K297-E300 WeakPolarHBondContact CD-OE2 3.46Å; K297-E300 WeakPolarHBondContact CE-OE2 3.35Å; K297-E300 IonicContact NZ-OE1 3.46Å; K297-E300 PolarHBondContact NZ-OE1 3.37Å; K297-E300 IonicContact NZ-OE2 2.68Å; K297-E300 PolarHBondContact NZ-OE2 3.38Å; K297-E300 PolarHBondContact O-N 3.32Å; K297-L301 HydrophobicContact CG-CD1 4.1Å; K297-L301 WeakPolarHBondContact O-CB 3.47Å; K297-L301 WeakPolarHBondContact O-CD1 3.35Å; K297-L301 WeakPolarHBondContact O-CG 3.39Å; K297-L301 PolarHBondContact O-N 2.85Å
298	V	60.1	Low	62	Low	79 Å²	79	97 Å²	97	48%	0.479	49%	0.492	S	S	.	.	H	α-helix	trans	-60.7	-46.5	171.4	168.1	0	0	0	0	110.3	L294 T295 E300 L301 E302	L294-V298 WeakPolarHBondContact O-CG2 3.07Å; L294-V298 PolarHBondContact O-N 3.35Å; T295-V298 PolarHBondContact O-N 3.06Å; V298-E300 VanDerWaalsContact C-N 3.33Å; V298-E300 PolarHBondContact O-N 3.25Å; V298-L301 PolarHBondContact O-N 3.47Å; V298-E302 HydrophobicContact CG1-CG 4.35Å; V298-E302 WeakPolarHBondContact O-CB 3.33Å; V298-E302 WeakPolarHBondContact O-CG 3.42Å; V298-E302 PolarHBondContact O-N 2.77Å
299	Q	66.1	Low	62.3	Low	135 Å²	135	96 Å²	96	63%	0.631	49%	0.485	S	S	*	.	H	α-helix	trans	-64.2	-36.9	179.6	-167.6	175	19	0	0	112.7	T295 S296 G303	T295-Q299 PolarHBondContact O-N 2.99Å; S296-Q299 PolarHBondContact O-N 3.5Å; Q299-G303 PolarHBondContact O-N 3.01Å; Q299-G303 VanDerWaalsContact O-N 3.07Å
300	E	65.8	Low	62.9	Low	98 Å²	98	97.9 Å²	97.9	46%	0.458	49%	0.488	S	S	.	.	H	α-helix	trans	-63.3	-49.8	171.8	-170.7	-174.6	-175.5	0	0	111.3	S296 K297 V298 E302 G303 E304	S296-E300 PolarHBondContact O-N 3.17Å; K297-E300 VanDerWaalsContact CD-OE2 3.31Å; K297-E300 WeakPolarHBondContact CD-OE2 3.46Å; K297-E300 WeakPolarHBondContact CE-OE2 3.35Å; K297-E300 IonicContact NZ-OE1 3.46Å; K297-E300 PolarHBondContact NZ-OE1 3.37Å; K297-E300 IonicContact NZ-OE2 2.68Å; K297-E300 PolarHBondContact NZ-OE2 3.38Å; K297-E300 PolarHBondContact O-N 3.32Å; V298-E300 VanDerWaalsContact C-N 3.33Å; V298-E300 PolarHBondContact O-N 3.25Å; E300-E302 VanDerWaalsContact C-N 3.32Å; E300-E302 PolarHBondContact O-N 3.34Å; E300-G303 CarbonylContact O-C 3.6Å; E300-G303 WeakPolarHBondContact O-CA 3.45Å; E300-G303 PolarHBondContact O-N 3.42Å; E300-E304 PolarHBondContact O-N 3.38Å
301	L	61.9	Low	63.3	Low	87 Å²	87	97.5 Å²	97.5	46%	0.455	49%	0.485	S	S	.	.	H	α-helix	trans	-63.4	-33.4	178.1	-70.9	167.6	0	0	0	112.7	K297 V298 E304 K305	K297-L301 HydrophobicContact CG-CD1 4.1Å; K297-L301 WeakPolarHBondContact O-CB 3.47Å; K297-L301 WeakPolarHBondContact O-CD1 3.35Å; K297-L301 WeakPolarHBondContact O-CG 3.39Å; K297-L301 PolarHBondContact O-N 2.85Å; V298-L301 PolarHBondContact O-N 3.47Å; L301-E304 PolarHBondContact O-N 3.27Å; L301-K305 WeakPolarHBondContact O-CB 3.39Å; L301-K305 PolarHBondContact O-N 3.01Å
302	E	58.9	Low	63.9	Low	113 Å²	113	98.5 Å²	98.5	53%	0.528	49%	0.487	S	S	.	.	H	α-helix	trans	-68.3	-36	171.6	-75.9	-172.6	146.8	0	0	112	V298 E300 S306	V298-E302 HydrophobicContact CG1-CG 4.35Å; V298-E302 WeakPolarHBondContact O-CB 3.33Å; V298-E302 WeakPolarHBondContact O-CG 3.42Å; V298-E302 PolarHBondContact O-N 2.77Å; E300-E302 VanDerWaalsContact C-N 3.32Å; E300-E302 PolarHBondContact O-N 3.34Å; E302-S306 WeakPolarHBondContact O-CB 3.15Å; E302-S306 PolarHBondContact O-N 3.08Å; E302-S306 PolarHBondContact O-OG 3.23Å
303	G	66.3	Low	64.5	Low	40 Å²	40	99.3 Å²	99.3	41%	0.412	49%	0.486	S	S	.	.	H	α-helix	trans	-64.1	-45.9	171.3	0	0	0	0	0	112.5	Q299 E300 S306 Q307	Q299-G303 PolarHBondContact O-N 3.01Å; Q299-G303 VanDerWaalsContact O-N 3.07Å; E300-G303 CarbonylContact O-C 3.6Å; E300-G303 WeakPolarHBondContact O-CA 3.45Å; E300-G303 PolarHBondContact O-N 3.42Å; G303-S306 PolarHBondContact O-N 3.49Å; G303-Q307 PolarHBondContact O-N 3.08Å
304	E	68	Low	65.3	Low	87 Å²	87	96.5 Å²	96.5	41%	0.407	48%	0.483	S	S	.	.	H	α-helix	trans	-63	-51.6	174.7	-69.7	-169.6	139.2	0	0	111.6	E300 L301 S306 Q307 Y308	E300-E304 PolarHBondContact O-N 3.38Å; L301-E304 PolarHBondContact O-N 3.27Å; E304-S306 VanDerWaalsContact C-N 3.29Å; E304-S306 PolarHBondContact O-N 2.96Å; E304-Q307 CarbonylContact O-C 3.54Å; E304-Q307 WeakPolarHBondContact O-CA 3.22Å; E304-Q307 VanDerWaalsContact O-CB 3.24Å; E304-Q307 WeakPolarHBondContact O-CB 3.22Å; E304-Q307 PolarHBondContact O-N 3.03Å; E304-Y308 HydrophobicContact CB-CD2 4.44Å; E304-Y308 HydrophobicContact CB-CE2 4.34Å; E304-Y308 WeakPolarHBondContact O-CD2 3.48Å; E304-Y308 PolarHBondContact O-N 2.69Å
305	K	63.1	Low	66.1	Low	124 Å²	124	94.9 Å²	94.9	54%	0.539	48%	0.478	S	S	.	.	H	α-helix	trans	-52.6	-47.1	173.4	177.1	-174.1	171.9	-172.1	0	111.1	L301 Q307 Y308 E309	L301-K305 WeakPolarHBondContact O-CB 3.39Å; L301-K305 PolarHBondContact O-N 3.01Å; K305-Q307 PolarHBondContact O-N 2.78Å; K305-Y308 PolarHBondContact O-N 2.93Å; K305-E309 WeakPolarHBondContact CE-OE1 3.37Å; K305-E309 WeakPolarHBondContact O-CG 3.48Å; K305-E309 PolarHBondContact O-N 3.12Å
306	S	63	Low	66.6	Low	55 Å²	55	97.9 Å²	97.9	39%	0.385	48%	0.484	S	S	.	.	H	α-helix	trans	-63.3	-25.1	176.5	-64	0	0	0	0	112.8	E302 G303 E304 R310	E302-S306 WeakPolarHBondContact O-CB 3.15Å; E302-S306 PolarHBondContact O-N 3.08Å; E302-S306 PolarHBondContact O-OG 3.23Å; G303-S306 PolarHBondContact O-N 3.49Å; E304-S306 VanDerWaalsContact C-N 3.29Å; E304-S306 PolarHBondContact O-N 2.96Å; S306-R310 WeakPolarHBondContact O-CG 3.28Å; S306-R310 PolarHBondContact O-NE 3Å; S306-R310 PolarHBondContact O-NH2 3.5Å
307	Q	63.4	Low	67.4	Low	90 Å²	90	96.7 Å²	96.7	42%	0.421	48%	0.478	S	S	.	.	H	α-helix	trans	-78.6	-44.5	171.8	-159	-161.5	87.9	0	0	111.6	G303 E304 K305 R310 K311	G303-Q307 PolarHBondContact O-N 3.08Å; E304-Q307 CarbonylContact O-C 3.54Å; E304-Q307 WeakPolarHBondContact O-CA 3.22Å; E304-Q307 VanDerWaalsContact O-CB 3.24Å; E304-Q307 WeakPolarHBondContact O-CB 3.22Å; E304-Q307 PolarHBondContact O-N 3.03Å; K305-Q307 PolarHBondContact O-N 2.78Å; Q307-R310 PolarHBondContact O-N 3.15Å; Q307-K311 WeakPolarHBondContact O-CG 3.44Å; Q307-K311 PolarHBondContact O-N 3.28Å
308	Y	63.2	Low	68	Low	129 Å²	129	96.7 Å²	96.7	51%	0.506	48%	0.48	S	S	.	.	H	α-helix	trans	-64	-41	176	-74	-68	0	0	0	112.4	E304 K305 R310 K311 L312	E304-Y308 HydrophobicContact CB-CD2 4.44Å; E304-Y308 HydrophobicContact CB-CE2 4.34Å; E304-Y308 WeakPolarHBondContact O-CD2 3.48Å; E304-Y308 PolarHBondContact O-N 2.69Å; K305-Y308 PolarHBondContact O-N 2.93Å; Y308-R310 VanDerWaalsContact C-N 3.28Å; Y308-R310 PolarHBondContact O-N 3.4Å; Y308-K311 HydrophobicContact CD1-CD 4.08Å; Y308-K311 HydrophobicContact CE1-CD 4.41Å; Y308-K311 WeakPolarHBondContact O-CB 3.39Å; Y308-K311 PolarHBondContact O-N 3.08Å; Y308-L312 WeakPolarHBondContact O-CB 3.35Å; Y308-L312 PolarHBondContact O-N 2.84Å
309	E	64.3	Low	68.6	Low	74 Å²	74	97.2 Å²	97.2	35%	0.346	48%	0.479	S	S	.	.	H	α-helix	trans	-60.2	-35.9	172.6	-77.2	-170.9	-158.2	0	0	112.8	K305 R313	K305-E309 WeakPolarHBondContact CE-OE1 3.37Å; K305-E309 WeakPolarHBondContact O-CG 3.48Å; K305-E309 PolarHBondContact O-N 3.12Å; E309-R313 VanDerWaalsContact O-CB 3.31Å; E309-R313 WeakPolarHBondContact O-CB 2.81Å; E309-R313 VanDerWaalsContact O-CG 3.24Å; E309-R313 WeakPolarHBondContact O-CG 3.37Å; E309-R313 PolarHBondContact O-N 3.09Å; E309-R313 PolarHBondContact O-NE 2.97Å; E309-R313 IonicContact OE2-CZ 2.68Å; E309-R313 IonicContact OE2-NH2 2.7Å; E309-R313 PolarHBondContact OE2-NH2 3Å
310	R	75.2	Confident	69	Low	143 Å²	143	93.5 Å²	93.5	54%	0.54	47%	0.468	S	S	.	.	H	α-helix	trans	-70.1	-41.6	175.2	-81.3	176.3	-73.6	144.2	-5.2	111.5	S306 Q307 Y308 R313 A314	S306-R310 WeakPolarHBondContact O-CG 3.28Å; S306-R310 PolarHBondContact O-NE 3Å; S306-R310 PolarHBondContact O-NH2 3.5Å; Q307-R310 PolarHBondContact O-N 3.15Å; Y308-R310 VanDerWaalsContact C-N 3.28Å; Y308-R310 PolarHBondContact O-N 3.4Å; R310-R313 PolarHBondContact O-N 3.43Å; R310-A314 WeakPolarHBondContact O-CB 3.29Å; R310-A314 PolarHBondContact O-N 3.15Å
311	K	71.2	Confident	69.5	Low	97 Å²	97	94.3 Å²	94.3	42%	0.422	47%	0.472	S	S	.	.	H	α-helix	trans	-59.3	-47.8	172.1	-68.3	170.7	-175.8	167.7	0	110.8	Q307 Y308 R313 A314 T315	Q307-K311 WeakPolarHBondContact O-CG 3.44Å; Q307-K311 PolarHBondContact O-N 3.28Å; Y308-K311 HydrophobicContact CD1-CD 4.08Å; Y308-K311 HydrophobicContact CE1-CD 4.41Å; Y308-K311 WeakPolarHBondContact O-CB 3.39Å; Y308-K311 PolarHBondContact O-N 3.08Å; K311-R313 PolarHBondContact O-N 2.92Å; K311-A314 WeakPolarHBondContact O-CB 3.45Å; K311-A314 PolarHBondContact O-N 3.45Å; K311-T315 PolarHBondContact O-N 2.95Å; K311-T315 PolarHBondContact O-OG1 2.86Å
312	L	69.5	Low	70	Confident	106 Å²	106	95.3 Å²	95.3	56%	0.555	48%	0.477	S	S	*	.	H	α-helix	trans	-64	-38.7	178.8	-178	62.6	0	0	0	112.8	Y308 T315 K316	Y308-L312 WeakPolarHBondContact O-CB 3.35Å; Y308-L312 PolarHBondContact O-N 2.84Å; L312-T315 PolarHBondContact O-OG1 2.74Å; L312-K316 WeakPolarHBondContact O-CB 3.49Å; L312-K316 PolarHBondContact O-N 3.15Å
313	R	75.1	Confident	70.4	Confident	151 Å²	151	95.6 Å²	95.6	57%	0.57	48%	0.478	S	S	*	.	H	α-helix	trans	-65.4	-39.8	172.9	-78.7	177.5	-104.9	163.2	-12.9	111.7	E309 R310 K311 A317	E309-R313 VanDerWaalsContact O-CB 3.31Å; E309-R313 WeakPolarHBondContact O-CB 2.81Å; E309-R313 VanDerWaalsContact O-CG 3.24Å; E309-R313 WeakPolarHBondContact O-CG 3.37Å; E309-R313 PolarHBondContact O-N 3.09Å; E309-R313 PolarHBondContact O-NE 2.97Å; E309-R313 IonicContact OE2-CZ 2.68Å; E309-R313 IonicContact OE2-NH2 2.7Å; E309-R313 PolarHBondContact OE2-NH2 3Å; R310-R313 PolarHBondContact O-N 3.43Å; K311-R313 PolarHBondContact O-N 2.92Å; R313-A317 PolarHBondContact O-N 2.99Å; R313-A317 VanDerWaalsContact O-N 3.1Å
314	A	76	Confident	71.1	Confident	60 Å²	60	100.9 Å²	100.9	50%	0.496	49%	0.492	S	S	.	.	H	α-helix	trans	-67.9	-47.2	176.5	0	0	0	0	0	112.6	R310 K311 K316 A317 E318	R310-A314 WeakPolarHBondContact O-CB 3.29Å; R310-A314 PolarHBondContact O-N 3.15Å; K311-A314 WeakPolarHBondContact O-CB 3.45Å; K311-A314 PolarHBondContact O-N 3.45Å; A314-K316 PolarHBondContact O-N 3.13Å; A314-A317 WeakPolarHBondContact O-CB 3.48Å; A314-A317 PolarHBondContact O-N 3.17Å; A314-E318 PolarHBondContact O-N 3.1Å
315	T	69.8	Low	71.5	Confident	70 Å²	70	101.4 Å²	101.4	43%	0.429	50%	0.497	S	S	.	.	H	α-helix	trans	-66.8	-36.6	177.8	55.9	0	0	0	0	112.1	K311 L312 A317 E318 I319	K311-T315 PolarHBondContact O-N 2.95Å; K311-T315 PolarHBondContact O-OG1 2.86Å; L312-T315 PolarHBondContact O-OG1 2.74Å; T315-A317 VanDerWaalsContact C-N 3.32Å; T315-A317 PolarHBondContact O-N 3.25Å; T315-E318 PolarHBondContact O-N 3.32Å; T315-I319 WeakPolarHBondContact O-CB 3.42Å; T315-I319 VanDerWaalsContact O-CG1 3.26Å; T315-I319 WeakPolarHBondContact O-CG1 3.31Å; T315-I319 PolarHBondContact O-N 3.4Å
316	K	71.2	Confident	71.9	Confident	147 Å²	147	100.7 Å²	100.7	64%	0.639	50%	0.499	S	S	*	.	H	α-helix	trans	-63.1	-36.3	172.3	-173.9	174.5	-180	-179.6	0	112.7	L312 A314 S320	L312-K316 WeakPolarHBondContact O-CB 3.49Å; L312-K316 PolarHBondContact O-N 3.15Å; A314-K316 PolarHBondContact O-N 3.13Å; K316-S320 WeakPolarHBondContact O-CB 3.28Å; K316-S320 PolarHBondContact O-N 3.09Å; K316-S320 VanDerWaalsContact O-N 3.11Å; K316-S320 PolarHBondContact O-OG 3.25Å
317	A	77.7	Confident	72.9	Confident	50 Å²	50	102.4 Å²	102.4	41%	0.413	51%	0.507	S	S	.	.	H	α-helix	trans	-66.2	-47.1	172.1	0	0	0	0	0	111.6	R313 A314 T315 I319 S320 E321	R313-A317 PolarHBondContact O-N 2.99Å; R313-A317 VanDerWaalsContact O-N 3.1Å; A314-A317 WeakPolarHBondContact O-CB 3.48Å; A314-A317 PolarHBondContact O-N 3.17Å; T315-A317 VanDerWaalsContact C-N 3.32Å; T315-A317 PolarHBondContact O-N 3.25Å; A317-I319 PolarHBondContact O-N 2.88Å; A317-S320 CarbonylContact O-C 3.51Å; A317-S320 WeakPolarHBondContact O-CA 3.42Å; A317-S320 WeakPolarHBondContact O-CB 3.38Å; A317-S320 PolarHBondContact O-N 3.47Å; A317-E321 PolarHBondContact O-N 3.47Å
318	E	78.8	Confident	73.7	Confident	95 Å²	95	101.2 Å²	101.2	44%	0.444	51%	0.509	S	S	.	.	H	α-helix	trans	-64.3	-37.1	179.1	-167.4	155.7	-124.6	0	0	112.3	A314 T315 S320 E321 L322 K898	A314-E318 PolarHBondContact O-N 3.1Å; T315-E318 PolarHBondContact O-N 3.32Å; E318-S320 VanDerWaalsContact C-N 3.3Å; E318-S320 PolarHBondContact O-N 2.91Å; E318-E321 PolarHBondContact O-N 3.27Å; E318-L322 WeakPolarHBondContact O-CB 3.49Å; E318-L322 VanDerWaalsContact O-CG 3.26Å; E318-L322 WeakPolarHBondContact O-CG 3.37Å; E318-L322 PolarHBondContact O-N 2.91Å; E318-K898 IonicContact OE1-NZ 2.72Å; E318-K898 PolarHBondContact OE1-NZ 2.85Å; E318-K898 VanDerWaalsContact OE1-NZ 3.15Å
319	I	71.7	Confident	74.3	Confident	91 Å²	91	99.8 Å²	99.8	47%	0.467	51%	0.505	S	S	.	.	H	α-helix	trans	-61.6	-38.7	169.8	-70.9	165.2	0	0	0	111.3	T315 A317 L322 Q323	T315-I319 WeakPolarHBondContact O-CB 3.42Å; T315-I319 VanDerWaalsContact O-CG1 3.26Å; T315-I319 WeakPolarHBondContact O-CG1 3.31Å; T315-I319 PolarHBondContact O-N 3.4Å; A317-I319 PolarHBondContact O-N 2.88Å; I319-L322 PolarHBondContact O-N 3.37Å; I319-Q323 HydrophobicContact CG2-CG 4.45Å; I319-Q323 WeakPolarHBondContact O-CB 3.5Å; I319-Q323 VanDerWaalsContact O-CG 3.27Å; I319-Q323 WeakPolarHBondContact O-CG 3.21Å; I319-Q323 PolarHBondContact O-N 3.44Å
320	S	74.3	Confident	74.9	Confident	57 Å²	57	99.9 Å²	99.9	40%	0.399	51%	0.508	S	S	.	.	H	α-helix	trans	-70.8	-39.5	179.2	-54.6	0	0	0	0	111.8	K316 A317 E318 Q323 Q324	K316-S320 WeakPolarHBondContact O-CB 3.28Å; K316-S320 PolarHBondContact O-N 3.09Å; K316-S320 VanDerWaalsContact O-N 3.11Å; K316-S320 PolarHBondContact O-OG 3.25Å; A317-S320 CarbonylContact O-C 3.51Å; A317-S320 WeakPolarHBondContact O-CA 3.42Å; A317-S320 WeakPolarHBondContact O-CB 3.38Å; A317-S320 PolarHBondContact O-N 3.47Å; E318-S320 VanDerWaalsContact C-N 3.3Å; E318-S320 PolarHBondContact O-N 2.91Å; S320-Q323 PolarHBondContact O-N 2.9Å; S320-Q324 WeakPolarHBondContact O-CB 3.5Å; S320-Q324 PolarHBondContact O-N 3.43Å
321	E	76.5	Confident	75.2	Confident	114 Å²	114	96.5 Å²	96.5	53%	0.533	50%	0.503	S	S	.	.	H	α-helix	trans	-60.8	-44.8	171.1	-71.4	-177.8	173.3	0	0	111.3	A317 E318 Q324 L325	A317-E321 PolarHBondContact O-N 3.47Å; E318-E321 PolarHBondContact O-N 3.27Å; E321-Q324 PolarHBondContact O-N 2.95Å; E321-L325 WeakPolarHBondContact O-CB 3.14Å; E321-L325 PolarHBondContact O-N 2.89Å
322	L	73.1	Confident	75.6	Confident	108 Å²	108	96.4 Å²	96.4	57%	0.565	50%	0.504	S	S	*	.	H	α-helix	trans	-66	-38.6	177.6	-71.7	170.3	0	0	0	112.6	E318 I319 L325 L326	E318-L322 WeakPolarHBondContact O-CB 3.49Å; E318-L322 VanDerWaalsContact O-CG 3.26Å; E318-L322 WeakPolarHBondContact O-CG 3.37Å; E318-L322 PolarHBondContact O-N 2.91Å; I319-L322 PolarHBondContact O-N 3.37Å; L322-L325 PolarHBondContact O-N 2.98Å; L322-L326 WeakPolarHBondContact O-CB 3.49Å; L322-L326 PolarHBondContact O-N 2.8Å
323	Q	66.3	Low	75.7	Confident	120 Å²	120	95.3 Å²	95.3	56%	0.561	50%	0.498	S	S	*	.	H	α-helix	trans	-65.1	-42.5	173.9	-76.7	173.2	-13.9	0	0	111.9	I319 S320 L325 L326 V327	I319-Q323 HydrophobicContact CG2-CG 4.45Å; I319-Q323 WeakPolarHBondContact O-CB 3.5Å; I319-Q323 VanDerWaalsContact O-CG 3.27Å; I319-Q323 WeakPolarHBondContact O-CG 3.21Å; I319-Q323 PolarHBondContact O-N 3.44Å; S320-Q323 PolarHBondContact O-N 2.9Å; Q323-L325 VanDerWaalsContact C-N 3.34Å; Q323-L326 PolarHBondContact O-N 3.28Å; Q323-V327 WeakPolarHBondContact O-CG2 3.37Å; Q323-V327 PolarHBondContact O-N 3.28Å; Q323-V327 VanDerWaalsContact O-N 3.1Å
324	Q	80.7	Confident	75.8	Confident	151 Å²	151	93.9 Å²	93.9	71%	0.706	50%	0.498	S	S	*	.	H	α-helix	trans	-65.1	-38.6	175.3	-171.8	176.1	10.5	0	0	111.8	S320 E321 S328	S320-Q324 WeakPolarHBondContact O-CB 3.5Å; S320-Q324 PolarHBondContact O-N 3.43Å; E321-Q324 PolarHBondContact O-N 2.95Å; Q324-S328 WeakPolarHBondContact O-CB 3.48Å; Q324-S328 PolarHBondContact O-N 2.78Å
325	L	77.6	Confident	75.7	Confident	98 Å²	98	94.7 Å²	94.7	51%	0.513	50%	0.499	S	S	.	.	H	α-helix	trans	-65.8	-38.2	175.1	-177.7	60.9	0	0	0	112.1	E321 L322 Q323 S328 K329	E321-L325 WeakPolarHBondContact O-CB 3.14Å; E321-L325 PolarHBondContact O-N 2.89Å; L322-L325 PolarHBondContact O-N 2.98Å; Q323-L325 VanDerWaalsContact C-N 3.34Å; L325-S328 PolarHBondContact O-N 3.41Å; L325-K329 WeakPolarHBondContact O-CG 3.4Å; L325-K329 PolarHBondContact O-N 3.37Å; L325-K329 VanDerWaalsContact O-N 3.07Å
326	L	71.6	Confident	75.6	Confident	108 Å²	108	95.5 Å²	95.5	57%	0.565	50%	0.5	S	S	*	.	H	α-helix	trans	-61.4	-53.6	175.7	-167.3	75.7	0	0	0	110.8	L322 Q323 S328 K329 D330	L322-L326 WeakPolarHBondContact O-CB 3.49Å; L322-L326 PolarHBondContact O-N 2.8Å; Q323-L326 PolarHBondContact O-N 3.28Å; L326-S328 PolarHBondContact O-N 2.85Å; L326-K329 CarbonylContact O-C 3.5Å; L326-K329 WeakPolarHBondContact O-CA 3.38Å; L326-K329 WeakPolarHBondContact O-CB 3.41Å; L326-K329 PolarHBondContact O-N 2.85Å; L326-D330 PolarHBondContact O-N 3.42Å
327	V	83.3	Confident	75	Confident	91 Å²	91	93.7 Å²	93.7	55%	0.552	49%	0.494	S	S	*	.	H	α-helix	trans	-59.5	-36.3	177.5	174.7	0	0	0	0	111.8	Q323 K329 T331	Q323-V327 WeakPolarHBondContact O-CG2 3.37Å; Q323-V327 PolarHBondContact O-N 3.28Å; Q323-V327 VanDerWaalsContact O-N 3.1Å; V327-K329 VanDerWaalsContact C-N 3.25Å; V327-K329 PolarHBondContact O-N 3.15Å; V327-T331 WeakPolarHBondContact O-CG2 3.15Å; V327-T331 PolarHBondContact O-N 2.87Å; V327-T331 VanDerWaalsContact O-N 3.08Å; V327-T331 PolarHBondContact O-OG1 2.99Å
328	S	81.4	Confident	74.7	Confident	66 Å²	66	95.6 Å²	95.6	46%	0.462	50%	0.501	S	S	.	.	H	α-helix	trans	-67.4	-22.2	173.7	-175	0	0	0	0	113.7	Q324 L325 L326 T331	Q324-S328 WeakPolarHBondContact O-CB 3.48Å; Q324-S328 PolarHBondContact O-N 2.78Å; L325-S328 PolarHBondContact O-N 3.41Å; L326-S328 PolarHBondContact O-N 2.85Å; S328-T331 PolarHBondContact O-OG1 3.38Å
329	K	75.9	Confident	74.1	Confident	99 Å²	99	97.3 Å²	97.3	43%	0.43	51%	0.509	S	S	.	.	H	α-helix	trans	-91.1	-37.8	175.9	-71.8	-72.9	153.3	-162.7	0	111.9	L325 L326 V327 T331 E332 I333	L325-K329 WeakPolarHBondContact O-CG 3.4Å; L325-K329 PolarHBondContact O-N 3.37Å; L325-K329 VanDerWaalsContact O-N 3.07Å; L326-K329 CarbonylContact O-C 3.5Å; L326-K329 WeakPolarHBondContact O-CA 3.38Å; L326-K329 WeakPolarHBondContact O-CB 3.41Å; L326-K329 PolarHBondContact O-N 2.85Å; V327-K329 VanDerWaalsContact C-N 3.25Å; V327-K329 PolarHBondContact O-N 3.15Å; K329-T331 VanDerWaalsContact C-N 3.35Å; K329-T331 PolarHBondContact O-N 3.46Å; K329-E332 IonicContact NZ-OE2 3.54Å; K329-E332 PolarHBondContact NZ-OE2 2.83Å; K329-E332 WeakPolarHBondContact O-CB 3.27Å; K329-E332 PolarHBondContact O-N 3.03Å; K329-I333 VanDerWaalsContact O-CG1 3.29Å; K329-I333 WeakPolarHBondContact O-CG1 3.38Å; K329-I333 PolarHBondContact O-N 2.84Å
330	D	75.7	Confident	73.4	Confident	76 Å²	76	99.1 Å²	99.1	41%	0.406	52%	0.519	S	S	.	.	H	α-helix	trans	-61.5	-44.2	174.2	-62.7	-35.1	0	0	0	110.9	L326 E332 I333 E334	L326-D330 PolarHBondContact O-N 3.42Å; D330-E332 VanDerWaalsContact C-N 3.34Å; D330-E332 PolarHBondContact O-N 3.32Å; D330-I333 WeakPolarHBondContact O-CB 3.47Å; D330-I333 PolarHBondContact O-N 3.36Å; D330-I333 VanDerWaalsContact O-N 3.13Å; D330-E334 PolarHBondContact O-N 3.21Å
331	T	82.3	Confident	72.6	Confident	72 Å²	72	103.2 Å²	103.2	44%	0.442	54%	0.536	S	S	.	.	H	α-helix	trans	-67.3	-29.5	174.8	49.3	0	0	0	0	113.8	V327 S328 K329 C335	V327-T331 WeakPolarHBondContact O-CG2 3.15Å; V327-T331 PolarHBondContact O-N 2.87Å; V327-T331 VanDerWaalsContact O-N 3.08Å; V327-T331 PolarHBondContact O-OG1 2.99Å; S328-T331 PolarHBondContact O-OG1 3.38Å; K329-T331 VanDerWaalsContact C-N 3.35Å; K329-T331 PolarHBondContact O-N 3.46Å; T331-C335 VanDerWaalsContact O-CB 3.29Å; T331-C335 WeakPolarHBondContact O-CB 3.45Å; T331-C335 PolarHBondContact O-N 3.02Å; T331-C335 VanDerWaalsContact O-N 3.1Å
332	E	78.7	Confident	71.6	Confident	94 Å²	94	102 Å²	102	44%	0.439	54%	0.544	S	S	.	.	H	α-helix	trans	-68.4	-39.7	169.9	-173.8	176.6	-163.4	0	0	111.1	K329 D330 C335 L336	K329-E332 IonicContact NZ-OE2 3.54Å; K329-E332 PolarHBondContact NZ-OE2 2.83Å; K329-E332 WeakPolarHBondContact O-CB 3.27Å; K329-E332 PolarHBondContact O-N 3.03Å; D330-E332 VanDerWaalsContact C-N 3.34Å; D330-E332 PolarHBondContact O-N 3.32Å; E332-C335 PolarHBondContact O-N 2.98Å; E332-L336 HydrophobicContact CG-CD1 4.28Å; E332-L336 VanDerWaalsContact O-CG 3.29Å; E332-L336 WeakPolarHBondContact O-CG 3.48Å; E332-L336 PolarHBondContact O-N 3.06Å
333	I	71.4	Confident	70.4	Confident	84 Å²	84	107 Å²	107	43%	0.431	56%	0.556	S	S	.	*	H	α-helix	trans	-65.7	-47	175.8	-69.7	163.4	0	0	0	111.1	K329 D330 C335 L336 Q337	K329-I333 VanDerWaalsContact O-CG1 3.29Å; K329-I333 WeakPolarHBondContact O-CG1 3.38Å; K329-I333 PolarHBondContact O-N 2.84Å; D330-I333 WeakPolarHBondContact O-CB 3.47Å; D330-I333 PolarHBondContact O-N 3.36Å; D330-I333 VanDerWaalsContact O-N 3.13Å; I333-C335 VanDerWaalsContact C-N 3.31Å; I333-C335 PolarHBondContact O-N 3.03Å; I333-L336 PolarHBondContact O-N 3.1Å; I333-Q337 HydrophobicContact CG2-CG 4.32Å; I333-Q337 WeakPolarHBondContact O-CB 3.42Å; I333-Q337 VanDerWaalsContact O-CG 3.31Å; I333-Q337 WeakPolarHBondContact O-CG 3.28Å; I333-Q337 PolarHBondContact O-N 3.41Å
334	E	78.4	Confident	69.1	Low	120 Å²	120	104.2 Å²	104.2	56%	0.561	56%	0.56	S	S	*	*	H	α-helix	trans	-59.7	-40.4	175.6	-73.4	-172.9	148.2	0	0	112.1	D330 Q337 T338	D330-E334 PolarHBondContact O-N 3.21Å; E334-Q337 PolarHBondContact O-N 3.12Å; E334-T338 VanDerWaalsContact O-CB 3.32Å; E334-T338 WeakPolarHBondContact O-CB 3.34Å; E334-T338 PolarHBondContact O-N 3.36Å; E334-T338 PolarHBondContact O-OG1 2.91Å
335	C	73.6	Confident	67.3	Low	77 Å²	77	100.7 Å²	100.7	52%	0.52	56%	0.563	S	S	.	*	H	α-helix	trans	-62.5	-45.1	175.4	-174.3	0	0	0	0	111.6	T331 E332 I333 T338 Q339	T331-C335 VanDerWaalsContact O-CB 3.29Å; T331-C335 WeakPolarHBondContact O-CB 3.45Å; T331-C335 PolarHBondContact O-N 3.02Å; T331-C335 VanDerWaalsContact O-N 3.1Å; E332-C335 PolarHBondContact O-N 2.98Å; I333-C335 VanDerWaalsContact C-N 3.31Å; I333-C335 PolarHBondContact O-N 3.03Å; C335-T338 PolarHBondContact O-N 2.94Å; C335-Q339 VanDerWaalsContact O-CB 3.3Å; C335-Q339 WeakPolarHBondContact O-CB 3.31Å; C335-Q339 PolarHBondContact O-N 3.12Å
336	L	66.9	Low	65.8	Low	87 Å²	87	100.5 Å²	100.5	46%	0.455	57%	0.567	S	S	.	*	H	α-helix	trans	-66.7	-39.2	176.5	-71.2	168.5	0	0	0	112.6	E332 I333 Q339 L340	E332-L336 HydrophobicContact CG-CD1 4.28Å; E332-L336 VanDerWaalsContact O-CG 3.29Å; E332-L336 WeakPolarHBondContact O-CG 3.48Å; E332-L336 PolarHBondContact O-N 3.06Å; I333-L336 PolarHBondContact O-N 3.1Å; L336-Q339 PolarHBondContact O-N 2.97Å; L336-L340 WeakPolarHBondContact O-CG 3.38Å; L336-L340 PolarHBondContact O-N 2.74Å
337	Q	59.8	Low	64.8	Low	109 Å²	109	99.8 Å²	99.8	51%	0.509	58%	0.576	S	S	.	*	H	α-helix	trans	-63.6	-45.3	173.9	-73	176.7	7.4	0	0	111.4	I333 E334 Q339 L340 L341	I333-Q337 HydrophobicContact CG2-CG 4.32Å; I333-Q337 WeakPolarHBondContact O-CB 3.42Å; I333-Q337 VanDerWaalsContact O-CG 3.31Å; I333-Q337 WeakPolarHBondContact O-CG 3.28Å; I333-Q337 PolarHBondContact O-N 3.41Å; E334-Q337 PolarHBondContact O-N 3.12Å; Q337-Q339 VanDerWaalsContact C-N 3.29Å; Q337-Q339 PolarHBondContact O-N 2.77Å; Q337-L340 WeakPolarHBondContact O-CB 3.4Å; Q337-L340 PolarHBondContact O-N 3.19Å; Q337-L341 WeakPolarHBondContact O-CG 3.38Å; Q337-L341 PolarHBondContact O-N 3.19Å
338	T	71.3	Confident	63.4	Low	91 Å²	91	101.6 Å²	101.6	56%	0.558	58%	0.583	S	S	*	*	H	α-helix	trans	-60.1	-41.1	175	-57.6	0	0	0	0	111.2	E334 C335 L341 A342	E334-T338 VanDerWaalsContact O-CB 3.32Å; E334-T338 WeakPolarHBondContact O-CB 3.34Å; E334-T338 PolarHBondContact O-N 3.36Å; E334-T338 PolarHBondContact O-OG1 2.91Å; C335-T338 PolarHBondContact O-N 2.94Å; T338-L341 PolarHBondContact O-N 3.23Å; T338-A342 WeakPolarHBondContact O-CB 3.42Å; T338-A342 PolarHBondContact O-N 3.3Å
339	Q	65.8	Low	61.9	Low	130 Å²	130	103.2 Å²	103.2	61%	0.607	59%	0.586	S	S	*	*	H	α-helix	trans	-70.9	-29.8	178.2	-167.4	167.1	94.5	0	0	113.1	C335 L336 Q337 R343	C335-Q339 VanDerWaalsContact O-CB 3.3Å; C335-Q339 WeakPolarHBondContact O-CB 3.31Å; C335-Q339 PolarHBondContact O-N 3.12Å; L336-Q339 PolarHBondContact O-N 2.97Å; Q337-Q339 VanDerWaalsContact C-N 3.29Å; Q337-Q339 PolarHBondContact O-N 2.77Å; Q339-R343 PolarHBondContact O-N 2.71Å
340	L	57.6	Low	60.8	Low	129 Å²	129	102.6 Å²	102.6	68%	0.675	59%	0.588	S	S	*	*	H	α-helix	trans	-69.9	-46.1	169.5	-79.8	163.8	0	0	0	111.8	L336 Q337 A342 R343 G344	L336-L340 WeakPolarHBondContact O-CG 3.38Å; L336-L340 PolarHBondContact O-N 2.74Å; Q337-L340 WeakPolarHBondContact O-CB 3.4Å; Q337-L340 PolarHBondContact O-N 3.19Å; L340-A342 PolarHBondContact O-N 3.25Å; L340-R343 WeakPolarHBondContact O-CB 3.32Å; L340-R343 PolarHBondContact O-N 2.85Å; L340-G344 PolarHBondContact O-N 2.85Å
341	L	57.5	Low	59.9	Low	144 Å²	144	102 Å²	102	75%	0.754	59%	0.593	S	S	*	*	H	α-helix	trans	-61	-44.3	177.2	-71	168	0	0	0	111.4	Q337 T338 R343 G344	Q337-L341 WeakPolarHBondContact O-CG 3.38Å; Q337-L341 PolarHBondContact O-N 3.19Å; T338-L341 PolarHBondContact O-N 3.23Å; L341-R343 PolarHBondContact O-N 2.79Å; L341-R343 VanDerWaalsContact O-N 3.14Å; L341-G344 PolarHBondContact O-N 2.99Å; L341-G344 VanDerWaalsContact O-N 3.1Å
342	A	56	Low	58.7	Low	87 Å²	87	104.5 Å²	104.5	72%	0.719	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	-20	174.4	0	0	0	0	0	113.7	T338 L340	T338-A342 WeakPolarHBondContact O-CB 3.42Å; T338-A342 PolarHBondContact O-N 3.3Å; L340-A342 PolarHBondContact O-N 3.25Å
343	R	46.3	Very low	57.9	Low	214 Å²	214	107.5 Å²	107.5	81%	0.808	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-3.5	178.2	-152.4	176.2	-173.6	-161.2	1	113.8	Q339 L340 L341 G345	Q339-R343 PolarHBondContact O-N 2.71Å; L340-R343 WeakPolarHBondContact O-CB 3.32Å; L340-R343 PolarHBondContact O-N 2.85Å; L341-R343 PolarHBondContact O-N 2.79Å; L341-R343 VanDerWaalsContact O-N 3.14Å; R343-G345 PolarHBondContact O-N 2.8Å; R343-G345 VanDerWaalsContact O-N 3.1Å
344	G	39.9	Very low	57.6	Low	62 Å²	62	108.3 Å²	108.3	64%	0.639	61%	0.612	S	S	*	*			trans	-67.8	-3.8	-179.2	0	0	0	0	0	116	L340 L341 T346	L340-G344 PolarHBondContact O-N 2.85Å; L341-G344 PolarHBondContact O-N 2.99Å; L341-G344 VanDerWaalsContact O-N 3.1Å; G344-T346 VanDerWaalsContact C-N 3.28Å; G344-T346 PolarHBondContact O-N 2.81Å
345	G	43.3	Very low	57.2	Low	76 Å²	76	108.7 Å²	108.7	78%	0.784	61%	0.614	S	S	*	*			trans	-75.5	35.5	-170	0	0	0	0	0	117.9	R343	R343-G345 PolarHBondContact O-N 2.8Å; R343-G345 VanDerWaalsContact O-N 3.1Å
346	T	44.8	Very low	57	Low	95 Å²	95	110.6 Å²	110.6	58%	0.583	62%	0.615	S	S	*	*			trans	-139.3	98.6	169.3	44.6	0	0	0	0	112	G344 N348	G344-T346 VanDerWaalsContact C-N 3.28Å; G344-T346 PolarHBondContact O-N 2.81Å; T346-N348 PolarHBondContact O-N 2.97Å
347	A	52	Low	57.3	Low	93 Å²	93	113.9 Å²	113.9	77%	0.769	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	-10.6	-169.2	0	0	0	0	0	116.1
348	N	53.2	Low	58	Low	129 Å²	129	113.3 Å²	113.3	69%	0.69	62%	0.62	S	S	*	*	H	α-helix	trans	-78.2	-24.6	-168.8	-144.4	63.9	0	0	0	114.4	T346	T346-N348 PolarHBondContact O-N 2.97Å
349	N	50.3	Low	58.4	Low	100 Å²	100	115.8 Å²	115.8	54%	0.535	62%	0.619	S	S	.	*	H	α-helix	trans	-85.2	-13.6	-174.7	-70.5	-39.5	0	0	0	114.5
350	N	53.1	Low	59.3	Low	85 Å²	85	115.7 Å²	115.7	46%	0.455	62%	0.622	S	S	.	*	H	α-helix	trans	-79.3	-42.9	178.2	-76	-22.9	0	0	0	111.4	E352 R353 D354	N350-E352 VanDerWaalsContact C-N 3.31Å; N350-E352 PolarHBondContact O-N 3.37Å; N350-R353 PolarHBondContact O-N 3.14Å; N350-R353 PolarHBondContact OD1-NH2 2.93Å; N350-D354 VanDerWaalsContact O-CG 3.26Å; N350-D354 PolarHBondContact O-N 2.78Å
351	A	55.1	Low	60.6	Low	64 Å²	64	113.4 Å²	113.4	53%	0.529	61%	0.607	S	S	.	*	H	α-helix	trans	-57	-39.9	-179.1	0	0	0	0	0	113.5	Q355	A351-Q355 VanDerWaalsContact O-CB 3.27Å; A351-Q355 WeakPolarHBondContact O-CB 3.31Å; A351-Q355 PolarHBondContact O-N 2.76Å
352	E	59	Low	62.1	Low	124 Å²	124	110.2 Å²	110.2	58%	0.579	59%	0.593	S	S	*	*	H	α-helix	trans	-68	-40.5	176.6	-65.8	-169.7	155.5	0	0	112.3	N350 Q355 E356	N350-E352 VanDerWaalsContact C-N 3.31Å; N350-E352 PolarHBondContact O-N 3.37Å; E352-Q355 PolarHBondContact O-N 2.94Å; E352-E356 WeakPolarHBondContact O-CB 3.36Å; E352-E356 PolarHBondContact O-N 2.82Å
353	R	60.8	Low	63.6	Low	158 Å²	158	107.8 Å²	107.8	60%	0.596	58%	0.576	S	S	*	*	H	α-helix	trans	-69	-38.3	176.1	-68.5	-161	-52.6	131.2	6.7	112.5	N350 Q355 E356 Y357	N350-R353 PolarHBondContact O-N 3.14Å; N350-R353 PolarHBondContact OD1-NH2 2.93Å; R353-Q355 VanDerWaalsContact C-N 3.34Å; R353-E356 PolarHBondContact O-N 2.97Å; R353-Y357 VanDerWaalsContact O-CB 3.31Å; R353-Y357 WeakPolarHBondContact O-CB 3.42Å; R353-Y357 PolarHBondContact O-N 3.34Å
354	D	64.9	Low	65.2	Low	100 Å²	100	103.1 Å²	103.1	54%	0.535	57%	0.565	S	S	.	*	H	α-helix	trans	-67.4	-38.3	176	-63.3	-27.6	0	0	0	110.5	N350 Q358	N350-D354 VanDerWaalsContact O-CG 3.26Å; N350-D354 PolarHBondContact O-N 2.78Å; D354-Q358 WeakPolarHBondContact O-CB 3.38Å; D354-Q358 PolarHBondContact O-N 2.87Å
355	Q	70.4	Confident	67.3	Low	129 Å²	129	104.7 Å²	104.7	60%	0.603	56%	0.556	S	S	*	*	H	α-helix	trans	-70.3	-28.8	173.5	-166.1	179.9	41.1	0	0	112.8	A351 E352 R353 R359	A351-Q355 VanDerWaalsContact O-CB 3.27Å; A351-Q355 WeakPolarHBondContact O-CB 3.31Å; A351-Q355 PolarHBondContact O-N 2.76Å; E352-Q355 PolarHBondContact O-N 2.94Å; R353-Q355 VanDerWaalsContact C-N 3.34Å; Q355-R359 VanDerWaalsContact O-CG 3.3Å; Q355-R359 WeakPolarHBondContact O-CG 3.44Å; Q355-R359 PolarHBondContact O-N 3.02Å; Q355-R359 PolarHBondContact O-NE 2.99Å
356	E	70	Confident	69.5	Low	116 Å²	116	104.9 Å²	104.9	54%	0.542	55%	0.545	S	S	.	.	H	α-helix	trans	-74.6	-45.1	171.6	-171.5	157.7	-113	0	0	112.2	E352 R353 Q358 R359 L360	E352-E356 WeakPolarHBondContact O-CB 3.36Å; E352-E356 PolarHBondContact O-N 2.82Å; R353-E356 PolarHBondContact O-N 2.97Å; E356-Q358 VanDerWaalsContact C-N 3.33Å; E356-Q358 PolarHBondContact O-N 2.64Å; E356-R359 VanDerWaalsContact CA-NH2 3.29Å; E356-R359 WeakPolarHBondContact O-CB 3.26Å; E356-R359 PolarHBondContact O-N 3.26Å; E356-L360 WeakPolarHBondContact O-CB 3.27Å; E356-L360 PolarHBondContact O-N 3.11Å
357	Y	72.8	Confident	71.5	Confident	156 Å²	156	106.2 Å²	106.2	61%	0.612	55%	0.548	S	S	*	.	H	α-helix	trans	-56.8	-45.9	173.6	178.6	-97.2	0	0	0	111.4	R353 R359 L360 K361	R353-Y357 VanDerWaalsContact O-CB 3.31Å; R353-Y357 WeakPolarHBondContact O-CB 3.42Å; R353-Y357 PolarHBondContact O-N 3.34Å; Y357-R359 PolarHBondContact O-N 3.45Å; Y357-L360 PolarHBondContact O-N 2.87Å; Y357-K361 WeakPolarHBondContact O-CB 3.44Å; Y357-K361 PolarHBondContact O-N 3.42Å
358	Q	73.7	Confident	73.1	Confident	97 Å²	97	106.6 Å²	106.6	45%	0.453	54%	0.537	S	S	.	.	H	α-helix	trans	-67.9	-33.4	178.3	-170	60.6	24.3	0	0	112.6	D354 E356 V362	D354-Q358 WeakPolarHBondContact O-CB 3.38Å; D354-Q358 PolarHBondContact O-N 2.87Å; E356-Q358 VanDerWaalsContact C-N 3.33Å; E356-Q358 PolarHBondContact O-N 2.64Å; Q358-V362 WeakPolarHBondContact O-CG2 3.5Å; Q358-V362 PolarHBondContact O-N 3.45Å; Q358-V362 VanDerWaalsContact O-N 3.13Å
359	R	80.7	Confident	74.8	Confident	144 Å²	144	103.2 Å²	103.2	54%	0.543	53%	0.526	S	S	.	.	H	α-helix	trans	-65.8	-44.4	171.1	-81	176	-73.1	146	-4.6	111.8	Q355 E356 Y357 V362 G363	Q355-R359 VanDerWaalsContact O-CG 3.3Å; Q355-R359 WeakPolarHBondContact O-CG 3.44Å; Q355-R359 PolarHBondContact O-N 3.02Å; Q355-R359 PolarHBondContact O-NE 2.99Å; E356-R359 VanDerWaalsContact CA-NH2 3.29Å; E356-R359 WeakPolarHBondContact O-CB 3.26Å; E356-R359 PolarHBondContact O-N 3.26Å; Y357-R359 PolarHBondContact O-N 3.45Å; R359-V362 PolarHBondContact O-N 2.87Å; R359-G363 PolarHBondContact O-N 3.45Å
360	L	84	Confident	76.7	Confident	127 Å²	127	101 Å²	101	67%	0.665	52%	0.519	S	S	*	.	H	α-helix	trans	-64.7	-40.9	178.1	-176.3	62	0	0	0	111.5	E356 Y357 G363 M364	E356-L360 WeakPolarHBondContact O-CB 3.27Å; E356-L360 PolarHBondContact O-N 3.11Å; Y357-L360 PolarHBondContact O-N 2.87Å; L360-G363 PolarHBondContact O-N 2.86Å; L360-M364 WeakPolarHBondContact O-CB 3.44Å; L360-M364 PolarHBondContact O-N 3.41Å
361	K	85.3	Confident	78.1	Confident	81 Å²	81	100.6 Å²	100.6	35%	0.352	52%	0.517	S	S	.	.	H	α-helix	trans	-58.6	-52	174.7	177.7	172.1	173.3	174.6	0	112	Y357 G363 M364 E365	Y357-K361 WeakPolarHBondContact O-CB 3.44Å; Y357-K361 PolarHBondContact O-N 3.42Å; K361-G363 VanDerWaalsContact C-N 3.28Å; K361-G363 PolarHBondContact O-N 2.85Å; K361-M364 PolarHBondContact O-N 3.1Å; K361-M364 VanDerWaalsContact O-N 3.1Å; K361-E365 WeakPolarHBondContact CE-OE1 3.36Å; K361-E365 WeakPolarHBondContact CG-OE1 3.31Å; K361-E365 IonicContact NZ-OE1 2.66Å; K361-E365 WeakPolarHBondContact O-CG 3.44Å; K361-E365 PolarHBondContact O-N 3.26Å
362	V	89	Confident	79.7	Confident	78 Å²	78	102 Å²	102	47%	0.473	52%	0.516	S	S	.	.	H	α-helix	trans	-62.5	-36.1	177.5	171.9	0	0	0	0	111.7	Q358 R359 S366	Q358-V362 WeakPolarHBondContact O-CG2 3.5Å; Q358-V362 PolarHBondContact O-N 3.45Å; Q358-V362 VanDerWaalsContact O-N 3.13Å; R359-V362 PolarHBondContact O-N 2.87Å; V362-S366 WeakPolarHBondContact O-CB 3.47Å; V362-S366 PolarHBondContact O-N 3.37Å
363	G	87.8	Confident	81.1	Confident	35 Å²	35	101.1 Å²	101.1	36%	0.361	51%	0.511	S	S	.	.	H	α-helix	trans	-62.3	-41.7	172.2	0	0	0	0	0	113.2	R359 L360 K361 S366 L367	R359-G363 PolarHBondContact O-N 3.45Å; L360-G363 PolarHBondContact O-N 2.86Å; K361-G363 VanDerWaalsContact C-N 3.28Å; K361-G363 PolarHBondContact O-N 2.85Å; G363-S366 PolarHBondContact O-N 3.25Å; G363-L367 WeakPolarHBondContact O-CG 3.42Å; G363-L367 PolarHBondContact O-N 3.2Å
364	M	78.6	Confident	82.3	Confident	116 Å²	116	98.4 Å²	98.4	57%	0.571	50%	0.504	S	S	*	.	H	α-helix	trans	-70.1	-41.4	177.9	-172.1	166.4	65.9	0	0	112.3	L360 K361 S366 L367 L368	L360-M364 WeakPolarHBondContact O-CB 3.44Å; L360-M364 PolarHBondContact O-N 3.41Å; K361-M364 PolarHBondContact O-N 3.1Å; K361-M364 VanDerWaalsContact O-N 3.1Å; M364-S366 VanDerWaalsContact C-N 3.32Å; M364-S366 PolarHBondContact O-N 3.31Å; M364-L367 PolarHBondContact O-N 3.4Å; M364-L367 VanDerWaalsContact O-N 3.15Å; M364-L368 HydrophobicContact CG-CD1 4.42Å; M364-L368 WeakPolarHBondContact O-CG 3.5Å; M364-L368 PolarHBondContact O-N 3.39Å
365	E	83.6	Confident	83.2	Confident	95 Å²	95	97.3 Å²	97.3	44%	0.444	50%	0.498	S	S	.	.	H	α-helix	trans	-60.1	-41.1	173.4	-71.5	167.2	171.6	0	0	111.2	K361 A369	K361-E365 WeakPolarHBondContact CE-OE1 3.36Å; K361-E365 WeakPolarHBondContact CG-OE1 3.31Å; K361-E365 IonicContact NZ-OE1 2.66Å; K361-E365 WeakPolarHBondContact O-CG 3.44Å; K361-E365 PolarHBondContact O-N 3.26Å; E365-A369 PolarHBondContact O-N 2.94Å; E365-A369 VanDerWaalsContact O-N 3.13Å
366	S	90.5	Very high	84.3	Confident	80 Å²	80	96.6 Å²	96.6	56%	0.559	49%	0.49	S	S	*	.	H	α-helix	trans	-69.7	-28.3	174.5	-173.3	0	0	0	0	113.9	V362 G363 M364 S370	V362-S366 WeakPolarHBondContact O-CB 3.47Å; V362-S366 PolarHBondContact O-N 3.37Å; G363-S366 PolarHBondContact O-N 3.25Å; M364-S366 VanDerWaalsContact C-N 3.32Å; M364-S366 PolarHBondContact O-N 3.31Å; S366-S370 WeakPolarHBondContact O-CB 3.45Å; S366-S370 PolarHBondContact O-N 3.3Å
367	L	86.3	Confident	85.1	Confident	123 Å²	123	97.5 Å²	97.5	64%	0.644	49%	0.488	S	S	*	.	H	α-helix	trans	-75.6	-40.6	175.7	-79.2	169.7	0	0	0	111.7	G363 M364 S370 N371	G363-L367 WeakPolarHBondContact O-CG 3.42Å; G363-L367 PolarHBondContact O-N 3.2Å; M364-L367 PolarHBondContact O-N 3.4Å; M364-L367 VanDerWaalsContact O-N 3.15Å; L367-S370 CarbonylContact O-C 3.51Å; L367-S370 PolarHBondContact O-N 3.48Å; L367-N371 PolarHBondContact O-N 3.21Å
368	L	86.4	Confident	85.7	Confident	102 Å²	102	94.7 Å²	94.7	53%	0.534	48%	0.483	S	S	.	.	H	α-helix	trans	-58.6	-53.6	173.4	-76.3	162.9	0	0	0	110.9	M364 S370 N371 D372	M364-L368 HydrophobicContact CG-CD1 4.42Å; M364-L368 WeakPolarHBondContact O-CG 3.5Å; M364-L368 PolarHBondContact O-N 3.39Å; L368-S370 PolarHBondContact O-N 2.98Å; L368-N371 WeakPolarHBondContact O-CA 3.27Å; L368-N371 WeakPolarHBondContact O-CB 3.34Å; L368-N371 PolarHBondContact O-N 3.46Å; L368-D372 VanDerWaalsContact O-CG 3.29Å; L368-D372 PolarHBondContact O-N 3.44Å
369	A	88.6	Confident	86.4	Confident	57 Å²	57	96.2 Å²	96.2	47%	0.471	49%	0.49	S	S	.	.	H	α-helix	trans	-59.4	-32.9	176.6	0	0	0	0	0	113	E365 N371 E373	E365-A369 PolarHBondContact O-N 2.94Å; E365-A369 VanDerWaalsContact O-N 3.13Å; A369-N371 VanDerWaalsContact C-N 3.3Å; A369-E373 WeakPolarHBondContact O-CB 3.41Å; A369-E373 PolarHBondContact O-N 3.37Å
370	S	89.7	Confident	86.9	Confident	53 Å²	53	93.1 Å²	93.1	37%	0.371	48%	0.481	S	S	.	.	H	α-helix	trans	-72.4	-21	172.6	-176.3	0	0	0	0	113.2	S366 L367 L368 K374	S366-S370 WeakPolarHBondContact O-CB 3.45Å; S366-S370 PolarHBondContact O-N 3.3Å; L367-S370 CarbonylContact O-C 3.51Å; L367-S370 PolarHBondContact O-N 3.48Å; L368-S370 PolarHBondContact O-N 2.98Å; S370-K374 VanDerWaalsContact O-CG 3.31Å; S370-K374 WeakPolarHBondContact O-CG 3.37Å; S370-K374 PolarHBondContact O-NZ 3.49Å; S370-K374 PolarHBondContact OG-NZ 3.29Å
371	N	82	Confident	87	Confident	78 Å²	78	91 Å²	91	42%	0.417	47%	0.47	S	S	.	.	H	α-helix	trans	-83.5	-46.8	174.3	-141.1	75.1	0	0	0	110.7	L367 L368 A369 E373 K374 D375	L367-N371 PolarHBondContact O-N 3.21Å; L368-N371 WeakPolarHBondContact O-CA 3.27Å; L368-N371 WeakPolarHBondContact O-CB 3.34Å; L368-N371 PolarHBondContact O-N 3.46Å; A369-N371 VanDerWaalsContact C-N 3.3Å; N371-E373 PolarHBondContact O-N 3.1Å; N371-E373 VanDerWaalsContact O-N 3.12Å; N371-K374 CarbonylContact O-C 3.55Å; N371-K374 WeakPolarHBondContact O-CA 3.41Å; N371-K374 WeakPolarHBondContact O-CB 3.44Å; N371-K374 PolarHBondContact O-N 2.85Å; N371-D375 PolarHBondContact ND2-OD2 3.2Å; N371-D375 PolarHBondContact O-N 3.41Å
372	D	88.9	Confident	87	Confident	94 Å²	94	91.2 Å²	91.2	50%	0.503	48%	0.479	S	S	.	.	H	α-helix	trans	-52.7	-37.3	174.3	-54.9	-28	0	0	0	112	L368 R376	L368-D372 VanDerWaalsContact O-CG 3.29Å; L368-D372 PolarHBondContact O-N 3.44Å; D372-R376 WeakPolarHBondContact O-CB 3.4Å; D372-R376 PolarHBondContact O-N 3.41Å
373	E	89.8	Confident	87	Confident	104 Å²	104	92 Å²	92	49%	0.486	48%	0.48	S	S	.	.	H	α-helix	trans	-68.4	-37.6	174.5	-164.6	63.2	-143.3	0	0	113.1	A369 N371 R376 R377	A369-E373 WeakPolarHBondContact O-CB 3.41Å; A369-E373 PolarHBondContact O-N 3.37Å; N371-E373 PolarHBondContact O-N 3.1Å; N371-E373 VanDerWaalsContact O-N 3.12Å; E373-R376 IonicContact OE1-CZ 3.46Å; E373-R376 IonicContact OE1-NH1 3.34Å; E373-R376 PolarHBondContact OE1-NH1 3.46Å; E373-R376 IonicContact OE2-CZ 2.59Å; E373-R376 IonicContact OE2-NH1 3.95Å; E373-R376 PolarHBondContact OE2-NH1 2.7Å; E373-R376 IonicContact OE2-NH2 2.59Å; E373-R376 PolarHBondContact OE2-NH2 3.49Å; E373-R377 WeakPolarHBondContact O-CB 3.37Å; E373-R377 PolarHBondContact O-N 2.98Å; E373-R377 VanDerWaalsContact O-N 3.07Å
374	K	85.9	Confident	87.1	Confident	101 Å²	101	94.7 Å²	94.7	44%	0.439	49%	0.485	S	S	.	.	H	α-helix	trans	-71.3	-40.5	174.9	-69	176.8	-157.5	93	0	111.2	S370 N371 R377 I378	S370-K374 VanDerWaalsContact O-CG 3.31Å; S370-K374 WeakPolarHBondContact O-CG 3.37Å; S370-K374 PolarHBondContact O-NZ 3.49Å; S370-K374 PolarHBondContact OG-NZ 3.29Å; N371-K374 CarbonylContact O-C 3.55Å; N371-K374 WeakPolarHBondContact O-CA 3.41Å; N371-K374 WeakPolarHBondContact O-CB 3.44Å; N371-K374 PolarHBondContact O-N 2.85Å; K374-R377 CarbonylContact O-C 3.55Å; K374-R377 WeakPolarHBondContact O-CA 3.25Å; K374-R377 WeakPolarHBondContact O-CB 3.02Å; K374-R377 PolarHBondContact O-N 3.28Å; K374-R377 VanDerWaalsContact O-N 3.11Å; K374-I378 VanDerWaalsContact O-CG1 3.3Å; K374-I378 WeakPolarHBondContact O-CG1 3.35Å; K374-I378 PolarHBondContact O-N 3.03Å
375	D	84.1	Confident	87.3	Confident	77 Å²	77	94.7 Å²	94.7	41%	0.412	49%	0.487	S	S	.	.	H	α-helix	trans	-67	-41.7	-179.6	-65.9	-38.9	0	0	0	110.4	N371 R377 I378 E379	N371-D375 PolarHBondContact ND2-OD2 3.2Å; N371-D375 PolarHBondContact O-N 3.41Å; D375-R377 VanDerWaalsContact C-N 3.32Å; D375-R377 PolarHBondContact O-N 2.87Å; D375-I378 WeakPolarHBondContact O-CB 3.48Å; D375-I378 PolarHBondContact O-N 3.38Å; D375-E379 PolarHBondContact O-N 2.95Å
376	R	92.9	Very high	87.3	Confident	114 Å²	114	91.7 Å²	91.7	43%	0.43	48%	0.481	S	S	.	.	H	α-helix	trans	-59.4	-40.8	168.2	-159.7	-169.2	-42.2	121.3	18	112.2	D372 E373 E379 E380	D372-R376 WeakPolarHBondContact O-CB 3.4Å; D372-R376 PolarHBondContact O-N 3.41Å; E373-R376 IonicContact OE1-CZ 3.46Å; E373-R376 IonicContact OE1-NH1 3.34Å; E373-R376 PolarHBondContact OE1-NH1 3.46Å; E373-R376 IonicContact OE2-CZ 2.59Å; E373-R376 IonicContact OE2-NH1 3.95Å; E373-R376 PolarHBondContact OE2-NH1 2.7Å; E373-R376 IonicContact OE2-NH2 2.59Å; E373-R376 PolarHBondContact OE2-NH2 3.49Å; R376-E379 PolarHBondContact O-N 2.74Å; R376-E380 WeakPolarHBondContact O-CG 3.46Å; R376-E380 PolarHBondContact O-N 2.91Å
377	R	86.2	Confident	87	Confident	135 Å²	135	93.1 Å²	93.1	51%	0.509	48%	0.479	S	S	.	.	H	α-helix	trans	-69.2	-31.6	177.5	-171	56.1	173.1	179.5	1.4	113	E373 K374 D375 E380 L381	E373-R377 WeakPolarHBondContact O-CB 3.37Å; E373-R377 PolarHBondContact O-N 2.98Å; E373-R377 VanDerWaalsContact O-N 3.07Å; K374-R377 CarbonylContact O-C 3.55Å; K374-R377 WeakPolarHBondContact O-CA 3.25Å; K374-R377 WeakPolarHBondContact O-CB 3.02Å; K374-R377 PolarHBondContact O-N 3.28Å; K374-R377 VanDerWaalsContact O-N 3.11Å; D375-R377 VanDerWaalsContact C-N 3.32Å; D375-R377 PolarHBondContact O-N 2.87Å; R377-E380 WeakPolarHBondContact CD-OE2 3.46Å; R377-E380 IonicContact CZ-OE2 2.69Å; R377-E380 IonicContact NE-OE2 3.46Å; R377-E380 IonicContact NH1-OE2 2.65Å; R377-E380 PolarHBondContact NH1-OE2 3.46Å; R377-L381 WeakPolarHBondContact O-CB 3.19Å; R377-L381 VanDerWaalsContact O-CG 3.23Å; R377-L381 WeakPolarHBondContact O-CG 3.48Å; R377-L381 PolarHBondContact O-N 3.48Å
378	I	86.8	Confident	86.7	Confident	98 Å²	98	95.1 Å²	95.1	50%	0.503	48%	0.479	S	S	.	.	H	α-helix	trans	-66.8	-40.3	170.9	-71.9	162.1	0	0	0	109.9	K374 D375 L381 T382	K374-I378 VanDerWaalsContact O-CG1 3.3Å; K374-I378 WeakPolarHBondContact O-CG1 3.35Å; K374-I378 PolarHBondContact O-N 3.03Å; D375-I378 WeakPolarHBondContact O-CB 3.48Å; D375-I378 PolarHBondContact O-N 3.38Å; I378-L381 PolarHBondContact O-N 3.1Å; I378-T382 WeakPolarHBondContact O-CB 3.09Å; I378-T382 PolarHBondContact O-N 2.73Å; I378-T382 PolarHBondContact O-OG1 3.41Å
379	E	87.9	Confident	86.4	Confident	129 Å²	129	97.7 Å²	97.7	60%	0.603	48%	0.482	S	S	*	.	H	α-helix	trans	-66.2	-46.1	175.9	-169.9	164.2	-127.8	0	0	112	D375 R376 L381 T382 I383	D375-E379 PolarHBondContact O-N 2.95Å; R376-E379 PolarHBondContact O-N 2.74Å; E379-L381 VanDerWaalsContact C-N 3.35Å; E379-L381 PolarHBondContact O-N 2.88Å; E379-T382 WeakPolarHBondContact O-CB 3.37Å; E379-T382 PolarHBondContact O-N 3.4Å; E379-T382 VanDerWaalsContact O-N 3.1Å; E379-I383 HydrophobicContact CG-CD1 4.25Å; E379-I383 WeakPolarHBondContact O-CG1 3.3Å; E379-I383 PolarHBondContact O-N 2.95Å
380	E	90.6	Very high	86.1	Confident	78 Å²	78	102.3 Å²	102.3	36%	0.364	49%	0.491	S	S	.	.	H	α-helix	trans	-54.8	-47.1	171.4	-74	177.7	174	0	0	112.4	R376 R377 T382 I383 L384	R376-E380 WeakPolarHBondContact O-CG 3.46Å; R376-E380 PolarHBondContact O-N 2.91Å; R377-E380 WeakPolarHBondContact CD-OE2 3.46Å; R377-E380 IonicContact CZ-OE2 2.69Å; R377-E380 IonicContact NE-OE2 3.46Å; R377-E380 IonicContact NH1-OE2 2.65Å; R377-E380 PolarHBondContact NH1-OE2 3.46Å; E380-T382 VanDerWaalsContact C-N 3.32Å; E380-T382 PolarHBondContact O-N 3.14Å; E380-I383 PolarHBondContact O-N 3.15Å; E380-L384 WeakPolarHBondContact O-CB 3.41Å; E380-L384 WeakPolarHBondContact O-CG 3.31Å; E380-L384 PolarHBondContact O-N 2.77Å
381	L	85.6	Confident	85.8	Confident	82 Å²	82	103.8 Å²	103.8	43%	0.429	50%	0.498	S	S	.	.	H	α-helix	trans	-65.1	-35.3	176.7	-75.1	172.8	0	0	0	112.1	R377 I378 E379 L384 L385	R377-L381 WeakPolarHBondContact O-CB 3.19Å; R377-L381 VanDerWaalsContact O-CG 3.23Å; R377-L381 WeakPolarHBondContact O-CG 3.48Å; R377-L381 PolarHBondContact O-N 3.48Å; I378-L381 PolarHBondContact O-N 3.1Å; E379-L381 VanDerWaalsContact C-N 3.35Å; E379-L381 PolarHBondContact O-N 2.88Å; L381-L384 PolarHBondContact O-N 2.88Å; L381-L385 WeakPolarHBondContact O-CB 3.4Å; L381-L385 VanDerWaalsContact O-CG 3.26Å; L381-L385 WeakPolarHBondContact O-CG 3.5Å; L381-L385 PolarHBondContact O-N 3.27Å
382	T	86.6	Confident	85.4	Confident	86 Å²	86	106.9 Å²	106.9	53%	0.528	50%	0.504	S	S	.	.	H	α-helix	trans	-67.4	-41.3	176.1	-60.4	0	0	0	0	111.1	I378 E379 E380 L385 G386	I378-T382 WeakPolarHBondContact O-CB 3.09Å; I378-T382 PolarHBondContact O-N 2.73Å; I378-T382 PolarHBondContact O-OG1 3.41Å; E379-T382 WeakPolarHBondContact O-CB 3.37Å; E379-T382 PolarHBondContact O-N 3.4Å; E379-T382 VanDerWaalsContact O-N 3.1Å; E380-T382 VanDerWaalsContact C-N 3.32Å; E380-T382 PolarHBondContact O-N 3.14Å; T382-L385 PolarHBondContact O-N 3.48Å; T382-G386 PolarHBondContact O-N 2.96Å
383	I	88.5	Confident	84.8	Confident	96 Å²	96	106.2 Å²	106.2	49%	0.492	50%	0.497	S	S	.	.	H	α-helix	trans	-62.7	-46.3	173.6	-67.7	163.7	0	0	0	110.4	E379 E380 G386 Q387	E379-I383 HydrophobicContact CG-CD1 4.25Å; E379-I383 WeakPolarHBondContact O-CG1 3.3Å; E379-I383 PolarHBondContact O-N 2.95Å; E380-I383 PolarHBondContact O-N 3.15Å; I383-G386 PolarHBondContact O-N 2.85Å; I383-Q387 WeakPolarHBondContact O-CG 3.48Å; I383-Q387 PolarHBondContact O-N 3.11Å
384	L	90.1	Very high	84	Confident	90 Å²	90	107.9 Å²	107.9	47%	0.471	51%	0.507	S	S	.	.	H	α-helix	trans	-62.2	-42	177.1	-77.3	163.4	0	0	0	112.6	E380 L381 G386 Q387 Y388	E380-L384 WeakPolarHBondContact O-CB 3.41Å; E380-L384 WeakPolarHBondContact O-CG 3.31Å; E380-L384 PolarHBondContact O-N 2.77Å; L381-L384 PolarHBondContact O-N 2.88Å; L384-G386 VanDerWaalsContact C-N 3.33Å; L384-G386 PolarHBondContact O-N 3.14Å; L384-Q387 PolarHBondContact O-N 3.45Å; L384-Y388 WeakPolarHBondContact O-CB 3.39Å; L384-Y388 PolarHBondContact O-N 2.88Å
385	L	81.4	Confident	83.1	Confident	117 Å²	117	109 Å²	109	61%	0.613	52%	0.516	S	S	*	.	H	α-helix	trans	-65.5	-35.5	174	-74.5	168.6	0	0	0	112.1	L381 T382 R389	L381-L385 WeakPolarHBondContact O-CB 3.4Å; L381-L385 VanDerWaalsContact O-CG 3.26Å; L381-L385 WeakPolarHBondContact O-CG 3.5Å; L381-L385 PolarHBondContact O-N 3.27Å; T382-L385 PolarHBondContact O-N 3.48Å; L385-R389 VanDerWaalsContact O-CB 3.32Å; L385-R389 WeakPolarHBondContact O-CB 3.41Å; L385-R389 PolarHBondContact O-N 2.75Å
386	G	85.3	Confident	81.9	Confident	32 Å²	32	108.9 Å²	108.9	33%	0.33	52%	0.52	S	S	.	.	H	α-helix	trans	-65.1	-41.6	171.8	0	0	0	0	0	112.8	T382 I383 L384 K390	T382-G386 PolarHBondContact O-N 2.96Å; I383-G386 PolarHBondContact O-N 2.85Å; L384-G386 VanDerWaalsContact C-N 3.33Å; L384-G386 PolarHBondContact O-N 3.14Å; G386-K390 WeakPolarHBondContact O-CG 3.27Å; G386-K390 PolarHBondContact O-N 2.77Å
387	Q	83.3	Confident	80.3	Confident	109 Å²	109	110.4 Å²	110.4	51%	0.509	54%	0.536	S	S	.	.	H	α-helix	trans	-65.1	-47.7	174	-71.3	175.3	3.3	0	0	111.5	I383 L384 R389 K390 V391	I383-Q387 WeakPolarHBondContact O-CG 3.48Å; I383-Q387 PolarHBondContact O-N 3.11Å; L384-Q387 PolarHBondContact O-N 3.45Å; Q387-R389 VanDerWaalsContact C-N 3.3Å; Q387-R389 PolarHBondContact O-N 3.36Å; Q387-K390 PolarHBondContact O-N 3.42Å; Q387-K390 VanDerWaalsContact O-N 3.17Å; Q387-V391 WeakPolarHBondContact O-CG2 3.38Å; Q387-V391 PolarHBondContact O-N 3.08Å
388	Y	79.2	Confident	78.7	Confident	166 Å²	166	109 Å²	109	65%	0.651	54%	0.543	S	S	*	.	H	α-helix	trans	-58.7	-41.4	176.9	-176	-101.2	0	0	0	112	L384 V391 R392	L384-Y388 WeakPolarHBondContact O-CB 3.39Å; L384-Y388 PolarHBondContact O-N 2.88Å; Y388-V391 PolarHBondContact O-N 2.67Å; Y388-R392 WeakPolarHBondContact O-CB 3.43Å; Y388-R392 PolarHBondContact O-N 2.82Å
389	R	81.9	Confident	76.9	Confident	155 Å²	155	112.2 Å²	112.2	59%	0.585	56%	0.556	S	S	*	*	H	α-helix	trans	-60.2	-48.7	174.3	-174.4	-179.1	-55.6	-157.2	5	111.9	L385 Q387 V391 R392 E393	L385-R389 VanDerWaalsContact O-CB 3.32Å; L385-R389 WeakPolarHBondContact O-CB 3.41Å; L385-R389 PolarHBondContact O-N 2.75Å; Q387-R389 VanDerWaalsContact C-N 3.3Å; Q387-R389 PolarHBondContact O-N 3.36Å; R389-V391 PolarHBondContact O-N 2.82Å; R389-R392 PolarHBondContact O-N 3.11Å; R389-E393 WeakPolarHBondContact CD-OE1 3.17Å; R389-E393 WeakPolarHBondContact CG-OE1 3.36Å; R389-E393 WeakPolarHBondContact O-CB 3.37Å; R389-E393 PolarHBondContact O-N 2.79Å
390	K	82.5	Confident	74.5	Confident	155 Å²	155	109.3 Å²	109.3	67%	0.674	56%	0.56	S	S	*	*	H	α-helix	trans	-61.9	-39.1	177	-74.1	178.2	178.5	-175.5	0	113	G386 Q387 E393 M394	G386-K390 WeakPolarHBondContact O-CG 3.27Å; G386-K390 PolarHBondContact O-N 2.77Å; Q387-K390 PolarHBondContact O-N 3.42Å; Q387-K390 VanDerWaalsContact O-N 3.17Å; K390-E393 PolarHBondContact O-N 3Å; K390-M394 WeakPolarHBondContact O-CB 3.38Å; K390-M394 PolarHBondContact O-N 3.14Å
391	V	81.6	Confident	71.6	Confident	84 Å²	84	111.4 Å²	111.4	51%	0.509	58%	0.583	S	S	.	*	H	α-helix	trans	-66	-44.1	175.9	170.4	0	0	0	0	110.9	Q387 Y388 R389 E393 M394 M395	Q387-V391 WeakPolarHBondContact O-CG2 3.38Å; Q387-V391 PolarHBondContact O-N 3.08Å; Y388-V391 PolarHBondContact O-N 2.67Å; R389-V391 PolarHBondContact O-N 2.82Å; V391-E393 VanDerWaalsContact C-N 3.35Å; V391-E393 PolarHBondContact O-N 2.84Å; V391-M394 PolarHBondContact O-N 2.97Å; V391-M395 VanDerWaalsContact O-CB 3.3Å; V391-M395 WeakPolarHBondContact O-CB 3.44Å; V391-M395 PolarHBondContact O-N 3.38Å
392	R	75.1	Confident	69.2	Low	143 Å²	143	112 Å²	112	54%	0.54	59%	0.594	S	S	.	*	H	α-helix	trans	-61.2	-42.5	174.8	-174.2	-164.5	65.7	176.9	-0.7	111.9	Y388 R389 M395 S396	Y388-R392 WeakPolarHBondContact O-CB 3.43Å; Y388-R392 PolarHBondContact O-N 2.82Å; R389-R392 PolarHBondContact O-N 3.11Å; R392-M395 PolarHBondContact O-N 3.29Å; R392-S396 PolarHBondContact O-N 3.41Å; R392-S396 PolarHBondContact O-OG 3.07Å
393	E	75.4	Confident	66.6	Low	79 Å²	79	116.2 Å²	116.2	37%	0.369	61%	0.608	S	S	.	*	H	α-helix	trans	-67.8	-43.3	178.2	-80	149.4	-156.8	0	0	111.7	R389 K390 V391 M395 S396 L397	R389-E393 WeakPolarHBondContact CD-OE1 3.17Å; R389-E393 WeakPolarHBondContact CG-OE1 3.36Å; R389-E393 WeakPolarHBondContact O-CB 3.37Å; R389-E393 PolarHBondContact O-N 2.79Å; K390-E393 PolarHBondContact O-N 3Å; V391-E393 VanDerWaalsContact C-N 3.35Å; V391-E393 PolarHBondContact O-N 2.84Å; E393-M395 VanDerWaalsContact C-N 3.32Å; E393-M395 PolarHBondContact O-N 3.44Å; E393-S396 WeakPolarHBondContact CA-OG 3.42Å; E393-S396 PolarHBondContact O-N 3.01Å; E393-S396 VanDerWaalsContact O-N 3.14Å; E393-S396 PolarHBondContact O-OG 2.87Å; E393-L397 WeakPolarHBondContact O-CD1 3.31Å; E393-L397 PolarHBondContact O-N 2.82Å
394	M	72.6	Confident	64	Low	139 Å²	139	120.4 Å²	120.4	69%	0.685	63%	0.626	S	S	*	*	H	α-helix	trans	-58.7	-42.6	171.8	-178.1	172.4	-75.2	0	0	112.3	K390 V391 S396 L397 T398	K390-M394 WeakPolarHBondContact O-CB 3.38Å; K390-M394 PolarHBondContact O-N 3.14Å; V391-M394 PolarHBondContact O-N 2.97Å; M394-S396 VanDerWaalsContact C-N 3.29Å; M394-S396 PolarHBondContact O-N 3.12Å; M394-L397 PolarHBondContact O-N 2.89Å; M394-L397 VanDerWaalsContact O-N 3.15Å; M394-T398 PolarHBondContact O-N 3.25Å; M394-T398 PolarHBondContact O-OG1 2.98Å
395	M	66.6	Low	61.6	Low	126 Å²	126	122.7 Å²	122.7	62%	0.621	63%	0.634	S	S	*	*	H	α-helix	trans	-64.9	-31.1	177.2	-167.7	173.6	-69.8	0	0	112.5	V391 R392 E393 T398	V391-M395 VanDerWaalsContact O-CB 3.3Å; V391-M395 WeakPolarHBondContact O-CB 3.44Å; V391-M395 PolarHBondContact O-N 3.38Å; R392-M395 PolarHBondContact O-N 3.29Å; E393-M395 VanDerWaalsContact C-N 3.32Å; E393-M395 PolarHBondContact O-N 3.44Å; M395-T398 PolarHBondContact O-OG1 3.45Å
396	S	60	Low	59.2	Low	73 Å²	73	124.5 Å²	124.5	51%	0.51	64%	0.643	S	S	.	*	H	α-helix	trans	-75	-29.9	171.5	61.5	0	0	0	0	113.9	R392 E393 M394 H399	R392-S396 PolarHBondContact O-N 3.41Å; R392-S396 PolarHBondContact O-OG 3.07Å; E393-S396 WeakPolarHBondContact CA-OG 3.42Å; E393-S396 PolarHBondContact O-N 3.01Å; E393-S396 VanDerWaalsContact O-N 3.14Å; E393-S396 PolarHBondContact O-OG 2.87Å; M394-S396 VanDerWaalsContact C-N 3.29Å; M394-S396 PolarHBondContact O-N 3.12Å; S396-H399 PolarHBondContact O-N 3.01Å
397	L	58.5	Low	56.6	Low	146 Å²	146	127.8 Å²	127.8	76%	0.764	66%	0.661	S	S	*	*	H	α-helix	trans	-78.1	-19.2	176.7	-89.1	80.7	0	0	0	113.6	E393 M394 H399	E393-L397 WeakPolarHBondContact O-CD1 3.31Å; E393-L397 PolarHBondContact O-N 2.82Å; M394-L397 PolarHBondContact O-N 2.89Å; M394-L397 VanDerWaalsContact O-N 3.15Å; L397-H399 VanDerWaalsContact C-N 3.25Å; L397-H399 PolarHBondContact O-N 3.19Å
398	T	54.3	Low	54.4	Low	106 Å²	106	126.7 Å²	126.7	65%	0.65	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-6.3	172.5	38.1	0	0	0	0	114.5	M394 M395	M394-T398 PolarHBondContact O-N 3.25Å; M394-T398 PolarHBondContact O-OG1 2.98Å; M395-T398 PolarHBondContact O-OG1 3.45Å
399	H	48.8	Very low	52.1	Low	166 Å²	166	123 Å²	123	77%	0.769	68%	0.677	S	S	*	*	S	Bend	trans	-117	91	170.9	-77.7	-79.2	0	0	0	109.8	S396 L397	S396-H399 PolarHBondContact O-N 3.01Å; L397-H399 VanDerWaalsContact C-N 3.25Å; L397-H399 PolarHBondContact O-N 3.19Å
400	G	36.3	Very low	49.7	Very low	67 Å²	67	123.2 Å²	123.2	69%	0.691	69%	0.689	S	S	*	*			trans	-117.6	132.7	-178.7	0	0	0	0	0	113.4
401	S	30.7	Very low	47.2	Very low	123 Å²	123	125.8 Å²	125.8	86%	0.86	70%	0.701	S	S	*	*			trans	69.9	132.8	173.9	-144.1	0	0	0	0	115.6
402	S	34.9	Very low	45	Very low	94 Å²	94	129.4 Å²	129.4	66%	0.657	72%	0.716	S	S	*	*			cis	-141.9	134.2	4.3	57.3	0	0	0	0	112.5
403	E	32.2	Very low	42.9	Very low	175 Å²	175	132.6 Å²	132.6	82%	0.818	73%	0.734	S	S	*	*				33.9	129.4	129.2	-63.5	165.5	-165.2	0	0	119.8
404	E	34.1	Very low	40.7	Very low	184 Å²	184	132.7 Å²	132.7	86%	0.86	75%	0.748	S	S	*	*			cis	-155.5	161.3	-15.4	-84.8	-155.3	127.1	0	0	106.2
405	E	40.1	Very low	38.6	Very low	137 Å²	137	133.8 Å²	133.8	64%	0.64	76%	0.755	S	S	*	*			cis	-139.8	164.1	-3.6	-156.6	-69.1	104.7	0	0	106
406	L	30.9	Very low	37	Very low	156 Å²	156	133.7 Å²	133.7	82%	0.817	76%	0.762	S	S	*	*			trans	-176.4	159.4	144.6	-104.2	165.9	0	0	0	111.8
407	S	30.4	Very low	35.5	Very low	101 Å²	101	138.8 Å²	138.8	71%	0.706	78%	0.777	S	S	*	*			trans	92.5	52.1	170.4	-146.8	0	0	0	0	116.9	S409	S407-S409 PolarHBondContact O-N 3.31Å
408	G	36	Very low	34.1	Very low	86 Å²	86	140.2 Å²	140.2	89%	0.887	78%	0.777	S	S	*	*			trans	-58.5	98.5	160.9	0	0	0	0	0	112.6
409	S	30.8	Very low	32.8	Very low	88 Å²	88	139.7 Å²	139.7	62%	0.615	78%	0.784	S	S	*	*			trans	-127	123	-176.9	-171.9	0	0	0	0	113.5	S407	S407-S409 PolarHBondContact O-N 3.31Å
410	L	32.6	Very low	31.8	Very low	159 Å²	159	138.8 Å²	138.8	83%	0.832	78%	0.78	S	S	*	*			trans	38.5	101	153.6	-59.7	174.9	0	0	0	118.2
411	K	30.2	Very low	31.4	Very low	210 Å²	210	139.6 Å²	139.6	91%	0.913	78%	0.775	S	S	*	*			trans	-131.4	108.6	158.4	-100.9	172.8	-178.2	164.4	0	112.8
412	L	33.8	Very low	31.3	Very low	160 Å²	160	140.9 Å²	140.9	84%	0.838	77%	0.772	S	S	*	*			trans	-63.1	142	157.2	-73.6	68.8	0	0	0	108.9
413	K	31.3	Very low	31.2	Very low	210 Å²	210	144.3 Å²	144.3	91%	0.913	78%	0.781	S	S	*	*			trans	-102	96.5	154.1	-105.3	-175.9	175.2	179.8	0	108.6
414	A	29.5	Very low	31.1	Very low	81 Å²	81	143.2 Å²	143.2	67%	0.669	78%	0.779	S	S	*	*			trans	-76.6	138.2	163.3	0	0	0	0	0	109.1
415	I	29	Very low	31	Very low	162 Å²	162	143.2 Å²	143.2	83%	0.831	78%	0.776	S	S	*	*			trans	-94.8	117.6	170.1	-60.2	173.3	0	0	0	107.2
416	T	32	Very low	30.4	Very low	123 Å²	123	140.4 Å²	140.4	76%	0.755	77%	0.772	S	S	*	*			trans	-136.2	121.1	172.9	52.1	0	0	0	0	110.1
417	H	29.2	Very low	30.2	Very low	180 Å²	180	140.7 Å²	140.7	83%	0.833	77%	0.769	S	S	*	*			trans	-61.8	144.5	172.4	-60.8	-109.5	0	0	0	111.1
418	K	29.9	Very low	30	Very low	176 Å²	176	143.4 Å²	143.4	77%	0.765	77%	0.773	S	S	*	*			trans	-154	113.9	134.2	-128.6	-174	-177.5	-149.5	0	110.7	H420	K418-H420 VanDerWaalsContact CE-NE2 3.33Å; K418-H420 WeakPolarHBondContact CE-NE2 3.26Å; K418-H420 PolarHBondContact NZ-CD2 2.95Å; K418-H420 PolarHBondContact NZ-NE2 3.26Å
419	A	26.5	Very low	29.8	Very low	95 Å²	95	144.1 Å²	144.1	79%	0.785	76%	0.764	S	S	*	*			trans	-79.6	146.8	152.8	0	0	0	0	0	108
420	H	28.5	Very low	29.6	Very low	148 Å²	148	145.5 Å²	145.5	69%	0.685	77%	0.774	S	S	*	*			trans	-144.1	153.9	157	-101.9	-78	0	0	0	109.8	K418	K418-H420 VanDerWaalsContact CE-NE2 3.33Å; K418-H420 WeakPolarHBondContact CE-NE2 3.26Å; K418-H420 PolarHBondContact NZ-CD2 2.95Å; K418-H420 PolarHBondContact NZ-NE2 3.26Å
421	S	26.6	Very low	29.6	Very low	84 Å²	84	149.7 Å²	149.7	59%	0.587	78%	0.778	S	S	*	*			trans	-94.2	-176.6	-165.4	44.4	0	0	0	0	113.4
422	D	28.9	Very low	29.7	Very low	149 Å²	149	143 Å²	143	80%	0.797	77%	0.769	S	S	*	*			trans	86.4	106.3	152.9	-49.2	-50.4	0	0	0	118.8
423	I	32.4	Very low	29.7	Very low	167 Å²	167	141.7 Å²	141.7	86%	0.856	77%	0.773	S	S	*	*			trans	-129.3	120.2	159.6	-67.9	177.2	0	0	0	108.1
424	I	30.8	Very low	29.6	Very low	152 Å²	152	137.2 Å²	137.2	78%	0.779	77%	0.769	S	S	*	*			trans	176	133.1	166.2	-99.6	150.2	0	0	0	104.8
425	K	30.7	Very low	30.6	Very low	184 Å²	184	138.6 Å²	138.6	80%	0.8	77%	0.771	S	S	*	*			cis	-152.2	176.3	-5.6	-101.9	170.7	-177.6	173.7	0	106
426	S	28.2	Very low	30.5	Very low	78 Å²	78	138.2 Å²	138.2	55%	0.545	77%	0.77	S	S	.	*			cis	-159.2	164.3	13.1	-148.5	0	0	0	0	110
427	E	26.5	Very low	30.4	Very low	161 Å²	161	139.6 Å²	139.6	75%	0.752	77%	0.769	S	S	*	*			trans	58.4	152.5	146.7	-76.8	158.2	115.2	0	0	120.9
428	M	25.9	Very low	30.1	Very low	159 Å²	159	138.3 Å²	138.3	78%	0.783	77%	0.768	S	S	*	*			cis	-151.9	155.7	-13.3	175.9	58.6	90.9	0	0	108.7
429	S	31.9	Very low	29.7	Very low	101 Å²	101	135.6 Å²	135.6	71%	0.706	77%	0.77	S	S	*	*			trans	-72	146.9	178.4	179.4	0	0	0	0	114
430	S	26.7	Very low	30.3	Very low	117 Å²	117	137.1 Å²	137.1	82%	0.818	77%	0.772	S	S	*	*			trans	-165.9	165	136.4	47.1	0	0	0	0	114.2
431	R	33.7	Very low	30	Very low	246 Å²	246	135.1 Å²	135.1	93%	0.928	77%	0.774	S	S	*	*			trans	-82.3	161.4	-166.3	-64.4	165.4	171.2	156.5	-5.7	113.7
432	G	31.5	Very low	31.1	Very low	70 Å²	70	135.8 Å²	135.8	72%	0.722	78%	0.777	S	S	*	*			trans	-69	-175.7	175.2	0	0	0	0	0	117.8
433	S	35.2	Very low	31	Very low	132 Å²	132	137.7 Å²	137.7	92%	0.923	78%	0.778	S	S	*	*			trans	78.3	123.5	178.6	-58.5	0	0	0	0	117.3
434	S	28.5	Very low	30.6	Very low	117 Å²	117	136.1 Å²	136.1	82%	0.818	77%	0.767	S	S	*	*			trans	-80.8	177.7	166.2	-39.5	0	0	0	0	110.5
435	P	49.4	Very low	30.6	Very low	110 Å²	110	137.1 Å²	137.1	71%	0.714	76%	0.761	S	S	*	*			cis	-141.7	-175.2	6.7	42.3	-22.8	0	0	0	117.3
436	L	27.9	Very low	30.3	Very low	154 Å²	154	135 Å²	135	81%	0.806	75%	0.754	S	S	*	*			trans	82.8	120	155.9	-63.4	-177.6	0	0	0	122.5
437	M	29	Very low	30.4	Very low	151 Å²	151	137.8 Å²	137.8	74%	0.744	76%	0.762	S	S	*	*			trans	78.1	112.7	134.7	-62.5	-65.6	-102.5	0	0	123.5
438	L	23.9	Very low	30.5	Very low	153 Å²	153	137 Å²	137	80%	0.801	76%	0.763	S	S	*	*			trans	77.8	140.3	136.3	-64.4	171	0	0	0	122.4
439	C	20.9	Very low	30.7	Very low	120 Å²	120	134.3 Å²	134.3	81%	0.811	76%	0.76	S	S	*	*			trans	-78.6	175.1	169.1	-61.9	0	0	0	0	111.4
440	P	39.6	Very low	30.4	Very low	127 Å²	127	133.4 Å²	133.4	83%	0.825	75%	0.754	S	S	*	*			cis	-142.9	-162.8	23	43.4	-21.5	0	0	0	117.4
441	S	22.6	Very low	30.3	Very low	105 Å²	105	136.6 Å²	136.6	73%	0.734	75%	0.753	S	S	*	*			trans	-87.1	-163.3	177.6	62	0	0	0	0	112.3
442	P	48.4	Very low	30.1	Very low	99 Å²	99	132.5 Å²	132.5	64%	0.643	74%	0.744	S	S	*	*			cis	-138	-169.3	-9.7	22.1	5.6	0	0	0	115.5
443	F	27.2	Very low	29.8	Very low	189 Å²	189	135.6 Å²	135.6	83%	0.829	74%	0.744	S	S	*	*			trans	80.7	140	152.5	-78.7	-68.8	0	0	0	123.7
444	Q	24.4	Very low	29.3	Very low	133 Å²	133	133.3 Å²	133.3	62%	0.621	73%	0.728	S	S	*	*				119.5	120	126.1	-144.9	124.5	-95.9	0	0	119.3
445	R	29.8	Very low	29.3	Very low	173 Å²	173	134.4 Å²	134.4	65%	0.653	72%	0.722	S	S	*	*				32.5	157.5	127.5	-63.7	-172	-90.6	152.2	-6.5	121.2
446	E	24.3	Very low	28.1	Very low	140 Å²	140	136.7 Å²	136.7	65%	0.654	72%	0.723	S	S	*	*			cis	-171.3	167.9	-0.3	-112.2	163.1	178.4	0	0	110.2
447	L	31.7	Very low	28	Very low	136 Å²	136	135.1 Å²	135.1	71%	0.712	72%	0.721	S	S	*	*			trans	42.8	122.1	145.1	-92.2	80.7	0	0	0	121.5
448	D	27.8	Very low	27.7	Very low	145 Å²	145	132.7 Å²	132.7	78%	0.775	72%	0.718	S	S	*	*				95.6	162.8	81.7	-92.2	15.5	0	0	0	113.7
449	S	29.7	Very low	27.9	Very low	102 Å²	102	132.5 Å²	132.5	71%	0.713	72%	0.717	S	S	*	*			cis	-165.8	-169.6	-0.4	45.1	0	0	0	0	111.5
450	S	26.8	Very low	28.2	Very low	83 Å²	83	132.4 Å²	132.4	58%	0.58	71%	0.713	S	S	*	*			trans	102.3	144.2	151.9	-134.2	0	0	0	0	117
451	F	25.3	Very low	27.5	Very low	184 Å²	184	131.7 Å²	131.7	81%	0.807	71%	0.706	S	S	*	*			cis	-134.2	165.6	17.7	-89.6	-86.7	0	0	0	116
452	Q	28.4	Very low	27.6	Very low	159 Å²	159	133.3 Å²	133.3	74%	0.743	71%	0.712	S	S	*	*			trans	-35.8	164.7	163.5	-69.9	169	-32.7	0	0	117.1
453	N	26	Very low	26.6	Very low	135 Å²	135	132 Å²	132	72%	0.722	72%	0.717	S	S	*	*			cis	-160	171.2	6.2	-124.2	12.8	0	0	0	108.1
454	S	24.2	Very low	26.5	Very low	84 Å²	84	131.1 Å²	131.1	59%	0.587	72%	0.721	S	S	*	*			cis	-152.3	-140	-7	-166.2	0	0	0	0	105.6
455	M	27.5	Very low	26.6	Very low	141 Å²	141	128.4 Å²	128.4	70%	0.695	72%	0.721	S	S	*	*			cis	-164.9	152	-7.2	-136.6	118.5	174.9	0	0	104.6
456	E	24.8	Very low	26.4	Very low	157 Å²	157	124.7 Å²	124.7	73%	0.734	72%	0.721	S	S	*	*			cis	-158.9	-126.9	-3.7	-149.2	166.5	-166.3	0	0	112
457	T	24.9	Very low	26.5	Very low	122 Å²	122	127 Å²	127	75%	0.748	73%	0.73	S	S	*	*			trans	-73.5	152.2	-175.6	42.9	0	0	0	0	116.4
458	S	24.6	Very low	26.4	Very low	100 Å²	100	128.3 Å²	128.3	70%	0.699	74%	0.737	S	S	*	*			cis	-163.4	-161.3	1.4	53	0	0	0	0	109
459	L	27.1	Very low	26.3	Very low	149 Å²	149	129.5 Å²	129.5	78%	0.78	74%	0.743	S	S	*	*			cis	-156.9	-152.2	14.8	-137.1	-179.5	0	0	0	110.1
460	V	26.8	Very low	26	Very low	118 Å²	118	127.5 Å²	127.5	72%	0.715	74%	0.739	S	S	*	*			trans	-146.5	168.8	-176.3	-95.8	0	0	0	0	110.3
461	T	24.5	Very low	25.9	Very low	111 Å²	111	128.7 Å²	128.7	68%	0.681	75%	0.747	S	S	*	*			cis	-157.9	165.3	23.3	-19.8	0	0	0	0	111.8
462	T	26.3	Very low	26	Very low	139 Å²	139	126.6 Å²	126.6	85%	0.853	74%	0.743	S	S	*	*			trans	58.9	143	159.7	49.4	0	0	0	0	119.5
463	G	25.8	Very low	26	Very low	73 Å²	73	126.3 Å²	126.3	75%	0.753	74%	0.742	S	S	*	*			cis	128.6	99.1	-12.1	0	0	0	0	0	115
464	D	25.5	Very low	25.9	Very low	170 Å²	170	128.9 Å²	128.9	91%	0.909	74%	0.741	S	S	*	*			trans	-167.5	173.7	137	-131.7	-28.7	0	0	0	115.5
465	A	26.2	Very low	25.8	Very low	75 Å²	75	132.5 Å²	132.5	62%	0.62	75%	0.748	S	S	*	*			trans	-40.6	116.9	-169.1	0	0	0	0	0	123.2
466	S	25.9	Very low	25.7	Very low	95 Å²	95	135.9 Å²	135.9	66%	0.664	75%	0.754	S	S	*	*				87.5	142.9	112.9	80	0	0	0	0	124.5
467	F	25.8	Very low	25.7	Very low	189 Å²	189	134.9 Å²	134.9	83%	0.829	75%	0.752	S	S	*	*			trans	83.7	124.9	154.5	-73.2	-65.8	0	0	0	124
468	L	30.6	Very low	25.6	Very low	164 Å²	164	136.3 Å²	136.3	86%	0.859	75%	0.754	S	S	*	*			trans	68.3	70.8	155.6	-58.2	-178.8	0	0	0	119.9
469	N	26.1	Very low	25.6	Very low	169 Å²	169	136.7 Å²	136.7	90%	0.904	76%	0.757	S	S	*	*			trans	-66.8	161.2	143.8	-150.8	31.6	0	0	0	109.4
470	G	23.7	Very low	25.3	Very low	61 Å²	61	135.1 Å²	135.1	63%	0.629	76%	0.759	S	S	*	*			cis	157.2	174.4	5.8	0	0	0	0	0	110.1
471	S	24.2	Very low	25.2	Very low	107 Å²	107	134.9 Å²	134.9	75%	0.748	76%	0.763	S	S	*	*			trans	-140.6	156.8	-168.8	-149.7	0	0	0	0	115
472	L	26.7	Very low	25.3	Very low	140 Å²	140	136 Å²	136	73%	0.733	76%	0.764	S	S	*	*			trans	73	133.9	157.1	-66.2	152.4	0	0	0	120.9
473	H	28.1	Very low	25.5	Very low	154 Å²	154	137.2 Å²	137.2	71%	0.713	76%	0.759	S	S	*	*				110.9	119.9	125.5	-88.9	11.2	0	0	0	124.2
474	R	23.7	Very low	25.7	Very low	189 Å²	189	141.7 Å²	141.7	71%	0.713	76%	0.761	S	S	*	*				94.1	130.1	128.9	-76.5	-179	114.9	175.3	3.9	123.5
475	H	23.6	Very low	25.6	Very low	159 Å²	159	141.3 Å²	141.3	74%	0.736	76%	0.758	S	S	*	*			trans	64.8	126.9	153.1	-65.8	-56.7	0	0	0	119.3
476	R	24.7	Very low	25.4	Very low	213 Å²	213	146.6 Å²	146.6	80%	0.804	77%	0.77	S	S	*	*				68.9	126.4	74.4	-104.3	-169.1	-174	-168.6	3.4	112.2
477	L	25.5	Very low	25.4	Very low	135 Å²	135	147.7 Å²	147.7	71%	0.707	78%	0.777	S	S	*	*			cis	-154.1	157.3	25.9	-87.1	163.6	0	0	0	114.7
478	L	23.1	Very low	25.2	Very low	152 Å²	152	142.7 Å²	142.7	80%	0.796	78%	0.779	S	S	*	*			trans	64	114.9	144	-67.6	167.2	0	0	0	125.4
479	S	23.5	Very low	25	Very low	109 Å²	109	139.9 Å²	139.9	76%	0.762	77%	0.772	S	S	*	*				72.5	119.2	124.3	-160.8	0	0	0	0	124.2
480	S	21.7	Very low	24.8	Very low	115 Å²	115	140 Å²	140	80%	0.804	77%	0.765	S	S	*	*				174.1	165.8	116.7	46	0	0	0	0	113.3
481	S	24	Very low	25.3	Very low	114 Å²	114	146.1 Å²	146.1	80%	0.797	78%	0.777	S	S	*	*			trans	67.9	124.9	-178.2	-145.9	0	0	0	0	115
482	L	26.5	Very low	25.2	Very low	135 Å²	135	148.8 Å²	148.8	71%	0.707	78%	0.775	S	S	*	*			cis	91.1	125.7	34.2	-172.8	69.5	0	0	0	113
483	E	31.2	Very low	25.8	Very low	163 Å²	163	147 Å²	147	76%	0.762	78%	0.775	S	S	*	*			trans	63.7	143.8	-178.5	-73.1	137.6	-144.4	0	0	115.4
484	E	28.7	Very low	25.5	Very low	167 Å²	167	145.9 Å²	145.9	78%	0.78	78%	0.781	S	S	*	*			cis	-150	163.3	4.5	-144.1	179.5	176.4	0	0	112.5
485	L	24.3	Very low	25.6	Very low	163 Å²	163	144.2 Å²	144.2	85%	0.853	78%	0.781	S	S	*	*			trans	64.5	127.8	170.6	-59	-179.9	0	0	0	119.6
486	Q	22.6	Very low	26.3	Very low	185 Å²	185	144.1 Å²	144.1	86%	0.864	78%	0.783	S	S	*	*			trans	-110.2	148.3	-172.4	-67.4	174.3	-59.2	0	0	114.1
487	S	24.7	Very low	26.2	Very low	118 Å²	118	142.6 Å²	142.6	83%	0.825	79%	0.785	S	S	*	*			trans	45.9	93	135.8	-56.2	0	0	0	0	120.4
488	G	21.6	Very low	26.2	Very low	84 Å²	84	140.4 Å²	140.4	87%	0.866	78%	0.779	S	S	*	*			trans	-115.7	93.3	153.3	0	0	0	0	0	111.2
489	C	26	Very low	26.2	Very low	105 Å²	105	138.2 Å²	138.2	71%	0.709	78%	0.776	S	S	*	*			trans	-87.3	122.3	178.8	179.4	0	0	0	0	111.6
490	F	23.6	Very low	26.2	Very low	171 Å²	171	142.1 Å²	142.1	75%	0.75	78%	0.779	S	S	*	*			trans	-174.1	139	147.7	-77.3	-51.2	0	0	0	106.4	K492	F490-K492 HydrophobicContact CB-CB 4.44Å; F490-K492 HydrophobicContact CD1-CB 4.2Å; F490-K492 HydrophobicContact CD1-CD 4.25Å; F490-K492 HydrophobicContact CE1-CD 4.26Å; F490-K492 HydrophobicContact CG-CB 4.42Å
491	Q	33.9	Very low	26.3	Very low	191 Å²	191	147.6 Å²	147.6	89%	0.893	78%	0.784	S	S	*	*			cis	51.2	57.1	6.7	-78.2	-144.6	0.7	0	0	116.2
492	K	22	Very low	26.3	Very low	162 Å²	162	151 Å²	151	70%	0.704	79%	0.787	S	S	*	*			trans	-155	104.7	148.3	-118.7	170.3	-174.2	175.2	0	113.1	F490	F490-K492 HydrophobicContact CB-CB 4.44Å; F490-K492 HydrophobicContact CD1-CB 4.2Å; F490-K492 HydrophobicContact CD1-CD 4.25Å; F490-K492 HydrophobicContact CE1-CD 4.26Å; F490-K492 HydrophobicContact CG-CB 4.42Å
493	S	37.9	Very low	26.1	Very low	104 Å²	104	149.5 Å²	149.5	73%	0.727	78%	0.784	S	S	*	*			trans	59.4	178.8	157.5	69.4	0	0	0	0	116.2
494	P	22.9	Very low	26.2	Very low	130 Å²	130	149.4 Å²	149.4	84%	0.844	79%	0.788	S	S	*	*				-113.1	147.5	64.1	2.6	18.6	0	0	0	114.7
495	Q	25.4	Very low	26.6	Very low	153 Å²	153	147.5 Å²	147.5	72%	0.715	79%	0.79	S	S	*	*			trans	-95.5	129.3	161.2	166.1	-173.1	-14.5	0	0	107.2
496	M	38.1	Very low	26.5	Very low	157 Å²	157	143 Å²	143	77%	0.773	78%	0.783	S	S	*	*			trans	57.8	133	164.3	-64.2	166.1	59.5	0	0	118.5
497	E	22.9	Very low	26.7	Very low	182 Å²	182	141.3 Å²	141.3	85%	0.85	77%	0.773	S	S	*	*			trans	-133.5	155.7	157.5	-100.7	-82.9	100.7	0	0	107.1
498	P	25.1	Very low	26.7	Very low	89 Å²	89	143.6 Å²	143.6	58%	0.578	78%	0.775	S	S	*	*				-132.9	166.5	-123.5	27	-3.6	0	0	0	114.9
499	S	23.2	Very low	26.8	Very low	105 Å²	105	144.8 Å²	144.8	73%	0.734	77%	0.77	S	S	*	*			trans	-159.5	141.5	152.8	-82.3	0	0	0	0	108.1
500	K	23.1	Very low	26.7	Very low	191 Å²	191	148.6 Å²	148.6	83%	0.83	78%	0.775	S	S	*	*			cis	172.5	139.6	-11.3	-115.5	165.7	-175.1	171.5	0	102.2
501	Y	25.2	Very low	26.7	Very low	230 Å²	230	149.8 Å²	149.8	90%	0.902	78%	0.78	S	S	*	*			trans	-80.3	123.4	177	-81.3	-86.5	0	0	0	111.8
502	Q	23.8	Very low	26.2	Very low	185 Å²	185	148.4 Å²	148.4	86%	0.864	77%	0.771	S	S	*	*			trans	-159.5	115.2	155.1	-102.1	174	-0.2	0	0	105.3
503	T	22.9	Very low	26.2	Very low	105 Å²	105	147.4 Å²	147.4	64%	0.644	77%	0.768	S	S	*	*			cis	78.3	90.5	26.4	-39.2	0	0	0	0	113.7
504	L	31.6	Very low	25.4	Very low	161 Å²	161	147.3 Å²	147.3	84%	0.843	77%	0.768	S	S	*	*				44.6	163.8	124.7	-65.8	175.8	0	0	0	120.2
505	P	37.3	Very low	25.4	Very low	126 Å²	126	149.3 Å²	149.3	82%	0.818	76%	0.763	S	S	*	*			cis	-121.5	-178.8	12.8	43.3	-27.3	0	0	0	113.1
506	G	22.9	Very low	25.3	Very low	69 Å²	69	147.4 Å²	147.4	71%	0.711	76%	0.758	S	S	*	*			cis	118.7	150.2	48.5	0	0	0	0	0	108.1
507	K	26.7	Very low	24.6	Very low	150 Å²	150	148 Å²	148	65%	0.652	76%	0.759	S	S	*	*			cis	-120	161.3	8.6	-50.1	-177.1	-174.5	-172.1	0	109.2	A104 N105	A104-K507 PolarHBondContact O-NZ 3.48Å; N105-K507 PolarHBondContact OD1-NZ 2.9Å
508	L	25.1	Very low	24.7	Very low	165 Å²	165	146.1 Å²	146.1	86%	0.864	75%	0.754	S	S	*	*			cis	90.7	93.9	25	-85.1	174.3	0	0	0	118.5
509	S	22.9	Very low	24.6	Very low	110 Å²	110	149 Å²	149	77%	0.769	77%	0.765	S	S	*	*			trans	176.8	149.7	146.9	-83.4	0	0	0	0	108.9
510	K	24.6	Very low	24.7	Very low	184 Å²	184	146.7 Å²	146.7	80%	0.8	76%	0.757	S	S	*	*			cis	-153.7	139.7	-14.4	-102.3	175.2	-179.5	177.6	0	104.8
511	K	24	Very low	24.7	Very low	197 Å²	197	143.7 Å²	143.7	86%	0.857	76%	0.755	S	S	*	*				45.2	121.7	84.1	-162.7	-176.9	-177.1	-179.8	0	113.4
512	K	23.1	Very low	24.7	Very low	161 Å²	161	144.7 Å²	144.7	70%	0.7	76%	0.757	S	S	*	*			cis	-167.4	169	-11.6	-170.1	-169.9	165.6	-140.2	0	106.9
513	E	21.9	Very low	24.8	Very low	141 Å²	141	139.6 Å²	139.6	66%	0.659	75%	0.754	S	S	*	*			trans	69.2	137	172.7	-72.5	134.7	-146.9	0	0	115.8
514	S	20.8	Very low	25	Very low	103 Å²	103	145.7 Å²	145.7	72%	0.72	77%	0.765	S	S	*	*			cis	99.9	95.3	7.9	85	0	0	0	0	118.3
515	K	23.2	Very low	24.8	Very low	172 Å²	172	145.3 Å²	145.3	75%	0.748	76%	0.759	S	S	*	*				-171.7	153.8	112.3	-107.5	-170.2	152	-74.6	0	114.5
516	D	22.8	Very low	24.3	Very low	112 Å²	112	145.3 Å²	145.3	60%	0.599	76%	0.757	S	S	*	*			trans	53.9	91	145.7	-51.8	-5.4	0	0	0	122.7
517	E	23.5	Very low	24.6	Very low	169 Å²	169	148.4 Å²	148.4	79%	0.79	75%	0.753	S	S	*	*				53.7	142.8	105.7	-80.1	-166.7	154.1	0	0	125.9
518	L	24.8	Very low	24.7	Very low	143 Å²	143	150.1 Å²	150.1	75%	0.749	76%	0.757	S	S	*	*			trans	73	145.6	153.7	-65.4	158.5	0	0	0	117.8
519	N	24.2	Very low	24.8	Very low	151 Å²	151	149.3 Å²	149.3	81%	0.807	75%	0.752	S	S	*	*			cis	-159.3	168.8	-7.9	-144.7	-10.2	0	0	0	107.5
520	G	24	Very low	25.1	Very low	55 Å²	55	148.6 Å²	148.6	57%	0.567	75%	0.748	S	S	*	*			cis	-152.3	-119.6	0.2	0	0	0	0	0	109.3
521	T	23.4	Very low	26	Very low	128 Å²	128	145.3 Å²	145.3	79%	0.785	75%	0.745	S	S	*	*			cis	-165.3	159.8	-4.1	-50.2	0	0	0	0	109.3
522	R	25.3	Very low	26.2	Very low	251 Å²	251	142.7 Å²	142.7	95%	0.947	75%	0.745	S	S	*	*			trans	75.2	146.9	-178.1	-57	178.2	166.4	-176.7	-4.1	114.5
523	G	25.8	Very low	26.3	Very low	78 Å²	78	143.6 Å²	143.6	80%	0.804	75%	0.752	S	S	*	*			cis	-173.7	-178.3	-3.9	0	0	0	0	0	108
524	R	27.6	Very low	26.5	Very low	234 Å²	234	145.1 Å²	145.1	88%	0.883	76%	0.764	S	S	*	*			cis	-159.5	167.7	4	-178.2	179.6	175.9	-162	-3	107.9
525	E	25.8	Very low	26.6	Very low	152 Å²	152	145.3 Å²	145.3	71%	0.71	77%	0.765	S	S	*	*			trans	-77.5	166.3	-175.1	-36.4	94.7	126.6	0	0	116.4
526	T	27.3	Very low	27.7	Very low	126 Å²	126	143 Å²	143	77%	0.773	77%	0.767	S	S	*	*			trans	-156.8	99.1	144	-58.8	0	0	0	0	106.1
527	E	29.6	Very low	27.7	Very low	135 Å²	135	141.3 Å²	141.3	63%	0.631	77%	0.769	S	S	*	*				59.9	125.7	104.1	-62.9	-176.4	164.3	0	0	113.3
528	Y	29.6	Very low	27.9	Very low	186 Å²	186	141 Å²	141	73%	0.729	77%	0.767	S	S	*	*			cis	-152.9	176.8	32	-83.5	-61	0	0	0	110.6
529	L	27.4	Very low	28	Very low	147 Å²	147	140.2 Å²	140.2	77%	0.77	76%	0.76	S	S	*	*			cis	-153.5	163.6	4.1	-126.6	163.8	0	0	0	111.4
530	S	27.8	Very low	28.3	Very low	96 Å²	96	140.7 Å²	140.7	67%	0.671	76%	0.757	S	S	*	*			trans	-44.4	-179.8	164.2	-58.9	0	0	0	0	120.6
531	P	45.1	Very low	28.3	Very low	115 Å²	115	142 Å²	142	75%	0.747	76%	0.757	S	S	*	*			cis	-142.1	174	-36.2	35.9	-19	0	0	0	114.8
532	V	27.8	Very low	28.7	Very low	142 Å²	142	145.2 Å²	145.2	86%	0.861	76%	0.76	S	S	*	*				-170	148	126.2	137.6	0	0	0	0	109.4
533	Q	24.6	Very low	28.7	Very low	179 Å²	179	139.4 Å²	139.4	84%	0.836	75%	0.748	S	S	*	*			trans	-103.1	151.4	178.4	-62.6	168.5	-52	0	0	111.2
534	L	26.9	Very low	28.8	Very low	174 Å²	174	146.1 Å²	146.1	91%	0.911	75%	0.75	S	S	*	*				-176.8	149.5	120.2	-96.1	162.1	0	0	0	110.9
535	S	22.4	Very low	28.8	Very low	107 Å²	107	139.8 Å²	139.8	75%	0.748	74%	0.738	S	S	*	*			trans	-121.1	-170.4	179.8	-32.2	0	0	0	0	108.9
536	P	46.1	Very low	28.9	Very low	122 Å²	122	139.5 Å²	139.5	79%	0.792	74%	0.74	S	S	*	*			cis	-127	-171.5	-27.5	38.4	-22.8	0	0	0	111.4
537	A	23.4	Very low	28.8	Very low	78 Å²	78	138.9 Å²	138.9	65%	0.645	73%	0.733	S	S	*	*				157.2	137.9	121.4	0	0	0	0	0	115.5
538	H	26.7	Very low	28.6	Very low	161 Å²	161	140 Å²	140	75%	0.745	74%	0.738	S	S	*	*			trans	60.3	151.8	151.8	-67.3	-56.1	0	0	0	120.1
539	H	27.1	Very low	28.4	Very low	127 Å²	127	135.9 Å²	135.9	59%	0.588	74%	0.742	S	S	*	*			cis	-157	143.6	-4.5	-124.1	-54.6	0	0	0	110.5
540	H	29.8	Very low	28.2	Very low	162 Å²	162	132.1 Å²	132.1	75%	0.75	74%	0.739	S	S	*	*			trans	57.4	157	150.3	-71.2	-38.6	0	0	0	120.6
541	S	25.7	Very low	28.1	Very low	81 Å²	81	137.1 Å²	137.1	57%	0.566	75%	0.748	S	S	*	*			cis	-173.7	139.5	-23.7	54.1	0	0	0	0	110.1
542	K	30.2	Very low	27.1	Very low	196 Å²	196	137 Å²	137	85%	0.852	74%	0.741	S	S	*	*				171	134.7	118.3	-94.3	166.5	-177.2	178.8	0	112
543	D	25.4	Very low	26.9	Very low	129 Å²	129	137.9 Å²	137.9	69%	0.69	74%	0.735	S	S	*	*			trans	-73.2	172.6	172.2	-44.3	-92.8	0	0	0	109.9
544	Y	28.9	Very low	26.9	Very low	219 Å²	219	137.2 Å²	137.2	86%	0.859	73%	0.732	S	S	*	*			cis	-135.6	153.3	39.7	-54.2	-104.1	0	0	0	110
545	T	27.4	Very low	26.7	Very low	101 Å²	101	133.4 Å²	133.4	62%	0.62	72%	0.719	S	S	*	*			cis	60.3	135.3	42	60.3	0	0	0	0	114.4
546	L	27.8	Very low	26.8	Very low	146 Å²	146	135.2 Å²	135.2	76%	0.764	72%	0.718	S	S	*	*			cis	-133.1	-145.2	-2.7	-144.9	56.8	0	0	0	106.7
547	D	25	Very low	25.8	Very low	114 Å²	114	136.3 Å²	136.3	61%	0.61	72%	0.716	S	S	*	*			cis	-160.9	174.1	4.1	-143.4	-11.7	0	0	0	114.4
548	H	26.1	Very low	25.8	Very low	159 Å²	159	137 Å²	137	74%	0.736	72%	0.716	S	S	*	*			trans	24.1	137.8	160.8	-78.1	66.4	0	0	0	122.3
549	A	24.6	Very low	25.6	Very low	99 Å²	99	135.3 Å²	135.3	82%	0.818	71%	0.713	S	S	*	*			cis	109.8	122.1	10.8	0	0	0	0	0	117
550	G	24.4	Very low	25.4	Very low	68 Å²	68	137.1 Å²	137.1	70%	0.701	72%	0.721	S	S	*	*			trans	158.4	122.1	173.8	0	0	0	0	0	110.1
551	K	24.8	Very low	25	Very low	200 Å²	200	134.8 Å²	134.8	87%	0.87	72%	0.723	S	S	*	*				68.8	142.4	74.2	-79.8	-158.6	172.9	-170.1	0	114.3
552	L	24.8	Very low	25.6	Very low	113 Å²	113	136.3 Å²	136.3	59%	0.592	73%	0.731	S	S	*	*			cis	-176.7	150.2	-10.4	173.2	64.9	0	0	0	108.7
553	E	23.6	Very low	25.4	Very low	160 Å²	160	135.1 Å²	135.1	75%	0.748	73%	0.733	S	S	*	*			trans	60	168.9	164.8	-78.4	148.4	-165.9	0	0	116.8
554	E	23.9	Very low	25.3	Very low	165 Å²	165	134.1 Å²	134.1	77%	0.771	74%	0.736	S	S	*	*			cis	-142.5	137.7	-16.5	-116.7	-173.9	133.1	0	0	105.2
555	C	22.9	Very low	25.2	Very low	95 Å²	95	129.4 Å²	129.4	64%	0.642	74%	0.736	S	S	*	*				79.8	148.5	70.1	-146.2	0	0	0	0	116.2
556	M	23.9	Very low	25.1	Very low	144 Å²	144	127.7 Å²	127.7	71%	0.709	74%	0.738	S	S	*	*			trans	70.1	146.9	171.6	-53	-48.3	180	0	0	117.7
557	L	25.5	Very low	25.1	Very low	146 Å²	146	128.5 Å²	128.5	76%	0.764	75%	0.749	S	S	*	*			cis	-155	-178.4	-7.3	-117.5	169.8	0	0	0	112.3
558	S	23.8	Very low	25.2	Very low	91 Å²	91	129.9 Å²	129.9	64%	0.636	76%	0.756	S	S	*	*			trans	-58.3	-174.2	-178.8	-42	0	0	0	0	116.3
559	D	22.5	Very low	25.4	Very low	127 Å²	127	127.6 Å²	127.6	68%	0.679	76%	0.758	S	S	*	*			cis	-167.4	175.1	22.3	-147.7	-3.5	0	0	0	116.3
560	Q	23.1	Very low	25.4	Very low	165 Å²	165	126.3 Å²	126.3	77%	0.771	75%	0.754	S	S	*	*			trans	74.3	150.6	149	-80.9	161	66.7	0	0	123
561	S	21	Very low	25.6	Very low	112 Å²	112	132.3 Å²	132.3	78%	0.783	76%	0.764	S	S	*	*			trans	-108.6	-169.5	171.5	-36.7	0	0	0	0	109.4
562	P	37.9	Very low	25.7	Very low	114 Å²	114	132 Å²	132	74%	0.74	77%	0.765	S	S	*	*			cis	-154.2	168.8	43.7	42.5	-19.2	0	0	0	120.5
563	L	25.3	Very low	25.8	Very low	170 Å²	170	131.9 Å²	131.9	89%	0.89	77%	0.774	S	S	*	*			trans	14.5	139.5	140.4	-49.5	170.4	0	0	0	123
564	S	24.4	Very low	27	Very low	108 Å²	108	129.9 Å²	129.9	76%	0.755	78%	0.775	S	S	*	*				143.7	144.2	102.9	-162	0	0	0	0	118.4
565	S	26.5	Very low	27	Very low	121 Å²	121	128.3 Å²	128.3	85%	0.846	78%	0.776	S	S	*	*			trans	65.4	157.1	156.1	69.7	0	0	0	0	120.7
566	G	24.3	Very low	27.2	Very low	65 Å²	65	129 Å²	129	67%	0.67	78%	0.782	S	S	*	*			cis	167.9	175.3	-9.2	0	0	0	0	0	115.3
567	V	28.9	Very low	28.1	Very low	163 Å²	163	127.3 Å²	127.3	99%	0.988	78%	0.782	S	S	*	*			trans	69.7	178.8	166.2	-59	0	0	0	0	121.4
568	D	27.4	Very low	28.3	Very low	143 Å²	143	126.3 Å²	126.3	77%	0.765	77%	0.773	S	S	*	*				-161.8	166.8	-124	178.7	34.6	0	0	0	115
569	S	29.8	Very low	28.5	Very low	111 Å²	111	130.6 Å²	130.6	78%	0.776	78%	0.78	S	S	*	*			trans	65.4	161.2	169.9	-71.9	0	0	0	0	119
570	G	23.8	Very low	29	Very low	71 Å²	71	133.5 Å²	133.5	73%	0.732	78%	0.782	S	S	*	*			cis	171	144.4	-10.5	0	0	0	0	0	115.3
571	Q	29.3	Very low	29.4	Very low	195 Å²	195	135.4 Å²	135.4	91%	0.911	79%	0.788	S	S	*	*			trans	50.2	133.2	162.9	-63.3	-170	-0.2	0	0	123.8
572	Q	27.2	Very low	29.7	Very low	192 Å²	192	135.4 Å²	135.4	90%	0.897	79%	0.787	S	S	*	*				-163.7	163.2	123.2	-112.8	-178.7	43.5	0	0	114.4
573	S	26.6	Very low	29.4	Very low	112 Å²	112	137.5 Å²	137.5	78%	0.783	79%	0.787	S	S	*	*			trans	-174.1	175.4	-178.2	-76.4	0	0	0	0	107.9
574	P	48.3	Very low	29.8	Very low	118 Å²	118	140.6 Å²	140.6	77%	0.766	79%	0.787	S	S	*	*			cis	-134.8	-166.3	5.3	43.3	-25.3	0	0	0	114.1
575	V	23.7	Very low	30	Very low	131 Å²	131	138.6 Å²	138.6	79%	0.794	78%	0.784	S	S	*	*				177.2	144.9	124.6	149.2	0	0	0	0	111.9
576	S	27.8	Very low	30.3	Very low	109 Å²	109	141.2 Å²	141.2	76%	0.762	78%	0.784	S	S	*	*			trans	-147.1	162.3	164.6	-53.4	0	0	0	0	107.8
577	P	43.6	Very low	31.1	Very low	109 Å²	109	147 Å²	147	71%	0.708	79%	0.791	S	S	*	*				-162.1	142.9	104	36.5	-15.2	0	0	0	119.8
578	E	28.4	Very low	31.4	Very low	126 Å²	126	147.8 Å²	147.8	59%	0.589	78%	0.781	S	S	*	*			trans	58.5	173.5	142.5	-54.8	-165.5	117.7	0	0	120.5	R580	E578-R580 IonicContact OE1-CZ 2.97Å; E578-R580 IonicContact OE1-NE 3.6Å; E578-R580 PolarHBondContact OE1-NE 3.03Å; E578-R580 IonicContact OE1-NH2 3.34Å; E578-R580 PolarHBondContact OE1-NH2 3.12Å; E578-R580 IonicContact OE2-CZ 2.74Å; E578-R580 IonicContact OE2-NE 3.75Å; E578-R580 IonicContact OE2-NH2 3.57Å; E578-R580 PolarHBondContact OE2-NH2 3.4Å
579	K	28.3	Very low	31.6	Very low	180 Å²	180	151 Å²	151	78%	0.783	79%	0.789	S	S	*	*			cis	-148.7	168.7	17	-71.6	176.8	-179.5	167.2	0	111.3
580	R	32.4	Very low	31.6	Very low	188 Å²	188	156.8 Å²	156.8	71%	0.709	79%	0.794	S	S	*	*			cis	-177.1	146.1	-27.8	-97	-172.3	-173.8	-170.4	4	108.9	E578	E578-R580 IonicContact OE1-CZ 2.97Å; E578-R580 IonicContact OE1-NE 3.6Å; E578-R580 PolarHBondContact OE1-NE 3.03Å; E578-R580 IonicContact OE1-NH2 3.34Å; E578-R580 PolarHBondContact OE1-NH2 3.12Å; E578-R580 IonicContact OE2-CZ 2.74Å; E578-R580 IonicContact OE2-NE 3.75Å; E578-R580 IonicContact OE2-NH2 3.57Å; E578-R580 PolarHBondContact OE2-NH2 3.4Å
581	K	32.4	Very low	32	Very low	206 Å²	206	156.7 Å²	156.7	90%	0.896	79%	0.792	S	S	*	*			trans	167.5	121.1	145.1	-93.9	155.6	-175.3	178.5	0	108.3
582	S	27.7	Very low	31.9	Very low	111 Å²	111	157.4 Å²	157.4	78%	0.776	79%	0.787	S	S	*	*				94.4	131	60.7	170.3	0	0	0	0	112.2
583	H	31.6	Very low	32	Very low	158 Å²	158	154.7 Å²	154.7	73%	0.731	78%	0.777	S	S	*	*			cis	-174.5	161.9	-12.5	-156.7	-82	0	0	0	110.2
584	R	33.3	Very low	32.2	Very low	236 Å²	236	160.8 Å²	160.8	89%	0.891	78%	0.783	S	S	*	*			trans	75.1	152	171.4	-41.3	172	-141.6	-100	1.4	116.7
585	G	28.6	Very low	31.5	Very low	66 Å²	66	166.6 Å²	166.6	68%	0.68	79%	0.79	S	S	*	*			cis	150.7	120.5	-20.2	0	0	0	0	0	117.6
586	M	33.7	Very low	31.8	Very low	175 Å²	175	165.6 Å²	165.6	86%	0.862	79%	0.788	S	S	*	*			trans	70.4	153.2	162.5	-48.1	171	74.2	0	0	116.4
587	K	40.2	Very low	31.6	Very low	188 Å²	188	169.4 Å²	169.4	82%	0.817	79%	0.794	S	S	*	*			cis	-140.6	146.3	20.2	-64.8	169.5	-178.6	170.3	0	114.5
588	K	34.7	Very low	30.8	Very low	179 Å²	179	169.8 Å²	169.8	78%	0.778	80%	0.799	S	S	*	*			trans	-1.5	140.9	143.9	-52.4	174.1	179.7	-178.8	0	119.6
589	F	32.6	Very low	30.8	Very low	209 Å²	209	167.5 Å²	167.5	92%	0.917	81%	0.809	S	S	*	*				-135.9	139.6	120	-116.4	-83.6	0	0	0	110.4
590	W	30.1	Very low	30.8	Very low	234 Å²	234	164.4 Å²	164.4	89%	0.886	81%	0.81	S	S	*	*			trans	-137.3	134	176.2	-100.2	77.8	0	0	0	108.5
591	G	30.7	Very low	30.7	Very low	68 Å²	68	160.7 Å²	160.7	70%	0.701	81%	0.811	S	S	*	*			trans	-171.1	88.3	173.5	0	0	0	0	0	108.8
592	R	28.6	Very low	30.4	Very low	210 Å²	210	156.8 Å²	156.8	79%	0.792	80%	0.804	S	S	*	*				55.5	103.7	89.1	-63.2	-169.1	80.7	163.1	3.7	111.1
593	I	29.7	Very low	30.4	Very low	136 Å²	136	160.6 Å²	160.6	70%	0.697	81%	0.809	S	S	*	*				69.9	119.6	98.4	-67.7	163	0	0	0	110.4
594	R	30.8	Very low	30.3	Very low	239 Å²	239	159 Å²	159	90%	0.902	81%	0.811	S	S	*	*				-158.7	170.4	63.8	-147.9	161.7	-163.8	-175	2.4	114.6
595	R	33.3	Very low	30	Very low	241 Å²	241	156.7 Å²	156.7	91%	0.909	81%	0.809	S	S	*	*			trans	-77.5	144.9	167.8	-62.7	171.7	173.5	169.9	-5.1	112.1
596	S	28.6	Very low	29.9	Very low	110 Å²	110	160.5 Å²	160.5	77%	0.769	81%	0.814	S	S	*	*			trans	-166.9	129	144	52.5	0	0	0	0	106
597	Q	24.2	Very low	30.2	Very low	189 Å²	189	157.2 Å²	157.2	88%	0.883	81%	0.806	S	S	*	*				49.7	135.9	59.6	-79.4	-173.2	-20	0	0	112.6
598	S	26.9	Very low	29.7	Very low	117 Å²	117	156.5 Å²	156.5	82%	0.818	81%	0.806	S	S	*	*			cis	-157.6	155.5	6.9	44.2	0	0	0	0	110.3
599	G	28.4	Very low	29.6	Very low	77 Å²	77	156.4 Å²	156.4	79%	0.794	81%	0.81	S	S	*	*			trans	178	50.1	179.4	0	0	0	0	0	116.6
600	S	27.7	Very low	29.6	Very low	115 Å²	115	149.6 Å²	149.6	80%	0.804	80%	0.798	S	S	*	*			trans	-91	139.8	164.6	170.8	0	0	0	0	109.8
601	P	31.6	Very low	29.6	Very low	111 Å²	111	146.3 Å²	146.3	72%	0.721	80%	0.798	S	S	*	*			trans	-112.8	119.4	149	1.1	20.1	0	0	0	111.3
602	V	26.6	Very low	29.4	Very low	123 Å²	123	153 Å²	153	75%	0.745	81%	0.808	S	S	*	*			trans	51.6	111	139.1	-172.3	0	0	0	0	118.7	V604	V602-V604 HydrophobicContact CG1-CG2 4.05Å
603	Q	27.6	Very low	29.8	Very low	192 Å²	192	153 Å²	153	90%	0.897	81%	0.814	S	S	*	*			trans	-72.3	148	155.3	-63.8	169.6	-58.1	0	0	110.7
604	V	28.5	Very low	30.1	Very low	125 Å²	125	158.5 Å²	158.5	76%	0.758	83%	0.826	S	S	*	*			trans	-133	107.9	158.9	-177.4	0	0	0	0	109.1	V602	V602-V604 HydrophobicContact CG1-CG2 4.05Å
605	H	27.4	Very low	30.2	Very low	186 Å²	186	150.8 Å²	150.8	86%	0.861	82%	0.821	S	S	*	*			trans	55.2	118.2	166.4	-80.8	-84.4	0	0	0	122
606	D	27.1	Very low	30.2	Very low	146 Å²	146	143 Å²	143	78%	0.781	82%	0.816	S	S	*	*			trans	-57.3	171.7	153.8	-131.6	31.4	0	0	0	112
607	P	38.6	Very low	30.3	Very low	107 Å²	107	147.8 Å²	147.8	70%	0.695	82%	0.823	S	S	*	*			cis	-143.3	-177.1	29.6	40.3	-18.2	0	0	0	119.6
608	E	30.8	Very low	30.9	Very low	173 Å²	173	150.3 Å²	150.3	81%	0.808	82%	0.824	S	S	*	*			trans	81.3	85	164.9	-57.7	-160.3	145.3	0	0	119.5
609	M	31.1	Very low	31.7	Very low	177 Å²	177	149.2 Å²	149.2	87%	0.872	82%	0.823	S	S	*	*				-171	136.8	104	-168	101.4	-64.5	0	0	110.4
610	G	32.5	Very low	32.4	Very low	65 Å²	65	152.4 Å²	152.4	67%	0.67	83%	0.827	S	S	*	*			trans	-89	151.2	-172.6	0	0	0	0	0	117.1
611	D	30.7	Very low	32.8	Very low	165 Å²	165	151.3 Å²	151.3	88%	0.882	82%	0.824	S	S	*	*			trans	51.7	101.7	154.9	-70.9	0.5	0	0	0	121.7
612	F	26.4	Very low	32.9	Very low	208 Å²	208	149 Å²	149	91%	0.912	82%	0.821	S	S	*	*			trans	-71.7	141.3	153.8	-80.5	-97	0	0	0	112.3
613	K	38.4	Very low	33.2	Very low	211 Å²	211	148.7 Å²	148.7	92%	0.917	82%	0.822	S	S	*	*			trans	-119.3	142.4	145.5	-78.2	-176	178.2	172	0	110.8
614	R	35.6	Very low	33.9	Very low	252 Å²	252	151 Å²	151	95%	0.951	82%	0.822	S	S	*	*			trans	-106.9	133.8	-161.5	164.9	-170.4	-84.8	-130.6	-1.9	111.3
615	G	32.6	Very low	34.5	Very low	76 Å²	76	151.9 Å²	151.9	78%	0.784	82%	0.822	S	S	*	*			trans	-170.4	94.6	172.1	0	0	0	0	0	116.8
616	G	32.3	Very low	35.1	Very low	78 Å²	78	148 Å²	148	80%	0.804	82%	0.822	S	S	*	*			trans	71	101.7	149.8	0	0	0	0	0	119.5
617	F	30.7	Very low	35.7	Very low	211 Å²	211	150.5 Å²	150.5	93%	0.925	82%	0.821	S	S	*	*			trans	-71.2	127.6	164.4	-81.5	-103	0	0	0	111.8
618	R	37.5	Very low	35.6	Very low	241 Å²	241	150.5 Å²	150.5	91%	0.909	82%	0.823	S	S	*	*			trans	-124.2	104	151.6	-83	-172.4	174.9	-109.3	2.4	108.5	T620	R618-T620 PolarHBondContact O-N 3.29Å
619	A	44.8	Very low	35.9	Very low	95 Å²	95	145.5 Å²	145.5	79%	0.785	82%	0.818	S	S	*	*			trans	-88.7	81.3	-172.9	0	0	0	0	0	112.3
620	T	42.8	Very low	36.3	Very low	144 Å²	144	145.1 Å²	145.1	88%	0.883	81%	0.812	S	S	*	*	S	Bend	trans	-129.9	18	167.7	57.7	0	0	0	0	113.2	R618	R618-T620 PolarHBondContact O-N 3.29Å
621	A	35.8	Very low	36.6	Very low	91 Å²	91	146.7 Å²	146.7	75%	0.752	82%	0.819	S	S	*	*	S	Bend	trans	-140	110.6	167	0	0	0	0	0	108.7
622	G	33.5	Very low	37.7	Very low	63 Å²	63	142.8 Å²	142.8	65%	0.649	79%	0.791	S	S	*	*			trans	-66.6	146.9	166.5	0	0	0	0	0	109.7	R624	G622-R624 VanDerWaalsContact C-N 3.31Å; G622-R624 PolarHBondContact O-N 2.81Å
623	P	32.3	Very low	38.7	Very low	117 Å²	117	137.1 Å²	137.1	76%	0.76	77%	0.77	S	S	*	*			trans	-73.1	80.3	-171	30.4	-36.4	0	0	0	112.3	L625	P623-L625 HydrophobicContact CB-CD1 4.31Å; P623-L625 HydrophobicContact CB-CG 4.28Å; P623-L625 PolarHBondContact O-N 3.31Å
624	R	42.3	Very low	39.6	Very low	241 Å²	241	134 Å²	134	91%	0.909	76%	0.763	S	S	*	*			trans	-76.8	53.1	157	-68.6	-168.2	176.7	-160.7	-0.5	110.2	G622	G622-R624 VanDerWaalsContact C-N 3.31Å; G622-R624 PolarHBondContact O-N 2.81Å
625	L	42.4	Very low	41	Very low	143 Å²	143	130.7 Å²	130.7	75%	0.749	76%	0.756	S	S	*	*			trans	-60.9	146.3	160.3	-67.8	170.1	0	0	0	107.6	P623 R627	P623-L625 HydrophobicContact CB-CD1 4.31Å; P623-L625 HydrophobicContact CB-CG 4.28Å; P623-L625 PolarHBondContact O-N 3.31Å; L625-R627 PolarHBondContact O-N 3.03Å
626	A	38.4	Very low	43.4	Very low	105 Å²	105	130.5 Å²	130.5	87%	0.868	74%	0.736	S	S	*	*			trans	-59.1	105.9	170.3	0	0	0	0	0	108.2	S628	A626-S628 PolarHBondContact O-N 2.91Å
627	R	41.5	Very low	46	Very low	198 Å²	198	129.9 Å²	129.9	75%	0.747	72%	0.718	S	S	*	*			trans	-63.6	127.7	175.5	-115.1	-179.3	171.5	178.9	-4	107	L625 G629 E651	L625-R627 PolarHBondContact O-N 3.03Å; R627-G629 PolarHBondContact O-N 3Å; R627-E651 IonicContact CZ-OE1 3.89Å; R627-E651 IonicContact NH1-OE1 3.15Å; R627-E651 PolarHBondContact NH1-OE1 3.04Å
628	S	34.7	Very low	48.8	Very low	106 Å²	106	120.4 Å²	120.4	74%	0.741	68%	0.676	S	S	*	*			trans	-52.6	115.7	176	178.3	0	0	0	0	108.6	A626 K630	A626-S628 PolarHBondContact O-N 2.91Å; S628-K630 PolarHBondContact O-N 3.42Å
629	G	37.9	Very low	51.4	Low	69 Å²	69	110.8 Å²	110.8	71%	0.711	65%	0.646	S	S	*	*			trans	-63.7	92.5	162.6	0	0	0	0	0	107	R627 A631	R627-G629 PolarHBondContact O-N 3Å; G629-A631 VanDerWaalsContact C-N 3.3Å; G629-A631 PolarHBondContact O-N 3.39Å
630	K	39.8	Very low	53.6	Low	168 Å²	168	113.5 Å²	113.5	73%	0.73	64%	0.64	S	S	*	*			trans	-49.4	107.1	157	-80	-177.8	-179.9	173.3	0	104.6	S628 R632	S628-K630 PolarHBondContact O-N 3.42Å; K630-R632 VanDerWaalsContact C-N 3.29Å; K630-R632 PolarHBondContact O-N 2.99Å
631	A	38.2	Very low	56	Low	99 Å²	99	107.8 Å²	107.8	82%	0.818	60%	0.603	S	S	*	*			trans	-61.2	99.2	179.2	0	0	0	0	0	106.7	G629 D633	G629-A631 VanDerWaalsContact C-N 3.3Å; G629-A631 PolarHBondContact O-N 3.39Å; A631-D633 PolarHBondContact O-N 3.23Å
632	R	54.9	Low	58.8	Low	83 Å²	83	105.9 Å²	105.9	31%	0.313	58%	0.584	S	S	.	*			trans	-55	136.4	177.1	-52.4	-172.6	-165.4	-176.2	6.2	105.7	K630 L634 W649 D652	K630-R632 VanDerWaalsContact C-N 3.29Å; K630-R632 PolarHBondContact O-N 2.99Å; R632-L634 PolarHBondContact O-N 3.5Å; R632-W649 VanDerWaalsContact NH1-CD1 3.28Å; R632-D652 IonicContact CZ-OD2 3.63Å; R632-D652 IonicContact NE-OD2 3.83Å; R632-D652 IonicContact NH2-OD2 2.77Å; R632-D652 PolarHBondContact NH2-OD2 3.37Å
633	D	46.4	Very low	61.7	Low	88 Å²	88	104.3 Å²	104.3	47%	0.471	56%	0.562	S	S	.	*			trans	-72.2	85.5	173.5	-170.1	7.5	0	0	0	108.2	A631 K635 L636	A631-D633 PolarHBondContact O-N 3.23Å; D633-K635 PolarHBondContact O-N 2.98Å; D633-K635 WeakPolarHBondContact OD1-CB 3.18Å; D633-K635 WeakPolarHBondContact OD1-CD 3.45Å; D633-K635 VanDerWaalsContact OD1-CG 3.31Å; D633-K635 WeakPolarHBondContact OD1-CG 3.5Å; D633-L636 HydrophobicContact CB-CD1 4.48Å; D633-L636 WeakPolarHBondContact O-CB 3.42Å; D633-L636 PolarHBondContact O-N 2.91Å
634	L	57.6	Low	64.6	Low	146 Å²	146	105.1 Å²	105.1	76%	0.764	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	-4.4	-175.6	-70.7	166.6	0	0	0	112.8	R632 L636	R632-L634 PolarHBondContact O-N 3.5Å; L634-L636 VanDerWaalsContact C-N 3.33Å
635	K	63.9	Low	67	Low	183 Å²	183	97.2 Å²	97.2	80%	0.796	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-22.1	169	-57	173.1	-171.5	168	0	112.6	D633 P637	D633-K635 PolarHBondContact O-N 2.98Å; D633-K635 WeakPolarHBondContact OD1-CB 3.18Å; D633-K635 WeakPolarHBondContact OD1-CD 3.45Å; D633-K635 VanDerWaalsContact OD1-CG 3.31Å; D633-K635 WeakPolarHBondContact OD1-CG 3.5Å; K635-P637 WeakPolarHBondContact O-CD 3.24Å
636	L	83.3	Confident	69.4	Low	71 Å²	71	90.4 Å²	90.4	37%	0.372	49%	0.493	S	S	.	.	S	Bend	trans	-81.3	116.5	174.2	-76	167.4	0	0	0	110.1	D633 L634 W641	D633-L636 HydrophobicContact CB-CD1 4.48Å; D633-L636 WeakPolarHBondContact O-CB 3.42Å; D633-L636 PolarHBondContact O-N 2.91Å; L634-L636 VanDerWaalsContact C-N 3.33Å; L636-W641 PolarHBondContact O-NE1 2.97Å
637	P	87.8	Confident	72.1	Confident	66 Å²	66	86.4 Å²	86.4	43%	0.429	46%	0.458	S	S	.	.			trans	-66.9	146.9	177.7	29.1	-35.2	0	0	0	110.7	K635 S639 K640	K635-P637 WeakPolarHBondContact O-CD 3.24Å; P637-S639 PolarHBondContact O-N 3.24Å; P637-S639 VanDerWaalsContact O-N 3.07Å; P637-K640 HydrophobicContact CG-CD 4.08Å; P637-K640 HydrophobicContact CG-CG 4.17Å; P637-K640 PolarHBondContact O-N 2.78Å
638	F	89.5	Confident	74.6	Confident	11 Å²	11	80.6 Å²	80.6	5%	0.048	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-53.1	-34.6	-173.7	-174.7	-91.3	0	0	0	114.2	K640 W641 V646 W649 G669 L672 L673 L699 I702	F638-K640 PolarHBondContact O-N 2.93Å; F638-K640 VanDerWaalsContact O-N 3.08Å; F638-W641 AromaticContact CD2-CD2 3.75Å; F638-W641 HydrophobicContact CD2-CD2 3.75Å; F638-W641 AromaticContact CD2-CE3 3.36Å; F638-W641 HydrophobicContact CD2-CE3 3.36Å; F638-W641 HydrophobicContact CD2-CG 4.48Å; F638-W641 AromaticContact CD2-CH2 3.87Å; F638-W641 HydrophobicContact CD2-CH2 3.87Å; F638-W641 HydrophobicContact CD2-CZ2 4.24Å; F638-W641 AromaticContact CD2-CZ3 3.42Å; F638-W641 HydrophobicContact CD2-CZ3 3.42Å; F638-W641 VanDerWaalsContact CD2-CZ3 3.42Å; F638-W641 HydrophobicContact CE2-CD2 4.39Å; F638-W641 AromaticContact CE2-CE3 3.61Å; F638-W641 HydrophobicContact CE2-CE3 3.61Å; F638-W641 HydrophobicContact CE2-CH2 4.45Å; F638-W641 AromaticContact CE2-CZ3 3.63Å; F638-W641 HydrophobicContact CE2-CZ3 3.63Å; F638-W641 HydrophobicContact CG-CD2 4.38Å; F638-W641 HydrophobicContact CG-CE3 4.37Å; F638-W641 WeakPolarHBondContact O-CB 3.47Å; F638-W641 PolarHBondContact O-N 2.92Å; F638-V646 HydrophobicContact CZ-CG2 4.46Å; F638-W649 AromaticContact CE2-CD2 3.88Å; F638-W649 HydrophobicContact CE2-CD2 3.88Å; F638-W649 AromaticContact CE2-CE3 3.78Å; F638-W649 HydrophobicContact CE2-CE3 3.78Å; F638-W649 HydrophobicContact CE2-CG 4.49Å; F638-W649 HydrophobicContact CE2-CH2 4.22Å; F638-W649 HydrophobicContact CE2-CZ2 4.33Å; F638-W649 AromaticContact CE2-CZ3 3.96Å; F638-W649 HydrophobicContact CE2-CZ3 3.96Å; F638-W649 HydrophobicContact CZ-CD2 4.43Å; F638-W649 AromaticContact CZ-CE3 3.89Å; F638-W649 HydrophobicContact CZ-CE3 3.89Å; F638-W649 HydrophobicContact CZ-CH2 4.02Å; F638-W649 AromaticContact CZ-CZ3 3.67Å; F638-W649 HydrophobicContact CZ-CZ3 3.67Å; F638-G669 WeakPolarHBondContact CE1-O 3.33Å; F638-G669 WeakPolarHBondContact O-CA 3.37Å; F638-L672 HydrophobicContact CE1-CB 4.26Å; F638-L672 HydrophobicContact CZ-CD1 4.35Å; F638-L673 HydrophobicContact CD1-CD1 3.94Å; F638-L673 HydrophobicContact CD1-CD2 3.85Å; F638-L673 HydrophobicContact CD1-CG 3.73Å; F638-L673 HydrophobicContact CE1-CD2 4.14Å; F638-L673 HydrophobicContact CE1-CG 4.07Å; F638-L699 HydrophobicContact CE1-CD2 3.71Å; F638-L699 HydrophobicContact CZ-CD2 3.84Å; F638-I702 HydrophobicContact CB-CG2 3.4Å; F638-I702 HydrophobicContact CD1-CG2 4.14Å; F638-I702 HydrophobicContact CD2-CD1 3.83Å; F638-I702 HydrophobicContact CD2-CG2 4.01Å; F638-I702 HydrophobicContact CE2-CD1 3.84Å; F638-I702 HydrophobicContact CG-CD1 4.44Å; F638-I702 HydrophobicContact CG-CG2 3.61Å; F638-I702 HydrophobicContact CZ-CD1 4.45Å
639	S	91.8	Very high	77.3	Confident	40 Å²	40	76.3 Å²	76.3	28%	0.28	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-56.3	-25.3	175.1	52.2	0	0	0	0	114.2	P637 Q670	P637-S639 PolarHBondContact O-N 3.24Å; P637-S639 VanDerWaalsContact O-N 3.07Å; S639-Q670 WeakPolarHBondContact O-CB 3.31Å; S639-Q670 PolarHBondContact O-N 3.49Å
640	K	91.5	Very high	80	Confident	151 Å²	151	73.1 Å²	73.1	66%	0.657	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-97.9	2.2	178.5	-63.4	-173.2	178.3	-175.6	0	114.2	P637 F638	P637-K640 HydrophobicContact CG-CD 4.08Å; P637-K640 HydrophobicContact CG-CG 4.17Å; P637-K640 PolarHBondContact O-N 2.78Å; F638-K640 PolarHBondContact O-N 2.93Å; F638-K640 VanDerWaalsContact O-N 3.08Å
641	W	92.9	Very high	82.6	Confident	25 Å²	25	69.7 Å²	69.7	10%	0.095	36%	0.363	C	S	.	.			trans	-70	139.9	178.8	-70.3	11.7	0	0	0	111	L636 F638 Q645 V646 W649 S668 G669	L636-W641 PolarHBondContact O-NE1 2.97Å; F638-W641 AromaticContact CD2-CD2 3.75Å; F638-W641 HydrophobicContact CD2-CD2 3.75Å; F638-W641 AromaticContact CD2-CE3 3.36Å; F638-W641 HydrophobicContact CD2-CE3 3.36Å; F638-W641 HydrophobicContact CD2-CG 4.48Å; F638-W641 AromaticContact CD2-CH2 3.87Å; F638-W641 HydrophobicContact CD2-CH2 3.87Å; F638-W641 HydrophobicContact CD2-CZ2 4.24Å; F638-W641 AromaticContact CD2-CZ3 3.42Å; F638-W641 HydrophobicContact CD2-CZ3 3.42Å; F638-W641 VanDerWaalsContact CD2-CZ3 3.42Å; F638-W641 HydrophobicContact CE2-CD2 4.39Å; F638-W641 AromaticContact CE2-CE3 3.61Å; F638-W641 HydrophobicContact CE2-CE3 3.61Å; F638-W641 HydrophobicContact CE2-CH2 4.45Å; F638-W641 AromaticContact CE2-CZ3 3.63Å; F638-W641 HydrophobicContact CE2-CZ3 3.63Å; F638-W641 HydrophobicContact CG-CD2 4.38Å; F638-W641 HydrophobicContact CG-CE3 4.37Å; F638-W641 WeakPolarHBondContact O-CB 3.47Å; F638-W641 PolarHBondContact O-N 2.92Å; W641-Q645 HydrophobicContact CB-CB 3.99Å; W641-Q645 HydrophobicContact CE3-CB 4.49Å; W641-Q645 HydrophobicContact CG-CB 4.35Å; W641-V646 HydrophobicContact CB-CG2 4.05Å; W641-W649 HydrophobicContact CE3-CB 4.48Å; W641-W649 HydrophobicContact CZ3-CB 3.87Å; W641-W649 AromaticContact CZ3-CG 3.9Å; W641-W649 HydrophobicContact CZ3-CG 3.9Å; W641-S668 CarbonylContact O-C 3.54Å; W641-S668 VanDerWaalsContact O-CA 3.28Å; W641-S668 WeakPolarHBondContact O-CA 3.33Å; W641-G669 PolarHBondContact O-N 3.35Å
642	S	93.9	Very high	85.1	Confident	50 Å²	50	70.5 Å²	70.5	35%	0.35	35%	0.353	S	S	.	.			trans	-71.1	164.2	175.5	69.9	0	0	0	0	112.1	E644 Q645 V646	S642-E644 VanDerWaalsContact C-N 3.26Å; S642-E644 PolarHBondContact O-N 3.41Å; S642-Q645 PolarHBondContact O-N 2.77Å; S642-Q645 VanDerWaalsContact O-N 3.12Å; S642-Q645 WeakPolarHBondContact OG-CG 3.4Å; S642-Q645 PolarHBondContact OG-N 3.39Å; S642-Q645 PolarHBondContact OG-OE1 2.96Å; S642-V646 WeakPolarHBondContact O-CG2 3.34Å; S642-V646 PolarHBondContact O-N 3.25Å
643	T	94.4	Very high	86.9	Confident	31 Å²	31	67.9 Å²	67.9	19%	0.19	35%	0.346	C	S	.	.	H	α-helix	trans	-49.7	-45.7	173	-53.7	0	0	0	0	112.4	V646 C647 H663 V666	T643-V646 PolarHBondContact O-N 3.23Å; T643-C647 PolarHBondContact O-N 2.87Å; T643-C647 PolarHBondContact O-SG 3.49Å; T643-H663 HydrophobicContact CG2-CB 4.21Å; T643-V666 WeakPolarHBondContact CB-O 3.27Å; T643-V666 VanDerWaalsContact CG2-O 3.24Å; T643-V666 WeakPolarHBondContact CG2-O 3.47Å; T643-V666 PolarHBondContact OG1-O 3.45Å
644	E	92.9	Very high	89.1	Confident	134 Å²	134	64.1 Å²	64.1	63%	0.626	33%	0.328	S	S	*	.	H	α-helix	trans	-60.2	-49.8	176.4	-64.2	-179.4	171.2	0	0	111.8	S642 V646 C647 D648	S642-E644 VanDerWaalsContact C-N 3.26Å; S642-E644 PolarHBondContact O-N 3.41Å; E644-V646 PolarHBondContact O-N 3.15Å; E644-C647 PolarHBondContact O-N 3.3Å; E644-D648 PolarHBondContact O-N 3.44Å
645	Q	93.1	Very high	90.9	Very high	74 Å²	74	57.2 Å²	57.2	35%	0.346	29%	0.291	S	S	.	.	H	α-helix	trans	-62.6	-30.9	-179.9	-70.9	173	-37.8	0	0	113	W641 S642 W649	W641-Q645 HydrophobicContact CB-CB 3.99Å; W641-Q645 HydrophobicContact CE3-CB 4.49Å; W641-Q645 HydrophobicContact CG-CB 4.35Å; S642-Q645 PolarHBondContact O-N 2.77Å; S642-Q645 VanDerWaalsContact O-N 3.12Å; S642-Q645 WeakPolarHBondContact OG-CG 3.4Å; S642-Q645 PolarHBondContact OG-N 3.39Å; S642-Q645 PolarHBondContact OG-OE1 2.96Å; Q645-W649 WeakPolarHBondContact O-CB 3.44Å; Q645-W649 PolarHBondContact O-N 3.23Å; Q645-W649 VanDerWaalsContact O-N 3.16Å
646	V	93.7	Very high	92.3	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-74.8	-37.5	173	177.4	0	0	0	0	111.4	F638 W641 S642 T643 E644 W649 L650 V666 L672	F638-V646 HydrophobicContact CZ-CG2 4.46Å; W641-V646 HydrophobicContact CB-CG2 4.05Å; S642-V646 WeakPolarHBondContact O-CG2 3.34Å; S642-V646 PolarHBondContact O-N 3.25Å; T643-V646 PolarHBondContact O-N 3.23Å; E644-V646 PolarHBondContact O-N 3.15Å; V646-W649 HydrophobicContact CG1-CE3 4.29Å; V646-W649 PolarHBondContact O-N 2.73Å; V646-L650 HydrophobicContact CG1-CD1 4.44Å; V646-L650 WeakPolarHBondContact O-CG 3.34Å; V646-L650 PolarHBondContact O-N 3.04Å; V646-V666 HydrophobicContact CB-CG1 4.32Å; V646-V666 HydrophobicContact CG1-CG1 4.07Å; V646-V666 HydrophobicContact CG2-CG1 4.34Å; V646-L672 HydrophobicContact CG1-CD1 3.41Å; V646-L672 VanDerWaalsContact CG1-CD1 3.41Å; V646-L672 HydrophobicContact CG1-CG 4.3Å
647	C	94.5	Very high	92.8	Very high	21 Å²	21	51.9 Å²	51.9	14%	0.142	28%	0.275	C	S	.	.	H	α-helix	trans	-68	-44.8	175.9	-65.6	0	0	0	0	112	T643 E644 W649 L650 E651	T643-C647 PolarHBondContact O-N 2.87Å; T643-C647 PolarHBondContact O-SG 3.49Å; E644-C647 PolarHBondContact O-N 3.3Å; C647-W649 VanDerWaalsContact C-N 3.26Å; C647-W649 PolarHBondContact O-N 3.19Å; C647-L650 PolarHBondContact O-N 2.99Å; C647-L650 VanDerWaalsContact O-N 3.14Å; C647-E651 PolarHBondContact O-N 3.27Å
648	D	93.3	Very high	93.2	Very high	76 Å²	76	49.9 Å²	49.9	41%	0.406	26%	0.26	S	S	.	.	H	α-helix	trans	-55.3	-43.2	171.5	-78.6	-0	0	0	0	110.5	E644 E651 D652	E644-D648 PolarHBondContact O-N 3.44Å; D648-E651 PolarHBondContact O-N 2.89Å; D648-D652 PolarHBondContact O-N 3.13Å
649	W	92.7	Very high	93.4	Very high	16 Å²	16	50 Å²	50	6%	0.061	26%	0.263	C	S	.	.	H	α-helix	trans	-66.4	-39.1	176.3	171.9	66.6	0	0	0	113.7	R632 F638 W641 Q645 V646 C647 E651 D652 I653 L672 L695 L699 I702	R632-W649 VanDerWaalsContact NH1-CD1 3.28Å; F638-W649 AromaticContact CE2-CD2 3.88Å; F638-W649 HydrophobicContact CE2-CD2 3.88Å; F638-W649 AromaticContact CE2-CE3 3.78Å; F638-W649 HydrophobicContact CE2-CE3 3.78Å; F638-W649 HydrophobicContact CE2-CG 4.49Å; F638-W649 HydrophobicContact CE2-CH2 4.22Å; F638-W649 HydrophobicContact CE2-CZ2 4.33Å; F638-W649 AromaticContact CE2-CZ3 3.96Å; F638-W649 HydrophobicContact CE2-CZ3 3.96Å; F638-W649 HydrophobicContact CZ-CD2 4.43Å; F638-W649 AromaticContact CZ-CE3 3.89Å; F638-W649 HydrophobicContact CZ-CE3 3.89Å; F638-W649 HydrophobicContact CZ-CH2 4.02Å; F638-W649 AromaticContact CZ-CZ3 3.67Å; F638-W649 HydrophobicContact CZ-CZ3 3.67Å; W641-W649 HydrophobicContact CE3-CB 4.48Å; W641-W649 HydrophobicContact CZ3-CB 3.87Å; W641-W649 AromaticContact CZ3-CG 3.9Å; W641-W649 HydrophobicContact CZ3-CG 3.9Å; Q645-W649 WeakPolarHBondContact O-CB 3.44Å; Q645-W649 PolarHBondContact O-N 3.23Å; Q645-W649 VanDerWaalsContact O-N 3.16Å; V646-W649 HydrophobicContact CG1-CE3 4.29Å; V646-W649 PolarHBondContact O-N 2.73Å; C647-W649 VanDerWaalsContact C-N 3.26Å; C647-W649 PolarHBondContact O-N 3.19Å; W649-E651 VanDerWaalsContact C-N 3.3Å; W649-D652 PolarHBondContact O-N 3.17Å; W649-I653 HydrophobicContact CH2-CD1 4.18Å; W649-I653 HydrophobicContact CZ2-CD1 3.96Å; W649-I653 WeakPolarHBondContact O-CG1 3.49Å; W649-I653 PolarHBondContact O-N 3.5Å; W649-L672 HydrophobicContact CZ3-CD1 3.91Å; W649-L695 HydrophobicContact CH2-CD1 3.61Å; W649-L695 HydrophobicContact CZ3-CD1 3.79Å; W649-L699 HydrophobicContact CH2-CD2 3.81Å; W649-L699 HydrophobicContact CH2-CG 4.1Å; W649-L699 HydrophobicContact CZ3-CD2 4.34Å; W649-I702 HydrophobicContact CH2-CD1 4.11Å; W649-I702 HydrophobicContact CZ2-CD1 3.34Å
650	L	94.4	Very high	93.5	Very high	2 Å²	2	53 Å²	53	1%	0.01	28%	0.28	C	S	.	.	H	α-helix	trans	-63	-37.6	173.4	-73.2	171.9	0	0	0	111.1	V646 C647 I653 L655 G656 A662 L695	V646-L650 HydrophobicContact CG1-CD1 4.44Å; V646-L650 WeakPolarHBondContact O-CG 3.34Å; V646-L650 PolarHBondContact O-N 3.04Å; C647-L650 PolarHBondContact O-N 2.99Å; C647-L650 VanDerWaalsContact O-N 3.14Å; L650-I653 HydrophobicContact CD2-CD1 4.28Å; L650-L655 HydrophobicContact CD2-CB 4.35Å; L650-L655 CarbonylContact O-C 3.44Å; L650-L655 VanDerWaalsContact O-CA 3.24Å; L650-L655 WeakPolarHBondContact O-CA 3.36Å; L650-L655 PolarHBondContact O-N 3.22Å; L650-G656 PolarHBondContact O-N 2.9Å; L650-A662 HydrophobicContact CD1-CB 3.41Å; L650-A662 VanDerWaalsContact CD1-CB 3.41Å; L650-L695 HydrophobicContact CD2-CD1 3.8Å
651	E	93.8	Very high	93.6	Very high	97 Å²	97	49.2 Å²	49.2	45%	0.453	27%	0.267	S	S	.	.	H	α-helix	trans	-63.9	-49.4	172	-166.1	175.1	153	0	0	111.7	R627 C647 D648 W649 I653 G654	R627-E651 IonicContact CZ-OE1 3.89Å; R627-E651 IonicContact NH1-OE1 3.15Å; R627-E651 PolarHBondContact NH1-OE1 3.04Å; C647-E651 PolarHBondContact O-N 3.27Å; D648-E651 PolarHBondContact O-N 2.89Å; W649-E651 VanDerWaalsContact C-N 3.3Å; E651-I653 VanDerWaalsContact C-N 3.34Å; E651-I653 PolarHBondContact O-N 3.4Å; E651-G654 WeakPolarHBondContact O-CA 3.4Å; E651-G654 PolarHBondContact O-N 3.27Å
652	D	91.1	Very high	93.7	Very high	115 Å²	115	48 Å²	48	62%	0.615	26%	0.262	S	S	*	.	H	α-helix	trans	-60.8	-35.8	-179.1	-82	-11.4	0	0	0	113.5	R632 D648 W649 G654	R632-D652 IonicContact CZ-OD2 3.63Å; R632-D652 IonicContact NE-OD2 3.83Å; R632-D652 IonicContact NH2-OD2 2.77Å; R632-D652 PolarHBondContact NH2-OD2 3.37Å; D648-D652 PolarHBondContact O-N 3.13Å; W649-D652 PolarHBondContact O-N 3.17Å; D652-G654 PolarHBondContact O-N 2.86Å
653	I	91.8	Very high	93.7	Very high	29 Å²	29	50.6 Å²	50.6	15%	0.149	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	2.9	172.9	70.4	177.3	0	0	0	113.3	W649 L650 E651 L655 K694 L695	W649-I653 HydrophobicContact CH2-CD1 4.18Å; W649-I653 HydrophobicContact CZ2-CD1 3.96Å; W649-I653 WeakPolarHBondContact O-CG1 3.49Å; W649-I653 PolarHBondContact O-N 3.5Å; L650-I653 HydrophobicContact CD2-CD1 4.28Å; E651-I653 VanDerWaalsContact C-N 3.34Å; E651-I653 PolarHBondContact O-N 3.4Å; I653-L655 HydrophobicContact CD1-CD1 3.91Å; I653-L655 HydrophobicContact CD1-CG 4.3Å; I653-L655 HydrophobicContact CG1-CB 4.13Å; I653-L655 HydrophobicContact CG1-CD1 4.3Å; I653-L655 HydrophobicContact CG1-CG 4.12Å; I653-K694 WeakPolarHBondContact O-CE 3.48Å; I653-K694 PolarHBondContact O-NZ 2.9Å; I653-L695 HydrophobicContact CD1-CD1 4.43Å
654	G	93.4	Very high	93.7	Very high	9 Å²	9	56.4 Å²	56.4	9%	0.093	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.9	11.4	178.7	0	0	0	0	0	115.3	E651 D652 R738	E651-G654 WeakPolarHBondContact O-CA 3.4Å; E651-G654 PolarHBondContact O-N 3.27Å; D652-G654 PolarHBondContact O-N 2.86Å; G654-R738 WeakPolarHBondContact O-CD 3.35Å; G654-R738 PolarHBondContact O-NE 2.96Å
655	L	96.3	Very high	93.8	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	27%	0.274	C	S	.	.			trans	-103.3	11.1	178.7	-66.8	-173	0	0	0	113.7	L650 I653 Q657 Y658 H691 K694 L695 R738	L650-L655 HydrophobicContact CD2-CB 4.35Å; L650-L655 CarbonylContact O-C 3.44Å; L650-L655 VanDerWaalsContact O-CA 3.24Å; L650-L655 WeakPolarHBondContact O-CA 3.36Å; L650-L655 PolarHBondContact O-N 3.22Å; I653-L655 HydrophobicContact CD1-CD1 3.91Å; I653-L655 HydrophobicContact CD1-CG 4.3Å; I653-L655 HydrophobicContact CG1-CB 4.13Å; I653-L655 HydrophobicContact CG1-CD1 4.3Å; I653-L655 HydrophobicContact CG1-CG 4.12Å; L655-Q657 PolarHBondContact O-N 3.44Å; L655-Y658 HydrophobicContact CB-CD2 4.22Å; L655-Y658 HydrophobicContact CD2-CD2 4.4Å; L655-Y658 HydrophobicContact CD2-CE2 4.2Å; L655-Y658 WeakPolarHBondContact O-CD2 3.4Å; L655-Y658 PolarHBondContact O-N 2.73Å; L655-H691 HydrophobicContact CD2-CB 3.83Å; L655-K694 HydrophobicContact CD1-CD 4.17Å; L655-K694 HydrophobicContact CD1-CG 4.46Å; L655-K694 HydrophobicContact CD2-CD 4.12Å; L655-K694 HydrophobicContact CG-CD 4.09Å; L655-L695 HydrophobicContact CD1-CB 4Å; L655-R738 HydrophobicContact CD2-CG 4.29Å
656	G	93.3	Very high	93.9	Very high	30 Å²	30	49.5 Å²	49.5	31%	0.309	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-55	-19.1	-176.3	0	0	0	0	0	115.8	L650 Y658 G659	L650-G656 PolarHBondContact O-N 2.9Å; G656-Y658 PolarHBondContact O-N 3.17Å; G656-Y658 VanDerWaalsContact O-N 3.12Å; G656-G659 PolarHBondContact O-N 2.92Å
657	Q	93.6	Very high	93.9	Very high	111 Å²	111	53.8 Å²	53.8	52%	0.519	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-57.3	-20	168.8	63.6	-175.8	74.2	0	0	114.5	L655	L655-Q657 PolarHBondContact O-N 3.44Å
658	Y	95.8	Very high	93.8	Very high	25 Å²	25	54.3 Å²	54.3	10%	0.098	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-96.3	-3.6	173.7	-58.3	-69.4	0	0	0	113.2	L655 G656 V660 L661 A662 L684 I686 H691	L655-Y658 HydrophobicContact CB-CD2 4.22Å; L655-Y658 HydrophobicContact CD2-CD2 4.4Å; L655-Y658 HydrophobicContact CD2-CE2 4.2Å; L655-Y658 WeakPolarHBondContact O-CD2 3.4Å; L655-Y658 PolarHBondContact O-N 2.73Å; G656-Y658 PolarHBondContact O-N 3.17Å; G656-Y658 VanDerWaalsContact O-N 3.12Å; Y658-V660 VanDerWaalsContact C-N 3.3Å; Y658-V660 PolarHBondContact O-N 3.31Å; Y658-L661 PolarHBondContact O-N 2.92Å; Y658-L661 VanDerWaalsContact O-N 3.15Å; Y658-A662 PolarHBondContact O-N 3.43Å; Y658-L684 WeakPolarHBondContact CD1-O 3.39Å; Y658-I686 HydrophobicContact CD1-CG1 3.95Å; Y658-I686 HydrophobicContact CD2-CG1 4.39Å; Y658-I686 HydrophobicContact CE1-CB 4.38Å; Y658-I686 HydrophobicContact CE1-CG1 3.87Å; Y658-I686 HydrophobicContact CE2-CG1 4.32Å; Y658-I686 HydrophobicContact CE2-CG2 4.47Å; Y658-I686 HydrophobicContact CG-CG1 4.22Å; Y658-H691 HydrophobicContact CE2-CB 4.08Å; Y658-H691 AromaticContact CE2-ND1 3.46Å; Y658-H691 WeakPolarHBondContact CE2-ND1 3.38Å; Y658-H691 AromaticContact CZ-ND1 3.66Å; Y658-H691 PolarHBondContact OH-ND1 3.23Å
659	G	93.1	Very high	93.8	Very high	12 Å²	12	50.7 Å²	50.7	12%	0.124	27%	0.273	C	S	.	.	H	α-helix	trans	-58.5	-35.1	-173.3	0	0	0	0	0	114.1	G656 A662 H663	G656-G659 PolarHBondContact O-N 2.92Å; G659-A662 PolarHBondContact O-N 3.42Å; G659-H663 WeakPolarHBondContact O-CB 3.41Å; G659-H663 PolarHBondContact O-N 2.88Å
660	V	93.6	Very high	93.8	Very high	105 Å²	105	54.5 Å²	54.5	64%	0.636	29%	0.291	S	S	*	.	H	α-helix	trans	-64.8	-45.7	177.1	-178.6	0	0	0	0	111.5	Y658 H663 H664	Y658-V660 VanDerWaalsContact C-N 3.3Å; Y658-V660 PolarHBondContact O-N 3.31Å; V660-H663 PolarHBondContact O-N 2.97Å; V660-H664 PolarHBondContact O-CD2 3.3Å; V660-H664 PolarHBondContact O-N 3.09Å
661	L	94.6	Very high	93.7	Very high	71 Å²	71	55.9 Å²	55.9	37%	0.372	30%	0.3	S	S	.	.	H	α-helix	trans	-69.5	-38.8	177.3	-63.7	178	0	0	0	111.2	Y658 H663 H664 W665 L684 A685	Y658-L661 PolarHBondContact O-N 2.92Å; Y658-L661 VanDerWaalsContact O-N 3.15Å; L661-H663 VanDerWaalsContact C-N 3.3Å; L661-H663 PolarHBondContact O-N 3.3Å; L661-H664 PolarHBondContact O-N 3.19Å; L661-W665 PolarHBondContact O-N 3.24Å; L661-W665 VanDerWaalsContact O-N 3.15Å; L661-L684 HydrophobicContact CB-CD2 4.36Å; L661-A685 HydrophobicContact CD1-CB 3.66Å
662	A	94.2	Very high	93.7	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-58.6	-42	172.3	0	0	0	0	0	111.7	L650 Y658 G659 H664 W665 V666 L684	L650-A662 HydrophobicContact CD1-CB 3.41Å; L650-A662 VanDerWaalsContact CD1-CB 3.41Å; Y658-A662 PolarHBondContact O-N 3.43Å; G659-A662 PolarHBondContact O-N 3.42Å; A662-H664 VanDerWaalsContact C-N 3.26Å; A662-H664 PolarHBondContact O-N 3.43Å; A662-W665 PolarHBondContact O-N 2.91Å; A662-V666 HydrophobicContact CB-CG2 4.22Å; A662-V666 WeakPolarHBondContact O-CA 3.24Å; A662-V666 WeakPolarHBondContact O-CB 3.44Å; A662-V666 WeakPolarHBondContact O-CG2 3.27Å; A662-V666 PolarHBondContact O-N 3.48Å; A662-L684 VanDerWaalsContact CA-CD2 3.47Å; A662-L684 HydrophobicContact CB-CD2 3.71Å
663	H	94.8	Very high	93.7	Very high	104 Å²	104	48.5 Å²	48.5	48%	0.481	26%	0.263	S	S	.	.	H	α-helix	trans	-64	-28.7	178.4	-165.3	-52.4	0	0	0	113.1	T643 G659 V660 L661	T643-H663 HydrophobicContact CG2-CB 4.21Å; G659-H663 WeakPolarHBondContact O-CB 3.41Å; G659-H663 PolarHBondContact O-N 2.88Å; V660-H663 PolarHBondContact O-N 2.97Å; L661-H663 VanDerWaalsContact C-N 3.3Å; L661-H663 PolarHBondContact O-N 3.3Å
664	H	94.6	Very high	93.7	Very high	153 Å²	153	50.4 Å²	50.4	71%	0.708	28%	0.284	S	S	*	.	H	α-helix	trans	-83.1	-28.1	177.5	-69.7	-57.7	0	0	0	113.9	V660 L661 A662	V660-H664 PolarHBondContact O-CD2 3.3Å; V660-H664 PolarHBondContact O-N 3.09Å; L661-H664 PolarHBondContact O-N 3.19Å; A662-H664 VanDerWaalsContact C-N 3.26Å; A662-H664 PolarHBondContact O-N 3.43Å
665	W	95.1	Very high	93.6	Very high	60 Å²	60	51 Å²	51	23%	0.227	29%	0.288	C	S	.	.	H	α-helix	trans	-103.4	-36.1	-175.3	172.2	58.3	0	0	0	114.2	L661 A662 S667 T671 L672 A675 D679 L680 E683 L684	L661-W665 PolarHBondContact O-N 3.24Å; L661-W665 VanDerWaalsContact O-N 3.15Å; A662-W665 PolarHBondContact O-N 2.91Å; W665-S667 PolarHBondContact O-N 2.99Å; W665-T671 HydrophobicContact CZ2-CG2 4.33Å; W665-L672 HydrophobicContact CE3-CD2 4.2Å; W665-L672 HydrophobicContact CH2-CD2 4.04Å; W665-L672 HydrophobicContact CZ3-CD2 3.44Å; W665-L672 VanDerWaalsContact CZ3-CD2 3.44Å; W665-A675 HydrophobicContact CH2-CB 3.62Å; W665-A675 HydrophobicContact CZ2-CB 4.14Å; W665-D679 HydrophobicContact CH2-CB 4.14Å; W665-D679 HydrophobicContact CZ2-CB 3.87Å; W665-L680 HydrophobicContact CH2-CD2 4.02Å; W665-L680 HydrophobicContact CZ3-CD2 4.09Å; W665-E683 HydrophobicContact CB-CB 4.36Å; W665-E683 HydrophobicContact CD2-CB 3.5Å; W665-E683 VanDerWaalsContact CD2-CB 3.5Å; W665-E683 HydrophobicContact CD2-CG 4.03Å; W665-E683 HydrophobicContact CE3-CB 3.87Å; W665-E683 HydrophobicContact CG-CB 3.72Å; W665-E683 HydrophobicContact CG-CG 4.19Å; W665-E683 HydrophobicContact CH2-CB 4.47Å; W665-E683 HydrophobicContact CZ2-CB 4.19Å; W665-E683 HydrophobicContact CZ2-CG 4.08Å; W665-E683 HydrophobicContact CZ3-CB 4.34Å; W665-L684 HydrophobicContact CE3-CD1 4.4Å; W665-L684 HydrophobicContact CE3-CD2 3.75Å; W665-L684 HydrophobicContact CE3-CG 3.78Å; W665-L684 HydrophobicContact CZ3-CD1 3.89Å; W665-L684 HydrophobicContact CZ3-CD2 4.1Å; W665-L684 HydrophobicContact CZ3-CG 3.65Å
666	V	94.7	Very high	93.4	Very high	2 Å²	2	54.2 Å²	54.2	1%	0.012	31%	0.307	C	S	.	.			trans	-87.9	100.6	-172.7	-176.8	0	0	0	0	110.5	T643 V646 A662 S668 L672	T643-V666 WeakPolarHBondContact CB-O 3.27Å; T643-V666 VanDerWaalsContact CG2-O 3.24Å; T643-V666 WeakPolarHBondContact CG2-O 3.47Å; T643-V666 PolarHBondContact OG1-O 3.45Å; V646-V666 HydrophobicContact CB-CG1 4.32Å; V646-V666 HydrophobicContact CG1-CG1 4.07Å; V646-V666 HydrophobicContact CG2-CG1 4.34Å; A662-V666 HydrophobicContact CB-CG2 4.22Å; A662-V666 WeakPolarHBondContact O-CA 3.24Å; A662-V666 WeakPolarHBondContact O-CB 3.44Å; A662-V666 WeakPolarHBondContact O-CG2 3.27Å; A662-V666 PolarHBondContact O-N 3.48Å; V666-S668 WeakPolarHBondContact CG1-O 3.23Å; V666-L672 HydrophobicContact CG1-CG 4.24Å; V666-L672 HydrophobicContact CG2-CD2 3.69Å; V666-L672 HydrophobicContact CG2-CG 3.92Å
667	S	93.2	Very high	93.1	Very high	91 Å²	91	56.3 Å²	56.3	64%	0.636	32%	0.316	S	S	*	.	S	Bend	trans	-74.1	-25.1	171.4	54.3	0	0	0	0	113.9	W665 T671	W665-S667 PolarHBondContact O-N 2.99Å; S667-T671 PolarHBondContact OG-OG1 2.94Å; S667-T671 VanDerWaalsContact OG-OG1 3.12Å
668	S	93.5	Very high	92.9	Very high	32 Å²	32	56.7 Å²	56.7	22%	0.224	32%	0.317	C	S	.	.	S	Bend	trans	-164	166.3	173.9	60.7	0	0	0	0	110.4	W641 V666 Q670 T671	W641-S668 CarbonylContact O-C 3.54Å; W641-S668 VanDerWaalsContact O-CA 3.28Å; W641-S668 WeakPolarHBondContact O-CA 3.33Å; V666-S668 WeakPolarHBondContact CG1-O 3.23Å; S668-Q670 PolarHBondContact O-N 3.09Å; S668-Q670 VanDerWaalsContact O-N 3.09Å; S668-T671 VanDerWaalsContact O-CB 3.29Å; S668-T671 WeakPolarHBondContact O-CB 3.45Å; S668-T671 PolarHBondContact O-N 3.4Å; S668-T671 PolarHBondContact O-OG1 2.71Å
669	G	91.8	Very high	92.8	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-57.6	-23.8	174.7	0	0	0	0	0	114.1	F638 W641 T671 L672 L673	F638-G669 WeakPolarHBondContact CE1-O 3.33Å; F638-G669 WeakPolarHBondContact O-CA 3.37Å; W641-G669 PolarHBondContact O-N 3.35Å; G669-T671 PolarHBondContact O-N 2.9Å; G669-L672 PolarHBondContact O-N 3.42Å; G669-L673 WeakPolarHBondContact O-CG 3.48Å; G669-L673 PolarHBondContact O-N 3.11Å; G669-L673 VanDerWaalsContact O-N 3.12Å
670	Q	92.6	Very high	92.7	Very high	95 Å²	95	57.4 Å²	57.4	44%	0.444	32%	0.32	S	S	.	.	H	α-helix	trans	-59.5	-30.9	171.5	-175.6	58.9	36.5	0	0	112.9	S639 S668 L673 A674	S639-Q670 WeakPolarHBondContact O-CB 3.31Å; S639-Q670 PolarHBondContact O-N 3.49Å; S668-Q670 PolarHBondContact O-N 3.09Å; S668-Q670 VanDerWaalsContact O-N 3.09Å; Q670-L673 PolarHBondContact O-N 3.43Å; Q670-A674 WeakPolarHBondContact O-CB 3.3Å; Q670-A674 PolarHBondContact O-N 3.02Å
671	T	93.9	Very high	92.6	Very high	31 Å²	31	56 Å²	56	19%	0.19	31%	0.306	C	S	.	.	H	α-helix	trans	-64.3	-41.2	176.9	-48.9	0	0	0	0	111.2	W665 S667 S668 G669 A674 A675	W665-T671 HydrophobicContact CZ2-CG2 4.33Å; S667-T671 PolarHBondContact OG-OG1 2.94Å; S667-T671 VanDerWaalsContact OG-OG1 3.12Å; S668-T671 VanDerWaalsContact O-CB 3.29Å; S668-T671 WeakPolarHBondContact O-CB 3.45Å; S668-T671 PolarHBondContact O-N 3.4Å; S668-T671 PolarHBondContact O-OG1 2.71Å; G669-T671 PolarHBondContact O-N 2.9Å; T671-A674 PolarHBondContact O-N 2.89Å; T671-A675 PolarHBondContact O-N 3.23Å; T671-A675 VanDerWaalsContact O-N 3.13Å
672	L	92.9	Very high	92.6	Very high	2 Å²	2	59 Å²	59	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-72.8	-31.2	174.7	-68.5	-171.2	0	0	0	113.1	F638 V646 W649 W665 V666 G669 A674 A675 L680 L684 L699	F638-L672 HydrophobicContact CE1-CB 4.26Å; F638-L672 HydrophobicContact CZ-CD1 4.35Å; V646-L672 HydrophobicContact CG1-CD1 3.41Å; V646-L672 VanDerWaalsContact CG1-CD1 3.41Å; V646-L672 HydrophobicContact CG1-CG 4.3Å; W649-L672 HydrophobicContact CZ3-CD1 3.91Å; W665-L672 HydrophobicContact CE3-CD2 4.2Å; W665-L672 HydrophobicContact CH2-CD2 4.04Å; W665-L672 HydrophobicContact CZ3-CD2 3.44Å; W665-L672 VanDerWaalsContact CZ3-CD2 3.44Å; V666-L672 HydrophobicContact CG1-CG 4.24Å; V666-L672 HydrophobicContact CG2-CD2 3.69Å; V666-L672 HydrophobicContact CG2-CG 3.92Å; G669-L672 PolarHBondContact O-N 3.42Å; L672-A674 VanDerWaalsContact C-N 3.32Å; L672-A675 PolarHBondContact O-N 2.85Å; L672-L680 HydrophobicContact CD2-CD2 4.09Å; L672-L684 HydrophobicContact CD2-CD1 4.27Å; L672-L699 HydrophobicContact CB-CD1 4.35Å; L672-L699 HydrophobicContact CB-CD2 3.96Å
673	L	91.4	Very high	92.6	Very high	55 Å²	55	62 Å²	62	29%	0.288	33%	0.331	S	S	.	.	H	α-helix	trans	-70.6	-27.7	174.7	-65.7	179.1	0	0	0	113.1	F638 G669 Q670 L699	F638-L673 HydrophobicContact CD1-CD1 3.94Å; F638-L673 HydrophobicContact CD1-CD2 3.85Å; F638-L673 HydrophobicContact CD1-CG 3.73Å; F638-L673 HydrophobicContact CE1-CD2 4.14Å; F638-L673 HydrophobicContact CE1-CG 4.07Å; G669-L673 WeakPolarHBondContact O-CG 3.48Å; G669-L673 PolarHBondContact O-N 3.11Å; G669-L673 VanDerWaalsContact O-N 3.12Å; Q670-L673 PolarHBondContact O-N 3.43Å; L673-L699 HydrophobicContact CD2-CD2 4.13Å
674	A	92	Very high	92.5	Very high	70 Å²	70	57.1 Å²	57.1	58%	0.579	31%	0.308	S	S	*	.	H	α-helix	trans	-90.4	-12.1	177	0	0	0	0	0	113.7	Q670 T671 L672	Q670-A674 WeakPolarHBondContact O-CB 3.3Å; Q670-A674 PolarHBondContact O-N 3.02Å; T671-A674 PolarHBondContact O-N 2.89Å; L672-A674 VanDerWaalsContact C-N 3.32Å
675	A	91.6	Very high	92.4	Very high	22 Å²	22	52 Å²	52	18%	0.182	29%	0.292	C	S	.	.			trans	-66.5	132.9	-175.9	0	0	0	0	0	112.7	W665 T671 L672 D679 L680	W665-A675 HydrophobicContact CH2-CB 3.62Å; W665-A675 HydrophobicContact CZ2-CB 4.14Å; T671-A675 PolarHBondContact O-N 3.23Å; T671-A675 VanDerWaalsContact O-N 3.13Å; L672-A675 PolarHBondContact O-N 2.85Å; A675-D679 HydrophobicContact CB-CB 4.36Å; A675-L680 HydrophobicContact CB-CD2 3.86Å; A675-L680 HydrophobicContact CB-CG 4.12Å
676	T	90.3	Very high	92.4	Very high	67 Å²	67	49.3 Å²	49.3	41%	0.411	28%	0.282	S	S	.	.			trans	-76.4	162.3	168.1	74.7	0	0	0	0	110.5	H678 D679 L680	T676-H678 PolarHBondContact O-N 3.22Å; T676-H678 VanDerWaalsContact O-N 3.13Å; T676-H678 PolarHBondContact OG1-N 3.38Å; T676-D679 WeakPolarHBondContact CA-OD2 3.46Å; T676-D679 VanDerWaalsContact CB-OD2 3.24Å; T676-D679 WeakPolarHBondContact CB-OD2 3.5Å; T676-D679 WeakPolarHBondContact CG2-OD2 3.49Å; T676-D679 PolarHBondContact N-OD2 2.86Å; T676-D679 PolarHBondContact O-N 3.26Å; T676-D679 VanDerWaalsContact O-N 3.09Å; T676-D679 VanDerWaalsContact OG1-CG 3.23Å; T676-D679 PolarHBondContact OG1-N 3.48Å; T676-D679 PolarHBondContact OG1-OD2 3.44Å; T676-L680 PolarHBondContact O-N 2.96Å
677	P	88.3	Confident	92.3	Very high	75 Å²	75	58.2 Å²	58.2	49%	0.487	32%	0.321	S	S	.	.	H	α-helix	trans	-50.4	-34.3	169.6	-30.8	38	0	0	0	114	E681	P677-E681 WeakPolarHBondContact O-CG 3.36Å; P677-E681 PolarHBondContact O-N 3.24Å
678	H	89.3	Confident	92.4	Very high	119 Å²	119	55.3 Å²	55.3	55%	0.551	30%	0.298	S	S	*	.	H	α-helix	trans	-72.2	-36.4	179.5	-174.6	68.7	0	0	0	112.7	T676 E681 K682	T676-H678 PolarHBondContact O-N 3.22Å; T676-H678 VanDerWaalsContact O-N 3.13Å; T676-H678 PolarHBondContact OG1-N 3.38Å; H678-E681 WeakPolarHBondContact O-CB 3.23Å; H678-E681 PolarHBondContact O-N 3.48Å; H678-E681 VanDerWaalsContact O-N 3.12Å; H678-K682 WeakPolarHBondContact O-CB 3.45Å; H678-K682 PolarHBondContact O-N 2.87Å
679	D	92.4	Very high	92.4	Very high	48 Å²	48	56.1 Å²	56.1	26%	0.257	30%	0.303	S	S	.	.	H	α-helix	trans	-67.9	-39.1	177.1	-50.4	-53.6	0	0	0	110.8	W665 A675 T676 E681 K682 E683	W665-D679 HydrophobicContact CH2-CB 4.14Å; W665-D679 HydrophobicContact CZ2-CB 3.87Å; A675-D679 HydrophobicContact CB-CB 4.36Å; T676-D679 WeakPolarHBondContact CA-OD2 3.46Å; T676-D679 VanDerWaalsContact CB-OD2 3.24Å; T676-D679 WeakPolarHBondContact CB-OD2 3.5Å; T676-D679 WeakPolarHBondContact CG2-OD2 3.49Å; T676-D679 PolarHBondContact N-OD2 2.86Å; T676-D679 PolarHBondContact O-N 3.26Å; T676-D679 VanDerWaalsContact O-N 3.09Å; T676-D679 VanDerWaalsContact OG1-CG 3.23Å; T676-D679 PolarHBondContact OG1-N 3.48Å; T676-D679 PolarHBondContact OG1-OD2 3.44Å; D679-E681 PolarHBondContact O-N 3.08Å; D679-K682 PolarHBondContact O-N 2.93Å; D679-E683 WeakPolarHBondContact O-CB 3.37Å; D679-E683 PolarHBondContact O-N 2.89Å
680	L	91.5	Very high	92.6	Very high	4 Å²	4	56.2 Å²	56.2	2%	0.021	30%	0.303	C	S	.	.	H	α-helix	trans	-63.6	-23.5	172.3	-60.1	177.8	0	0	0	112.9	W665 L672 A675 T676 L684 I686 L695 Q696	W665-L680 HydrophobicContact CH2-CD2 4.02Å; W665-L680 HydrophobicContact CZ3-CD2 4.09Å; L672-L680 HydrophobicContact CD2-CD2 4.09Å; A675-L680 HydrophobicContact CB-CD2 3.86Å; A675-L680 HydrophobicContact CB-CG 4.12Å; T676-L680 PolarHBondContact O-N 2.96Å; L680-L684 HydrophobicContact CD2-CD1 3.93Å; L680-I686 WeakPolarHBondContact O-CB 3.42Å; L680-I686 WeakPolarHBondContact O-CG1 3.35Å; L680-L695 HydrophobicContact CD1-CD2 4.41Å; L680-L695 HydrophobicContact CD2-CD2 3.93Å; L680-Q696 HydrophobicContact CD1-CG 3.99Å
681	E	91.8	Very high	92.8	Very high	75 Å²	75	52 Å²	52	35%	0.35	28%	0.283	S	S	.	.	H	α-helix	trans	-82.2	-43	173.5	-74	179.5	-130.3	0	0	112.5	P677 H678 D679 A685 I686 R692	P677-E681 WeakPolarHBondContact O-CG 3.36Å; P677-E681 PolarHBondContact O-N 3.24Å; H678-E681 WeakPolarHBondContact O-CB 3.23Å; H678-E681 PolarHBondContact O-N 3.48Å; H678-E681 VanDerWaalsContact O-N 3.12Å; D679-E681 PolarHBondContact O-N 3.08Å; E681-A685 WeakPolarHBondContact O-CA 3.35Å; E681-A685 PolarHBondContact O-N 3.25Å; E681-I686 PolarHBondContact O-N 3.32Å; E681-R692 WeakPolarHBondContact OE1-CD 3.38Å; E681-R692 IonicContact OE1-CZ 2.63Å; E681-R692 VanDerWaalsContact OE1-CZ 3.23Å; E681-R692 IonicContact OE1-NE 3.23Å; E681-R692 PolarHBondContact OE1-NE 3.23Å; E681-R692 IonicContact OE1-NH1 2.78Å; E681-R692 PolarHBondContact OE1-NH1 3.37Å; E681-R692 IonicContact OE2-CZ 3.7Å; E681-R692 IonicContact OE2-NE 3.2Å; E681-R692 IonicContact OE2-NH1 3.29Å; E681-R692 PolarHBondContact OE2-NH1 3.2Å; E681-R692 IonicContact OE2-NH2 2.65Å; E681-R692 PolarHBondContact OE2-NH2 2.86Å
682	K	93.8	Very high	92.9	Very high	135 Å²	135	52.8 Å²	52.8	59%	0.587	28%	0.283	S	S	*	.	H	α-helix	trans	-81.4	-50.3	-172.1	-177.9	172.6	166.9	-79.7	0	112.8	H678 D679	H678-K682 WeakPolarHBondContact O-CB 3.45Å; H678-K682 PolarHBondContact O-N 2.87Å; D679-K682 PolarHBondContact O-N 2.93Å
683	E	94.3	Very high	92.9	Very high	63 Å²	63	54.4 Å²	54.4	29%	0.294	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-38.2	-171.4	-52.1	-57.5	141.2	0	0	112.2	W665 D679	W665-E683 HydrophobicContact CB-CB 4.36Å; W665-E683 HydrophobicContact CD2-CB 3.5Å; W665-E683 VanDerWaalsContact CD2-CB 3.5Å; W665-E683 HydrophobicContact CD2-CG 4.03Å; W665-E683 HydrophobicContact CE3-CB 3.87Å; W665-E683 HydrophobicContact CG-CB 3.72Å; W665-E683 HydrophobicContact CG-CG 4.19Å; W665-E683 HydrophobicContact CH2-CB 4.47Å; W665-E683 HydrophobicContact CZ2-CB 4.19Å; W665-E683 HydrophobicContact CZ2-CG 4.08Å; W665-E683 HydrophobicContact CZ3-CB 4.34Å; D679-E683 WeakPolarHBondContact O-CB 3.37Å; D679-E683 PolarHBondContact O-N 2.89Å
684	L	93.7	Very high	93.1	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.005	28%	0.276	C	S	.	.	S	Bend	trans	-91.1	-0.1	174.6	-62.4	-179.3	0	0	0	113.6	Y658 L661 A662 W665 L672 L680 I686 L695	Y658-L684 WeakPolarHBondContact CD1-O 3.39Å; L661-L684 HydrophobicContact CB-CD2 4.36Å; A662-L684 VanDerWaalsContact CA-CD2 3.47Å; A662-L684 HydrophobicContact CB-CD2 3.71Å; W665-L684 HydrophobicContact CE3-CD1 4.4Å; W665-L684 HydrophobicContact CE3-CD2 3.75Å; W665-L684 HydrophobicContact CE3-CG 3.78Å; W665-L684 HydrophobicContact CZ3-CD1 3.89Å; W665-L684 HydrophobicContact CZ3-CD2 4.1Å; W665-L684 HydrophobicContact CZ3-CG 3.65Å; L672-L684 HydrophobicContact CD2-CD1 4.27Å; L680-L684 HydrophobicContact CD2-CD1 3.93Å; L684-I686 HydrophobicContact CB-CD1 3.79Å; L684-I686 HydrophobicContact CB-CG1 3.66Å; L684-I686 HydrophobicContact CD1-CD1 3.86Å; L684-I686 PolarHBondContact O-N 3.31Å; L684-L695 HydrophobicContact CD1-CD2 3.82Å
685	A	93.3	Very high	93.2	Very high	46 Å²	46	48.6 Å²	48.6	38%	0.38	25%	0.249	S	C	.	.			trans	52	33.2	-178.3	0	0	0	0	0	114.9	L661 E681 K687	L661-A685 HydrophobicContact CD1-CB 3.66Å; E681-A685 WeakPolarHBondContact O-CA 3.35Å; E681-A685 PolarHBondContact O-N 3.25Å; A685-K687 PolarHBondContact O-N 2.86Å
686	I	94.6	Very high	93.3	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.01	25%	0.254	C	S	.	.			trans	-76.8	84.4	-173	-54.9	176.6	0	0	0	111.4	Y658 L680 E681 L684 H691 R692 L695	Y658-I686 HydrophobicContact CD1-CG1 3.95Å; Y658-I686 HydrophobicContact CD2-CG1 4.39Å; Y658-I686 HydrophobicContact CE1-CB 4.38Å; Y658-I686 HydrophobicContact CE1-CG1 3.87Å; Y658-I686 HydrophobicContact CE2-CG1 4.32Å; Y658-I686 HydrophobicContact CE2-CG2 4.47Å; Y658-I686 HydrophobicContact CG-CG1 4.22Å; L680-I686 WeakPolarHBondContact O-CB 3.42Å; L680-I686 WeakPolarHBondContact O-CG1 3.35Å; E681-I686 PolarHBondContact O-N 3.32Å; L684-I686 HydrophobicContact CB-CD1 3.79Å; L684-I686 HydrophobicContact CB-CG1 3.66Å; L684-I686 HydrophobicContact CD1-CD1 3.86Å; L684-I686 PolarHBondContact O-N 3.31Å; I686-H691 HydrophobicContact CG2-CB 3.71Å; I686-R692 HydrophobicContact CG2-CB 3.9Å; I686-R692 PolarHBondContact O-NE 3.07Å; I686-R692 PolarHBondContact O-NH2 3.01Å; I686-L695 HydrophobicContact CD1-CD2 3.7Å
687	K	92.6	Very high	93.3	Very high	190 Å²	190	48.2 Å²	48.2	83%	0.826	24%	0.239	S	C	*	.			trans	-69.3	-29.7	175.9	-63.9	-173.1	179.9	-174.7	0	114.3	A685 P689	A685-K687 PolarHBondContact O-N 2.86Å; K687-P689 WeakPolarHBondContact O-CD 3.23Å
688	N	94.8	Very high	93.4	Very high	29 Å²	29	45.4 Å²	45.4	16%	0.155	22%	0.221	C	C	.	.			trans	-80.2	117.1	179.6	-176.7	-7.1	0	0	0	110.1	L690 H691 R692 D736 F754	N688-L690 PolarHBondContact O-N 2.94Å; N688-L690 WeakPolarHBondContact OD1-CB 3.49Å; N688-L690 PolarHBondContact OD1-N 2.9Å; N688-H691 HydrophobicContact CB-CB 4.11Å; N688-H691 PolarHBondContact ND2-CD2 3.05Å; N688-H691 PolarHBondContact ND2-NE2 3.35Å; N688-H691 PolarHBondContact O-N 2.96Å; N688-R692 PolarHBondContact O-N 3.11Å; N688-D736 PolarHBondContact ND2-O 2.8Å; N688-F754 WeakPolarHBondContact OD1-CE1 3.37Å
689	P	94.1	Very high	93.5	Very high	50 Å²	50	40.5 Å²	40.5	33%	0.325	20%	0.199	S	C	.	.	H	α-helix	trans	-61.2	-30.8	179.9	25.7	-35.2	0	0	0	112.7	K687 R692 K693 F754	K687-P689 WeakPolarHBondContact O-CD 3.23Å; P689-R692 WeakPolarHBondContact O-CB 3.4Å; P689-R692 PolarHBondContact O-N 2.88Å; P689-K693 VanDerWaalsContact O-CB 3.3Å; P689-K693 WeakPolarHBondContact O-CB 3.45Å; P689-K693 PolarHBondContact O-N 2.99Å; P689-F754 HydrophobicContact CG-CD1 4.36Å; P689-F754 HydrophobicContact CG-CD2 4.06Å; P689-F754 HydrophobicContact CG-CE1 4.02Å; P689-F754 HydrophobicContact CG-CE2 3.7Å; P689-F754 HydrophobicContact CG-CG 4.39Å; P689-F754 HydrophobicContact CG-CZ 3.68Å
690	L	96.3	Very high	93.2	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-68.9	-40.9	178	-64.8	-179.8	0	0	0	112.1	N688 R692 K693 K694 G737 V739 M743 D751 F754 L755	N688-L690 PolarHBondContact O-N 2.94Å; N688-L690 WeakPolarHBondContact OD1-CB 3.49Å; N688-L690 PolarHBondContact OD1-N 2.9Å; L690-R692 VanDerWaalsContact C-N 3.3Å; L690-R692 PolarHBondContact O-N 3.18Å; L690-K693 PolarHBondContact O-N 3.46Å; L690-K694 VanDerWaalsContact O-CB 3.27Å; L690-K694 WeakPolarHBondContact O-CB 3.24Å; L690-K694 PolarHBondContact O-N 2.97Å; L690-G737 WeakPolarHBondContact CB-O 3.39Å; L690-V739 HydrophobicContact CD1-CG2 4.35Å; L690-M743 HydrophobicContact CB-CE 4.02Å; L690-M743 HydrophobicContact CD2-CE 4.17Å; L690-M743 WeakPolarHBondContact O-CE 3.23Å; L690-D751 HydrophobicContact CD2-CB 4.03Å; L690-F754 HydrophobicContact CD1-CD1 3.71Å; L690-F754 HydrophobicContact CD1-CE1 4Å; L690-F754 HydrophobicContact CG-CD1 3.87Å; L690-F754 HydrophobicContact CG-CE1 4.08Å; L690-L755 HydrophobicContact CD1-CD1 4.31Å; L690-L755 HydrophobicContact CD1-CD2 3.5Å; L690-L755 HydrophobicContact CD1-CG 3.8Å
691	H	96.8	Very high	92.9	Very high	6 Å²	6	45.2 Å²	45.2	3%	0.028	22%	0.221	C	C	.	.	H	α-helix	trans	-63.2	-37.7	174.3	-66.8	176.6	0	0	0	112	L655 Y658 I686 N688 K694 L695 D736 R738	L655-H691 HydrophobicContact CD2-CB 3.83Å; Y658-H691 HydrophobicContact CE2-CB 4.08Å; Y658-H691 AromaticContact CE2-ND1 3.46Å; Y658-H691 WeakPolarHBondContact CE2-ND1 3.38Å; Y658-H691 AromaticContact CZ-ND1 3.66Å; Y658-H691 PolarHBondContact OH-ND1 3.23Å; I686-H691 HydrophobicContact CG2-CB 3.71Å; N688-H691 HydrophobicContact CB-CB 4.11Å; N688-H691 PolarHBondContact ND2-CD2 3.05Å; N688-H691 PolarHBondContact ND2-NE2 3.35Å; N688-H691 PolarHBondContact O-N 2.96Å; H691-K694 WeakPolarHBondContact O-CB 3.26Å; H691-L695 WeakPolarHBondContact O-CB 3.29Å; H691-L695 PolarHBondContact O-N 2.87Å; H691-D736 PolarHBondContact NE2-O 3.46Å; H691-R738 WeakPolarHBondContact NE2-CG 3.4Å
692	R	94.5	Very high	92.5	Very high	48 Å²	48	44.7 Å²	44.7	18%	0.181	22%	0.22	C	C	.	.	H	α-helix	trans	-66.4	-47.7	176.5	-165.3	-172.5	-49.3	164.5	1.4	111.2	E681 I686 N688 P689 L690 L695 Q696	E681-R692 WeakPolarHBondContact OE1-CD 3.38Å; E681-R692 IonicContact OE1-CZ 2.63Å; E681-R692 VanDerWaalsContact OE1-CZ 3.23Å; E681-R692 IonicContact OE1-NE 3.23Å; E681-R692 PolarHBondContact OE1-NE 3.23Å; E681-R692 IonicContact OE1-NH1 2.78Å; E681-R692 PolarHBondContact OE1-NH1 3.37Å; E681-R692 IonicContact OE2-CZ 3.7Å; E681-R692 IonicContact OE2-NE 3.2Å; E681-R692 IonicContact OE2-NH1 3.29Å; E681-R692 PolarHBondContact OE2-NH1 3.2Å; E681-R692 IonicContact OE2-NH2 2.65Å; E681-R692 PolarHBondContact OE2-NH2 2.86Å; I686-R692 HydrophobicContact CG2-CB 3.9Å; I686-R692 PolarHBondContact O-NE 3.07Å; I686-R692 PolarHBondContact O-NH2 3.01Å; N688-R692 PolarHBondContact O-N 3.11Å; P689-R692 WeakPolarHBondContact O-CB 3.4Å; P689-R692 PolarHBondContact O-N 2.88Å; L690-R692 VanDerWaalsContact C-N 3.3Å; L690-R692 PolarHBondContact O-N 3.18Å; R692-L695 PolarHBondContact O-N 3.3Å; R692-Q696 WeakPolarHBondContact O-CB 3.22Å; R692-Q696 VanDerWaalsContact O-CG 3.25Å; R692-Q696 WeakPolarHBondContact O-CG 3.49Å; R692-Q696 PolarHBondContact O-N 3.29Å
693	K	94.5	Very high	91.6	Very high	37 Å²	37	42.5 Å²	42.5	16%	0.161	22%	0.221	C	C	.	.	H	α-helix	trans	-60.7	-44.1	175.9	-179.6	165.4	179.5	163.5	0	111.8	P689 L690 Q696 L697 Y746 D751	P689-K693 VanDerWaalsContact O-CB 3.3Å; P689-K693 WeakPolarHBondContact O-CB 3.45Å; P689-K693 PolarHBondContact O-N 2.99Å; L690-K693 PolarHBondContact O-N 3.46Å; K693-Q696 PolarHBondContact O-N 2.86Å; K693-L697 HydrophobicContact CG-CD1 3.98Å; K693-L697 HydrophobicContact CG-CG 4.46Å; K693-L697 WeakPolarHBondContact O-CB 3.48Å; K693-L697 VanDerWaalsContact O-CG 3.26Å; K693-L697 WeakPolarHBondContact O-CG 3.33Å; K693-L697 PolarHBondContact O-N 3.29Å; K693-Y746 VanDerWaalsContact CE-O 3.23Å; K693-Y746 WeakPolarHBondContact CE-O 3.36Å; K693-Y746 PolarHBondContact NZ-O 3.09Å; K693-D751 IonicContact NZ-OD1 2.82Å; K693-D751 IonicContact NZ-OD2 3.48Å; K693-D751 PolarHBondContact NZ-OD2 3.26Å
694	K	95.1	Very high	90.8	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.009	23%	0.229	C	C	.	.	H	α-helix	trans	-53.7	-56.7	172.7	-171	178.4	175.9	73	0	111.4	I653 L655 L690 H691 Q696 L697 S698 R738 D740 M743	I653-K694 WeakPolarHBondContact O-CE 3.48Å; I653-K694 PolarHBondContact O-NZ 2.9Å; L655-K694 HydrophobicContact CD1-CD 4.17Å; L655-K694 HydrophobicContact CD1-CG 4.46Å; L655-K694 HydrophobicContact CD2-CD 4.12Å; L655-K694 HydrophobicContact CG-CD 4.09Å; L690-K694 VanDerWaalsContact O-CB 3.27Å; L690-K694 WeakPolarHBondContact O-CB 3.24Å; L690-K694 PolarHBondContact O-N 2.97Å; H691-K694 WeakPolarHBondContact O-CB 3.26Å; K694-Q696 VanDerWaalsContact C-N 3.35Å; K694-Q696 PolarHBondContact O-N 3.42Å; K694-L697 PolarHBondContact O-N 3.22Å; K694-S698 PolarHBondContact O-N 3.49Å; K694-S698 PolarHBondContact O-OG 3.34Å; K694-R738 HydrophobicContact CD-CB 3.72Å; K694-R738 WeakPolarHBondContact CD-O 3.45Å; K694-R738 WeakPolarHBondContact CE-O 3.48Å; K694-R738 PolarHBondContact NZ-O 2.84Å; K694-D740 VanDerWaalsContact NZ-CG 3.34Å; K694-D740 IonicContact NZ-OD2 3.79Å; K694-D740 PolarHBondContact NZ-OD2 2.97Å; K694-M743 HydrophobicContact CB-CE 4.27Å; K694-M743 HydrophobicContact CB-CG 4.33Å; K694-M743 HydrophobicContact CB-SD 3.44Å; K694-M743 WeakPolarHBondContact CB-SD 3.32Å; K694-M743 HydrophobicContact CD-SD 3.98Å; K694-M743 HydrophobicContact CG-CG 4.42Å; K694-M743 HydrophobicContact CG-SD 3.61Å
695	L	94.3	Very high	89.2	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-59.4	-44	-179	-177.6	56.9	0	0	0	111.9	W649 L650 I653 L655 L680 L684 I686 H691 R692 S698 L699	W649-L695 HydrophobicContact CH2-CD1 3.61Å; W649-L695 HydrophobicContact CZ3-CD1 3.79Å; L650-L695 HydrophobicContact CD2-CD1 3.8Å; I653-L695 HydrophobicContact CD1-CD1 4.43Å; L655-L695 HydrophobicContact CD1-CB 4Å; L680-L695 HydrophobicContact CD1-CD2 4.41Å; L680-L695 HydrophobicContact CD2-CD2 3.93Å; L684-L695 HydrophobicContact CD1-CD2 3.82Å; I686-L695 HydrophobicContact CD1-CD2 3.7Å; H691-L695 WeakPolarHBondContact O-CB 3.29Å; H691-L695 PolarHBondContact O-N 2.87Å; R692-L695 PolarHBondContact O-N 3.3Å; L695-S698 PolarHBondContact O-N 3.22Å; L695-L699 HydrophobicContact CD1-CD1 4.11Å; L695-L699 HydrophobicContact CD1-CG 4.29Å; L695-L699 HydrophobicContact CG-CD1 4.02Å; L695-L699 WeakPolarHBondContact O-CB 3.36Å; L695-L699 VanDerWaalsContact O-CG 3.24Å; L695-L699 WeakPolarHBondContact O-CG 3.5Å; L695-L699 PolarHBondContact O-N 3.22Å
696	Q	92.2	Very high	87.8	Confident	63 Å²	63	60.4 Å²	60.4	29%	0.294	29%	0.292	S	S	.	.	H	α-helix	trans	-61.5	-42.9	175.7	-73.2	169.1	-6.8	0	0	112.6	L680 R692 K693 K694 K700	L680-Q696 HydrophobicContact CD1-CG 3.99Å; R692-Q696 WeakPolarHBondContact O-CB 3.22Å; R692-Q696 VanDerWaalsContact O-CG 3.25Å; R692-Q696 WeakPolarHBondContact O-CG 3.49Å; R692-Q696 PolarHBondContact O-N 3.29Å; K693-Q696 PolarHBondContact O-N 2.86Å; K694-Q696 VanDerWaalsContact C-N 3.35Å; K694-Q696 PolarHBondContact O-N 3.42Å; Q696-K700 WeakPolarHBondContact O-CB 3.16Å; Q696-K700 WeakPolarHBondContact O-CG 3.47Å; Q696-K700 PolarHBondContact O-N 2.8Å
697	L	90.9	Very high	86.5	Confident	18 Å²	18	66.3 Å²	66.3	9%	0.094	33%	0.33	C	S	.	.	H	α-helix	trans	-65.1	-48.3	175.7	-73.5	172.2	0	0	0	110.8	K693 K694 L699 K700 S701 H742 M743 Y746	K693-L697 HydrophobicContact CG-CD1 3.98Å; K693-L697 HydrophobicContact CG-CG 4.46Å; K693-L697 WeakPolarHBondContact O-CB 3.48Å; K693-L697 VanDerWaalsContact O-CG 3.26Å; K693-L697 WeakPolarHBondContact O-CG 3.33Å; K693-L697 PolarHBondContact O-N 3.29Å; K694-L697 PolarHBondContact O-N 3.22Å; L697-L699 VanDerWaalsContact C-N 3.3Å; L697-L699 PolarHBondContact O-N 3.06Å; L697-K700 WeakPolarHBondContact O-CB 3.49Å; L697-K700 PolarHBondContact O-N 2.86Å; L697-K700 VanDerWaalsContact O-N 3.15Å; L697-S701 PolarHBondContact O-N 2.85Å; L697-H742 PolarHBondContact O-CE1 3.16Å; L697-H742 VanDerWaalsContact O-CE1 3.31Å; L697-M743 HydrophobicContact CD1-CG 4.03Å; L697-Y746 HydrophobicContact CD1-CD2 3.99Å; L697-Y746 HydrophobicContact CD1-CG 4.38Å; L697-Y746 HydrophobicContact CD2-CD2 3.47Å; L697-Y746 VanDerWaalsContact CD2-CD2 3.47Å; L697-Y746 HydrophobicContact CD2-CE2 3.94Å; L697-Y746 HydrophobicContact CD2-CG 3.93Å; L697-Y746 HydrophobicContact CG-CD2 4.36Å
698	S	91.3	Very high	85.9	Confident	15 Å²	15	59.7 Å²	59.7	11%	0.105	30%	0.304	C	S	.	.	H	α-helix	trans	-58.5	-40.8	177.2	-52.4	0	0	0	0	112.1	K694 L695 S701 I702	K694-S698 PolarHBondContact O-N 3.49Å; K694-S698 PolarHBondContact O-OG 3.34Å; L695-S698 PolarHBondContact O-N 3.22Å; S698-S701 PolarHBondContact O-N 3.21Å; S698-I702 WeakPolarHBondContact O-CB 3.4Å; S698-I702 WeakPolarHBondContact O-CD1 3.34Å; S698-I702 VanDerWaalsContact O-CG1 3.29Å; S698-I702 WeakPolarHBondContact O-CG1 3.5Å; S698-I702 PolarHBondContact O-N 3.18Å
699	L	90.4	Very high	85.5	Confident	16 Å²	16	63.8 Å²	63.8	8%	0.084	32%	0.32	C	S	.	.	H	α-helix	trans	-66.7	-41.7	174.3	-68.5	166.5	0	0	0	112.4	F638 W649 L672 L673 L695 L697 S701 I702 C703	F638-L699 HydrophobicContact CE1-CD2 3.71Å; F638-L699 HydrophobicContact CZ-CD2 3.84Å; W649-L699 HydrophobicContact CH2-CD2 3.81Å; W649-L699 HydrophobicContact CH2-CG 4.1Å; W649-L699 HydrophobicContact CZ3-CD2 4.34Å; L672-L699 HydrophobicContact CB-CD1 4.35Å; L672-L699 HydrophobicContact CB-CD2 3.96Å; L673-L699 HydrophobicContact CD2-CD2 4.13Å; L695-L699 HydrophobicContact CD1-CD1 4.11Å; L695-L699 HydrophobicContact CD1-CG 4.29Å; L695-L699 HydrophobicContact CG-CD1 4.02Å; L695-L699 WeakPolarHBondContact O-CB 3.36Å; L695-L699 VanDerWaalsContact O-CG 3.24Å; L695-L699 WeakPolarHBondContact O-CG 3.5Å; L695-L699 PolarHBondContact O-N 3.22Å; L697-L699 VanDerWaalsContact C-N 3.3Å; L697-L699 PolarHBondContact O-N 3.06Å; L699-S701 VanDerWaalsContact C-N 3.31Å; L699-S701 PolarHBondContact O-N 2.9Å; L699-I702 PolarHBondContact O-N 2.98Å; L699-C703 PolarHBondContact O-N 3.13Å
700	K	86.8	Confident	85.2	Confident	120 Å²	120	61.4 Å²	61.4	52%	0.522	31%	0.305	S	S	.	.	H	α-helix	trans	-57.9	-42.6	171.7	-81.4	-171.2	173.6	-166.9	0	111.4	Q696 L697 C703 S704 D913	Q696-K700 WeakPolarHBondContact O-CB 3.16Å; Q696-K700 WeakPolarHBondContact O-CG 3.47Å; Q696-K700 PolarHBondContact O-N 2.8Å; L697-K700 WeakPolarHBondContact O-CB 3.49Å; L697-K700 PolarHBondContact O-N 2.86Å; L697-K700 VanDerWaalsContact O-N 3.15Å; K700-C703 PolarHBondContact O-N 3.22Å; K700-S704 PolarHBondContact O-N 3.32Å; K700-D913 IonicContact NZ-OD1 3.17Å; K700-D913 PolarHBondContact NZ-OD1 2.96Å
701	S	85.4	Confident	84.8	Confident	32 Å²	32	64.1 Å²	64.1	22%	0.224	33%	0.327	C	S	.	.	H	α-helix	trans	-69.1	-39.1	-179.8	-174.5	0	0	0	0	112.8	L697 S698 L699 C703 S704	L697-S701 PolarHBondContact O-N 2.85Å; S698-S701 PolarHBondContact O-N 3.21Å; L699-S701 VanDerWaalsContact C-N 3.31Å; L699-S701 PolarHBondContact O-N 2.9Å; S701-C703 PolarHBondContact O-N 2.89Å; S701-S704 WeakPolarHBondContact O-CA 3.36Å; S701-S704 WeakPolarHBondContact O-CB 3.34Å; S701-S704 PolarHBondContact O-N 2.8Å
702	I	83.8	Confident	84.4	Confident	63 Å²	63	70.1 Å²	70.1	32%	0.323	36%	0.356	S	S	.	.	H	α-helix	trans	-61.7	-28.3	174	-75.6	166.1	0	0	0	112.7	F638 W649 S698 L699 S704	F638-I702 HydrophobicContact CB-CG2 3.4Å; F638-I702 HydrophobicContact CD1-CG2 4.14Å; F638-I702 HydrophobicContact CD2-CD1 3.83Å; F638-I702 HydrophobicContact CD2-CG2 4.01Å; F638-I702 HydrophobicContact CE2-CD1 3.84Å; F638-I702 HydrophobicContact CG-CD1 4.44Å; F638-I702 HydrophobicContact CG-CG2 3.61Å; F638-I702 HydrophobicContact CZ-CD1 4.45Å; W649-I702 HydrophobicContact CH2-CD1 4.11Å; W649-I702 HydrophobicContact CZ2-CD1 3.34Å; S698-I702 WeakPolarHBondContact O-CB 3.4Å; S698-I702 WeakPolarHBondContact O-CD1 3.34Å; S698-I702 VanDerWaalsContact O-CG1 3.29Å; S698-I702 WeakPolarHBondContact O-CG1 3.5Å; S698-I702 PolarHBondContact O-N 3.18Å; L699-I702 PolarHBondContact O-N 2.98Å; I702-S704 VanDerWaalsContact C-N 3.34Å
703	C	74.8	Confident	84.3	Confident	90 Å²	90	68 Å²	68	61%	0.608	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-9.5	171.7	-71.4	0	0	0	0	114	L699 K700 S701	L699-C703 PolarHBondContact O-N 3.13Å; K700-C703 PolarHBondContact O-N 3.22Å; S701-C703 PolarHBondContact O-N 2.89Å
704	S	75.9	Confident	84.4	Confident	66 Å²	66	69.9 Å²	69.9	46%	0.462	36%	0.36	S	S	.	.			trans	-80.1	144.2	178.3	-174.4	0	0	0	0	111.8	K700 S701 I702 R706	K700-S704 PolarHBondContact O-N 3.32Å; S701-S704 WeakPolarHBondContact O-CA 3.36Å; S701-S704 WeakPolarHBondContact O-CB 3.34Å; S701-S704 PolarHBondContact O-N 2.8Å; I702-S704 VanDerWaalsContact C-N 3.34Å; S704-R706 VanDerWaalsContact C-N 3.34Å; S704-R706 PolarHBondContact OG-N 3.21Å; S704-R706 PolarHBondContact OG-O 2.81Å
705	K	61.7	Low	84.4	Confident	212 Å²	212	72.3 Å²	72.3	92%	0.922	37%	0.369	S	S	*	.	S	Bend	trans	-87.6	1.5	175.4	-65.3	-175.7	179.2	179.3	0	113.8
706	R	63.3	Low	84.5	Confident	207 Å²	207	75 Å²	75	78%	0.781	39%	0.385	S	S	*	.	S	Bend	trans	-118.9	126.5	179.2	-70.9	-179.9	175.2	161.1	-1.3	109.3	S704	S704-R706 VanDerWaalsContact C-N 3.34Å; S704-R706 PolarHBondContact OG-N 3.21Å; S704-R706 PolarHBondContact OG-O 2.81Å
707	P	66.8	Low	84.7	Confident	127 Å²	127	74.1 Å²	74.1	83%	0.825	38%	0.379	S	S	*	.			trans	-65.8	133.7	170	29.2	-33.3	0	0	0	109.1
708	D	79.9	Confident	85.1	Confident	51 Å²	51	73.3 Å²	73.3	27%	0.273	38%	0.375	S	S	.	.			trans	-106	125.7	175.4	-176.3	8.1	0	0	0	110.4	S710 A711 H742	D708-S710 PolarHBondContact O-N 3.17Å; D708-S710 PolarHBondContact OD1-N 3.24Å; D708-S710 PolarHBondContact OD1-OG 2.88Å; D708-S710 WeakPolarHBondContact OD2-CB 3.24Å; D708-S710 PolarHBondContact OD2-OG 3.01Å; D708-A711 WeakPolarHBondContact O-CB 3.36Å; D708-A711 PolarHBondContact O-N 2.76Å; D708-A711 VanDerWaalsContact O-N 3.16Å; D708-H742 IonicContact OD2-CD2 2.63Å
709	K	86.4	Confident	85.4	Confident	114 Å²	114	73.6 Å²	73.6	50%	0.496	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-63.9	-24.3	176.9	-66.1	-167.1	169.7	-162.9	0	112.8	A711 E712 R777 F778	K709-A711 PolarHBondContact O-N 2.84Å; K709-E712 WeakPolarHBondContact O-CB 3.23Å; K709-E712 PolarHBondContact O-N 3.02Å; K709-E712 VanDerWaalsContact O-N 3.09Å; K709-R777 WeakPolarHBondContact CD-O 3.4Å; K709-F778 HydrophobicContact CB-CB 4.12Å
710	S	89	Confident	85.7	Confident	0 Å²	0	80.7 Å²	80.7	0%	0	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-59.4	-29.4	175	82.2	0	0	0	0	112.3	D708 L713 G741 H742	D708-S710 PolarHBondContact O-N 3.17Å; D708-S710 PolarHBondContact OD1-N 3.24Å; D708-S710 PolarHBondContact OD1-OG 2.88Å; D708-S710 WeakPolarHBondContact OD2-CB 3.24Å; D708-S710 PolarHBondContact OD2-OG 3.01Å; S710-L713 PolarHBondContact O-N 3.22Å; S710-G741 CarbonylContact O-C 3.26Å; S710-G741 VanDerWaalsContact O-C 3.3Å; S710-G741 WeakPolarHBondContact O-CA 3.35Å; S710-H742 PolarHBondContact O-N 3.07Å; S710-H742 VanDerWaalsContact OG-CA 3.24Å; S710-H742 WeakPolarHBondContact OG-CA 3.46Å; S710-H742 WeakPolarHBondContact OG-CB 3.2Å; S710-H742 PolarHBondContact OG-CD2 3.37Å; S710-H742 VanDerWaalsContact OG-CD2 3.26Å
711	A	86.1	Confident	86.2	Confident	58 Å²	58	75.1 Å²	75.1	48%	0.479	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-83.1	-9.2	179	0	0	0	0	0	114.1	D708 K709 L713 H742	D708-A711 WeakPolarHBondContact O-CB 3.36Å; D708-A711 PolarHBondContact O-N 2.76Å; D708-A711 VanDerWaalsContact O-N 3.16Å; K709-A711 PolarHBondContact O-N 2.84Å; A711-L713 VanDerWaalsContact C-N 3.26Å; A711-H742 HydrophobicContact CB-CB 4.36Å
712	E	88.7	Confident	86.8	Confident	133 Å²	133	73.6 Å²	73.6	62%	0.621	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-74.9	-20.1	169	-61.2	173.7	-159.7	0	0	111.5	K709 D714	K709-E712 WeakPolarHBondContact O-CB 3.23Å; K709-E712 PolarHBondContact O-N 3.02Å; K709-E712 VanDerWaalsContact O-N 3.09Å; E712-D714 PolarHBondContact O-N 3.11Å
713	L	94	Very high	87.5	Confident	4 Å²	4	73.3 Å²	73.3	2%	0.021	37%	0.366	C	S	.	.	S	Bend	trans	-91.4	94	-177.3	-54.8	-176.1	0	0	0	110.6	S710 A711 W717 D740 G741 F778 P780	S710-L713 PolarHBondContact O-N 3.22Å; A711-L713 VanDerWaalsContact C-N 3.26Å; L713-W717 HydrophobicContact CB-CD2 4.18Å; L713-W717 HydrophobicContact CB-CE3 3.86Å; L713-W717 HydrophobicContact CB-CZ3 4.38Å; L713-W717 HydrophobicContact CD1-CD2 4.45Å; L713-W717 HydrophobicContact CD1-CE3 4.04Å; L713-W717 HydrophobicContact CD1-CH2 3.92Å; L713-W717 HydrophobicContact CD1-CZ2 4.3Å; L713-W717 HydrophobicContact CD1-CZ3 3.78Å; L713-W717 HydrophobicContact CD2-CD2 4Å; L713-W717 HydrophobicContact CD2-CE3 4.36Å; L713-W717 HydrophobicContact CD2-CG 4.33Å; L713-W717 HydrophobicContact CD2-CZ2 4.39Å; L713-W717 HydrophobicContact CG-CD2 4.45Å; L713-W717 HydrophobicContact CG-CE3 4.32Å; L713-D740 WeakPolarHBondContact O-CB 3.47Å; L713-G741 PolarHBondContact O-N 3.36Å; L713-F778 HydrophobicContact CD1-CB 3.94Å; L713-F778 HydrophobicContact CD1-CD1 3.78Å; L713-F778 HydrophobicContact CD1-CG 4.33Å; L713-P780 HydrophobicContact CD2-CB 3.6Å; L713-P780 HydrophobicContact CD2-CG 4.29Å
714	D	94.8	Very high	88.6	Confident	76 Å²	76	70 Å²	70	41%	0.406	34%	0.343	S	S	.	.			trans	-67.4	170.4	-178.5	92.6	-49.9	0	0	0	113.5	E712 V716 W717 V718	E712-D714 PolarHBondContact O-N 3.11Å; D714-V716 PolarHBondContact O-N 3.23Å; D714-V716 PolarHBondContact OD1-N 3.42Å; D714-V716 WeakPolarHBondContact OD2-CB 3.49Å; D714-V716 VanDerWaalsContact OD2-CG2 3.27Å; D714-V716 WeakPolarHBondContact OD2-CG2 3.38Å; D714-V716 PolarHBondContact OD2-N 3.34Å; D714-V716 VanDerWaalsContact OD2-N 3.11Å; D714-W717 WeakPolarHBondContact O-CB 3.49Å; D714-W717 PolarHBondContact O-N 3.49Å; D714-W717 WeakPolarHBondContact OD1-CB 3.39Å; D714-W717 PolarHBondContact OD1-N 3.35Å; D714-V718 PolarHBondContact O-N 3.47Å
715	Y	96.4	Very high	89.7	Confident	53 Å²	53	66.9 Å²	66.9	21%	0.208	32%	0.321	C	S	.	.	H	α-helix	trans	-66.9	-25.4	-179.1	72.3	-85.2	0	0	0	112.6	V718 T719 V739	Y715-V718 PolarHBondContact O-N 3.36Å; Y715-T719 WeakPolarHBondContact O-CG2 3.19Å; Y715-T719 PolarHBondContact O-N 2.97Å; Y715-T719 VanDerWaalsContact O-N 3.08Å; Y715-V739 VanDerWaalsContact CA-O 3.28Å; Y715-V739 WeakPolarHBondContact CA-O 3.38Å; Y715-V739 WeakPolarHBondContact CB-O 3.21Å
716	V	96.2	Very high	91.4	Very high	56 Å²	56	56.8 Å²	56.8	34%	0.339	28%	0.277	S	S	.	.	H	α-helix	trans	-69.9	-41.3	173.3	-174.5	0	0	0	0	110.5	D714 V718 T719 R720	D714-V716 PolarHBondContact O-N 3.23Å; D714-V716 PolarHBondContact OD1-N 3.42Å; D714-V716 WeakPolarHBondContact OD2-CB 3.49Å; D714-V716 VanDerWaalsContact OD2-CG2 3.27Å; D714-V716 WeakPolarHBondContact OD2-CG2 3.38Å; D714-V716 PolarHBondContact OD2-N 3.34Å; D714-V716 VanDerWaalsContact OD2-N 3.11Å; V716-V718 VanDerWaalsContact C-N 3.34Å; V716-V718 PolarHBondContact O-N 3Å; V716-T719 PolarHBondContact O-N 3.27Å; V716-T719 PolarHBondContact O-OG1 2.83Å; V716-R720 PolarHBondContact O-N 3Å
717	W	97.2	Very high	93.1	Very high	46 Å²	46	47 Å²	47	17%	0.174	24%	0.239	C	C	.	.	H	α-helix	trans	-57.9	-44.7	170.6	-178.1	97.5	0	0	0	111.3	L713 D714 T719 R720 W721 L744 L773 P780	L713-W717 HydrophobicContact CB-CD2 4.18Å; L713-W717 HydrophobicContact CB-CE3 3.86Å; L713-W717 HydrophobicContact CB-CZ3 4.38Å; L713-W717 HydrophobicContact CD1-CD2 4.45Å; L713-W717 HydrophobicContact CD1-CE3 4.04Å; L713-W717 HydrophobicContact CD1-CH2 3.92Å; L713-W717 HydrophobicContact CD1-CZ2 4.3Å; L713-W717 HydrophobicContact CD1-CZ3 3.78Å; L713-W717 HydrophobicContact CD2-CD2 4Å; L713-W717 HydrophobicContact CD2-CE3 4.36Å; L713-W717 HydrophobicContact CD2-CG 4.33Å; L713-W717 HydrophobicContact CD2-CZ2 4.39Å; L713-W717 HydrophobicContact CG-CD2 4.45Å; L713-W717 HydrophobicContact CG-CE3 4.32Å; D714-W717 WeakPolarHBondContact O-CB 3.49Å; D714-W717 PolarHBondContact O-N 3.49Å; D714-W717 WeakPolarHBondContact OD1-CB 3.39Å; D714-W717 PolarHBondContact OD1-N 3.35Å; W717-T719 VanDerWaalsContact C-N 3.34Å; W717-T719 PolarHBondContact O-N 2.89Å; W717-R720 WeakPolarHBondContact O-CA 3.49Å; W717-R720 WeakPolarHBondContact O-CB 3.34Å; W717-R720 PolarHBondContact O-N 3.15Å; W717-W721 HydrophobicContact CD2-CB 4.48Å; W717-W721 HydrophobicContact CE3-CB 4.04Å; W717-W721 HydrophobicContact CH2-CB 3.7Å; W717-W721 AromaticContact CH2-CD1 3.37Å; W717-W721 HydrophobicContact CH2-CD2 4.43Å; W717-W721 AromaticContact CH2-CG 3.59Å; W717-W721 HydrophobicContact CH2-CG 3.59Å; W717-W721 HydrophobicContact CZ2-CB 4.2Å; W717-W721 HydrophobicContact CZ2-CG 4.39Å; W717-W721 HydrophobicContact CZ3-CB 3.62Å; W717-W721 AromaticContact CZ3-CD1 3.95Å; W717-W721 HydrophobicContact CZ3-CD2 4.29Å; W717-W721 AromaticContact CZ3-CG 3.7Å; W717-W721 HydrophobicContact CZ3-CG 3.7Å; W717-W721 PolarHBondContact O-N 2.94Å; W717-L744 HydrophobicContact CZ3-CD1 4.49Å; W717-L773 HydrophobicContact CH2-CD1 4.22Å; W717-L773 HydrophobicContact CH2-CD2 3.78Å; W717-L773 HydrophobicContact CZ2-CD2 4.47Å; W717-L773 HydrophobicContact CZ3-CD1 4.46Å; W717-P780 PolarHBondContact NE1-O 3.3Å; W717-P780 VanDerWaalsContact NE1-O 3.12Å
718	V	98.1	Very high	94.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.3	-41.1	177.6	175.3	0	0	0	0	111.9	D714 Y715 V716 R720 W721 L722 F734 V739 L744	D714-V718 PolarHBondContact O-N 3.47Å; Y715-V718 PolarHBondContact O-N 3.36Å; V716-V718 VanDerWaalsContact C-N 3.34Å; V716-V718 PolarHBondContact O-N 3Å; V718-R720 PolarHBondContact O-N 2.86Å; V718-W721 HydrophobicContact CG1-CE3 4.18Å; V718-W721 PolarHBondContact O-N 3.32Å; V718-L722 PolarHBondContact O-N 3.5Å; V718-F734 HydrophobicContact CG1-CD1 3.89Å; V718-V739 VanDerWaalsContact CB-O 3.29Å; V718-V739 WeakPolarHBondContact CB-O 3.38Å; V718-V739 HydrophobicContact CG1-CG1 4.41Å; V718-V739 WeakPolarHBondContact CG2-O 3.43Å; V718-L744 HydrophobicContact CG1-CD1 4.37Å; V718-L744 HydrophobicContact CG1-CD2 4.14Å; V718-L744 HydrophobicContact CG1-CG 4.47Å; V718-L744 HydrophobicContact CG2-CD1 4.01Å; V718-L744 HydrophobicContact CG2-CG 4.27Å
719	T	97.1	Very high	95.4	Very high	22 Å²	22	44.5 Å²	44.5	14%	0.135	22%	0.22	C	C	.	.	H	α-helix	trans	-63	-27.1	174.8	65.9	0	0	0	0	113.3	Y715 V716 W717 K731 N735	Y715-T719 WeakPolarHBondContact O-CG2 3.19Å; Y715-T719 PolarHBondContact O-N 2.97Å; Y715-T719 VanDerWaalsContact O-N 3.08Å; V716-T719 PolarHBondContact O-N 3.27Å; V716-T719 PolarHBondContact O-OG1 2.83Å; W717-T719 VanDerWaalsContact C-N 3.34Å; W717-T719 PolarHBondContact O-N 2.89Å; T719-K731 WeakPolarHBondContact O-CE 3.48Å; T719-K731 WeakPolarHBondContact O-CG 3.5Å; T719-N735 HydrophobicContact CG2-CB 3.87Å
720	R	97.2	Very high	96	Very high	164 Å²	164	40.1 Å²	40.1	62%	0.619	20%	0.2	S	C	*	.	H	α-helix	trans	-80.5	-38.9	175.1	-65.2	172.6	62	162.3	-0.8	111.8	V716 W717 V718 L722 D723 D724	V716-R720 PolarHBondContact O-N 3Å; W717-R720 WeakPolarHBondContact O-CA 3.49Å; W717-R720 WeakPolarHBondContact O-CB 3.34Å; W717-R720 PolarHBondContact O-N 3.15Å; V718-R720 PolarHBondContact O-N 2.86Å; R720-L722 PolarHBondContact O-N 3.4Å; R720-D723 VanDerWaalsContact O-CB 3.3Å; R720-D723 WeakPolarHBondContact O-CB 3.16Å; R720-D723 PolarHBondContact O-N 3.12Å; R720-D724 PolarHBondContact O-N 2.88Å
721	W	98.1	Very high	96.4	Very high	4 Å²	4	42.9 Å²	42.9	2%	0.015	21%	0.212	C	C	.	.	H	α-helix	trans	-59.6	-30.1	172.7	170.9	84.6	0	0	0	112.4	W717 V718 D723 D724 I725 L744 A769 I770 L773	W717-W721 HydrophobicContact CD2-CB 4.48Å; W717-W721 HydrophobicContact CE3-CB 4.04Å; W717-W721 HydrophobicContact CH2-CB 3.7Å; W717-W721 AromaticContact CH2-CD1 3.37Å; W717-W721 HydrophobicContact CH2-CD2 4.43Å; W717-W721 AromaticContact CH2-CG 3.59Å; W717-W721 HydrophobicContact CH2-CG 3.59Å; W717-W721 HydrophobicContact CZ2-CB 4.2Å; W717-W721 HydrophobicContact CZ2-CG 4.39Å; W717-W721 HydrophobicContact CZ3-CB 3.62Å; W717-W721 AromaticContact CZ3-CD1 3.95Å; W717-W721 HydrophobicContact CZ3-CD2 4.29Å; W717-W721 AromaticContact CZ3-CG 3.7Å; W717-W721 HydrophobicContact CZ3-CG 3.7Å; W717-W721 PolarHBondContact O-N 2.94Å; V718-W721 HydrophobicContact CG1-CE3 4.18Å; V718-W721 PolarHBondContact O-N 3.32Å; W721-D723 VanDerWaalsContact C-N 3.25Å; W721-D723 PolarHBondContact O-N 2.92Å; W721-D724 WeakPolarHBondContact O-CB 3.47Å; W721-D724 PolarHBondContact O-N 3.35Å; W721-I725 HydrophobicContact CD2-CG2 4.2Å; W721-I725 HydrophobicContact CE3-CD1 4.19Å; W721-I725 HydrophobicContact CG-CG2 4.49Å; W721-I725 HydrophobicContact CH2-CD1 3.94Å; W721-I725 HydrophobicContact CZ2-CD1 4.25Å; W721-I725 HydrophobicContact CZ2-CG2 4.15Å; W721-I725 HydrophobicContact CZ3-CD1 3.89Å; W721-I725 PolarHBondContact O-N 3.36Å; W721-L744 HydrophobicContact CD2-CD1 4.36Å; W721-L744 HydrophobicContact CE3-CD1 4.03Å; W721-L744 HydrophobicContact CH2-CD1 3.8Å; W721-L744 HydrophobicContact CH2-CD2 4.1Å; W721-L744 HydrophobicContact CZ2-CD1 4.14Å; W721-L744 HydrophobicContact CZ3-CD1 3.76Å; W721-L744 HydrophobicContact CZ3-CD2 3.82Å; W721-L744 HydrophobicContact CZ3-CG 4.48Å; W721-A769 HydrophobicContact CH2-CB 4.2Å; W721-A769 HydrophobicContact CZ2-CB 3.47Å; W721-A769 VanDerWaalsContact CZ2-CB 3.47Å; W721-I770 HydrophobicContact CH2-CG1 4.11Å; W721-I770 HydrophobicContact CZ2-CG1 4.35Å; W721-L773 HydrophobicContact CZ2-CD1 3.78Å
722	L	98.6	Very high	96.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.8	-28	169.6	-71.2	177.9	0	0	0	113.9	V718 R720 I725 G726 L727 K731 F734	V718-L722 PolarHBondContact O-N 3.5Å; R720-L722 PolarHBondContact O-N 3.4Å; L722-I725 HydrophobicContact CD2-CD1 3.96Å; L722-I725 HydrophobicContact CD2-CG1 4.5Å; L722-G726 PolarHBondContact O-N 3.5Å; L722-L727 HydrophobicContact CD2-CB 4.39Å; L722-L727 CarbonylContact O-C 3.4Å; L722-L727 VanDerWaalsContact O-C 3.28Å; L722-L727 WeakPolarHBondContact O-CA 3.31Å; L722-L727 PolarHBondContact O-N 2.85Å; L722-K731 HydrophobicContact CB-CG 4.28Å; L722-K731 HydrophobicContact CD1-CG 4.22Å; L722-F734 HydrophobicContact CD1-CB 3.82Å; L722-F734 HydrophobicContact CD1-CD1 4.17Å; L722-F734 HydrophobicContact CD1-CD2 3.97Å; L722-F734 HydrophobicContact CD1-CG 3.73Å; L722-F734 HydrophobicContact CD2-CE1 4.43Å; L722-F734 HydrophobicContact CD2-CZ 4.45Å
723	D	97.2	Very high	97.4	Very high	57 Å²	57	41.3 Å²	41.3	31%	0.305	20%	0.199	S	C	.	.	H	α-helix	trans	-69.9	-44.1	168	-65.4	-49.1	0	0	0	111	R720 W721 I725 G726 K731	R720-D723 VanDerWaalsContact O-CB 3.3Å; R720-D723 WeakPolarHBondContact O-CB 3.16Å; R720-D723 PolarHBondContact O-N 3.12Å; W721-D723 VanDerWaalsContact C-N 3.25Å; W721-D723 PolarHBondContact O-N 2.92Å; D723-I725 VanDerWaalsContact C-N 3.32Å; D723-I725 PolarHBondContact O-N 3.41Å; D723-G726 PolarHBondContact O-N 2.99Å; D723-K731 VanDerWaalsContact OD1-CE 3.32Å; D723-K731 WeakPolarHBondContact OD1-CE 3.26Å; D723-K731 IonicContact OD1-NZ 3.77Å; D723-K731 PolarHBondContact OD1-NZ 2.96Å; D723-K731 WeakPolarHBondContact OD2-CE 3.26Å; D723-K731 IonicContact OD2-NZ 2.67Å; D723-K731 PolarHBondContact OD2-NZ 3.41Å
724	D	97.9	Very high	97.6	Very high	21 Å²	21	41.1 Å²	41.1	11%	0.112	20%	0.198	C	C	.	.	H	α-helix	trans	-63.5	-34.8	-176.2	-77.1	-69.7	0	0	0	113	R720 W721 G726 L783 R785 S802 N803	R720-D724 PolarHBondContact O-N 2.88Å; W721-D724 WeakPolarHBondContact O-CB 3.47Å; W721-D724 PolarHBondContact O-N 3.35Å; D724-G726 VanDerWaalsContact C-N 3.32Å; D724-L783 HydrophobicContact CB-CB 4.46Å; D724-L783 HydrophobicContact CB-CD1 3.67Å; D724-R785 VanDerWaalsContact OD1-CG 3.24Å; D724-R785 WeakPolarHBondContact OD1-CG 3.37Å; D724-R785 IonicContact OD1-CZ 2.75Å; D724-R785 IonicContact OD1-NE 2.67Å; D724-R785 PolarHBondContact OD1-NE 3.5Å; D724-R785 IonicContact OD1-NH2 3.31Å; D724-R785 PolarHBondContact OD1-NH2 2.98Å; D724-R785 IonicContact OD2-CZ 3.98Å; D724-R785 IonicContact OD2-NE 2.69Å; D724-R785 PolarHBondContact OD2-NE 3.3Å; D724-R785 IonicContact OD2-NH2 3.8Å; D724-R785 PolarHBondContact OD2-NH2 2.9Å; D724-S802 CarbonylContact O-C 3.6Å; D724-S802 WeakPolarHBondContact O-CA 3.44Å; D724-S802 WeakPolarHBondContact O-CB 3.39Å; D724-N803 PolarHBondContact O-N 3.35Å
725	I	98.3	Very high	97.7	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-3.9	176.1	73	175	0	0	0	113	W721 L722 D723 L727 I766 A769 L783 G826 H828	W721-I725 HydrophobicContact CD2-CG2 4.2Å; W721-I725 HydrophobicContact CE3-CD1 4.19Å; W721-I725 HydrophobicContact CG-CG2 4.49Å; W721-I725 HydrophobicContact CH2-CD1 3.94Å; W721-I725 HydrophobicContact CZ2-CD1 4.25Å; W721-I725 HydrophobicContact CZ2-CG2 4.15Å; W721-I725 HydrophobicContact CZ3-CD1 3.89Å; W721-I725 PolarHBondContact O-N 3.36Å; L722-I725 HydrophobicContact CD2-CD1 3.96Å; L722-I725 HydrophobicContact CD2-CG1 4.5Å; D723-I725 VanDerWaalsContact C-N 3.32Å; D723-I725 PolarHBondContact O-N 3.41Å; I725-L727 HydrophobicContact CD1-CB 4.41Å; I725-L727 HydrophobicContact CD1-CD1 3.94Å; I725-L727 HydrophobicContact CD1-CG 4.37Å; I725-L727 HydrophobicContact CG1-CB 4.17Å; I725-L727 HydrophobicContact CG1-CD1 4.35Å; I725-L727 HydrophobicContact CG1-CG 4.23Å; I725-I766 HydrophobicContact CD1-CG1 4.19Å; I725-A769 HydrophobicContact CB-CB 4.27Å; I725-A769 HydrophobicContact CD1-CB 4.36Å; I725-A769 HydrophobicContact CG2-CB 3.53Å; I725-L783 HydrophobicContact CG2-CD1 4.11Å; I725-G826 CarbonylContact O-C 3.3Å; I725-G826 VanDerWaalsContact O-C 3.26Å; I725-G826 WeakPolarHBondContact O-CA 3.45Å; I725-H828 PolarHBondContact O-ND1 3.44Å
726	G	98.1	Very high	97.8	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	28.7	177.9	0	0	0	0	0	115.1	L722 D723 D724 N803 G824 S825 G826	L722-G726 PolarHBondContact O-N 3.5Å; D723-G726 PolarHBondContact O-N 2.99Å; D724-G726 VanDerWaalsContact C-N 3.32Å; G726-N803 VanDerWaalsContact CA-CB 3.49Å; G726-N803 VanDerWaalsContact CA-CG 3.45Å; G726-G824 CarbonylContact O-C 3.57Å; G726-G824 WeakPolarHBondContact O-CA 3.49Å; G726-G824 PolarHBondContact O-N 2.88Å; G726-S825 PolarHBondContact O-N 2.89Å; G726-G826 PolarHBondContact O-N 3.18Å
727	L	98.5	Very high	97.8	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.19	C	C	.	.			trans	-123.1	46.9	178.2	-64.6	-179.2	0	0	0	114.1	L722 I725 Q729 Y730 H762 I766 G826	L722-L727 HydrophobicContact CD2-CB 4.39Å; L722-L727 CarbonylContact O-C 3.4Å; L722-L727 VanDerWaalsContact O-C 3.28Å; L722-L727 WeakPolarHBondContact O-CA 3.31Å; L722-L727 PolarHBondContact O-N 2.85Å; I725-L727 HydrophobicContact CD1-CB 4.41Å; I725-L727 HydrophobicContact CD1-CD1 3.94Å; I725-L727 HydrophobicContact CD1-CG 4.37Å; I725-L727 HydrophobicContact CG1-CB 4.17Å; I725-L727 HydrophobicContact CG1-CD1 4.35Å; I725-L727 HydrophobicContact CG1-CG 4.23Å; L727-Q729 VanDerWaalsContact C-OE1 3.24Å; L727-Q729 PolarHBondContact O-N 2.94Å; L727-Q729 VanDerWaalsContact O-N 3.09Å; L727-Y730 HydrophobicContact CB-CD2 4.1Å; L727-Y730 HydrophobicContact CD1-CD2 4.44Å; L727-Y730 HydrophobicContact CD2-CE2 4.23Å; L727-Y730 PolarHBondContact O-N 3.41Å; L727-H762 HydrophobicContact CD1-CB 4.25Å; L727-H762 HydrophobicContact CD2-CB 4.22Å; L727-I766 HydrophobicContact CD1-CD1 3.98Å; L727-I766 HydrophobicContact CD1-CG1 3.68Å; L727-G826 VanDerWaalsContact CD2-CA 3.45Å
728	P	97.9	Very high	97.8	Very high	50 Å²	50	39.1 Å²	39.1	33%	0.325	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-59.4	-24.2	-177.2	26.8	-37	0	0	0	114.2	Y730 K731	P728-Y730 PolarHBondContact O-N 3.44Å; P728-Y730 VanDerWaalsContact O-N 3.16Å; P728-K731 HydrophobicContact CB-CD 4.4Å; P728-K731 VanDerWaalsContact O-CB 3.32Å; P728-K731 WeakPolarHBondContact O-CB 3.45Å; P728-K731 WeakPolarHBondContact O-CD 3.32Å; P728-K731 VanDerWaalsContact O-CG 3.26Å; P728-K731 WeakPolarHBondContact O-CG 3.47Å; P728-K731 PolarHBondContact O-N 3.35Å; P728-K731 VanDerWaalsContact O-N 3.17Å
729	Q	97.6	Very high	97.8	Very high	76 Å²	76	39.1 Å²	39.1	36%	0.355	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-64.1	-17	-178.1	67.2	-86.6	20.3	0	0	114.8	L727 H762 G824	L727-Q729 VanDerWaalsContact C-OE1 3.24Å; L727-Q729 PolarHBondContact O-N 2.94Å; L727-Q729 VanDerWaalsContact O-N 3.09Å; Q729-H762 PolarHBondContact NE2-CE1 3.14Å; Q729-G824 PolarHBondContact NE2-O 2.83Å; Q729-G824 VanDerWaalsContact OE1-CA 3.3Å
730	Y	98.5	Very high	97.8	Very high	22 Å²	22	38.8 Å²	38.8	9%	0.086	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-97.2	1.2	178.6	-59.1	-54.8	0	0	0	113.7	L727 P728 D732 Q733 F734 V757 H762	L727-Y730 HydrophobicContact CB-CD2 4.1Å; L727-Y730 HydrophobicContact CD1-CD2 4.44Å; L727-Y730 HydrophobicContact CD2-CE2 4.23Å; L727-Y730 PolarHBondContact O-N 3.41Å; P728-Y730 PolarHBondContact O-N 3.44Å; P728-Y730 VanDerWaalsContact O-N 3.16Å; Y730-D732 PolarHBondContact O-N 2.86Å; Y730-Q733 PolarHBondContact O-N 2.95Å; Y730-Q733 VanDerWaalsContact O-N 3.16Å; Y730-F734 WeakPolarHBondContact O-CD2 3.42Å; Y730-F734 PolarHBondContact O-N 3.03Å; Y730-V757 HydrophobicContact CD1-CG2 3.98Å; Y730-V757 HydrophobicContact CD2-CG1 4.46Å; Y730-V757 HydrophobicContact CD2-CG2 3.86Å; Y730-V757 HydrophobicContact CE1-CB 4.45Å; Y730-V757 HydrophobicContact CE1-CG2 4.1Å; Y730-V757 HydrophobicContact CE2-CB 4.34Å; Y730-V757 HydrophobicContact CE2-CG1 3.85Å; Y730-V757 HydrophobicContact CE2-CG2 3.98Å; Y730-V757 HydrophobicContact CG-CG2 3.88Å; Y730-H762 HydrophobicContact CE2-CB 4.22Å; Y730-H762 AromaticContact CE2-ND1 3.52Å; Y730-H762 AromaticContact CZ-ND1 3.66Å; Y730-H762 PolarHBondContact OH-ND1 2.91Å
731	K	98.2	Very high	97.6	Very high	59 Å²	59	31 Å²	31	26%	0.257	16%	0.157	S	C	.	.	H	α-helix	trans	-48.8	-52.1	-177.6	-87.4	173.6	156.8	173.1	0	113.5	T719 L722 D723 P728 Q733 F734 N735	T719-K731 WeakPolarHBondContact O-CE 3.48Å; T719-K731 WeakPolarHBondContact O-CG 3.5Å; L722-K731 HydrophobicContact CB-CG 4.28Å; L722-K731 HydrophobicContact CD1-CG 4.22Å; D723-K731 VanDerWaalsContact OD1-CE 3.32Å; D723-K731 WeakPolarHBondContact OD1-CE 3.26Å; D723-K731 IonicContact OD1-NZ 3.77Å; D723-K731 PolarHBondContact OD1-NZ 2.96Å; D723-K731 WeakPolarHBondContact OD2-CE 3.26Å; D723-K731 IonicContact OD2-NZ 2.67Å; D723-K731 PolarHBondContact OD2-NZ 3.41Å; P728-K731 HydrophobicContact CB-CD 4.4Å; P728-K731 VanDerWaalsContact O-CB 3.32Å; P728-K731 WeakPolarHBondContact O-CB 3.45Å; P728-K731 WeakPolarHBondContact O-CD 3.32Å; P728-K731 VanDerWaalsContact O-CG 3.26Å; P728-K731 WeakPolarHBondContact O-CG 3.47Å; P728-K731 PolarHBondContact O-N 3.35Å; P728-K731 VanDerWaalsContact O-N 3.17Å; K731-Q733 VanDerWaalsContact C-N 3.31Å; K731-Q733 PolarHBondContact O-N 3.33Å; K731-F734 PolarHBondContact O-N 3.48Å; K731-N735 VanDerWaalsContact O-CB 3.27Å; K731-N735 WeakPolarHBondContact O-CB 3.48Å; K731-N735 PolarHBondContact O-N 3.35Å
732	D	97.5	Very high	97.3	Very high	109 Å²	109	31.3 Å²	31.3	58%	0.583	16%	0.159	S	C	*	.	H	α-helix	trans	-65.5	-38.2	-174.8	-50.3	-34.9	0	0	0	110.9	Y730 N735 D736	Y730-D732 PolarHBondContact O-N 2.86Å; D732-N735 PolarHBondContact O-N 3.42Å; D732-D736 VanDerWaalsContact O-CB 3.22Å; D732-D736 WeakPolarHBondContact O-CB 3.18Å; D732-D736 PolarHBondContact O-N 3.47Å
733	Q	97.9	Very high	97.2	Very high	49 Å²	49	31.3 Å²	31.3	23%	0.229	16%	0.159	C	C	.	.	H	α-helix	trans	-68	-41.2	177.4	-67.7	85.4	82.5	0	0	112.3	Y730 K731 G737 L755 K756	Y730-Q733 PolarHBondContact O-N 2.95Å; Y730-Q733 VanDerWaalsContact O-N 3.16Å; K731-Q733 VanDerWaalsContact C-N 3.31Å; K731-Q733 PolarHBondContact O-N 3.33Å; Q733-G737 PolarHBondContact O-N 2.96Å; Q733-L755 HydrophobicContact CB-CD2 4.12Å; Q733-L755 VanDerWaalsContact O-CD2 3.22Å; Q733-L755 WeakPolarHBondContact O-CD2 3.34Å; Q733-K756 HydrophobicContact CG-CD 4.05Å; Q733-K756 HydrophobicContact CG-CG 4.3Å
734	F	98.3	Very high	97.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-69.1	-38.6	176	-84.2	-116.3	0	0	0	111.7	V718 L722 Y730 K731 G737 R738 V739 L744 L747 L752 L755 V757 I766	V718-F734 HydrophobicContact CG1-CD1 3.89Å; L722-F734 HydrophobicContact CD1-CB 3.82Å; L722-F734 HydrophobicContact CD1-CD1 4.17Å; L722-F734 HydrophobicContact CD1-CD2 3.97Å; L722-F734 HydrophobicContact CD1-CG 3.73Å; L722-F734 HydrophobicContact CD2-CE1 4.43Å; L722-F734 HydrophobicContact CD2-CZ 4.45Å; Y730-F734 WeakPolarHBondContact O-CD2 3.42Å; Y730-F734 PolarHBondContact O-N 3.03Å; K731-F734 PolarHBondContact O-N 3.48Å; F734-G737 PolarHBondContact O-N 2.85Å; F734-R738 PolarHBondContact O-N 2.71Å; F734-V739 HydrophobicContact CB-CB 4.38Å; F734-V739 HydrophobicContact CB-CG2 4.41Å; F734-V739 HydrophobicContact CD1-CB 3.78Å; F734-V739 HydrophobicContact CD1-CG1 3.79Å; F734-V739 HydrophobicContact CD1-CG2 4.02Å; F734-V739 HydrophobicContact CE1-CG1 4.11Å; F734-V739 HydrophobicContact CG-CB 4.38Å; F734-V739 HydrophobicContact CG-CG2 4.31Å; F734-V739 PolarHBondContact O-N 3.29Å; F734-L744 HydrophobicContact CE1-CD2 4.21Å; F734-L747 HydrophobicContact CE1-CD1 4.3Å; F734-L752 HydrophobicContact CZ-CD2 4.15Å; F734-L755 HydrophobicContact CD1-CD1 4.49Å; F734-L755 HydrophobicContact CD2-CB 4.34Å; F734-L755 HydrophobicContact CD2-CD1 4.15Å; F734-L755 HydrophobicContact CD2-CD2 3.91Å; F734-L755 HydrophobicContact CD2-CG 4.36Å; F734-L755 HydrophobicContact CE1-CD1 4.15Å; F734-L755 HydrophobicContact CE2-CB 4Å; F734-L755 HydrophobicContact CE2-CD1 3.78Å; F734-L755 HydrophobicContact CE2-CD2 4.3Å; F734-L755 HydrophobicContact CE2-CG 4.24Å; F734-L755 HydrophobicContact CG-CD1 4.5Å; F734-L755 HydrophobicContact CG-CD2 4.27Å; F734-L755 HydrophobicContact CZ-CD1 3.79Å; F734-V757 HydrophobicContact CE2-CG2 4.03Å; F734-I766 HydrophobicContact CZ-CD1 4.23Å
735	N	97.9	Very high	96.8	Very high	52 Å²	52	28.6 Å²	28.6	28%	0.278	14%	0.144	S	C	.	.	H	α-helix	trans	-60	-50.4	172.1	176.8	80.7	0	0	0	111.4	T719 K731 D732 G737 R738	T719-N735 HydrophobicContact CG2-CB 3.87Å; K731-N735 VanDerWaalsContact O-CB 3.27Å; K731-N735 WeakPolarHBondContact O-CB 3.48Å; K731-N735 PolarHBondContact O-N 3.35Å; D732-N735 PolarHBondContact O-N 3.42Å; N735-G737 VanDerWaalsContact C-N 3.29Å; N735-G737 PolarHBondContact O-N 3.22Å; N735-R738 PolarHBondContact ND2-NH1 3.36Å; N735-R738 WeakPolarHBondContact O-CA 3.43Å; N735-R738 WeakPolarHBondContact O-CD 3.26Å; N735-R738 PolarHBondContact O-N 2.85Å; N735-R738 PolarHBondContact O-NH1 3.01Å
736	D	96.6	Very high	96.6	Very high	94 Å²	94	31.2 Å²	31.2	50%	0.503	15%	0.154	S	C	.	.	H	α-helix	trans	-76.1	-17.1	-176.4	-67.1	-7.2	0	0	0	113	N688 H691 D732	N688-D736 PolarHBondContact ND2-O 2.8Å; H691-D736 PolarHBondContact NE2-O 3.46Å; D732-D736 VanDerWaalsContact O-CB 3.22Å; D732-D736 WeakPolarHBondContact O-CB 3.18Å; D732-D736 PolarHBondContact O-N 3.47Å
737	G	96.9	Very high	96.4	Very high	2 Å²	2	31.3 Å²	31.3	2%	0.021	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-7.2	163.1	0	0	0	0	0	114.4	L690 Q733 F734 N735 V739	L690-G737 WeakPolarHBondContact CB-O 3.39Å; Q733-G737 PolarHBondContact O-N 2.96Å; F734-G737 PolarHBondContact O-N 2.85Å; N735-G737 VanDerWaalsContact C-N 3.29Å; N735-G737 PolarHBondContact O-N 3.22Å; G737-V739 PolarHBondContact O-N 3.5Å
738	R	97.6	Very high	96.2	Very high	40 Å²	40	32.6 Å²	32.6	15%	0.151	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	34.5	-173.8	-58.7	-71.4	-172.5	-92.7	-12.4	113.7	G654 L655 H691 K694 F734 N735 D740	G654-R738 WeakPolarHBondContact O-CD 3.35Å; G654-R738 PolarHBondContact O-NE 2.96Å; L655-R738 HydrophobicContact CD2-CG 4.29Å; H691-R738 WeakPolarHBondContact NE2-CG 3.4Å; K694-R738 HydrophobicContact CD-CB 3.72Å; K694-R738 WeakPolarHBondContact CD-O 3.45Å; K694-R738 WeakPolarHBondContact CE-O 3.48Å; K694-R738 PolarHBondContact NZ-O 2.84Å; F734-R738 PolarHBondContact O-N 2.71Å; N735-R738 PolarHBondContact ND2-NH1 3.36Å; N735-R738 WeakPolarHBondContact O-CA 3.43Å; N735-R738 WeakPolarHBondContact O-CD 3.26Å; N735-R738 PolarHBondContact O-N 2.85Å; N735-R738 PolarHBondContact O-NH1 3.01Å; R738-D740 PolarHBondContact O-N 2.6Å
739	V	97.9	Very high	95.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.161	C	C	.	.			trans	-63.9	115.2	-176	-175	0	0	0	0	110.3	L690 Y715 V718 F734 G737 M743 L744 L747 L755	L690-V739 HydrophobicContact CD1-CG2 4.35Å; Y715-V739 VanDerWaalsContact CA-O 3.28Å; Y715-V739 WeakPolarHBondContact CA-O 3.38Å; Y715-V739 WeakPolarHBondContact CB-O 3.21Å; V718-V739 VanDerWaalsContact CB-O 3.29Å; V718-V739 WeakPolarHBondContact CB-O 3.38Å; V718-V739 HydrophobicContact CG1-CG1 4.41Å; V718-V739 WeakPolarHBondContact CG2-O 3.43Å; F734-V739 HydrophobicContact CB-CB 4.38Å; F734-V739 HydrophobicContact CB-CG2 4.41Å; F734-V739 HydrophobicContact CD1-CB 3.78Å; F734-V739 HydrophobicContact CD1-CG1 3.79Å; F734-V739 HydrophobicContact CD1-CG2 4.02Å; F734-V739 HydrophobicContact CE1-CG1 4.11Å; F734-V739 HydrophobicContact CG-CB 4.38Å; F734-V739 HydrophobicContact CG-CG2 4.31Å; F734-V739 PolarHBondContact O-N 3.29Å; G737-V739 PolarHBondContact O-N 3.5Å; V739-M743 HydrophobicContact CG1-CB 4.02Å; V739-M743 HydrophobicContact CG2-CE 4.16Å; V739-L744 HydrophobicContact CG1-CD2 3.9Å; V739-L747 HydrophobicContact CG1-CD1 4.46Å; V739-L747 HydrophobicContact CG1-CD2 4.49Å; V739-L755 HydrophobicContact CG2-CD1 4.1Å; V739-L755 HydrophobicContact CG2-CD2 4.09Å
740	D	96.3	Very high	95.6	Very high	15 Å²	15	33 Å²	33	8%	0.08	17%	0.173	C	C	.	.			trans	-104.8	175.7	175.4	60.9	25.1	0	0	0	111.6	K694 L713 R738 H742 M743 L744	K694-D740 VanDerWaalsContact NZ-CG 3.34Å; K694-D740 IonicContact NZ-OD2 3.79Å; K694-D740 PolarHBondContact NZ-OD2 2.97Å; L713-D740 WeakPolarHBondContact O-CB 3.47Å; R738-D740 PolarHBondContact O-N 2.6Å; D740-H742 VanDerWaalsContact C-N 3.25Å; D740-H742 PolarHBondContact O-N 2.86Å; D740-H742 PolarHBondContact OD1-N 2.87Å; D740-M743 WeakPolarHBondContact O-CB 3.33Å; D740-M743 PolarHBondContact O-N 3.43Å; D740-M743 VanDerWaalsContact O-N 3.13Å; D740-M743 WeakPolarHBondContact OD1-CB 3.26Å; D740-M743 VanDerWaalsContact OD1-CG 3.29Å; D740-M743 WeakPolarHBondContact OD1-CG 3.41Å; D740-M743 PolarHBondContact OD1-N 3.19Å; D740-L744 PolarHBondContact O-N 2.94Å
741	G	94.4	Very high	95.5	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-62.8	-30.7	-178.5	0	0	0	0	0	113.9	S710 L713 L744 Q745	S710-G741 CarbonylContact O-C 3.26Å; S710-G741 VanDerWaalsContact O-C 3.3Å; S710-G741 WeakPolarHBondContact O-CA 3.35Å; L713-G741 PolarHBondContact O-N 3.36Å; G741-L744 WeakPolarHBondContact O-CB 2.98Å; G741-L744 PolarHBondContact O-N 3.48Å; G741-Q745 PolarHBondContact O-N 2.92Å
742	H	92.1	Very high	95.4	Very high	12 Å²	12	30 Å²	30	6%	0.056	16%	0.161	C	C	.	.	H	α-helix	trans	-69.5	-38.2	174	-173.6	-138.8	0	0	0	111.4	L697 D708 S710 A711 D740 Y746	L697-H742 PolarHBondContact O-CE1 3.16Å; L697-H742 VanDerWaalsContact O-CE1 3.31Å; D708-H742 IonicContact OD2-CD2 2.63Å; S710-H742 PolarHBondContact O-N 3.07Å; S710-H742 VanDerWaalsContact OG-CA 3.24Å; S710-H742 WeakPolarHBondContact OG-CA 3.46Å; S710-H742 WeakPolarHBondContact OG-CB 3.2Å; S710-H742 PolarHBondContact OG-CD2 3.37Å; S710-H742 VanDerWaalsContact OG-CD2 3.26Å; A711-H742 HydrophobicContact CB-CB 4.36Å; D740-H742 VanDerWaalsContact C-N 3.25Å; D740-H742 PolarHBondContact O-N 2.86Å; D740-H742 PolarHBondContact OD1-N 2.87Å; H742-Y746 AromaticContact CD2-CE2 3.83Å; H742-Y746 AromaticContact NE2-CE2 3.64Å; H742-Y746 VanDerWaalsContact O-CD2 3.28Å; H742-Y746 WeakPolarHBondContact O-CD2 3.33Å
743	M	95.7	Very high	95.2	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-64.9	-37.5	168.5	-72.8	176.9	72.4	0	0	112.4	L690 K694 L697 V739 D740 Q745 Y746 L747	L690-M743 HydrophobicContact CB-CE 4.02Å; L690-M743 HydrophobicContact CD2-CE 4.17Å; L690-M743 WeakPolarHBondContact O-CE 3.23Å; K694-M743 HydrophobicContact CB-CE 4.27Å; K694-M743 HydrophobicContact CB-CG 4.33Å; K694-M743 HydrophobicContact CB-SD 3.44Å; K694-M743 WeakPolarHBondContact CB-SD 3.32Å; K694-M743 HydrophobicContact CD-SD 3.98Å; K694-M743 HydrophobicContact CG-CG 4.42Å; K694-M743 HydrophobicContact CG-SD 3.61Å; L697-M743 HydrophobicContact CD1-CG 4.03Å; V739-M743 HydrophobicContact CG1-CB 4.02Å; V739-M743 HydrophobicContact CG2-CE 4.16Å; D740-M743 WeakPolarHBondContact O-CB 3.33Å; D740-M743 PolarHBondContact O-N 3.43Å; D740-M743 VanDerWaalsContact O-N 3.13Å; D740-M743 WeakPolarHBondContact OD1-CB 3.26Å; D740-M743 VanDerWaalsContact OD1-CG 3.29Å; D740-M743 WeakPolarHBondContact OD1-CG 3.41Å; D740-M743 PolarHBondContact OD1-N 3.19Å; M743-Q745 VanDerWaalsContact C-N 3.28Å; M743-Q745 PolarHBondContact O-N 2.87Å; M743-Y746 CarbonylContact O-C 3.13Å; M743-Y746 PolarHBondContact O-N 3.3Å; M743-L747 WeakPolarHBondContact O-CG 3.19Å; M743-L747 PolarHBondContact O-N 3.45Å
744	L	95.9	Very high	95.1	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-55	-43.2	177.8	-67.8	-176.3	0	0	0	111.8	W717 V718 W721 F734 V739 D740 G741 Y746 L747 I770 L773	W717-L744 HydrophobicContact CZ3-CD1 4.49Å; V718-L744 HydrophobicContact CG1-CD1 4.37Å; V718-L744 HydrophobicContact CG1-CD2 4.14Å; V718-L744 HydrophobicContact CG1-CG 4.47Å; V718-L744 HydrophobicContact CG2-CD1 4.01Å; V718-L744 HydrophobicContact CG2-CG 4.27Å; W721-L744 HydrophobicContact CD2-CD1 4.36Å; W721-L744 HydrophobicContact CE3-CD1 4.03Å; W721-L744 HydrophobicContact CH2-CD1 3.8Å; W721-L744 HydrophobicContact CH2-CD2 4.1Å; W721-L744 HydrophobicContact CZ2-CD1 4.14Å; W721-L744 HydrophobicContact CZ3-CD1 3.76Å; W721-L744 HydrophobicContact CZ3-CD2 3.82Å; W721-L744 HydrophobicContact CZ3-CG 4.48Å; F734-L744 HydrophobicContact CE1-CD2 4.21Å; V739-L744 HydrophobicContact CG1-CD2 3.9Å; D740-L744 PolarHBondContact O-N 2.94Å; G741-L744 WeakPolarHBondContact O-CB 2.98Å; G741-L744 PolarHBondContact O-N 3.48Å; L744-Y746 PolarHBondContact O-N 3.15Å; L744-L747 HydrophobicContact CD2-CD1 3.74Å; L744-L747 PolarHBondContact O-N 2.88Å; L744-I770 HydrophobicContact CB-CD1 4.47Å; L744-I770 HydrophobicContact CB-CG1 4.32Å; L744-I770 WeakPolarHBondContact O-CD1 3.37Å; L744-L773 HydrophobicContact CD1-CD1 3.85Å
745	Q	91.3	Very high	95	Very high	18 Å²	18	29.9 Å²	29.9	8%	0.084	16%	0.157	C	C	.	.	H	α-helix	trans	-57.6	-29.7	176	176.9	165	80.6	0	0	113.5	G741 M743 H774 F778 I922	G741-Q745 PolarHBondContact O-N 2.92Å; M743-Q745 VanDerWaalsContact C-N 3.28Å; M743-Q745 PolarHBondContact O-N 2.87Å; Q745-H774 PolarHBondContact NE2-NE2 3.1Å; Q745-F778 HydrophobicContact CB-CZ 4Å; Q745-I922 VanDerWaalsContact CD-CD1 3.45Å; Q745-I922 HydrophobicContact CG-CD1 3.61Å; Q745-I922 HydrophobicContact CG-CG1 3.94Å
746	Y	92.6	Very high	94.9	Very high	56 Å²	56	34 Å²	34	22%	0.22	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.3	12.2	-173.9	-62	-64.7	0	0	0	113.9	K693 L697 H742 M743 L744 Y918 I922	K693-Y746 VanDerWaalsContact CE-O 3.23Å; K693-Y746 WeakPolarHBondContact CE-O 3.36Å; K693-Y746 PolarHBondContact NZ-O 3.09Å; L697-Y746 HydrophobicContact CD1-CD2 3.99Å; L697-Y746 HydrophobicContact CD1-CG 4.38Å; L697-Y746 HydrophobicContact CD2-CD2 3.47Å; L697-Y746 VanDerWaalsContact CD2-CD2 3.47Å; L697-Y746 HydrophobicContact CD2-CE2 3.94Å; L697-Y746 HydrophobicContact CD2-CG 3.93Å; L697-Y746 HydrophobicContact CG-CD2 4.36Å; H742-Y746 AromaticContact CD2-CE2 3.83Å; H742-Y746 AromaticContact NE2-CE2 3.64Å; H742-Y746 VanDerWaalsContact O-CD2 3.28Å; H742-Y746 WeakPolarHBondContact O-CD2 3.33Å; M743-Y746 CarbonylContact O-C 3.13Å; M743-Y746 PolarHBondContact O-N 3.3Å; L744-Y746 PolarHBondContact O-N 3.15Å; Y746-Y918 AromaticContact CD1-CE1 3.88Å; Y746-Y918 HydrophobicContact CD1-CE1 3.88Å; Y746-Y918 HydrophobicContact CD1-CE2 4.08Å; Y746-Y918 AromaticContact CD1-CZ 3.63Å; Y746-Y918 HydrophobicContact CG-CE1 4.44Å; Y746-Y918 WeakPolarHBondContact O-CD1 3.34Å; Y746-Y918 WeakPolarHBondContact O-CE1 3.47Å; Y746-I922 HydrophobicContact CE1-CD1 4.05Å
747	L	95.2	Very high	94.9	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	15%	0.148	C	C	.	.			trans	-62	139.5	173.2	-77.4	179.2	0	0	0	110.5	F734 V739 M743 L744 D751 L752 L755 Y918 V919	F734-L747 HydrophobicContact CE1-CD1 4.3Å; V739-L747 HydrophobicContact CG1-CD1 4.46Å; V739-L747 HydrophobicContact CG1-CD2 4.49Å; M743-L747 WeakPolarHBondContact O-CG 3.19Å; M743-L747 PolarHBondContact O-N 3.45Å; L744-L747 HydrophobicContact CD2-CD1 3.74Å; L744-L747 PolarHBondContact O-N 2.88Å; L747-D751 HydrophobicContact CD2-CB 3.66Å; L747-L752 HydrophobicContact CD1-CD2 4.04Å; L747-L755 HydrophobicContact CD2-CD1 4.25Å; L747-Y918 CarbonylContact O-C 3.18Å; L747-Y918 WeakPolarHBondContact O-CA 3.44Å; L747-V919 HydrophobicContact CB-CG2 4.23Å; L747-V919 WeakPolarHBondContact O-CG2 3.33Å; L747-V919 PolarHBondContact O-N 3.05Å
748	T	94	Very high	94.8	Very high	28 Å²	28	32.4 Å²	32.4	17%	0.172	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-110.2	166.5	172.5	68.4	0	0	0	0	110.5	S750 D751 L752 D917 Y918 V919	T748-S750 PolarHBondContact O-N 3.33Å; T748-S750 PolarHBondContact OG1-N 3.49Å; T748-D751 WeakPolarHBondContact CA-OD2 3.28Å; T748-D751 WeakPolarHBondContact CB-OD2 3.5Å; T748-D751 PolarHBondContact N-OD2 2.97Å; T748-D751 PolarHBondContact O-N 3.15Å; T748-D751 VanDerWaalsContact O-N 3.11Å; T748-D751 PolarHBondContact OG1-N 2.99Å; T748-D751 PolarHBondContact OG1-OD2 3.01Å; T748-L752 PolarHBondContact O-N 2.91Å; T748-L752 VanDerWaalsContact O-N 3.13Å; T748-D917 WeakPolarHBondContact CA-O 3.42Å; T748-D917 VanDerWaalsContact CB-O 3.31Å; T748-D917 WeakPolarHBondContact CB-O 3.35Å; T748-Y918 HydrophobicContact CG2-CD1 4.03Å; T748-Y918 HydrophobicContact CG2-CE1 4.41Å; T748-V919 VanDerWaalsContact C-CG2 3.47Å
749	V	91.9	Very high	94.7	Very high	48 Å²	48	31.3 Å²	31.3	29%	0.291	16%	0.164	S	C	.	.	H	α-helix	trans	-55.7	-32.4	172.2	-178.7	0	0	0	0	111.5	L753 V894	V749-L753 HydrophobicContact CG1-CD1 4.43Å; V749-L753 WeakPolarHBondContact O-CG 3.45Å; V749-L753 PolarHBondContact O-N 2.95Å; V749-L753 VanDerWaalsContact O-N 3.13Å; V749-V894 HydrophobicContact CG1-CG1 3.82Å
750	S	91.6	Very high	94.6	Very high	87 Å²	87	34.4 Å²	34.4	61%	0.608	18%	0.178	S	C	*	.	H	α-helix	trans	-69	-42.9	176.7	-163.1	0	0	0	0	112.4	T748 L752 L753 F754	T748-S750 PolarHBondContact O-N 3.33Å; T748-S750 PolarHBondContact OG1-N 3.49Å; S750-L752 VanDerWaalsContact C-N 3.33Å; S750-L752 PolarHBondContact O-N 3.43Å; S750-L753 PolarHBondContact O-N 2.86Å; S750-F754 PolarHBondContact O-N 2.91Å
751	D	95.8	Very high	94.6	Very high	17 Å²	17	33.8 Å²	33.8	9%	0.091	18%	0.175	C	C	.	.	H	α-helix	trans	-62.5	-40.9	176.5	-57.2	-71.4	0	0	0	111.1	L690 K693 L747 T748 L753 F754 L755	L690-D751 HydrophobicContact CD2-CB 4.03Å; K693-D751 IonicContact NZ-OD1 2.82Å; K693-D751 IonicContact NZ-OD2 3.48Å; K693-D751 PolarHBondContact NZ-OD2 3.26Å; L747-D751 HydrophobicContact CD2-CB 3.66Å; T748-D751 WeakPolarHBondContact CA-OD2 3.28Å; T748-D751 WeakPolarHBondContact CB-OD2 3.5Å; T748-D751 PolarHBondContact N-OD2 2.97Å; T748-D751 PolarHBondContact O-N 3.15Å; T748-D751 VanDerWaalsContact O-N 3.11Å; T748-D751 PolarHBondContact OG1-N 2.99Å; T748-D751 PolarHBondContact OG1-OD2 3.01Å; D751-L753 PolarHBondContact O-N 2.96Å; D751-F754 PolarHBondContact O-N 3.04Å; D751-L755 WeakPolarHBondContact O-CB 3.38Å; D751-L755 WeakPolarHBondContact O-CD1 3.16Å; D751-L755 VanDerWaalsContact O-CG 3.28Å; D751-L755 WeakPolarHBondContact O-CG 3.24Å; D751-L755 PolarHBondContact O-N 3.02Å
752	L	96	Very high	94.7	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.5	-39.6	175.8	-72.3	-172	0	0	0	112.7	F734 L747 T748 S750 L755 K756 V757 H763 I766 V919	F734-L752 HydrophobicContact CZ-CD2 4.15Å; L747-L752 HydrophobicContact CD1-CD2 4.04Å; T748-L752 PolarHBondContact O-N 2.91Å; T748-L752 VanDerWaalsContact O-N 3.13Å; S750-L752 VanDerWaalsContact C-N 3.33Å; S750-L752 PolarHBondContact O-N 3.43Å; L752-L755 HydrophobicContact CD2-CD1 4.41Å; L752-L755 CarbonylContact O-C 3.27Å; L752-L755 PolarHBondContact O-N 3.1Å; L752-K756 PolarHBondContact O-N 3.35Å; L752-V757 HydrophobicContact CB-CB 4.24Å; L752-V757 HydrophobicContact CD2-CG2 4.33Å; L752-V757 WeakPolarHBondContact O-CA 3.46Å; L752-V757 WeakPolarHBondContact O-CB 3.35Å; L752-V757 PolarHBondContact O-N 2.96Å; L752-H763 HydrophobicContact CD1-CB 4.44Å; L752-I766 HydrophobicContact CD1-CD1 4.44Å; L752-I766 HydrophobicContact CD1-CG2 4.4Å; L752-I766 HydrophobicContact CD2-CD1 3.84Å; L752-I766 HydrophobicContact CD2-CG2 4.27Å; L752-V919 HydrophobicContact CD1-CG1 4.08Å; L752-V919 HydrophobicContact CD1-CG2 3.58Å; L752-V919 HydrophobicContact CG-CG2 4Å
753	L	94.1	Very high	94.9	Very high	40 Å²	40	35.2 Å²	35.2	21%	0.209	18%	0.182	C	C	.	.	H	α-helix	trans	-66.1	-38.4	173.9	-71.3	170.8	0	0	0	111.9	V749 S750 D751 L755 K756 T758 V894 P896	V749-L753 HydrophobicContact CG1-CD1 4.43Å; V749-L753 WeakPolarHBondContact O-CG 3.45Å; V749-L753 PolarHBondContact O-N 2.95Å; V749-L753 VanDerWaalsContact O-N 3.13Å; S750-L753 PolarHBondContact O-N 2.86Å; D751-L753 PolarHBondContact O-N 2.96Å; L753-L755 VanDerWaalsContact C-N 3.33Å; L753-K756 WeakPolarHBondContact O-CA 3.41Å; L753-K756 PolarHBondContact O-N 2.87Å; L753-T758 HydrophobicContact CD2-CG2 4.09Å; L753-V894 HydrophobicContact CD2-CB 4.4Å; L753-P896 HydrophobicContact CD1-CB 4.13Å
754	F	94.6	Very high	94.9	Very high	114 Å²	114	36.5 Å²	36.5	50%	0.5	19%	0.188	S	C	.	.	H	α-helix	trans	-64.2	-37.5	173	-173.8	-91	0	0	0	112	N688 P689 L690 S750 D751 K756	N688-F754 WeakPolarHBondContact OD1-CE1 3.37Å; P689-F754 HydrophobicContact CG-CD1 4.36Å; P689-F754 HydrophobicContact CG-CD2 4.06Å; P689-F754 HydrophobicContact CG-CE1 4.02Å; P689-F754 HydrophobicContact CG-CE2 3.7Å; P689-F754 HydrophobicContact CG-CG 4.39Å; P689-F754 HydrophobicContact CG-CZ 3.68Å; L690-F754 HydrophobicContact CD1-CD1 3.71Å; L690-F754 HydrophobicContact CD1-CE1 4Å; L690-F754 HydrophobicContact CG-CD1 3.87Å; L690-F754 HydrophobicContact CG-CE1 4.08Å; S750-F754 PolarHBondContact O-N 2.91Å; D751-F754 PolarHBondContact O-N 3.04Å; F754-K756 PolarHBondContact O-N 3.49Å; F754-K756 VanDerWaalsContact O-N 3.12Å
755	L	97.1	Very high	95.1	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.01	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	9.1	170.4	-69.3	163.1	0	0	0	113.8	L690 Q733 F734 V739 L747 D751 L752 L753 V757	L690-L755 HydrophobicContact CD1-CD1 4.31Å; L690-L755 HydrophobicContact CD1-CD2 3.5Å; L690-L755 HydrophobicContact CD1-CG 3.8Å; Q733-L755 HydrophobicContact CB-CD2 4.12Å; Q733-L755 VanDerWaalsContact O-CD2 3.22Å; Q733-L755 WeakPolarHBondContact O-CD2 3.34Å; F734-L755 HydrophobicContact CD1-CD1 4.49Å; F734-L755 HydrophobicContact CD2-CB 4.34Å; F734-L755 HydrophobicContact CD2-CD1 4.15Å; F734-L755 HydrophobicContact CD2-CD2 3.91Å; F734-L755 HydrophobicContact CD2-CG 4.36Å; F734-L755 HydrophobicContact CE1-CD1 4.15Å; F734-L755 HydrophobicContact CE2-CB 4Å; F734-L755 HydrophobicContact CE2-CD1 3.78Å; F734-L755 HydrophobicContact CE2-CD2 4.3Å; F734-L755 HydrophobicContact CE2-CG 4.24Å; F734-L755 HydrophobicContact CG-CD1 4.5Å; F734-L755 HydrophobicContact CG-CD2 4.27Å; F734-L755 HydrophobicContact CZ-CD1 3.79Å; V739-L755 HydrophobicContact CG2-CD1 4.1Å; V739-L755 HydrophobicContact CG2-CD2 4.09Å; L747-L755 HydrophobicContact CD2-CD1 4.25Å; D751-L755 WeakPolarHBondContact O-CB 3.38Å; D751-L755 WeakPolarHBondContact O-CD1 3.16Å; D751-L755 VanDerWaalsContact O-CG 3.28Å; D751-L755 WeakPolarHBondContact O-CG 3.24Å; D751-L755 PolarHBondContact O-N 3.02Å; L752-L755 HydrophobicContact CD2-CD1 4.41Å; L752-L755 CarbonylContact O-C 3.27Å; L752-L755 PolarHBondContact O-N 3.1Å; L753-L755 VanDerWaalsContact C-N 3.33Å; L755-V757 HydrophobicContact CB-CG2 4.21Å; L755-V757 PolarHBondContact O-N 3.25Å; L755-V757 VanDerWaalsContact O-N 3.16Å
756	K	96	Very high	95.4	Very high	139 Å²	139	35.5 Å²	35.5	60%	0.604	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.2	10.8	-179.2	-51.6	179.2	-174.6	174.1	0	114.8	Q733 L752 L753 F754 T758	Q733-K756 HydrophobicContact CG-CD 4.05Å; Q733-K756 HydrophobicContact CG-CG 4.3Å; L752-K756 PolarHBondContact O-N 3.35Å; L753-K756 WeakPolarHBondContact O-CA 3.41Å; L753-K756 PolarHBondContact O-N 2.87Å; F754-K756 PolarHBondContact O-N 3.49Å; F754-K756 VanDerWaalsContact O-N 3.12Å; K756-T758 PolarHBondContact O-N 3.47Å; K756-T758 VanDerWaalsContact O-N 3.09Å
757	V	96.9	Very high	95.6	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.182	C	C	.	.			trans	-74.6	99.8	171.1	-167.1	0	0	0	0	107.9	Y730 F734 L752 L755 H762 H763 I766	Y730-V757 HydrophobicContact CD1-CG2 3.98Å; Y730-V757 HydrophobicContact CD2-CG1 4.46Å; Y730-V757 HydrophobicContact CD2-CG2 3.86Å; Y730-V757 HydrophobicContact CE1-CB 4.45Å; Y730-V757 HydrophobicContact CE1-CG2 4.1Å; Y730-V757 HydrophobicContact CE2-CB 4.34Å; Y730-V757 HydrophobicContact CE2-CG1 3.85Å; Y730-V757 HydrophobicContact CE2-CG2 3.98Å; Y730-V757 HydrophobicContact CG-CG2 3.88Å; F734-V757 HydrophobicContact CE2-CG2 4.03Å; L752-V757 HydrophobicContact CB-CB 4.24Å; L752-V757 HydrophobicContact CD2-CG2 4.33Å; L752-V757 WeakPolarHBondContact O-CA 3.46Å; L752-V757 WeakPolarHBondContact O-CB 3.35Å; L752-V757 PolarHBondContact O-N 2.96Å; L755-V757 HydrophobicContact CB-CG2 4.21Å; L755-V757 PolarHBondContact O-N 3.25Å; L755-V757 VanDerWaalsContact O-N 3.16Å; V757-H762 HydrophobicContact CG1-CB 3.68Å; V757-H763 PolarHBondContact O-NE2 3.12Å; V757-I766 HydrophobicContact CG1-CD1 4.04Å; V757-I766 HydrophobicContact CG2-CD1 4.22Å
758	T	94.7	Very high	95.6	Very high	61 Å²	61	34.9 Å²	34.9	37%	0.374	18%	0.182	S	C	.	.			trans	-110.6	-16.9	-175.9	50.2	0	0	0	0	114.1	L753 K756 K893 V894	L753-T758 HydrophobicContact CD2-CG2 4.09Å; K756-T758 PolarHBondContact O-N 3.47Å; K756-T758 VanDerWaalsContact O-N 3.09Å; T758-K893 CarbonylContact O-C 3.55Å; T758-K893 WeakPolarHBondContact O-CA 3.36Å; T758-V894 PolarHBondContact O-N 3.41Å
759	S	95.8	Very high	95.8	Very high	17 Å²	17	33.6 Å²	33.6	12%	0.119	18%	0.175	C	C	.	.	B	Isolated β-bridge	trans	-72.8	132	176.9	166.2	0	0	0	0	111.5	L761 H762 H763	S759-L761 VanDerWaalsContact C-N 3.31Å; S759-L761 PolarHBondContact O-N 2.9Å; S759-L761 PolarHBondContact OG-N 2.92Å; S759-H762 PolarHBondContact O-N 3.27Å; S759-H762 VanDerWaalsContact O-N 3.17Å; S759-H762 PolarHBondContact OG-N 3.45Å; S759-H763 PolarHBondContact O-CD2 2.66Å; S759-H763 VanDerWaalsContact O-CD2 3.27Å; S759-H763 PolarHBondContact O-N 3.41Å
760	Q	94.6	Very high	96	Very high	66 Å²	66	31.4 Å²	31.4	31%	0.308	16%	0.161	S	C	.	.	H	α-helix	trans	-62	-39.8	174.6	-173.9	176	14.2	0	0	111.3	H762 H763 L764 A892 V894	Q760-H762 VanDerWaalsContact C-N 3.27Å; Q760-H762 PolarHBondContact O-N 3.22Å; Q760-H763 PolarHBondContact O-N 2.88Å; Q760-L764 HydrophobicContact CG-CD1 4.49Å; Q760-L764 WeakPolarHBondContact O-CG 3.46Å; Q760-L764 PolarHBondContact O-N 2.99Å; Q760-A892 HydrophobicContact CB-CB 4.12Å; Q760-A892 WeakPolarHBondContact CB-O 3.43Å; Q760-A892 PolarHBondContact N-O 2.73Å; Q760-V894 HydrophobicContact CB-CG2 4.1Å; Q760-V894 HydrophobicContact CG-CG2 4.49Å
761	L	95.9	Very high	96.1	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-59.1	-39.3	174.6	-179.1	68.3	0	0	0	111.5	S759 L764 S765 L831 F838 L846 L888 I890	S759-L761 VanDerWaalsContact C-N 3.31Å; S759-L761 PolarHBondContact O-N 2.9Å; S759-L761 PolarHBondContact OG-N 2.92Å; L761-L764 PolarHBondContact O-N 2.92Å; L761-S765 WeakPolarHBondContact O-CB 3.42Å; L761-S765 PolarHBondContact O-N 2.96Å; L761-L831 HydrophobicContact CD1-CD2 4.08Å; L761-F838 HydrophobicContact CD1-CD2 4.47Å; L761-L846 HydrophobicContact CD2-CD1 3.8Å; L761-L846 HydrophobicContact CD2-CD2 3.65Å; L761-L846 HydrophobicContact CD2-CG 4.37Å; L761-L888 HydrophobicContact CD1-CD2 3.81Å; L761-L888 HydrophobicContact CD1-CG 4.37Å; L761-I890 HydrophobicContact CD2-CB 4.44Å; L761-I890 HydrophobicContact CD2-CG2 4.3Å
762	H	97.8	Very high	96.1	Very high	24 Å²	24	28.2 Å²	28.2	11%	0.111	14%	0.136	C	C	.	.	H	α-helix	trans	-74.8	-31.2	179.7	-58.8	172.5	0	0	0	112.4	L727 Q729 Y730 V757 S759 Q760 S765 I766	L727-H762 HydrophobicContact CD1-CB 4.25Å; L727-H762 HydrophobicContact CD2-CB 4.22Å; Q729-H762 PolarHBondContact NE2-CE1 3.14Å; Y730-H762 HydrophobicContact CE2-CB 4.22Å; Y730-H762 AromaticContact CE2-ND1 3.52Å; Y730-H762 AromaticContact CZ-ND1 3.66Å; Y730-H762 PolarHBondContact OH-ND1 2.91Å; V757-H762 HydrophobicContact CG1-CB 3.68Å; S759-H762 PolarHBondContact O-N 3.27Å; S759-H762 VanDerWaalsContact O-N 3.17Å; S759-H762 PolarHBondContact OG-N 3.45Å; Q760-H762 VanDerWaalsContact C-N 3.27Å; Q760-H762 PolarHBondContact O-N 3.22Å; H762-S765 PolarHBondContact O-N 3.03Å; H762-I766 VanDerWaalsContact O-CG1 3.31Å; H762-I766 WeakPolarHBondContact O-CG1 3.27Å; H762-I766 PolarHBondContact O-N 3.27Å
763	H	96.3	Very high	96	Very high	18 Å²	18	28.3 Å²	28.3	8%	0.083	14%	0.136	C	C	.	.	H	α-helix	trans	-63	-44.4	168.5	-81.3	-127.7	0	0	0	111.4	L752 V757 S759 Q760 I766 K767 V894	L752-H763 HydrophobicContact CD1-CB 4.44Å; V757-H763 PolarHBondContact O-NE2 3.12Å; S759-H763 PolarHBondContact O-CD2 2.66Å; S759-H763 VanDerWaalsContact O-CD2 3.27Å; S759-H763 PolarHBondContact O-N 3.41Å; Q760-H763 PolarHBondContact O-N 2.88Å; H763-I766 PolarHBondContact O-N 2.59Å; H763-K767 WeakPolarHBondContact O-CB 3.4Å; H763-K767 PolarHBondContact O-N 3.03Å; H763-V894 HydrophobicContact CB-CG2 4.39Å
764	L	95.8	Very high	96	Very high	26 Å²	26	28 Å²	28	14%	0.136	13%	0.134	C	C	.	.	H	α-helix	trans	-66.2	-40.3	176.7	-63.5	174.9	0	0	0	111.9	Q760 L761 K767 C768 L831 E835 L888	Q760-L764 HydrophobicContact CG-CD1 4.49Å; Q760-L764 WeakPolarHBondContact O-CG 3.46Å; Q760-L764 PolarHBondContact O-N 2.99Å; L761-L764 PolarHBondContact O-N 2.92Å; L764-K767 WeakPolarHBondContact O-CB 3.31Å; L764-K767 PolarHBondContact O-N 3.4Å; L764-C768 WeakPolarHBondContact O-CB 3.35Å; L764-C768 PolarHBondContact O-N 3.28Å; L764-C768 PolarHBondContact O-SG 2.77Å; L764-L831 HydrophobicContact CB-CD1 4.27Å; L764-E835 HydrophobicContact CD1-CG 4.32Å; L764-L888 HydrophobicContact CD1-CD1 3.71Å; L764-L888 HydrophobicContact CD1-CD2 4.25Å
765	S	98.2	Very high	95.8	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-56.3	-50.7	172.4	177.5	0	0	0	0	111.6	L761 H762 K767 C768 A769 G826 H828	L761-S765 WeakPolarHBondContact O-CB 3.42Å; L761-S765 PolarHBondContact O-N 2.96Å; H762-S765 PolarHBondContact O-N 3.03Å; S765-K767 PolarHBondContact O-N 3.12Å; S765-C768 PolarHBondContact O-N 3.01Å; S765-A769 WeakPolarHBondContact O-CB 3.31Å; S765-A769 PolarHBondContact O-N 3.42Å; S765-G826 WeakPolarHBondContact CB-O 3.24Å; S765-G826 WeakPolarHBondContact OG-CA 3.31Å; S765-G826 PolarHBondContact OG-O 2.87Å; S765-H828 PolarHBondContact O-CE1 2.81Å; S765-H828 VanDerWaalsContact O-CE1 3.28Å; S765-H828 PolarHBondContact OG-CE1 3.02Å; S765-H828 PolarHBondContact OG-ND1 2.85Å
766	I	98.2	Very high	95.6	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-65.1	-41.2	179.2	-67.2	167.9	0	0	0	111.2	I725 L727 F734 L752 V757 H762 H763 A769 I770 V919	I725-I766 HydrophobicContact CD1-CG1 4.19Å; L727-I766 HydrophobicContact CD1-CD1 3.98Å; L727-I766 HydrophobicContact CD1-CG1 3.68Å; F734-I766 HydrophobicContact CZ-CD1 4.23Å; L752-I766 HydrophobicContact CD1-CD1 4.44Å; L752-I766 HydrophobicContact CD1-CG2 4.4Å; L752-I766 HydrophobicContact CD2-CD1 3.84Å; L752-I766 HydrophobicContact CD2-CG2 4.27Å; V757-I766 HydrophobicContact CG1-CD1 4.04Å; V757-I766 HydrophobicContact CG2-CD1 4.22Å; H762-I766 VanDerWaalsContact O-CG1 3.31Å; H762-I766 WeakPolarHBondContact O-CG1 3.27Å; H762-I766 PolarHBondContact O-N 3.27Å; H763-I766 PolarHBondContact O-N 2.59Å; I766-A769 PolarHBondContact O-N 3.13Å; I766-I770 HydrophobicContact CG2-CD1 3.57Å; I766-I770 HydrophobicContact CG2-CG1 4.3Å; I766-I770 WeakPolarHBondContact O-CB 3.43Å; I766-I770 WeakPolarHBondContact O-CD1 3.39Å; I766-I770 VanDerWaalsContact O-CG1 3.23Å; I766-I770 WeakPolarHBondContact O-CG1 3.39Å; I766-I770 PolarHBondContact O-N 3.45Å; I766-V919 HydrophobicContact CG2-CG1 4.42Å
767	K	96.4	Very high	95.4	Very high	41 Å²	41	30.2 Å²	30.2	18%	0.178	15%	0.146	C	C	.	.	H	α-helix	trans	-53.1	-56	171.5	172.9	-163.7	67.5	161.5	0	111.4	H763 L764 S765 A769 I770 H771 E835 V919 C920	H763-K767 WeakPolarHBondContact O-CB 3.4Å; H763-K767 PolarHBondContact O-N 3.03Å; L764-K767 WeakPolarHBondContact O-CB 3.31Å; L764-K767 PolarHBondContact O-N 3.4Å; S765-K767 PolarHBondContact O-N 3.12Å; K767-A769 VanDerWaalsContact C-N 3.33Å; K767-A769 PolarHBondContact O-N 2.91Å; K767-I770 PolarHBondContact O-N 3.14Å; K767-H771 PolarHBondContact O-N 2.84Å; K767-E835 IonicContact NZ-OE2 3.66Å; K767-E835 PolarHBondContact NZ-OE2 2.96Å; K767-V919 HydrophobicContact CB-CG1 3.97Å; K767-V919 WeakPolarHBondContact CG-O 3.48Å; K767-C920 HydrophobicContact CG-CB 4.48Å
768	C	96.8	Very high	95.3	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.014	15%	0.148	C	C	.	.	H	α-helix	trans	-62.6	-39.8	-177.2	-67.4	0	0	0	0	111.7	L764 S765 H771 V772 L834	L764-C768 WeakPolarHBondContact O-CB 3.35Å; L764-C768 PolarHBondContact O-N 3.28Å; L764-C768 PolarHBondContact O-SG 2.77Å; S765-C768 PolarHBondContact O-N 3.01Å; C768-H771 WeakPolarHBondContact O-CB 3.4Å; C768-H771 PolarHBondContact O-N 3.47Å; C768-V772 WeakPolarHBondContact O-CG2 3.44Å; C768-V772 PolarHBondContact O-N 3.03Å; C768-L834 HydrophobicContact CB-CB 4.47Å; C768-L834 HydrophobicContact CB-CD1 4.44Å
769	A	97.3	Very high	95.2	Very high	2 Å²	2	31.4 Å²	31.4	2%	0.017	15%	0.149	C	C	.	.	H	α-helix	trans	-67.2	-38.2	176.8	0	0	0	0	0	113.3	W721 I725 S765 I766 K767 V772 L773	W721-A769 HydrophobicContact CH2-CB 4.2Å; W721-A769 HydrophobicContact CZ2-CB 3.47Å; W721-A769 VanDerWaalsContact CZ2-CB 3.47Å; I725-A769 HydrophobicContact CB-CB 4.27Å; I725-A769 HydrophobicContact CD1-CB 4.36Å; I725-A769 HydrophobicContact CG2-CB 3.53Å; S765-A769 WeakPolarHBondContact O-CB 3.31Å; S765-A769 PolarHBondContact O-N 3.42Å; I766-A769 PolarHBondContact O-N 3.13Å; K767-A769 VanDerWaalsContact C-N 3.33Å; K767-A769 PolarHBondContact O-N 2.91Å; A769-V772 PolarHBondContact O-N 3.46Å; A769-L773 WeakPolarHBondContact O-CG 3.18Å; A769-L773 PolarHBondContact O-N 3.22Å
770	I	96.1	Very high	95	Very high	1 Å²	1	33 Å²	33	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-66.9	-38.6	173.7	-65.7	163.8	0	0	0	110.5	W721 L744 I766 K767 V772 L773 H774 V919 C920	W721-I770 HydrophobicContact CH2-CG1 4.11Å; W721-I770 HydrophobicContact CZ2-CG1 4.35Å; L744-I770 HydrophobicContact CB-CD1 4.47Å; L744-I770 HydrophobicContact CB-CG1 4.32Å; L744-I770 WeakPolarHBondContact O-CD1 3.37Å; I766-I770 HydrophobicContact CG2-CD1 3.57Å; I766-I770 HydrophobicContact CG2-CG1 4.3Å; I766-I770 WeakPolarHBondContact O-CB 3.43Å; I766-I770 WeakPolarHBondContact O-CD1 3.39Å; I766-I770 VanDerWaalsContact O-CG1 3.23Å; I766-I770 WeakPolarHBondContact O-CG1 3.39Å; I766-I770 PolarHBondContact O-N 3.45Å; K767-I770 PolarHBondContact O-N 3.14Å; I770-V772 VanDerWaalsContact C-N 3.34Å; I770-V772 PolarHBondContact O-N 3.43Å; I770-L773 WeakPolarHBondContact O-CB 3.18Å; I770-L773 PolarHBondContact O-N 3.39Å; I770-L773 VanDerWaalsContact O-N 3.14Å; I770-H774 PolarHBondContact O-N 3.28Å; I770-V919 HydrophobicContact CD1-CG1 4.42Å; I770-C920 HydrophobicContact CB-CB 4.02Å; I770-C920 HydrophobicContact CG2-CB 3.72Å
771	H	94.6	Very high	94.8	Very high	35 Å²	35	36.3 Å²	36.3	16%	0.162	18%	0.179	C	C	.	.	H	α-helix	trans	-60.4	-42.5	172.8	-174.5	98.5	0	0	0	111.7	K767 C768 L773 H774 V775 L834 Y942	K767-H771 PolarHBondContact O-N 2.84Å; C768-H771 WeakPolarHBondContact O-CB 3.4Å; C768-H771 PolarHBondContact O-N 3.47Å; H771-L773 VanDerWaalsContact C-N 3.31Å; H771-L773 PolarHBondContact O-N 2.82Å; H771-H774 PolarHBondContact O-N 2.84Å; H771-V775 WeakPolarHBondContact O-CG2 3.23Å; H771-V775 PolarHBondContact O-N 2.96Å; H771-L834 HydrophobicContact CB-CD1 4.24Å; H771-Y942 AromaticContact CE1-CD1 3.66Å; H771-Y942 AromaticContact ND1-CD1 3.5Å; H771-Y942 AromaticContact ND1-CE1 3.74Å
772	V	94.6	Very high	94.6	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.018	18%	0.181	C	C	.	.	H	α-helix	trans	-59.5	-41.1	173	173.3	0	0	0	0	111.4	C768 A769 I770 N776 L783 V799 L834	C768-V772 WeakPolarHBondContact O-CG2 3.44Å; C768-V772 PolarHBondContact O-N 3.03Å; A769-V772 PolarHBondContact O-N 3.46Å; I770-V772 VanDerWaalsContact C-N 3.34Å; I770-V772 PolarHBondContact O-N 3.43Å; V772-N776 WeakPolarHBondContact O-CB 3.48Å; V772-N776 PolarHBondContact O-N 3.41Å; V772-N776 PolarHBondContact O-ND2 2.95Å; V772-L783 HydrophobicContact CG1-CD2 3.89Å; V772-V799 HydrophobicContact CG2-CG2 3.95Å; V772-L834 HydrophobicContact CG2-CD1 3.93Å
773	L	94.9	Very high	94.4	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-63.7	-42.2	174	-67.3	173.6	0	0	0	112.5	W717 W721 L744 A769 I770 H771 N776 R777 F778	W717-L773 HydrophobicContact CH2-CD1 4.22Å; W717-L773 HydrophobicContact CH2-CD2 3.78Å; W717-L773 HydrophobicContact CZ2-CD2 4.47Å; W717-L773 HydrophobicContact CZ3-CD1 4.46Å; W721-L773 HydrophobicContact CZ2-CD1 3.78Å; L744-L773 HydrophobicContact CD1-CD1 3.85Å; A769-L773 WeakPolarHBondContact O-CG 3.18Å; A769-L773 PolarHBondContact O-N 3.22Å; I770-L773 WeakPolarHBondContact O-CB 3.18Å; I770-L773 PolarHBondContact O-N 3.39Å; I770-L773 VanDerWaalsContact O-N 3.14Å; H771-L773 VanDerWaalsContact C-N 3.31Å; H771-L773 PolarHBondContact O-N 2.82Å; L773-N776 CarbonylContact O-C 3.54Å; L773-N776 PolarHBondContact O-N 2.7Å; L773-R777 PolarHBondContact O-N 3.34Å; L773-F778 HydrophobicContact CB-CD1 3.72Å; L773-F778 HydrophobicContact CB-CE1 3.7Å; L773-F778 HydrophobicContact CB-CZ 4.47Å; L773-F778 HydrophobicContact CD1-CD1 4.19Å; L773-F778 HydrophobicContact CD1-CE1 4.06Å; L773-F778 HydrophobicContact CG-CD1 4.39Å; L773-F778 HydrophobicContact CG-CE1 4.48Å; L773-F778 PolarHBondContact O-N 3.41Å
774	H	92.8	Very high	94.1	Very high	35 Å²	35	38.6 Å²	38.6	16%	0.162	19%	0.19	C	C	.	.	H	α-helix	trans	-59.9	-50.7	176	-76.3	147	0	0	0	112.2	Q745 I770 H771 N776 R777 F778	Q745-H774 PolarHBondContact NE2-NE2 3.1Å; I770-H774 PolarHBondContact O-N 3.28Å; H771-H774 PolarHBondContact O-N 2.84Å; H774-N776 VanDerWaalsContact C-N 3.3Å; H774-N776 PolarHBondContact O-N 3.13Å; H774-R777 PolarHBondContact O-N 2.94Å; H774-F778 AromaticContact CD2-CE2 3.47Å; H774-F778 VanDerWaalsContact CD2-CE2 3.47Å; H774-F778 WeakPolarHBondContact CD2-CE2 3.46Å; H774-F778 AromaticContact CD2-CZ 3.57Å; H774-F778 AromaticContact NE2-CE2 3.89Å; H774-F778 AromaticContact NE2-CZ 3.71Å
775	V	91.7	Very high	93.7	Very high	74 Å²	74	42.7 Å²	42.7	45%	0.448	20%	0.204	S	C	.	.	H	α-helix	trans	-60.3	-41	178.3	174.5	0	0	0	0	111.1	H771 R777	H771-V775 WeakPolarHBondContact O-CG2 3.23Å; H771-V775 PolarHBondContact O-N 2.96Å; V775-R777 PolarHBondContact O-N 3.05Å
776	N	91.6	Very high	92.9	Very high	35 Å²	35	52.3 Å²	52.3	19%	0.187	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	16.1	178.1	-66.7	-95.2	0	0	0	113.8	V772 L773 H774 F778 N779 C782 Q800	V772-N776 WeakPolarHBondContact O-CB 3.48Å; V772-N776 PolarHBondContact O-N 3.41Å; V772-N776 PolarHBondContact O-ND2 2.95Å; L773-N776 CarbonylContact O-C 3.54Å; L773-N776 PolarHBondContact O-N 2.7Å; H774-N776 VanDerWaalsContact C-N 3.3Å; H774-N776 PolarHBondContact O-N 3.13Å; N776-F778 VanDerWaalsContact C-N 3.28Å; N776-F778 PolarHBondContact O-N 3.35Å; N776-N779 VanDerWaalsContact O-CB 3.31Å; N776-N779 WeakPolarHBondContact O-CB 3.43Å; N776-N779 PolarHBondContact O-N 3.21Å; N776-C782 HydrophobicContact CB-CB 3.5Å; N776-C782 VanDerWaalsContact CB-CB 3.5Å; N776-Q800 PolarHBondContact OD1-NE2 2.98Å
777	R	93.1	Very high	91.5	Very high	192 Å²	192	55.3 Å²	55.3	73%	0.725	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	40.9	175.8	-52.6	-61.3	-173.4	89.6	2.7	114.1	K709 L773 H774 V775 N779	K709-R777 WeakPolarHBondContact CD-O 3.4Å; L773-R777 PolarHBondContact O-N 3.34Å; H774-R777 PolarHBondContact O-N 2.94Å; V775-R777 PolarHBondContact O-N 3.05Å; R777-N779 PolarHBondContact O-N 3.12Å
778	F	94	Very high	89.9	Confident	8 Å²	8	56 Å²	56	4%	0.035	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	31.2	-176.4	-70.5	-77.7	0	0	0	114.9	K709 L713 Q745 L773 H774 N776 P780	K709-F778 HydrophobicContact CB-CB 4.12Å; L713-F778 HydrophobicContact CD1-CB 3.94Å; L713-F778 HydrophobicContact CD1-CD1 3.78Å; L713-F778 HydrophobicContact CD1-CG 4.33Å; Q745-F778 HydrophobicContact CB-CZ 4Å; L773-F778 HydrophobicContact CB-CD1 3.72Å; L773-F778 HydrophobicContact CB-CE1 3.7Å; L773-F778 HydrophobicContact CB-CZ 4.47Å; L773-F778 HydrophobicContact CD1-CD1 4.19Å; L773-F778 HydrophobicContact CD1-CE1 4.06Å; L773-F778 HydrophobicContact CG-CD1 4.39Å; L773-F778 HydrophobicContact CG-CE1 4.48Å; L773-F778 PolarHBondContact O-N 3.41Å; H774-F778 AromaticContact CD2-CE2 3.47Å; H774-F778 VanDerWaalsContact CD2-CE2 3.47Å; H774-F778 WeakPolarHBondContact CD2-CE2 3.46Å; H774-F778 AromaticContact CD2-CZ 3.57Å; H774-F778 AromaticContact NE2-CE2 3.89Å; H774-F778 AromaticContact NE2-CZ 3.71Å; N776-F778 VanDerWaalsContact C-N 3.28Å; N776-F778 PolarHBondContact O-N 3.35Å; F778-P780 WeakPolarHBondContact O-CD 3.46Å
779	N	92.2	Very high	87.8	Confident	77 Å²	77	63.5 Å²	63.5	41%	0.412	32%	0.318	S	S	.	.			trans	-61.6	121.1	172	177.4	-12.3	0	0	0	110.8	N776 R777 N781 C782	N776-N779 VanDerWaalsContact O-CB 3.31Å; N776-N779 WeakPolarHBondContact O-CB 3.43Å; N776-N779 PolarHBondContact O-N 3.21Å; R777-N779 PolarHBondContact O-N 3.12Å; N779-N781 PolarHBondContact O-N 3.33Å; N779-N781 PolarHBondContact OD1-N 3.41Å; N779-C782 HydrophobicContact CB-CB 4.27Å; N779-C782 WeakPolarHBondContact O-CB 3.5Å; N779-C782 PolarHBondContact O-N 3.01Å; N779-C782 VanDerWaalsContact O-N 3.13Å
780	P	91.9	Very high	85.5	Confident	52 Å²	52	71.9 Å²	71.9	34%	0.338	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-16.8	-176.1	21.9	-33.4	0	0	0	114.8	L713 W717 F778	L713-P780 HydrophobicContact CD2-CB 3.6Å; L713-P780 HydrophobicContact CD2-CG 4.29Å; W717-P780 PolarHBondContact NE1-O 3.3Å; W717-P780 VanDerWaalsContact NE1-O 3.12Å; F778-P780 WeakPolarHBondContact O-CD 3.46Å
781	N	90.6	Very high	83.5	Confident	134 Å²	134	80 Å²	80	72%	0.717	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.6	19.8	-177.8	-61.2	-56.2	0	0	0	112.9	N779 L783	N779-N781 PolarHBondContact O-N 3.33Å; N779-N781 PolarHBondContact OD1-N 3.41Å; N781-L783 VanDerWaalsContact C-N 3.26Å; N781-L783 PolarHBondContact O-N 2.88Å
782	C	91.9	Very high	81.9	Confident	6 Å²	6	87.1 Å²	87.1	4%	0.041	43%	0.434	C	S	.	.			trans	-71.2	-13.7	-176.3	75.9	0	0	0	0	115.1	N776 N779 Q800	N776-C782 HydrophobicContact CB-CB 3.5Å; N776-C782 VanDerWaalsContact CB-CB 3.5Å; N779-C782 HydrophobicContact CB-CB 4.27Å; N779-C782 WeakPolarHBondContact O-CB 3.5Å; N779-C782 PolarHBondContact O-N 3.01Å; N779-C782 VanDerWaalsContact O-N 3.13Å; C782-Q800 WeakPolarHBondContact O-CB 3.46Å; C782-Q800 WeakPolarHBondContact O-CG 3.49Å
783	L	93.3	Very high	80.8	Confident	25 Å²	25	89.9 Å²	89.9	13%	0.131	45%	0.446	C	S	.	.	S	Bend	trans	-99.1	124	179.3	-65.1	-178.2	0	0	0	111.6	D724 I725 V772 N781 Q800	D724-L783 HydrophobicContact CB-CB 4.46Å; D724-L783 HydrophobicContact CB-CD1 3.67Å; I725-L783 HydrophobicContact CG2-CD1 4.11Å; V772-L783 HydrophobicContact CG1-CD2 3.89Å; N781-L783 VanDerWaalsContact C-N 3.26Å; N781-L783 PolarHBondContact O-N 2.88Å; L783-Q800 CarbonylContact C-O 3.56Å; L783-Q800 VanDerWaalsContact CA-O 3.28Å; L783-Q800 WeakPolarHBondContact CA-O 3.44Å; L783-Q800 WeakPolarHBondContact CD2-O 3.48Å
784	K	90.5	Very high	79.8	Confident	62 Å²	62	94.5 Å²	94.5	27%	0.27	47%	0.471	S	S	.	.	B	Isolated β-bridge	trans	-84.2	122.8	-178.3	-71.3	172	172.9	165.1	0	110.7	E797 Q800 S802 R805	K784-E797 IonicContact NZ-OE1 2.94Å; K784-E797 PolarHBondContact NZ-OE1 3.02Å; K784-E797 IonicContact NZ-OE2 2.74Å; K784-E797 PolarHBondContact NZ-OE2 3.22Å; K784-Q800 HydrophobicContact CD-CB 4.39Å; K784-Q800 VanDerWaalsContact CE-OE1 3.27Å; K784-Q800 PolarHBondContact N-O 2.82Å; K784-Q800 VanDerWaalsContact NZ-OE1 3.1Å; K784-S802 WeakPolarHBondContact O-CB 3.48Å; K784-S802 PolarHBondContact O-N 3.42Å; K784-S802 PolarHBondContact O-OG 2.89Å; K784-R805 WeakPolarHBondContact O-CB 3.41Å
785	R	87.9	Confident	78.9	Confident	111 Å²	111	94.7 Å²	94.7	42%	0.419	48%	0.475	S	S	.	.			trans	-97.1	-15.2	174.7	-75	-167.9	179.6	-144	-0.8	115.1	D724 S802 H804	D724-R785 VanDerWaalsContact OD1-CG 3.24Å; D724-R785 WeakPolarHBondContact OD1-CG 3.37Å; D724-R785 IonicContact OD1-CZ 2.75Å; D724-R785 IonicContact OD1-NE 2.67Å; D724-R785 PolarHBondContact OD1-NE 3.5Å; D724-R785 IonicContact OD1-NH2 3.31Å; D724-R785 PolarHBondContact OD1-NH2 2.98Å; D724-R785 IonicContact OD2-CZ 3.98Å; D724-R785 IonicContact OD2-NE 2.69Å; D724-R785 PolarHBondContact OD2-NE 3.3Å; D724-R785 IonicContact OD2-NH2 3.8Å; D724-R785 PolarHBondContact OD2-NH2 2.9Å; R785-S802 WeakPolarHBondContact CA-OG 3.48Å; R785-H804 PolarHBondContact O-CD2 3.47Å
786	R	80.6	Confident	78.3	Confident	203 Å²	203	93.7 Å²	93.7	77%	0.766	47%	0.471	S	S	*	.	S	Bend	trans	-129.9	165.5	-174.7	-72.7	-172.7	-179.4	-169.2	0.2	109.6
787	P	68.3	Low	78.1	Confident	63 Å²	63	95.4 Å²	95.4	41%	0.409	48%	0.478	S	S	.	.			trans	-60.7	156.1	163.3	-3	17.8	0	0	0	109.6	E808	P787-E808 WeakPolarHBondContact CD-OE2 3.43Å
788	G	63.3	Low	78	Confident	55 Å²	55	86.3 Å²	86.3	57%	0.567	44%	0.444	S	S	*	.			trans	-71.6	-172.2	155.2	0	0	0	0	0	110.4
789	N	52.7	Low	78	Confident	160 Å²	160	87 Å²	87	86%	0.856	45%	0.449	S	S	*	.	S	Bend	trans	-70	156.8	156.7	-71	4.2	0	0	0	108.8
790	E	49.5	Very low	78.1	Confident	178 Å²	178	85.2 Å²	85.2	83%	0.832	44%	0.438	S	S	*	.	S	Bend	trans	79.5	150.5	177.8	-54.4	179.1	-169.5	0	0	116.2	E792	E790-E792 VanDerWaalsContact C-N 3.34Å; E790-E792 PolarHBondContact O-N 3.09Å
791	N	53.5	Low	78.3	Confident	172 Å²	172	82.9 Å²	82.9	92%	0.92	42%	0.422	S	S	*	.	S	Bend	trans	-86.9	-2.5	-165.1	-69.3	-33.2	0	0	0	113.9
792	E	61.5	Low	78.6	Confident	184 Å²	184	76.5 Å²	76.5	86%	0.86	39%	0.388	S	S	*	.			trans	-117.7	137.5	-179.6	-62.7	-173.1	169.4	0	0	109.5	E790	E790-E792 VanDerWaalsContact C-N 3.34Å; E790-E792 PolarHBondContact O-N 3.09Å
793	F	70.6	Confident	78.9	Confident	61 Å²	61	76.7 Å²	76.7	27%	0.268	39%	0.389	S	S	.	.			trans	-116.7	138.9	174.9	56.2	-96.5	0	0	0	109.2	V798 W801 L867	F793-V798 HydrophobicContact CD2-CG2 3.54Å; F793-V798 HydrophobicContact CE2-CG2 3.81Å; F793-W801 HydrophobicContact CB-CZ2 3.98Å; F793-W801 AromaticContact CD1-CH2 3.88Å; F793-W801 HydrophobicContact CD1-CH2 3.88Å; F793-W801 AromaticContact CD1-CZ2 3.82Å; F793-W801 HydrophobicContact CD1-CZ2 3.82Å; F793-W801 HydrophobicContact CD2-CH2 4.07Å; F793-W801 AromaticContact CD2-CZ2 3.78Å; F793-W801 HydrophobicContact CD2-CZ2 3.78Å; F793-W801 AromaticContact CE1-CH2 3.88Å; F793-W801 HydrophobicContact CE1-CH2 3.88Å; F793-W801 HydrophobicContact CE1-CZ2 4.28Å; F793-W801 HydrophobicContact CE2-CH2 4.1Å; F793-W801 HydrophobicContact CE2-CZ2 4.28Å; F793-W801 AromaticContact CG-CH2 3.99Å; F793-W801 HydrophobicContact CG-CH2 3.99Å; F793-W801 AromaticContact CG-CZ2 3.55Å; F793-W801 HydrophobicContact CG-CZ2 3.55Å; F793-W801 AromaticContact CZ-CH2 4Å; F793-W801 HydrophobicContact CZ-CH2 4Å; F793-W801 HydrophobicContact CZ-CZ2 4.5Å; F793-L867 HydrophobicContact CD2-CD1 4.43Å; F793-L867 HydrophobicContact CE2-CD1 3.57Å; F793-L867 HydrophobicContact CZ-CB 4.5Å; F793-L867 HydrophobicContact CZ-CD1 3.73Å
794	N	75	Confident	79.1	Confident	98 Å²	98	79.9 Å²	79.9	52%	0.524	40%	0.403	S	S	.	.			trans	-77.7	137.1	173.2	-168.1	-37.5	0	0	0	109.2	S796 E797 V798	N794-S796 PolarHBondContact O-N 2.92Å; N794-S796 PolarHBondContact OD1-N 3.2Å; N794-S796 VanDerWaalsContact OD1-N 3.1Å; N794-S796 PolarHBondContact OD1-OG 3.42Å; N794-S796 VanDerWaalsContact OD1-OG 3.06Å; N794-E797 HydrophobicContact CB-CG 4.11Å; N794-E797 WeakPolarHBondContact O-CA 3.25Å; N794-E797 VanDerWaalsContact O-CB 3.26Å; N794-E797 WeakPolarHBondContact O-CB 3.48Å; N794-E797 PolarHBondContact O-N 3.27Å; N794-V798 PolarHBondContact O-N 3.05Å
795	P	74.2	Confident	79.3	Confident	38 Å²	38	78.3 Å²	78.3	25%	0.247	40%	0.395	C	S	.	.	H	α-helix	trans	-50.8	-26.3	171.1	-32.1	37.7	0	0	0	115	E797 V798 M833 V868	P795-E797 VanDerWaalsContact C-N 3.28Å; P795-E797 PolarHBondContact O-N 2.83Å; P795-V798 WeakPolarHBondContact O-CB 3.5Å; P795-V798 PolarHBondContact O-N 3.07Å; P795-M833 HydrophobicContact CB-CE 4.33Å; P795-V868 WeakPolarHBondContact CB-O 3.4Å
796	S	77.2	Confident	79.7	Confident	54 Å²	54	73 Å²	73	38%	0.378	38%	0.375	S	S	.	.	H	α-helix	trans	-65.7	-27	171.5	64.1	0	0	0	0	113.9	N794 V799	N794-S796 PolarHBondContact O-N 2.92Å; N794-S796 PolarHBondContact OD1-N 3.2Å; N794-S796 VanDerWaalsContact OD1-N 3.1Å; N794-S796 PolarHBondContact OD1-OG 3.42Å; N794-S796 VanDerWaalsContact OD1-OG 3.06Å; S796-V799 WeakPolarHBondContact O-CG1 3.4Å
797	E	87.4	Confident	80.5	Confident	71 Å²	71	63.9 Å²	63.9	33%	0.332	34%	0.341	S	S	.	.	H	α-helix	trans	-77.2	-29.8	172.5	-58	-123.2	129.3	0	0	112.4	K784 N794 P795 V799 Q800	K784-E797 IonicContact NZ-OE1 2.94Å; K784-E797 PolarHBondContact NZ-OE1 3.02Å; K784-E797 IonicContact NZ-OE2 2.74Å; K784-E797 PolarHBondContact NZ-OE2 3.22Å; N794-E797 HydrophobicContact CB-CG 4.11Å; N794-E797 WeakPolarHBondContact O-CA 3.25Å; N794-E797 VanDerWaalsContact O-CB 3.26Å; N794-E797 WeakPolarHBondContact O-CB 3.48Å; N794-E797 PolarHBondContact O-N 3.27Å; P795-E797 VanDerWaalsContact C-N 3.28Å; P795-E797 PolarHBondContact O-N 2.83Å; E797-V799 PolarHBondContact O-N 3.39Å; E797-Q800 WeakPolarHBondContact O-CB 3.24Å; E797-Q800 PolarHBondContact O-N 2.89Å
798	V	91.7	Very high	81.8	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-60.6	-33.2	-174.5	177.8	0	0	0	0	110.9	F793 N794 P795 Q800 W801 G829 M833 L867	F793-V798 HydrophobicContact CD2-CG2 3.54Å; F793-V798 HydrophobicContact CE2-CG2 3.81Å; N794-V798 PolarHBondContact O-N 3.05Å; P795-V798 WeakPolarHBondContact O-CB 3.5Å; P795-V798 PolarHBondContact O-N 3.07Å; V798-Q800 PolarHBondContact O-N 3.41Å; V798-Q800 VanDerWaalsContact O-N 3.16Å; V798-W801 HydrophobicContact CG1-CD2 4.38Å; V798-W801 HydrophobicContact CG1-CE3 4.42Å; V798-W801 HydrophobicContact CG2-CH2 4.46Å; V798-W801 HydrophobicContact CG2-CZ2 4.07Å; V798-W801 WeakPolarHBondContact O-CB 3.41Å; V798-W801 PolarHBondContact O-N 3.46Å; V798-G829 CarbonylContact O-C 3.4Å; V798-G829 WeakPolarHBondContact O-CA 3.35Å; V798-M833 HydrophobicContact CB-CG 4.38Å; V798-M833 HydrophobicContact CB-SD 4.28Å; V798-M833 HydrophobicContact CG1-CG 4.14Å; V798-M833 HydrophobicContact CG1-SD 4.03Å; V798-L867 HydrophobicContact CB-CD1 4.45Å; V798-L867 HydrophobicContact CG1-CD1 3.75Å; V798-L867 HydrophobicContact CG1-CG 4.12Å; V798-L867 HydrophobicContact CG2-CD1 3.76Å
799	V	93.6	Very high	83.3	Confident	23 Å²	23	61.1 Å²	61.1	14%	0.139	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-27	175.6	85.7	0	0	0	0	113.3	V772 S796 E797 G830 M833 L834	V772-V799 HydrophobicContact CG2-CG2 3.95Å; S796-V799 WeakPolarHBondContact O-CG1 3.4Å; E797-V799 PolarHBondContact O-N 3.39Å; V799-G830 PolarHBondContact O-N 2.71Å; V799-G830 VanDerWaalsContact O-N 3.11Å; V799-M833 HydrophobicContact CB-CB 4.5Å; V799-M833 HydrophobicContact CB-CG 4.23Å; V799-M833 HydrophobicContact CG2-CB 4.16Å; V799-M833 HydrophobicContact CG2-CG 4.42Å; V799-L834 HydrophobicContact CG2-CD1 3.96Å; V799-L834 HydrophobicContact CG2-CD2 4.06Å; V799-L834 HydrophobicContact CG2-CG 3.86Å
800	Q	94.6	Very high	85.4	Confident	40 Å²	40	53.5 Å²	53.5	19%	0.187	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-1.7	177.5	-69.9	177.3	-23	0	0	113.5	N776 C782 L783 K784 E797 V798 S802	N776-Q800 PolarHBondContact OD1-NE2 2.98Å; C782-Q800 WeakPolarHBondContact O-CB 3.46Å; C782-Q800 WeakPolarHBondContact O-CG 3.49Å; L783-Q800 CarbonylContact C-O 3.56Å; L783-Q800 VanDerWaalsContact CA-O 3.28Å; L783-Q800 WeakPolarHBondContact CA-O 3.44Å; L783-Q800 WeakPolarHBondContact CD2-O 3.48Å; K784-Q800 HydrophobicContact CD-CB 4.39Å; K784-Q800 VanDerWaalsContact CE-OE1 3.27Å; K784-Q800 PolarHBondContact N-O 2.82Å; K784-Q800 VanDerWaalsContact NZ-OE1 3.1Å; E797-Q800 WeakPolarHBondContact O-CB 3.24Å; E797-Q800 PolarHBondContact O-N 2.89Å; V798-Q800 PolarHBondContact O-N 3.41Å; V798-Q800 VanDerWaalsContact O-N 3.16Å; Q800-S802 PolarHBondContact O-N 2.59Å
801	W	96.1	Very high	87.6	Confident	3 Å²	3	50.1 Å²	50.1	1%	0.011	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-70.9	130.2	-175.3	-72.8	14.5	0	0	0	112.8	F793 V798 R805 V806 W809 G829 L867	F793-W801 HydrophobicContact CB-CZ2 3.98Å; F793-W801 AromaticContact CD1-CH2 3.88Å; F793-W801 HydrophobicContact CD1-CH2 3.88Å; F793-W801 AromaticContact CD1-CZ2 3.82Å; F793-W801 HydrophobicContact CD1-CZ2 3.82Å; F793-W801 HydrophobicContact CD2-CH2 4.07Å; F793-W801 AromaticContact CD2-CZ2 3.78Å; F793-W801 HydrophobicContact CD2-CZ2 3.78Å; F793-W801 AromaticContact CE1-CH2 3.88Å; F793-W801 HydrophobicContact CE1-CH2 3.88Å; F793-W801 HydrophobicContact CE1-CZ2 4.28Å; F793-W801 HydrophobicContact CE2-CH2 4.1Å; F793-W801 HydrophobicContact CE2-CZ2 4.28Å; F793-W801 AromaticContact CG-CH2 3.99Å; F793-W801 HydrophobicContact CG-CH2 3.99Å; F793-W801 AromaticContact CG-CZ2 3.55Å; F793-W801 HydrophobicContact CG-CZ2 3.55Å; F793-W801 AromaticContact CZ-CH2 4Å; F793-W801 HydrophobicContact CZ-CH2 4Å; F793-W801 HydrophobicContact CZ-CZ2 4.5Å; V798-W801 HydrophobicContact CG1-CD2 4.38Å; V798-W801 HydrophobicContact CG1-CE3 4.42Å; V798-W801 HydrophobicContact CG2-CH2 4.46Å; V798-W801 HydrophobicContact CG2-CZ2 4.07Å; V798-W801 WeakPolarHBondContact O-CB 3.41Å; V798-W801 PolarHBondContact O-N 3.46Å; W801-R805 HydrophobicContact CB-CB 4.15Å; W801-R805 HydrophobicContact CB-CG 3.98Å; W801-R805 HydrophobicContact CD2-CG 3.51Å; W801-R805 HydrophobicContact CE3-CG 3.9Å; W801-R805 HydrophobicContact CG-CB 4.27Å; W801-R805 HydrophobicContact CG-CG 3.55Å; W801-V806 HydrophobicContact CB-CG2 4.35Å; W801-V806 HydrophobicContact CE3-CG2 4.29Å; W801-W809 HydrophobicContact CE3-CB 4.39Å; W801-W809 HydrophobicContact CH2-CB 4Å; W801-W809 HydrophobicContact CH2-CG 4.06Å; W801-W809 HydrophobicContact CZ3-CB 3.46Å; W801-W809 VanDerWaalsContact CZ3-CB 3.46Å; W801-W809 HydrophobicContact CZ3-CD2 4.35Å; W801-W809 AromaticContact CZ3-CG 3.65Å; W801-W809 HydrophobicContact CZ3-CG 3.65Å; W801-G829 WeakPolarHBondContact O-CA 3.5Å; W801-G829 PolarHBondContact O-N 2.93Å; W801-L867 HydrophobicContact CE3-CD1 4.16Å; W801-L867 HydrophobicContact CH2-CD1 3.5Å; W801-L867 VanDerWaalsContact CH2-CD1 3.5Å; W801-L867 HydrophobicContact CZ2-CD1 4.37Å; W801-L867 HydrophobicContact CZ3-CD1 3.36Å
802	S	97.5	Very high	89.5	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.231	C	C	.	.			trans	-67.5	160.6	164.8	63.5	0	0	0	0	112.2	D724 K784 R785 Q800 H804 R805 V806	D724-S802 CarbonylContact O-C 3.6Å; D724-S802 WeakPolarHBondContact O-CA 3.44Å; D724-S802 WeakPolarHBondContact O-CB 3.39Å; K784-S802 WeakPolarHBondContact O-CB 3.48Å; K784-S802 PolarHBondContact O-N 3.42Å; K784-S802 PolarHBondContact O-OG 2.89Å; R785-S802 WeakPolarHBondContact CA-OG 3.48Å; Q800-S802 PolarHBondContact O-N 2.59Å; S802-H804 PolarHBondContact O-N 3.12Å; S802-R805 PolarHBondContact O-N 2.98Å; S802-R805 PolarHBondContact OG-N 2.86Å; S802-R805 VanDerWaalsContact OG-N 3.15Å; S802-V806 PolarHBondContact O-N 2.87Å
803	N	98.1	Very high	91.1	Very high	9 Å²	9	37.9 Å²	37.9	5%	0.048	19%	0.194	C	C	.	.	H	α-helix	trans	-50.4	-37.7	166.6	176.3	-104.1	0	0	0	112.1	D724 G726 V806 M807 L822 V827	D724-N803 PolarHBondContact O-N 3.35Å; G726-N803 VanDerWaalsContact CA-CB 3.49Å; G726-N803 VanDerWaalsContact CA-CG 3.45Å; N803-V806 PolarHBondContact O-N 2.9Å; N803-M807 WeakPolarHBondContact O-CG 3.42Å; N803-M807 PolarHBondContact O-N 3.21Å; N803-M807 VanDerWaalsContact OD1-CE 3.28Å; N803-M807 WeakPolarHBondContact OD1-CE 3.36Å; N803-L822 PolarHBondContact ND2-O 3.39Å; N803-V827 WeakPolarHBondContact CA-O 3.32Å; N803-V827 VanDerWaalsContact CB-O 3.32Å; N803-V827 WeakPolarHBondContact CB-O 3.49Å; N803-V827 PolarHBondContact ND2-O 3.3Å
804	H	96.7	Very high	92.3	Very high	93 Å²	93	41.5 Å²	41.5	43%	0.431	22%	0.216	S	C	.	.	H	α-helix	trans	-63.4	-44	174.9	-168.2	89	0	0	0	112.4	R785 S802 M807 E808	R785-H804 PolarHBondContact O-CD2 3.47Å; S802-H804 PolarHBondContact O-N 3.12Å; H804-M807 PolarHBondContact O-N 3.04Å; H804-E808 PolarHBondContact O-N 3.49Å
805	R	95.6	Very high	93.3	Very high	28 Å²	28	36.8 Å²	36.8	11%	0.106	19%	0.192	C	C	.	.	H	α-helix	trans	-67.7	-34.7	177.5	179.6	58.9	-175.8	154.1	5.4	112.3	K784 W801 S802 E808 W809	K784-R805 WeakPolarHBondContact O-CB 3.41Å; W801-R805 HydrophobicContact CB-CB 4.15Å; W801-R805 HydrophobicContact CB-CG 3.98Å; W801-R805 HydrophobicContact CD2-CG 3.51Å; W801-R805 HydrophobicContact CE3-CG 3.9Å; W801-R805 HydrophobicContact CG-CB 4.27Å; W801-R805 HydrophobicContact CG-CG 3.55Å; S802-R805 PolarHBondContact O-N 2.98Å; S802-R805 PolarHBondContact OG-N 2.86Å; S802-R805 VanDerWaalsContact OG-N 3.15Å; R805-E808 WeakPolarHBondContact CD-OE2 3.41Å; R805-E808 IonicContact CZ-OE2 2.89Å; R805-E808 IonicContact NE-OE2 3.28Å; R805-E808 IonicContact NH1-OE2 2.6Å; R805-E808 PolarHBondContact NH1-OE2 3.04Å; R805-E808 WeakPolarHBondContact O-CB 3.3Å; R805-E808 PolarHBondContact O-N 3.12Å; R805-W809 PolarHBondContact O-N 3.01Å
806	V	97.1	Very high	94.4	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.6	-43.6	170.7	-179.7	0	0	0	0	111.3	W801 S802 N803 E808 W809 L810 L822 V827 I832 M843	W801-V806 HydrophobicContact CB-CG2 4.35Å; W801-V806 HydrophobicContact CE3-CG2 4.29Å; S802-V806 PolarHBondContact O-N 2.87Å; N803-V806 PolarHBondContact O-N 2.9Å; V806-E808 VanDerWaalsContact C-N 3.26Å; V806-E808 PolarHBondContact O-N 2.68Å; V806-W809 HydrophobicContact CG1-CE3 4.35Å; V806-W809 PolarHBondContact O-N 3.49Å; V806-L810 PolarHBondContact O-N 3.36Å; V806-L822 HydrophobicContact CG1-CD1 3.68Å; V806-V827 HydrophobicContact CG1-CG1 4.18Å; V806-I832 HydrophobicContact CB-CD1 4.4Å; V806-I832 HydrophobicContact CG1-CD1 3.81Å; V806-I832 HydrophobicContact CG2-CD1 3.59Å; V806-M843 HydrophobicContact CG1-CE 4.17Å
807	M	96.8	Very high	95.2	Very high	11 Å²	11	41 Å²	41	5%	0.054	21%	0.21	C	C	.	.	H	α-helix	trans	-63.8	-30.6	174.2	-73.4	-170.6	-73.5	0	0	113	N803 H804 R811 A819 L822 R823	N803-M807 WeakPolarHBondContact O-CG 3.42Å; N803-M807 PolarHBondContact O-N 3.21Å; N803-M807 VanDerWaalsContact OD1-CE 3.28Å; N803-M807 WeakPolarHBondContact OD1-CE 3.36Å; H804-M807 PolarHBondContact O-N 3.04Å; M807-R811 PolarHBondContact O-NH1 3.17Å; M807-R811 VanDerWaalsContact O-NH1 3.14Å; M807-A819 HydrophobicContact CB-CB 4.31Å; M807-A819 VanDerWaalsContact CG-O 3.26Å; M807-A819 WeakPolarHBondContact CG-O 3.46Å; M807-A819 VanDerWaalsContact SD-O 3.34Å; M807-L822 HydrophobicContact CG-CB 4.08Å; M807-R823 HydrophobicContact CE-CG 4.31Å; M807-R823 HydrophobicContact SD-CG 3.91Å
808	E	94.8	Very high	95.7	Very high	55 Å²	55	38.4 Å²	38.4	26%	0.257	20%	0.197	S	C	.	.	H	α-helix	trans	-71.9	-45.1	174	-173.5	-178.2	-134.8	0	0	111.5	P787 H804 R805 V806 L810 R811 S812	P787-E808 WeakPolarHBondContact CD-OE2 3.43Å; H804-E808 PolarHBondContact O-N 3.49Å; R805-E808 WeakPolarHBondContact CD-OE2 3.41Å; R805-E808 IonicContact CZ-OE2 2.89Å; R805-E808 IonicContact NE-OE2 3.28Å; R805-E808 IonicContact NH1-OE2 2.6Å; R805-E808 PolarHBondContact NH1-OE2 3.04Å; R805-E808 WeakPolarHBondContact O-CB 3.3Å; R805-E808 PolarHBondContact O-N 3.12Å; V806-E808 VanDerWaalsContact C-N 3.26Å; V806-E808 PolarHBondContact O-N 2.68Å; E808-L810 VanDerWaalsContact C-N 3.3Å; E808-L810 PolarHBondContact O-N 3.39Å; E808-R811 WeakPolarHBondContact O-CA 3.48Å; E808-R811 WeakPolarHBondContact O-CB 3.43Å; E808-R811 PolarHBondContact O-N 2.95Å; E808-S812 PolarHBondContact O-N 3.06Å; E808-S812 VanDerWaalsContact O-N 3.17Å
809	W	95.1	Very high	96	Very high	5 Å²	5	38.4 Å²	38.4	2%	0.019	20%	0.197	C	C	.	.	H	α-helix	trans	-55.8	-43.2	173.1	165.9	74.7	0	0	0	112.3	W801 R805 V806 R811 S812 V813 M843 L860 N863 L867	W801-W809 HydrophobicContact CE3-CB 4.39Å; W801-W809 HydrophobicContact CH2-CB 4Å; W801-W809 HydrophobicContact CH2-CG 4.06Å; W801-W809 HydrophobicContact CZ3-CB 3.46Å; W801-W809 VanDerWaalsContact CZ3-CB 3.46Å; W801-W809 HydrophobicContact CZ3-CD2 4.35Å; W801-W809 AromaticContact CZ3-CG 3.65Å; W801-W809 HydrophobicContact CZ3-CG 3.65Å; R805-W809 PolarHBondContact O-N 3.01Å; V806-W809 HydrophobicContact CG1-CE3 4.35Å; V806-W809 PolarHBondContact O-N 3.49Å; W809-R811 PolarHBondContact O-N 3.39Å; W809-S812 WeakPolarHBondContact CA-OG 3.38Å; W809-S812 WeakPolarHBondContact O-CA 3.33Å; W809-S812 PolarHBondContact O-N 3.02Å; W809-S812 PolarHBondContact O-OG 3.09Å; W809-V813 HydrophobicContact CZ2-CG1 4.49Å; W809-V813 HydrophobicContact CZ2-CG2 4.18Å; W809-V813 PolarHBondContact O-N 3.32Å; W809-V813 VanDerWaalsContact O-N 3.13Å; W809-M843 HydrophobicContact CZ3-CE 4.45Å; W809-L860 HydrophobicContact CH2-CD1 4.29Å; W809-N863 HydrophobicContact CZ2-CB 3.99Å; W809-L867 HydrophobicContact CD2-CD1 4.42Å; W809-L867 HydrophobicContact CD2-CD2 4Å; W809-L867 HydrophobicContact CE3-CD2 3.94Å; W809-L867 HydrophobicContact CH2-CB 4.48Å; W809-L867 HydrophobicContact CH2-CD2 3.73Å; W809-L867 HydrophobicContact CZ2-CB 3.83Å; W809-L867 HydrophobicContact CZ2-CD2 3.76Å; W809-L867 HydrophobicContact CZ2-CG 4.3Å; W809-L867 HydrophobicContact CZ3-CD2 3.82Å
810	L	96.9	Very high	96.2	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-58.8	-30.4	174.6	-75.7	168.6	0	0	0	113.5	V806 E808 L815 A816 A819 L822 L847 L860	V806-L810 PolarHBondContact O-N 3.36Å; E808-L810 VanDerWaalsContact C-N 3.3Å; E808-L810 PolarHBondContact O-N 3.39Å; L810-L815 HydrophobicContact CB-CB 4.45Å; L810-L815 HydrophobicContact CD2-CB 4Å; L810-L815 HydrophobicContact CD2-CD1 4Å; L810-L815 CarbonylContact O-C 3.52Å; L810-L815 VanDerWaalsContact O-C 3.27Å; L810-L815 VanDerWaalsContact O-CA 3.31Å; L810-L815 WeakPolarHBondContact O-CA 3.44Å; L810-L815 PolarHBondContact O-N 3.4Å; L810-A816 PolarHBondContact O-N 2.98Å; L810-A819 HydrophobicContact CB-CB 3.9Å; L810-A819 HydrophobicContact CD1-CB 4.24Å; L810-L822 HydrophobicContact CD1-CD1 3.55Å; L810-L822 HydrophobicContact CD1-CG 4.2Å; L810-L847 HydrophobicContact CD1-CD1 4.29Å; L810-L847 HydrophobicContact CD1-CD2 3.56Å; L810-L847 HydrophobicContact CD2-CD1 3.96Å; L810-L860 HydrophobicContact CD2-CD1 4.33Å
811	R	95.2	Very high	96.3	Very high	107 Å²	107	41.8 Å²	41.8	40%	0.404	22%	0.219	S	C	.	.	H	α-helix	trans	-73.7	-33.7	173	-63.1	178.2	-168	92.8	18.1	112.2	M807 E808 W809 V813 A816 A819	M807-R811 PolarHBondContact O-NH1 3.17Å; M807-R811 VanDerWaalsContact O-NH1 3.14Å; E808-R811 WeakPolarHBondContact O-CA 3.48Å; E808-R811 WeakPolarHBondContact O-CB 3.43Å; E808-R811 PolarHBondContact O-N 2.95Å; W809-R811 PolarHBondContact O-N 3.39Å; R811-V813 VanDerWaalsContact C-N 3.27Å; R811-V813 PolarHBondContact O-N 2.88Å; R811-A816 HydrophobicContact CB-CB 4.21Å; R811-A816 HydrophobicContact CG-CB 3.86Å; R811-A819 HydrophobicContact CG-CB 4.49Å
812	S	93.3	Very high	96.4	Very high	83 Å²	83	41.7 Å²	41.7	58%	0.58	22%	0.219	S	C	*	.	H	α-helix	trans	-75.9	-9.9	175.9	59.8	0	0	0	0	114.7	E808 W809	E808-S812 PolarHBondContact O-N 3.06Å; E808-S812 VanDerWaalsContact O-N 3.17Å; W809-S812 WeakPolarHBondContact CA-OG 3.38Å; W809-S812 WeakPolarHBondContact O-CA 3.33Å; W809-S812 PolarHBondContact O-N 3.02Å; W809-S812 PolarHBondContact O-OG 3.09Å
813	V	94.8	Very high	96.3	Very high	16 Å²	16	50.5 Å²	50.5	10%	0.097	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	31.1	173.9	-57	0	0	0	0	112.3	W809 R811 L815 H859 N863	W809-V813 HydrophobicContact CZ2-CG1 4.49Å; W809-V813 HydrophobicContact CZ2-CG2 4.18Å; W809-V813 PolarHBondContact O-N 3.32Å; W809-V813 VanDerWaalsContact O-N 3.13Å; R811-V813 VanDerWaalsContact C-N 3.27Å; R811-V813 PolarHBondContact O-N 2.88Å; V813-L815 HydrophobicContact CG2-CD1 4.33Å; V813-L815 PolarHBondContact O-N 3.28Å; V813-L815 VanDerWaalsContact O-N 3.09Å; V813-H859 PolarHBondContact O-NE2 3.47Å; V813-N863 HydrophobicContact CB-CB 4.2Å; V813-N863 HydrophobicContact CG1-CB 4.16Å; V813-N863 WeakPolarHBondContact CG1-OD1 3.41Å; V813-N863 HydrophobicContact CG2-CB 4.3Å
814	D	96.2	Very high	96.3	Very high	137 Å²	137	50.9 Å²	50.9	73%	0.733	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.2	17.5	175.1	-53.6	-51.3	0	0	0	116.3
815	L	96.9	Very high	96.3	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.242	C	C	.	.			trans	-103.9	31.7	175.5	-64	175	0	0	0	111.9	L810 V813 E817 Y818 A819 L856 L860	L810-L815 HydrophobicContact CB-CB 4.45Å; L810-L815 HydrophobicContact CD2-CB 4Å; L810-L815 HydrophobicContact CD2-CD1 4Å; L810-L815 CarbonylContact O-C 3.52Å; L810-L815 VanDerWaalsContact O-C 3.27Å; L810-L815 VanDerWaalsContact O-CA 3.31Å; L810-L815 WeakPolarHBondContact O-CA 3.44Å; L810-L815 PolarHBondContact O-N 3.4Å; V813-L815 HydrophobicContact CG2-CD1 4.33Å; V813-L815 PolarHBondContact O-N 3.28Å; V813-L815 VanDerWaalsContact O-N 3.09Å; L815-E817 VanDerWaalsContact C-N 3.27Å; L815-E817 PolarHBondContact O-N 3.46Å; L815-Y818 HydrophobicContact CB-CD2 4.32Å; L815-Y818 HydrophobicContact CD2-CD2 3.91Å; L815-Y818 HydrophobicContact CD2-CE2 4.16Å; L815-Y818 PolarHBondContact O-N 2.7Å; L815-Y818 VanDerWaalsContact O-N 3.15Å; L815-A819 PolarHBondContact O-N 3.34Å; L815-L856 HydrophobicContact CD2-CD2 3.77Å; L815-L860 HydrophobicContact CD1-CB 3.88Å; L815-L860 HydrophobicContact CD1-CD1 3.73Å; L815-L860 HydrophobicContact CD1-CG 4.32Å
816	A	96.2	Very high	96.4	Very high	48 Å²	48	45.7 Å²	45.7	40%	0.397	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-33.2	-174.7	0	0	0	0	0	113.9	L810 R811	L810-A816 PolarHBondContact O-N 2.98Å; R811-A816 HydrophobicContact CB-CB 4.21Å; R811-A816 HydrophobicContact CG-CB 3.86Å
817	E	95.8	Very high	96.5	Very high	131 Å²	131	45.7 Å²	45.7	61%	0.612	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-32.8	178.2	63.7	174.9	173.9	0	0	113.1	L815 P820	L815-E817 VanDerWaalsContact C-N 3.27Å; L815-E817 PolarHBondContact O-N 3.46Å; E817-P820 WeakPolarHBondContact O-CD 3.38Å
818	Y	97.9	Very high	96.5	Very high	17 Å²	17	45.2 Å²	45.2	7%	0.067	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-22.8	-179.4	-57	-73.9	0	0	0	113.1	L815 P820 N821 L847 I849 K853 L856	L815-Y818 HydrophobicContact CB-CD2 4.32Å; L815-Y818 HydrophobicContact CD2-CD2 3.91Å; L815-Y818 HydrophobicContact CD2-CE2 4.16Å; L815-Y818 PolarHBondContact O-N 2.7Å; L815-Y818 VanDerWaalsContact O-N 3.15Å; Y818-P820 VanDerWaalsContact C-N 3.34Å; Y818-N821 VanDerWaalsContact O-CB 3.29Å; Y818-N821 WeakPolarHBondContact O-CB 3.47Å; Y818-N821 PolarHBondContact O-N 3.49Å; Y818-L847 WeakPolarHBondContact CD1-O 3.31Å; Y818-L847 WeakPolarHBondContact O-CD2 3.33Å; Y818-I849 HydrophobicContact CD1-CD1 4.25Å; Y818-I849 HydrophobicContact CD1-CG1 3.57Å; Y818-I849 HydrophobicContact CD2-CD1 4.08Å; Y818-I849 HydrophobicContact CD2-CG1 4.23Å; Y818-I849 HydrophobicContact CE1-CG1 3.73Å; Y818-I849 HydrophobicContact CE2-CD1 4.42Å; Y818-I849 HydrophobicContact CE2-CG1 4.37Å; Y818-I849 HydrophobicContact CG-CD1 4.03Å; Y818-I849 HydrophobicContact CG-CG1 3.87Å; Y818-K853 PolarHBondContact OH-NZ 3.4Å; Y818-L856 HydrophobicContact CE2-CD1 4.17Å; Y818-L856 HydrophobicContact CE2-CD2 4.31Å; Y818-L856 WeakPolarHBondContact OH-CD1 3.4Å
819	A	97.2	Very high	96.6	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-50.5	-39.8	-176.7	0	0	0	0	0	115.1	M807 L810 R811 L815 N821 L822	M807-A819 HydrophobicContact CB-CB 4.31Å; M807-A819 VanDerWaalsContact CG-O 3.26Å; M807-A819 WeakPolarHBondContact CG-O 3.46Å; M807-A819 VanDerWaalsContact SD-O 3.34Å; L810-A819 HydrophobicContact CB-CB 3.9Å; L810-A819 HydrophobicContact CD1-CB 4.24Å; R811-A819 HydrophobicContact CG-CB 4.49Å; L815-A819 PolarHBondContact O-N 3.34Å; A819-N821 PolarHBondContact O-N 2.97Å; A819-N821 VanDerWaalsContact O-N 3.17Å; A819-L822 PolarHBondContact O-N 2.71Å
820	P	97.1	Very high	96.7	Very high	58 Å²	58	42.3 Å²	42.3	38%	0.377	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-58.8	-25.7	177.1	-24.7	36	0	0	0	114.8	E817 Y818 L822 R823	E817-P820 WeakPolarHBondContact O-CD 3.38Å; Y818-P820 VanDerWaalsContact C-N 3.34Å; P820-L822 PolarHBondContact O-N 3.05Å; P820-R823 WeakPolarHBondContact O-CB 3.4Å; P820-R823 WeakPolarHBondContact O-CG 3.42Å; P820-R823 PolarHBondContact O-N 2.86Å; P820-R823 VanDerWaalsContact O-N 3.16Å
821	N	97.4	Very high	96.7	Very high	77 Å²	77	42.3 Å²	42.3	41%	0.412	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-68.4	-18.3	-176.9	-60.9	-18.5	0	0	0	112.6	Y818 A819 R823 L847	Y818-N821 VanDerWaalsContact O-CB 3.29Å; Y818-N821 WeakPolarHBondContact O-CB 3.47Å; Y818-N821 PolarHBondContact O-N 3.49Å; A819-N821 PolarHBondContact O-N 2.97Å; A819-N821 VanDerWaalsContact O-N 3.17Å; N821-R823 PolarHBondContact O-N 3.27Å; N821-L847 PolarHBondContact ND2-O 2.73Å
822	L	97.6	Very high	96.8	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-75.5	-5.3	174.1	-62.4	-168.6	0	0	0	114.2	N803 V806 M807 L810 A819 P820 G824 S825 V827 M843 L846 L847	N803-L822 PolarHBondContact ND2-O 3.39Å; V806-L822 HydrophobicContact CG1-CD1 3.68Å; M807-L822 HydrophobicContact CG-CB 4.08Å; L810-L822 HydrophobicContact CD1-CD1 3.55Å; L810-L822 HydrophobicContact CD1-CG 4.2Å; A819-L822 PolarHBondContact O-N 2.71Å; P820-L822 PolarHBondContact O-N 3.05Å; L822-G824 PolarHBondContact O-N 2.88Å; L822-S825 WeakPolarHBondContact CA-OG 3.28Å; L822-S825 WeakPolarHBondContact O-CB 3.26Å; L822-S825 PolarHBondContact O-N 2.86Å; L822-S825 PolarHBondContact O-OG 3.46Å; L822-V827 HydrophobicContact CD1-CB 4.28Å; L822-V827 HydrophobicContact CD1-CG1 4Å; L822-V827 HydrophobicContact CD2-CB 4.21Å; L822-V827 HydrophobicContact CD2-CG1 4.49Å; L822-V827 HydrophobicContact CD2-CG2 4.11Å; L822-M843 HydrophobicContact CD1-SD 4.13Å; L822-M843 HydrophobicContact CD2-SD 4.17Å; L822-L846 HydrophobicContact CD2-CB 4.13Å; L822-L847 HydrophobicContact CD1-CD2 4.22Å; L822-L847 HydrophobicContact CD2-CD2 3.71Å; L822-L847 HydrophobicContact CD2-CG 4.14Å; L822-L847 HydrophobicContact CG-CD2 3.68Å
823	R	95.9	Very high	96.8	Very high	185 Å²	185	33.4 Å²	33.4	70%	0.698	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	118.8	175.1	-70.1	176.8	174.5	-173.6	-0.7	110.6	M807 P820 N821 S825	M807-R823 HydrophobicContact CE-CG 4.31Å; M807-R823 HydrophobicContact SD-CG 3.91Å; P820-R823 WeakPolarHBondContact O-CB 3.4Å; P820-R823 WeakPolarHBondContact O-CG 3.42Å; P820-R823 PolarHBondContact O-N 2.86Å; P820-R823 VanDerWaalsContact O-N 3.16Å; N821-R823 PolarHBondContact O-N 3.27Å; R823-S825 VanDerWaalsContact C-N 3.31Å
824	G	97.2	Very high	96.7	Very high	18 Å²	18	34.2 Å²	34.2	19%	0.186	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.2	-1.2	-178.4	0	0	0	0	0	115	G726 Q729 L822	G726-G824 CarbonylContact O-C 3.57Å; G726-G824 WeakPolarHBondContact O-CA 3.49Å; G726-G824 PolarHBondContact O-N 2.88Å; Q729-G824 PolarHBondContact NE2-O 2.83Å; Q729-G824 VanDerWaalsContact OE1-CA 3.3Å; L822-G824 PolarHBondContact O-N 2.88Å
825	S	97.6	Very high	96.6	Very high	11 Å²	11	28.1 Å²	28.1	8%	0.077	15%	0.146	C	C	.	.	S	Bend	trans	-77.6	-14.9	-179	67.5	0	0	0	0	114.9	G726 L822 R823 V827	G726-S825 PolarHBondContact O-N 2.89Å; L822-S825 WeakPolarHBondContact CA-OG 3.28Å; L822-S825 WeakPolarHBondContact O-CB 3.26Å; L822-S825 PolarHBondContact O-N 2.86Å; L822-S825 PolarHBondContact O-OG 3.46Å; R823-S825 VanDerWaalsContact C-N 3.31Å; S825-V827 PolarHBondContact O-N 3.02Å; S825-V827 WeakPolarHBondContact OG-CB 3.46Å; S825-V827 WeakPolarHBondContact OG-CG2 3.36Å; S825-V827 PolarHBondContact OG-N 2.88Å; S825-V827 VanDerWaalsContact OG-N 3.15Å
826	G	97.9	Very high	96.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.16	C	C	.	.			trans	72.2	4.4	-169	0	0	0	0	0	115.5	I725 G726 L727 S765 H828	I725-G826 CarbonylContact O-C 3.3Å; I725-G826 VanDerWaalsContact O-C 3.26Å; I725-G826 WeakPolarHBondContact O-CA 3.45Å; G726-G826 PolarHBondContact O-N 3.18Å; L727-G826 VanDerWaalsContact CD2-CA 3.45Å; S765-G826 WeakPolarHBondContact CB-O 3.24Å; S765-G826 WeakPolarHBondContact OG-CA 3.31Å; S765-G826 PolarHBondContact OG-O 2.87Å; G826-H828 PolarHBondContact O-N 3.1Å; G826-H828 PolarHBondContact O-ND1 3.22Å
827	V	98.4	Very high	96.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.146	C	C	.	.			trans	-73.2	116.9	178.5	179	0	0	0	0	110.7	N803 V806 L822 S825 L831 I832 F838 M843 L846	N803-V827 WeakPolarHBondContact CA-O 3.32Å; N803-V827 VanDerWaalsContact CB-O 3.32Å; N803-V827 WeakPolarHBondContact CB-O 3.49Å; N803-V827 PolarHBondContact ND2-O 3.3Å; V806-V827 HydrophobicContact CG1-CG1 4.18Å; L822-V827 HydrophobicContact CD1-CB 4.28Å; L822-V827 HydrophobicContact CD1-CG1 4Å; L822-V827 HydrophobicContact CD2-CB 4.21Å; L822-V827 HydrophobicContact CD2-CG1 4.49Å; L822-V827 HydrophobicContact CD2-CG2 4.11Å; S825-V827 PolarHBondContact O-N 3.02Å; S825-V827 WeakPolarHBondContact OG-CB 3.46Å; S825-V827 WeakPolarHBondContact OG-CG2 3.36Å; S825-V827 PolarHBondContact OG-N 2.88Å; S825-V827 VanDerWaalsContact OG-N 3.15Å; V827-L831 HydrophobicContact CG2-CD2 4.49Å; V827-I832 HydrophobicContact CG1-CD1 4Å; V827-I832 HydrophobicContact CG1-CG1 4.07Å; V827-F838 HydrophobicContact CG1-CZ 4.09Å; V827-F838 HydrophobicContact CG2-CE2 3.98Å; V827-F838 HydrophobicContact CG2-CZ 3.89Å; V827-M843 HydrophobicContact CG1-CE 3.83Å; V827-M843 HydrophobicContact CG1-SD 4.08Å; V827-L846 HydrophobicContact CG2-CD1 3.53Å
828	H	98.1	Very high	96.1	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.005	12%	0.117	C	C	.	.			trans	-148	170.4	174.8	66.1	-77.8	0	0	0	108.5	I725 S765 G826 G830 L831 I832	I725-H828 PolarHBondContact O-ND1 3.44Å; S765-H828 PolarHBondContact O-CE1 2.81Å; S765-H828 VanDerWaalsContact O-CE1 3.28Å; S765-H828 PolarHBondContact OG-CE1 3.02Å; S765-H828 PolarHBondContact OG-ND1 2.85Å; G826-H828 PolarHBondContact O-N 3.1Å; G826-H828 PolarHBondContact O-ND1 3.22Å; H828-G830 PolarHBondContact CD2-N 3.36Å; H828-G830 VanDerWaalsContact CD2-N 3.31Å; H828-G830 PolarHBondContact O-N 3.01Å; H828-L831 PolarHBondContact NE2-N 2.91Å; H828-L831 PolarHBondContact O-N 3.45Å; H828-I832 WeakPolarHBondContact O-CG1 3.4Å; H828-I832 PolarHBondContact O-N 3.46Å
829	G	96.8	Very high	95.9	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-52.9	-45.9	-175.6	0	0	0	0	0	115.1	V798 W801 L831 I832 M833	V798-G829 CarbonylContact O-C 3.4Å; V798-G829 WeakPolarHBondContact O-CA 3.35Å; W801-G829 WeakPolarHBondContact O-CA 3.5Å; W801-G829 PolarHBondContact O-N 2.93Å; G829-L831 VanDerWaalsContact C-N 3.34Å; G829-L831 PolarHBondContact O-N 2.98Å; G829-I832 PolarHBondContact O-N 3.39Å; G829-M833 PolarHBondContact O-N 3.02Å
830	G	96	Very high	95.8	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-55.1	-43.4	174.6	0	0	0	0	0	113.3	V799 H828 L834	V799-G830 PolarHBondContact O-N 2.71Å; V799-G830 VanDerWaalsContact O-N 3.11Å; H828-G830 PolarHBondContact CD2-N 3.36Å; H828-G830 VanDerWaalsContact CD2-N 3.31Å; H828-G830 PolarHBondContact O-N 3.01Å; G830-L834 WeakPolarHBondContact O-CB 3.38Å; G830-L834 VanDerWaalsContact O-CG 3.29Å; G830-L834 WeakPolarHBondContact O-CG 3.46Å; G830-L834 PolarHBondContact O-N 3.26Å
831	L	97.2	Very high	95.7	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-70.1	-43.6	175.4	-178.4	68.3	0	0	0	112.3	L761 L764 V827 H828 G829 M833 E835 F838	L761-L831 HydrophobicContact CD1-CD2 4.08Å; L764-L831 HydrophobicContact CB-CD1 4.27Å; V827-L831 HydrophobicContact CG2-CD2 4.49Å; H828-L831 PolarHBondContact NE2-N 2.91Å; H828-L831 PolarHBondContact O-N 3.45Å; G829-L831 VanDerWaalsContact C-N 3.34Å; G829-L831 PolarHBondContact O-N 2.98Å; L831-M833 VanDerWaalsContact C-N 3.29Å; L831-M833 PolarHBondContact O-N 3.35Å; L831-E835 HydrophobicContact CD1-CB 3.81Å; L831-E835 HydrophobicContact CD1-CG 4.26Å; L831-E835 PolarHBondContact O-N 3.11Å; L831-F838 HydrophobicContact CD1-CD2 4.43Å; L831-F838 HydrophobicContact CD2-CD2 3.82Å; L831-F838 HydrophobicContact CD2-CE2 3.8Å; L831-F838 HydrophobicContact CG-CD2 3.83Å; L831-F838 HydrophobicContact CG-CE2 4.22Å; L831-F838 HydrophobicContact CG-CG 4.26Å
832	I	96.6	Very high	95.6	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-57.2	-45.1	-179.8	-71.2	167	0	0	0	110.6	V806 V827 H828 G829 F838 M843 F864 L867 V868 K876	V806-I832 HydrophobicContact CB-CD1 4.4Å; V806-I832 HydrophobicContact CG1-CD1 3.81Å; V806-I832 HydrophobicContact CG2-CD1 3.59Å; V827-I832 HydrophobicContact CG1-CD1 4Å; V827-I832 HydrophobicContact CG1-CG1 4.07Å; H828-I832 WeakPolarHBondContact O-CG1 3.4Å; H828-I832 PolarHBondContact O-N 3.46Å; G829-I832 PolarHBondContact O-N 3.39Å; I832-F838 HydrophobicContact CG1-CD1 4.37Å; I832-F838 HydrophobicContact CG1-CE1 3.88Å; I832-F838 HydrophobicContact CG1-CZ 4.48Å; I832-M843 HydrophobicContact CD1-CE 3.73Å; I832-M843 HydrophobicContact CG1-CE 4Å; I832-F864 HydrophobicContact CG2-CE2 3.93Å; I832-F864 HydrophobicContact CG2-CZ 4.3Å; I832-L867 HydrophobicContact CD1-CD2 4.49Å; I832-L867 HydrophobicContact CG2-CD2 4.2Å; I832-V868 HydrophobicContact CG2-CG1 3.76Å; I832-K876 WeakPolarHBondContact O-CE 3.29Å; I832-K876 PolarHBondContact O-NZ 2.94Å
833	M	94.5	Very high	95.6	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.01	11%	0.11	C	C	.	.	H	α-helix	trans	-76	-74.5	174.6	-58.6	-55.8	-74.6	0	0	110.3	P795 V798 V799 G829 L831 E835 V868 A872 K876 F945 L948	P795-M833 HydrophobicContact CB-CE 4.33Å; V798-M833 HydrophobicContact CB-CG 4.38Å; V798-M833 HydrophobicContact CB-SD 4.28Å; V798-M833 HydrophobicContact CG1-CG 4.14Å; V798-M833 HydrophobicContact CG1-SD 4.03Å; V799-M833 HydrophobicContact CB-CB 4.5Å; V799-M833 HydrophobicContact CB-CG 4.23Å; V799-M833 HydrophobicContact CG2-CB 4.16Å; V799-M833 HydrophobicContact CG2-CG 4.42Å; G829-M833 PolarHBondContact O-N 3.02Å; L831-M833 VanDerWaalsContact C-N 3.29Å; L831-M833 PolarHBondContact O-N 3.35Å; M833-E835 VanDerWaalsContact C-N 3.29Å; M833-E835 PolarHBondContact O-N 3.02Å; M833-E835 VanDerWaalsContact O-N 3.08Å; M833-V868 HydrophobicContact CE-CB 4.48Å; M833-V868 HydrophobicContact SD-CB 3.94Å; M833-V868 HydrophobicContact SD-CG1 3.93Å; M833-A872 HydrophobicContact CE-CB 3.87Å; M833-K876 PolarHBondContact O-NZ 2.9Å; M833-F945 HydrophobicContact CB-CE2 4Å; M833-F945 HydrophobicContact CE-CD2 4.43Å; M833-F945 HydrophobicContact CE-CE2 4.34Å; M833-F945 WeakPolarHBondContact O-CE2 3.38Å; M833-F945 WeakPolarHBondContact O-CZ 3.31Å; M833-L948 HydrophobicContact CE-CD1 4.49Å
834	L	92.7	Very high	95.7	Very high	34 Å²	34	13.3 Å²	13.3	18%	0.178	8%	0.078	C	C	.	.	H	α-helix	trans	-71.3	-8.9	-155.3	-55.2	169	0	0	0	116.1	C768 H771 V772 V799 G830 P836	C768-L834 HydrophobicContact CB-CB 4.47Å; C768-L834 HydrophobicContact CB-CD1 4.44Å; H771-L834 HydrophobicContact CB-CD1 4.24Å; V772-L834 HydrophobicContact CG2-CD1 3.93Å; V799-L834 HydrophobicContact CG2-CD1 3.96Å; V799-L834 HydrophobicContact CG2-CD2 4.06Å; V799-L834 HydrophobicContact CG2-CG 3.86Å; G830-L834 WeakPolarHBondContact O-CB 3.38Å; G830-L834 VanDerWaalsContact O-CG 3.29Å; G830-L834 WeakPolarHBondContact O-CG 3.46Å; G830-L834 PolarHBondContact O-N 3.26Å; L834-P836 WeakPolarHBondContact O-CD 3.44Å
835	E	94	Very high	95.6	Very high	9 Å²	9	16.2 Å²	16.2	4%	0.042	9%	0.087	C	C	.	.			trans	-99.4	110.7	174.4	-178.3	57.3	-140	0	0	110	L764 K767 L831 M833 R837 F838 K876 L888	L764-E835 HydrophobicContact CD1-CG 4.32Å; K767-E835 IonicContact NZ-OE2 3.66Å; K767-E835 PolarHBondContact NZ-OE2 2.96Å; L831-E835 HydrophobicContact CD1-CB 3.81Å; L831-E835 HydrophobicContact CD1-CG 4.26Å; L831-E835 PolarHBondContact O-N 3.11Å; M833-E835 VanDerWaalsContact C-N 3.29Å; M833-E835 PolarHBondContact O-N 3.02Å; M833-E835 VanDerWaalsContact O-N 3.08Å; E835-R837 HydrophobicContact CG-CB 4.42Å; E835-R837 PolarHBondContact O-N 3.22Å; E835-F838 HydrophobicContact CB-CB 4.01Å; E835-F838 HydrophobicContact CG-CB 4.12Å; E835-F838 WeakPolarHBondContact O-CB 3.39Å; E835-F838 PolarHBondContact O-N 3.42Å; E835-K876 PolarHBondContact O-NZ 3.19Å; E835-L888 HydrophobicContact CG-CD2 4.39Å
836	P	90.8	Very high	95.6	Very high	45 Å²	45	16.9 Å²	16.9	29%	0.292	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-33.1	-177.3	-25.6	35.5	0	0	0	113.1	L834 F838 Y879	L834-P836 WeakPolarHBondContact O-CD 3.44Å; P836-F838 VanDerWaalsContact C-N 3.25Å; P836-F838 PolarHBondContact O-N 2.99Å; P836-Y879 HydrophobicContact CB-CD1 3.97Å; P836-Y879 HydrophobicContact CB-CD2 3.58Å; P836-Y879 HydrophobicContact CB-CE1 4.41Å; P836-Y879 HydrophobicContact CB-CE2 4.02Å; P836-Y879 HydrophobicContact CB-CG 3.56Å; P836-Y879 HydrophobicContact CG-CD2 4.21Å; P836-Y879 HydrophobicContact CG-CE2 4.38Å
837	R	91.5	Very high	95.6	Very high	30 Å²	30	16.9 Å²	16.9	11%	0.113	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-7.8	179.4	-60.5	169.4	70.6	-143.6	5.2	113.8	E835 Y879 Y885 S886 P887 L888	E835-R837 HydrophobicContact CG-CB 4.42Å; E835-R837 PolarHBondContact O-N 3.22Å; R837-Y879 HydrophobicContact CG-CD1 4.05Å; R837-Y879 HydrophobicContact CG-CE1 3.35Å; R837-Y885 HydrophobicContact CG-CE2 4.5Å; R837-S886 PolarHBondContact NE-O 3.3Å; R837-S886 PolarHBondContact NH2-O 3.35Å; R837-P887 PolarHBondContact NH2-O 3.07Å; R837-L888 HydrophobicContact CB-CB 4.07Å
838	F	95.4	Very high	95.6	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.123	C	C	.	.			trans	-89.6	111.2	176.1	-166.8	-78.8	0	0	0	110.1	L761 V827 L831 I832 E835 P836 T842 M843 L846 F864 K876 L888	L761-F838 HydrophobicContact CD1-CD2 4.47Å; V827-F838 HydrophobicContact CG1-CZ 4.09Å; V827-F838 HydrophobicContact CG2-CE2 3.98Å; V827-F838 HydrophobicContact CG2-CZ 3.89Å; L831-F838 HydrophobicContact CD1-CD2 4.43Å; L831-F838 HydrophobicContact CD2-CD2 3.82Å; L831-F838 HydrophobicContact CD2-CE2 3.8Å; L831-F838 HydrophobicContact CG-CD2 3.83Å; L831-F838 HydrophobicContact CG-CE2 4.22Å; L831-F838 HydrophobicContact CG-CG 4.26Å; I832-F838 HydrophobicContact CG1-CD1 4.37Å; I832-F838 HydrophobicContact CG1-CE1 3.88Å; I832-F838 HydrophobicContact CG1-CZ 4.48Å; E835-F838 HydrophobicContact CB-CB 4.01Å; E835-F838 HydrophobicContact CG-CB 4.12Å; E835-F838 WeakPolarHBondContact O-CB 3.39Å; E835-F838 PolarHBondContact O-N 3.42Å; P836-F838 VanDerWaalsContact C-N 3.25Å; P836-F838 PolarHBondContact O-N 2.99Å; F838-T842 HydrophobicContact CD2-CG2 3.76Å; F838-T842 HydrophobicContact CE2-CG2 3.8Å; F838-T842 HydrophobicContact CG-CG2 4.43Å; F838-T842 HydrophobicContact CZ-CG2 4.49Å; F838-M843 HydrophobicContact CE1-CB 4.27Å; F838-M843 HydrophobicContact CE1-CE 4.1Å; F838-M843 HydrophobicContact CZ-CB 4.36Å; F838-M843 HydrophobicContact CZ-CE 4.28Å; F838-M843 HydrophobicContact CZ-SD 4.36Å; F838-L846 HydrophobicContact CE2-CD1 3.73Å; F838-L846 HydrophobicContact CZ-CD1 4.2Å; F838-F864 HydrophobicContact CD1-CE2 4.3Å; F838-F864 HydrophobicContact CD1-CZ 4.27Å; F838-F864 HydrophobicContact CE1-CE2 4.08Å; F838-F864 HydrophobicContact CE1-CZ 4.49Å; F838-K876 PolarHBondContact O-NZ 3.15Å; F838-L888 HydrophobicContact CD2-CD2 4.34Å
839	N	94.3	Very high	95.5	Very high	26 Å²	26	23.3 Å²	23.3	14%	0.139	12%	0.124	C	C	.	.			trans	-131.2	-178.9	-174.6	65	7.7	0	0	0	112.2	D841 T842 M843	N839-D841 VanDerWaalsContact C-N 3.33Å; N839-D841 PolarHBondContact O-N 3.08Å; N839-D841 PolarHBondContact OD1-N 2.94Å; N839-T842 WeakPolarHBondContact O-CB 3.3Å; N839-T842 PolarHBondContact O-N 3.12Å; N839-T842 VanDerWaalsContact O-N 3.14Å; N839-T842 WeakPolarHBondContact OD1-CB 3.45Å; N839-T842 PolarHBondContact OD1-N 3.21Å; N839-T842 PolarHBondContact OD1-OG1 3.08Å; N839-M843 PolarHBondContact O-N 2.99Å
840	S	95.8	Very high	95.4	Very high	15 Å²	15	25.1 Å²	25.1	11%	0.105	14%	0.136	C	C	.	.	H	α-helix	trans	-60.2	-36.1	-179.2	46.2	0	0	0	0	113.7	M843 A844 N861	S840-M843 WeakPolarHBondContact O-CB 3.41Å; S840-M843 PolarHBondContact O-N 3.01Å; S840-A844 WeakPolarHBondContact O-CB 3.46Å; S840-A844 PolarHBondContact O-N 2.85Å; S840-N861 WeakPolarHBondContact CB-OD1 3.39Å; S840-N861 PolarHBondContact OG-OD1 3.46Å
841	D	94.2	Very high	95.3	Very high	85 Å²	85	29.7 Å²	29.7	46%	0.455	17%	0.166	S	C	.	.	H	α-helix	trans	-69.5	-36.2	173.8	-77.7	-59.8	0	0	0	112.9	N839 A844 M845 R857	N839-D841 VanDerWaalsContact C-N 3.33Å; N839-D841 PolarHBondContact O-N 3.08Å; N839-D841 PolarHBondContact OD1-N 2.94Å; D841-A844 WeakPolarHBondContact O-CB 3.35Å; D841-A844 PolarHBondContact O-N 3.33Å; D841-M845 WeakPolarHBondContact O-CG 3.36Å; D841-M845 PolarHBondContact O-N 2.81Å; D841-R857 IonicContact OD1-NH1 3.4Å; D841-R857 PolarHBondContact OD1-NH1 3.46Å
842	T	95.6	Very high	95.1	Very high	3 Å²	3	37.8 Å²	37.8	2%	0.018	20%	0.204	C	C	.	.	H	α-helix	trans	-63.5	-43.8	172.5	-54.5	0	0	0	0	110.7	F838 N839 M845 L846 L888 I890	F838-T842 HydrophobicContact CD2-CG2 3.76Å; F838-T842 HydrophobicContact CE2-CG2 3.8Å; F838-T842 HydrophobicContact CG-CG2 4.43Å; F838-T842 HydrophobicContact CZ-CG2 4.49Å; N839-T842 WeakPolarHBondContact O-CB 3.3Å; N839-T842 PolarHBondContact O-N 3.12Å; N839-T842 VanDerWaalsContact O-N 3.14Å; N839-T842 WeakPolarHBondContact OD1-CB 3.45Å; N839-T842 PolarHBondContact OD1-N 3.21Å; N839-T842 PolarHBondContact OD1-OG1 3.08Å; T842-M845 PolarHBondContact O-N 2.92Å; T842-L846 HydrophobicContact CG2-CD1 4.2Å; T842-L846 WeakPolarHBondContact O-CG 3.5Å; T842-L846 PolarHBondContact O-N 3.48Å; T842-L846 VanDerWaalsContact O-N 3.1Å; T842-L888 HydrophobicContact CG2-CB 4.49Å; T842-L888 HydrophobicContact CG2-CD2 4.29Å; T842-L888 HydrophobicContact CG2-CG 4.49Å; T842-I890 HydrophobicContact CG2-CG2 4.22Å
843	M	97.7	Very high	95.1	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60.1	-44.2	171.7	-176.3	68.8	89.5	0	0	111.2	V806 W809 L822 V827 I832 F838 N839 S840 M845 L846 L847 L860 F864	V806-M843 HydrophobicContact CG1-CE 4.17Å; W809-M843 HydrophobicContact CZ3-CE 4.45Å; L822-M843 HydrophobicContact CD1-SD 4.13Å; L822-M843 HydrophobicContact CD2-SD 4.17Å; V827-M843 HydrophobicContact CG1-CE 3.83Å; V827-M843 HydrophobicContact CG1-SD 4.08Å; I832-M843 HydrophobicContact CD1-CE 3.73Å; I832-M843 HydrophobicContact CG1-CE 4Å; F838-M843 HydrophobicContact CE1-CB 4.27Å; F838-M843 HydrophobicContact CE1-CE 4.1Å; F838-M843 HydrophobicContact CZ-CB 4.36Å; F838-M843 HydrophobicContact CZ-CE 4.28Å; F838-M843 HydrophobicContact CZ-SD 4.36Å; N839-M843 PolarHBondContact O-N 2.99Å; S840-M843 WeakPolarHBondContact O-CB 3.41Å; S840-M843 PolarHBondContact O-N 3.01Å; M843-M845 VanDerWaalsContact C-N 3.35Å; M843-M845 PolarHBondContact O-N 3.37Å; M843-L846 PolarHBondContact O-N 2.95Å; M843-L847 HydrophobicContact CG-CD1 3.79Å; M843-L847 HydrophobicContact CG-CG 4.33Å; M843-L847 WeakPolarHBondContact O-CB 3.01Å; M843-L847 VanDerWaalsContact O-CG 3.28Å; M843-L847 WeakPolarHBondContact O-CG 3.48Å; M843-L847 PolarHBondContact O-N 3.48Å; M843-L847 HydrophobicContact SD-CD1 4.26Å; M843-L847 HydrophobicContact SD-CG 4.36Å; M843-L860 HydrophobicContact CB-CD2 4.48Å; M843-L860 HydrophobicContact CG-CD1 4.08Å; M843-L860 HydrophobicContact CG-CD2 4.18Å; M843-F864 HydrophobicContact CE-CD2 4.48Å; M843-F864 HydrophobicContact CE-CE2 4.42Å
844	A	97.4	Very high	95.1	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.008	25%	0.252	C	S	.	.	H	α-helix	trans	-62.1	-38.5	178.8	0	0	0	0	0	113	S840 D841 N848 I849 R857 L860	S840-A844 WeakPolarHBondContact O-CB 3.46Å; S840-A844 PolarHBondContact O-N 2.85Å; D841-A844 WeakPolarHBondContact O-CB 3.35Å; D841-A844 PolarHBondContact O-N 3.33Å; A844-N848 PolarHBondContact O-N 3Å; A844-I849 PolarHBondContact O-N 3.34Å; A844-R857 HydrophobicContact CB-CG 4.3Å; A844-L860 HydrophobicContact CB-CD2 3.78Å
845	M	96.3	Very high	95.3	Very high	79 Å²	79	51 Å²	51	39%	0.389	27%	0.273	S	S	.	.	H	α-helix	trans	-64.7	-43.9	173.2	-70.5	-172.4	-69.4	0	0	111.9	D841 T842 M843 L847 N848 I890	D841-M845 WeakPolarHBondContact O-CG 3.36Å; D841-M845 PolarHBondContact O-N 2.81Å; T842-M845 PolarHBondContact O-N 2.92Å; M843-M845 VanDerWaalsContact C-N 3.35Å; M843-M845 PolarHBondContact O-N 3.37Å; M845-L847 VanDerWaalsContact C-N 3.3Å; M845-L847 PolarHBondContact O-N 3.49Å; M845-N848 WeakPolarHBondContact O-CA 3.12Å; M845-N848 PolarHBondContact O-N 2.79Å; M845-I890 HydrophobicContact CB-CD1 4.05Å; M845-I890 HydrophobicContact CE-CG2 4.36Å
846	L	97.6	Very high	95.5	Very high	24 Å²	24	52.7 Å²	52.7	13%	0.126	28%	0.283	C	S	.	.	H	α-helix	trans	-72.2	-23.9	179.6	-66	169.5	0	0	0	113.2	L761 L822 V827 F838 T842 M843 N848 I890	L761-L846 HydrophobicContact CD2-CD1 3.8Å; L761-L846 HydrophobicContact CD2-CD2 3.65Å; L761-L846 HydrophobicContact CD2-CG 4.37Å; L822-L846 HydrophobicContact CD2-CB 4.13Å; V827-L846 HydrophobicContact CG2-CD1 3.53Å; F838-L846 HydrophobicContact CE2-CD1 3.73Å; F838-L846 HydrophobicContact CZ-CD1 4.2Å; T842-L846 HydrophobicContact CG2-CD1 4.2Å; T842-L846 WeakPolarHBondContact O-CG 3.5Å; T842-L846 PolarHBondContact O-N 3.48Å; T842-L846 VanDerWaalsContact O-N 3.1Å; M843-L846 PolarHBondContact O-N 2.95Å; L846-N848 VanDerWaalsContact C-N 3.26Å; L846-I890 HydrophobicContact CD1-CG2 4.34Å; L846-I890 HydrophobicContact CD2-CB 4.02Å; L846-I890 HydrophobicContact CD2-CD1 4.26Å; L846-I890 HydrophobicContact CD2-CG2 3.72Å; L846-I890 HydrophobicContact CG-CG2 3.93Å
847	L	97.9	Very high	95.8	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-4.1	168.5	-70.8	173.9	0	0	0	113.5	L810 Y818 N821 L822 M843 M845 I849 L860	L810-L847 HydrophobicContact CD1-CD1 4.29Å; L810-L847 HydrophobicContact CD1-CD2 3.56Å; L810-L847 HydrophobicContact CD2-CD1 3.96Å; Y818-L847 WeakPolarHBondContact CD1-O 3.31Å; Y818-L847 WeakPolarHBondContact O-CD2 3.33Å; N821-L847 PolarHBondContact ND2-O 2.73Å; L822-L847 HydrophobicContact CD1-CD2 4.22Å; L822-L847 HydrophobicContact CD2-CD2 3.71Å; L822-L847 HydrophobicContact CD2-CG 4.14Å; L822-L847 HydrophobicContact CG-CD2 3.68Å; M843-L847 HydrophobicContact CG-CD1 3.79Å; M843-L847 HydrophobicContact CG-CG 4.33Å; M843-L847 WeakPolarHBondContact O-CB 3.01Å; M843-L847 VanDerWaalsContact O-CG 3.28Å; M843-L847 WeakPolarHBondContact O-CG 3.48Å; M843-L847 PolarHBondContact O-N 3.48Å; M843-L847 HydrophobicContact SD-CD1 4.26Å; M843-L847 HydrophobicContact SD-CG 4.36Å; M845-L847 VanDerWaalsContact C-N 3.3Å; M845-L847 PolarHBondContact O-N 3.49Å; L847-I849 VanDerWaalsContact C-N 3.3Å; L847-I849 HydrophobicContact CB-CD1 3.85Å; L847-I849 HydrophobicContact CB-CG1 3.92Å; L847-I849 HydrophobicContact CD1-CD1 4.07Å; L847-I849 PolarHBondContact O-N 2.92Å; L847-L860 HydrophobicContact CD1-CD1 4.13Å; L847-L860 HydrophobicContact CD1-CD2 3.78Å
848	N	96.9	Very high	96	Very high	133 Å²	133	59.1 Å²	59.1	71%	0.711	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	35.5	-175.5	-157.5	42.1	0	0	0	113.9	A844 M845 L846	A844-N848 PolarHBondContact O-N 3Å; M845-N848 WeakPolarHBondContact O-CA 3.12Å; M845-N848 PolarHBondContact O-N 2.79Å; L846-N848 VanDerWaalsContact C-N 3.26Å
849	I	96.8	Very high	96.1	Very high	4 Å²	4	62.3 Å²	62.3	2%	0.021	32%	0.316	C	S	.	.			trans	-86.8	111.6	176.5	-60.3	170.5	0	0	0	108.7	Y818 A844 L847 K853 L856 R857 L860	Y818-I849 HydrophobicContact CD1-CD1 4.25Å; Y818-I849 HydrophobicContact CD1-CG1 3.57Å; Y818-I849 HydrophobicContact CD2-CD1 4.08Å; Y818-I849 HydrophobicContact CD2-CG1 4.23Å; Y818-I849 HydrophobicContact CE1-CG1 3.73Å; Y818-I849 HydrophobicContact CE2-CD1 4.42Å; Y818-I849 HydrophobicContact CE2-CG1 4.37Å; Y818-I849 HydrophobicContact CG-CD1 4.03Å; Y818-I849 HydrophobicContact CG-CG1 3.87Å; A844-I849 PolarHBondContact O-N 3.34Å; L847-I849 VanDerWaalsContact C-N 3.3Å; L847-I849 HydrophobicContact CB-CD1 3.85Å; L847-I849 HydrophobicContact CB-CG1 3.92Å; L847-I849 HydrophobicContact CD1-CD1 4.07Å; L847-I849 PolarHBondContact O-N 2.92Å; I849-K853 HydrophobicContact CG2-CB 3.89Å; I849-K853 HydrophobicContact CG2-CD 4.47Å; I849-L856 HydrophobicContact CG2-CB 4.24Å; I849-R857 HydrophobicContact CG2-CG 3.88Å; I849-R857 PolarHBondContact O-NE 2.94Å; I849-R857 PolarHBondContact O-NH2 3.22Å; I849-L860 HydrophobicContact CD1-CD2 4.01Å
850	S	95	Very high	96.3	Very high	37 Å²	37	61 Å²	61	26%	0.259	31%	0.309	S	S	.	.			trans	-49.5	143.5	177.4	170.7	0	0	0	0	112.3	Q852 K853 R857	S850-Q852 PolarHBondContact O-N 2.81Å; S850-Q852 PolarHBondContact OG-N 3.39Å; S850-Q852 VanDerWaalsContact OG-N 3.13Å; S850-Q852 PolarHBondContact OG-OE1 3.41Å; S850-K853 PolarHBondContact O-N 3.05Å; S850-R857 PolarHBondContact O-NE 3.42Å
851	P	92.9	Very high	96.4	Very high	97 Å²	97	63.2 Å²	63.2	63%	0.63	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-32.8	168.7	-27.3	36.5	0	0	0	113.9	K853	P851-K853 VanDerWaalsContact C-N 3.26Å; P851-K853 PolarHBondContact O-N 2.96Å
852	Q	94.3	Very high	96.5	Very high	169 Å²	169	62.6 Å²	62.6	79%	0.79	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-24.5	178.7	-61.8	152.5	-34.2	0	0	112.9	S850 T854	S850-Q852 PolarHBondContact O-N 2.81Å; S850-Q852 PolarHBondContact OG-N 3.39Å; S850-Q852 VanDerWaalsContact OG-N 3.13Å; S850-Q852 PolarHBondContact OG-OE1 3.41Å; Q852-T854 PolarHBondContact O-N 3.4Å
853	K	94.9	Very high	96.5	Very high	96 Å²	96	63.9 Å²	63.9	42%	0.417	33%	0.325	S	S	.	.			trans	-78.1	56.7	178.7	-77.4	-178.2	157.9	-171.5	0	111.2	Y818 I849 S850 P851 L855 L856 R857	Y818-K853 PolarHBondContact OH-NZ 3.4Å; I849-K853 HydrophobicContact CG2-CB 3.89Å; I849-K853 HydrophobicContact CG2-CD 4.47Å; S850-K853 PolarHBondContact O-N 3.05Å; P851-K853 VanDerWaalsContact C-N 3.26Å; P851-K853 PolarHBondContact O-N 2.96Å; K853-L855 VanDerWaalsContact C-N 3.35Å; K853-L855 PolarHBondContact O-N 3.43Å; K853-L856 HydrophobicContact CB-CB 4.35Å; K853-L856 HydrophobicContact CB-CD1 4.18Å; K853-L856 HydrophobicContact CD-CD1 3.82Å; K853-L856 HydrophobicContact CG-CD1 4.27Å; K853-L856 PolarHBondContact O-N 3.48Å; K853-L856 VanDerWaalsContact O-N 3.15Å; K853-R857 PolarHBondContact O-N 2.91Å
854	T	95.9	Very high	96.4	Very high	96 Å²	96	64 Å²	64	59%	0.589	33%	0.326	S	S	*	.	H	α-helix	trans	-57.7	-39.3	-171.8	57.3	0	0	0	0	113.7	Q852 R857 R858	Q852-T854 PolarHBondContact O-N 3.4Å; T854-R857 PolarHBondContact O-N 3.29Å; T854-R858 WeakPolarHBondContact O-CB 3.3Å; T854-R858 PolarHBondContact O-N 2.91Å
855	L	96.9	Very high	96.2	Very high	121 Å²	121	65.2 Å²	65.2	63%	0.634	33%	0.332	S	S	*	.	H	α-helix	trans	-62.5	-45.6	176.6	-69	176.2	0	0	0	112.2	K853 R858 H859	K853-L855 VanDerWaalsContact C-N 3.35Å; K853-L855 PolarHBondContact O-N 3.43Å; L855-R858 PolarHBondContact O-N 3.47Å; L855-H859 WeakPolarHBondContact O-CB 3.27Å; L855-H859 PolarHBondContact O-N 3.03Å
856	L	96.9	Very high	96	Very high	46 Å²	46	66.6 Å²	66.6	24%	0.241	34%	0.342	C	S	.	.	H	α-helix	trans	-67.9	-38.3	177.3	-73.5	163.6	0	0	0	111.6	L815 Y818 I849 K853 H859 L860	L815-L856 HydrophobicContact CD2-CD2 3.77Å; Y818-L856 HydrophobicContact CE2-CD1 4.17Å; Y818-L856 HydrophobicContact CE2-CD2 4.31Å; Y818-L856 WeakPolarHBondContact OH-CD1 3.4Å; I849-L856 HydrophobicContact CG2-CB 4.24Å; K853-L856 HydrophobicContact CB-CB 4.35Å; K853-L856 HydrophobicContact CB-CD1 4.18Å; K853-L856 HydrophobicContact CD-CD1 3.82Å; K853-L856 HydrophobicContact CG-CD1 4.27Å; K853-L856 PolarHBondContact O-N 3.48Å; K853-L856 VanDerWaalsContact O-N 3.15Å; L856-H859 PolarHBondContact O-N 3.44Å; L856-L860 VanDerWaalsContact O-CB 3.31Å; L856-L860 WeakPolarHBondContact O-CB 3.41Å; L856-L860 PolarHBondContact O-N 3.35Å
857	R	96.8	Very high	95.8	Very high	42 Å²	42	65.5 Å²	65.5	16%	0.158	34%	0.336	C	S	.	.	H	α-helix	trans	-64	-40.7	172.9	-75	-173.8	163.7	-108.7	-2.9	112.4	D841 A844 I849 S850 K853 T854 N861	D841-R857 IonicContact OD1-NH1 3.4Å; D841-R857 PolarHBondContact OD1-NH1 3.46Å; A844-R857 HydrophobicContact CB-CG 4.3Å; I849-R857 HydrophobicContact CG2-CG 3.88Å; I849-R857 PolarHBondContact O-NE 2.94Å; I849-R857 PolarHBondContact O-NH2 3.22Å; S850-R857 PolarHBondContact O-NE 3.42Å; K853-R857 PolarHBondContact O-N 2.91Å; T854-R857 PolarHBondContact O-N 3.29Å; R857-N861 VanDerWaalsContact O-CB 3.27Å; R857-N861 WeakPolarHBondContact O-CB 3.37Å; R857-N861 PolarHBondContact O-N 2.85Å
858	R	97.1	Very high	95.5	Very high	168 Å²	168	65.6 Å²	65.6	63%	0.634	34%	0.336	S	S	*	.	H	α-helix	trans	-64.1	-45.5	174.4	-173.4	176.2	67.5	163.6	0.6	111.5	T854 L855 N861 T862	T854-R858 WeakPolarHBondContact O-CB 3.3Å; T854-R858 PolarHBondContact O-N 2.91Å; L855-R858 PolarHBondContact O-N 3.47Å; R858-N861 PolarHBondContact O-N 3.47Å; R858-T862 PolarHBondContact O-N 2.9Å; R858-T862 PolarHBondContact O-OG1 3.41Å
859	H	97.5	Very high	95.3	Very high	66 Å²	66	60 Å²	60	31%	0.306	31%	0.31	S	S	.	.	H	α-helix	trans	-60.8	-48	176.5	-176.8	66.6	0	0	0	112.1	V813 L855 L856 N861 T862 N863	V813-H859 PolarHBondContact O-NE2 3.47Å; L855-H859 WeakPolarHBondContact O-CB 3.27Å; L855-H859 PolarHBondContact O-N 3.03Å; L856-H859 PolarHBondContact O-N 3.44Å; H859-N861 VanDerWaalsContact C-N 3.34Å; H859-N861 PolarHBondContact O-N 2.87Å; H859-T862 PolarHBondContact O-N 2.8Å; H859-N863 PolarHBondContact CE1-ND2 2.88Å; H859-N863 VanDerWaalsContact CE1-ND2 3.26Å; H859-N863 PolarHBondContact ND1-ND2 3.24Å; H859-N863 PolarHBondContact O-N 3.37Å; H859-N863 PolarHBondContact O-ND2 3.12Å
860	L	98	Very high	94.9	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-60.1	-42.5	173.9	175.2	60.6	0	0	0	111.7	W809 L810 L815 M843 A844 L847 I849 L856 N863 F864	W809-L860 HydrophobicContact CH2-CD1 4.29Å; L810-L860 HydrophobicContact CD2-CD1 4.33Å; L815-L860 HydrophobicContact CD1-CB 3.88Å; L815-L860 HydrophobicContact CD1-CD1 3.73Å; L815-L860 HydrophobicContact CD1-CG 4.32Å; M843-L860 HydrophobicContact CB-CD2 4.48Å; M843-L860 HydrophobicContact CG-CD1 4.08Å; M843-L860 HydrophobicContact CG-CD2 4.18Å; A844-L860 HydrophobicContact CB-CD2 3.78Å; L847-L860 HydrophobicContact CD1-CD1 4.13Å; L847-L860 HydrophobicContact CD1-CD2 3.78Å; I849-L860 HydrophobicContact CD1-CD2 4.01Å; L856-L860 VanDerWaalsContact O-CB 3.31Å; L856-L860 WeakPolarHBondContact O-CB 3.41Å; L856-L860 PolarHBondContact O-N 3.35Å; L860-N863 PolarHBondContact O-N 3.31Å; L860-F864 WeakPolarHBondContact O-CB 3.49Å; L860-F864 PolarHBondContact O-N 2.87Å
861	N	97	Very high	94.6	Very high	61 Å²	61	67.6 Å²	67.6	33%	0.326	35%	0.349	S	S	.	.	H	α-helix	trans	-62.8	-46.7	178.6	-176.5	48.2	0	0	0	111.9	S840 R857 R858 H859 N863 F864 N865	S840-N861 WeakPolarHBondContact CB-OD1 3.39Å; S840-N861 PolarHBondContact OG-OD1 3.46Å; R857-N861 VanDerWaalsContact O-CB 3.27Å; R857-N861 WeakPolarHBondContact O-CB 3.37Å; R857-N861 PolarHBondContact O-N 2.85Å; R858-N861 PolarHBondContact O-N 3.47Å; H859-N861 VanDerWaalsContact C-N 3.34Å; H859-N861 PolarHBondContact O-N 2.87Å; N861-N863 PolarHBondContact O-N 3.23Å; N861-F864 PolarHBondContact O-N 2.85Å; N861-N865 WeakPolarHBondContact O-CB 3.46Å; N861-N865 VanDerWaalsContact O-CG 3.24Å; N861-N865 PolarHBondContact O-N 3Å; N861-N865 PolarHBondContact O-ND2 3.44Å; N861-N865 PolarHBondContact OD1-ND2 3.34Å; N861-N865 VanDerWaalsContact OD1-ND2 3.1Å
862	T	96	Very high	94.4	Very high	71 Å²	71	63 Å²	63	44%	0.436	32%	0.32	S	S	.	.	H	α-helix	trans	-57.9	-50.1	175.1	-59.2	0	0	0	0	111.1	R858 H859 F864 N865 N866	R858-T862 PolarHBondContact O-N 2.9Å; R858-T862 PolarHBondContact O-OG1 3.41Å; H859-T862 PolarHBondContact O-N 2.8Å; T862-F864 PolarHBondContact O-N 3.06Å; T862-N865 PolarHBondContact O-N 3.29Å; T862-N866 VanDerWaalsContact O-CG 3.29Å; T862-N866 PolarHBondContact O-N 3.07Å; T862-N866 PolarHBondContact O-OD1 2.82Å
863	N	95.7	Very high	94.2	Very high	30 Å²	30	57.8 Å²	57.8	16%	0.16	30%	0.296	C	S	.	.	H	α-helix	trans	-67.1	-35.2	-179.4	-75.4	-75.5	0	0	0	113	W809 V813 H859 L860 N861 N866 L867	W809-N863 HydrophobicContact CZ2-CB 3.99Å; V813-N863 HydrophobicContact CB-CB 4.2Å; V813-N863 HydrophobicContact CG1-CB 4.16Å; V813-N863 WeakPolarHBondContact CG1-OD1 3.41Å; V813-N863 HydrophobicContact CG2-CB 4.3Å; H859-N863 PolarHBondContact CE1-ND2 2.88Å; H859-N863 VanDerWaalsContact CE1-ND2 3.26Å; H859-N863 PolarHBondContact ND1-ND2 3.24Å; H859-N863 PolarHBondContact O-N 3.37Å; H859-N863 PolarHBondContact O-ND2 3.12Å; L860-N863 PolarHBondContact O-N 3.31Å; N861-N863 PolarHBondContact O-N 3.23Å; N863-N866 PolarHBondContact O-N 2.95Å; N863-L867 WeakPolarHBondContact O-CB 3.21Å; N863-L867 PolarHBondContact O-N 3.48Å
864	F	96.3	Very high	94	Very high	3 Å²	3	57.1 Å²	57.1	1%	0.013	29%	0.294	C	S	.	.	H	α-helix	trans	-65.5	-41	175	-178.7	-89.2	0	0	0	111.8	I832 F838 M843 L860 N861 T862 L867 V868	I832-F864 HydrophobicContact CG2-CE2 3.93Å; I832-F864 HydrophobicContact CG2-CZ 4.3Å; F838-F864 HydrophobicContact CD1-CE2 4.3Å; F838-F864 HydrophobicContact CD1-CZ 4.27Å; F838-F864 HydrophobicContact CE1-CE2 4.08Å; F838-F864 HydrophobicContact CE1-CZ 4.49Å; M843-F864 HydrophobicContact CE-CD2 4.48Å; M843-F864 HydrophobicContact CE-CE2 4.42Å; L860-F864 WeakPolarHBondContact O-CB 3.49Å; L860-F864 PolarHBondContact O-N 2.87Å; N861-F864 PolarHBondContact O-N 2.85Å; T862-F864 PolarHBondContact O-N 3.06Å; F864-L867 WeakPolarHBondContact O-CB 3.36Å; F864-L867 PolarHBondContact O-N 3.46Å; F864-V868 HydrophobicContact CD1-CG1 4.42Å; F864-V868 HydrophobicContact CE1-CG1 3.98Å; F864-V868 HydrophobicContact CE1-CG2 4.43Å; F864-V868 HydrophobicContact CE2-CG1 4.35Å; F864-V868 HydrophobicContact CZ-CG1 3.95Å; F864-V868 PolarHBondContact O-N 3.43Å
865	N	93.7	Very high	93.5	Very high	26 Å²	26	55 Å²	55	14%	0.139	28%	0.277	C	S	.	.	H	α-helix	trans	-66.8	-39.4	176.1	-68.1	-41.1	0	0	0	111.5	N861 T862 L867 G869 Q873	N861-N865 WeakPolarHBondContact O-CB 3.46Å; N861-N865 VanDerWaalsContact O-CG 3.24Å; N861-N865 PolarHBondContact O-N 3Å; N861-N865 PolarHBondContact O-ND2 3.44Å; N861-N865 PolarHBondContact OD1-ND2 3.34Å; N861-N865 VanDerWaalsContact OD1-ND2 3.1Å; T862-N865 PolarHBondContact O-N 3.29Å; N865-L867 VanDerWaalsContact C-N 3.33Å; N865-L867 PolarHBondContact O-N 2.68Å; N865-G869 PolarHBondContact O-N 3.35Å; N865-Q873 HydrophobicContact CB-CG 4.32Å; N865-Q873 PolarHBondContact ND2-NE2 3.1Å; N865-Q873 WeakPolarHBondContact OD1-CG 3.48Å; N865-Q873 PolarHBondContact OD1-NE2 3.16Å
866	N	92.4	Very high	93.3	Very high	109 Å²	109	49.7 Å²	49.7	58%	0.583	25%	0.249	S	C	*	.	H	α-helix	trans	-63.1	-38.6	171.1	-65.3	-5.7	0	0	0	112	T862 N863	T862-N866 VanDerWaalsContact O-CG 3.29Å; T862-N866 PolarHBondContact O-N 3.07Å; T862-N866 PolarHBondContact O-OD1 2.82Å; N863-N866 PolarHBondContact O-N 2.95Å
867	L	92.8	Very high	92.9	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-63.6	-48.2	178.2	170.7	67.7	0	0	0	112.6	F793 V798 W801 W809 I832 N863 F864 N865	F793-L867 HydrophobicContact CD2-CD1 4.43Å; F793-L867 HydrophobicContact CE2-CD1 3.57Å; F793-L867 HydrophobicContact CZ-CB 4.5Å; F793-L867 HydrophobicContact CZ-CD1 3.73Å; V798-L867 HydrophobicContact CB-CD1 4.45Å; V798-L867 HydrophobicContact CG1-CD1 3.75Å; V798-L867 HydrophobicContact CG1-CG 4.12Å; V798-L867 HydrophobicContact CG2-CD1 3.76Å; W801-L867 HydrophobicContact CE3-CD1 4.16Å; W801-L867 HydrophobicContact CH2-CD1 3.5Å; W801-L867 VanDerWaalsContact CH2-CD1 3.5Å; W801-L867 HydrophobicContact CZ2-CD1 4.37Å; W801-L867 HydrophobicContact CZ3-CD1 3.36Å; W809-L867 HydrophobicContact CD2-CD1 4.42Å; W809-L867 HydrophobicContact CD2-CD2 4Å; W809-L867 HydrophobicContact CE3-CD2 3.94Å; W809-L867 HydrophobicContact CH2-CB 4.48Å; W809-L867 HydrophobicContact CH2-CD2 3.73Å; W809-L867 HydrophobicContact CZ2-CB 3.83Å; W809-L867 HydrophobicContact CZ2-CD2 3.76Å; W809-L867 HydrophobicContact CZ2-CG 4.3Å; W809-L867 HydrophobicContact CZ3-CD2 3.82Å; I832-L867 HydrophobicContact CD1-CD2 4.49Å; I832-L867 HydrophobicContact CG2-CD2 4.2Å; N863-L867 WeakPolarHBondContact O-CB 3.21Å; N863-L867 PolarHBondContact O-N 3.48Å; F864-L867 WeakPolarHBondContact O-CB 3.36Å; F864-L867 PolarHBondContact O-N 3.46Å; N865-L867 VanDerWaalsContact C-N 3.33Å; N865-L867 PolarHBondContact O-N 2.68Å
868	V	92.4	Very high	92.6	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.012	27%	0.274	C	S	.	.	H	α-helix	trans	-82.8	-19.9	-177.5	-54.1	0	0	0	0	112.8	P795 I832 M833 F864 A872 Q873	P795-V868 WeakPolarHBondContact CB-O 3.4Å; I832-V868 HydrophobicContact CG2-CG1 3.76Å; M833-V868 HydrophobicContact CE-CB 4.48Å; M833-V868 HydrophobicContact SD-CB 3.94Å; M833-V868 HydrophobicContact SD-CG1 3.93Å; F864-V868 HydrophobicContact CD1-CG1 4.42Å; F864-V868 HydrophobicContact CE1-CG1 3.98Å; F864-V868 HydrophobicContact CE1-CG2 4.43Å; F864-V868 HydrophobicContact CE2-CG1 4.35Å; F864-V868 HydrophobicContact CZ-CG1 3.95Å; F864-V868 PolarHBondContact O-N 3.43Å; V868-A872 HydrophobicContact CB-CB 3.85Å; V868-A872 HydrophobicContact CG2-CB 4.05Å; V868-A872 WeakPolarHBondContact O-CB 3.31Å; V868-Q873 HydrophobicContact CG2-CB 4.31Å
869	G	91.3	Very high	92.2	Very high	15 Å²	15	51.9 Å²	51.9	16%	0.155	26%	0.259	C	S	.	.	H	α-helix	trans	78.4	160.7	-178.2	0	0	0	0	0	113.8	N865 Q871 A872 Q873	N865-G869 PolarHBondContact O-N 3.35Å; G869-Q871 VanDerWaalsContact C-N 3.25Å; G869-Q871 PolarHBondContact O-N 3.24Å; G869-Q871 VanDerWaalsContact O-N 3.12Å; G869-A872 PolarHBondContact O-N 2.84Å; G869-A872 VanDerWaalsContact O-N 3.15Å; G869-Q873 WeakPolarHBondContact O-CB 3.33Å; G869-Q873 PolarHBondContact O-N 2.91Å
870	V	89.3	Confident	91.7	Very high	124 Å²	124	51.2 Å²	51.2	75%	0.752	26%	0.26	S	S	*	.	H	α-helix	trans	-54.6	-36.2	-170.6	-63.4	0	0	0	0	114.1	Q874	V870-Q874 WeakPolarHBondContact O-CB 3.43Å; V870-Q874 PolarHBondContact O-N 3.45Å
871	Q	87.9	Confident	91.2	Very high	76 Å²	76	57.4 Å²	57.4	36%	0.355	29%	0.289	S	S	.	.	H	α-helix	trans	-67.4	-52.6	178.2	172.8	161.7	23.3	0	0	112.1	G869 Q873 Q874 E875 F945 R946	G869-Q871 VanDerWaalsContact C-N 3.25Å; G869-Q871 PolarHBondContact O-N 3.24Å; G869-Q871 VanDerWaalsContact O-N 3.12Å; Q871-Q873 VanDerWaalsContact C-N 3.27Å; Q871-Q873 PolarHBondContact O-N 2.95Å; Q871-Q874 PolarHBondContact O-N 2.82Å; Q871-Q874 VanDerWaalsContact O-N 3.1Å; Q871-E875 WeakPolarHBondContact CG-OE1 3.44Å; Q871-E875 PolarHBondContact NE2-OE1 3.28Å; Q871-E875 PolarHBondContact O-N 3.46Å; Q871-F945 HydrophobicContact CG-CB 4.35Å; Q871-R946 VanDerWaalsContact NE2-CA 3.32Å; Q871-R946 PolarHBondContact NE2-O 3.37Å
872	A	88.6	Confident	90.8	Very high	2 Å²	2	56.9 Å²	56.9	2%	0.017	29%	0.293	C	S	.	.	H	α-helix	trans	-70.7	-28.3	-177.5	0	0	0	0	0	111.9	M833 V868 G869 K876 F945	M833-A872 HydrophobicContact CE-CB 3.87Å; V868-A872 HydrophobicContact CB-CB 3.85Å; V868-A872 HydrophobicContact CG2-CB 4.05Å; V868-A872 WeakPolarHBondContact O-CB 3.31Å; G869-A872 PolarHBondContact O-N 2.84Å; G869-A872 VanDerWaalsContact O-N 3.15Å; A872-K876 VanDerWaalsContact O-CB 3.27Å; A872-K876 WeakPolarHBondContact O-CB 3.32Å; A872-K876 WeakPolarHBondContact O-CD 3.37Å; A872-K876 WeakPolarHBondContact O-CG 3.18Å; A872-K876 PolarHBondContact O-N 3.48Å; A872-K876 VanDerWaalsContact O-N 3.12Å; A872-F945 VanDerWaalsContact CA-CE1 3.42Å; A872-F945 HydrophobicContact CB-CD1 3.68Å; A872-F945 HydrophobicContact CB-CD2 4.41Å; A872-F945 HydrophobicContact CB-CE1 3.45Å; A872-F945 VanDerWaalsContact CB-CE1 3.45Å; A872-F945 HydrophobicContact CB-CE2 4.21Å; A872-F945 HydrophobicContact CB-CG 4.18Å; A872-F945 HydrophobicContact CB-CZ 3.74Å
873	Q	91	Very high	89.9	Confident	59 Å²	59	58.9 Å²	58.9	28%	0.276	32%	0.316	S	S	.	.	H	α-helix	trans	-59.7	-47	167	-179.8	-178	21.4	0	0	111.5	N865 V868 G869 Q871 R877	N865-Q873 HydrophobicContact CB-CG 4.32Å; N865-Q873 PolarHBondContact ND2-NE2 3.1Å; N865-Q873 WeakPolarHBondContact OD1-CG 3.48Å; N865-Q873 PolarHBondContact OD1-NE2 3.16Å; V868-Q873 HydrophobicContact CG2-CB 4.31Å; G869-Q873 WeakPolarHBondContact O-CB 3.33Å; G869-Q873 PolarHBondContact O-N 2.91Å; Q871-Q873 VanDerWaalsContact C-N 3.27Å; Q871-Q873 PolarHBondContact O-N 2.95Å; Q873-R877 WeakPolarHBondContact O-CB 3.38Å; Q873-R877 PolarHBondContact O-N 3.29Å
874	Q	89.4	Confident	89.1	Confident	81 Å²	81	61.2 Å²	61.2	38%	0.379	35%	0.348	S	S	.	.	H	α-helix	trans	-69.3	-46.2	-178.1	-177	58.8	21	0	0	112.4	V870 Q871 K876 R877 E878	V870-Q874 WeakPolarHBondContact O-CB 3.43Å; V870-Q874 PolarHBondContact O-N 3.45Å; Q871-Q874 PolarHBondContact O-N 2.82Å; Q871-Q874 VanDerWaalsContact O-N 3.1Å; Q874-K876 VanDerWaalsContact C-N 3.3Å; Q874-K876 PolarHBondContact O-N 2.96Å; Q874-R877 WeakPolarHBondContact O-CB 3.46Å; Q874-R877 PolarHBondContact O-N 3.41Å; Q874-R877 VanDerWaalsContact O-N 3.11Å; Q874-E878 WeakPolarHBondContact CG-OE1 3.33Å; Q874-E878 PolarHBondContact NE2-OE1 2.9Å; Q874-E878 WeakPolarHBondContact O-CG 3.35Å; Q874-E878 PolarHBondContact O-N 3.44Å
875	E	87.4	Confident	88.6	Confident	52 Å²	52	64 Å²	64	24%	0.243	36%	0.359	C	S	.	.	H	α-helix	trans	-64.9	-33.7	178.6	-66.2	-176.3	-147.2	0	0	111.8	Q871 Y879 F945 R946	Q871-E875 WeakPolarHBondContact CG-OE1 3.44Å; Q871-E875 PolarHBondContact NE2-OE1 3.28Å; Q871-E875 PolarHBondContact O-N 3.46Å; E875-Y879 WeakPolarHBondContact O-CB 3.26Å; E875-Y879 PolarHBondContact O-N 3.49Å; E875-Y879 VanDerWaalsContact O-N 3.12Å; E875-F945 HydrophobicContact CB-CD1 3.85Å; E875-F945 HydrophobicContact CB-CE1 3.92Å; E875-F945 HydrophobicContact CG-CD1 4.15Å; E875-F945 WeakPolarHBondContact OE2-CA 3.49Å; E875-F945 VanDerWaalsContact OE2-CD1 3.28Å; E875-F945 WeakPolarHBondContact OE2-CD1 3.46Å; E875-R946 PolarHBondContact OE1-N 3.04Å; E875-R946 VanDerWaalsContact OE1-N 3.12Å
876	K	91.2	Very high	88	Confident	10 Å²	10	65.8 Å²	65.8	4%	0.043	37%	0.373	C	S	.	.	H	α-helix	trans	-71.2	-33.5	171.8	-71.6	171.9	-175	-73	0	113.1	I832 M833 E835 F838 A872 Q874 T880	I832-K876 WeakPolarHBondContact O-CE 3.29Å; I832-K876 PolarHBondContact O-NZ 2.94Å; M833-K876 PolarHBondContact O-NZ 2.9Å; E835-K876 PolarHBondContact O-NZ 3.19Å; F838-K876 PolarHBondContact O-NZ 3.15Å; A872-K876 VanDerWaalsContact O-CB 3.27Å; A872-K876 WeakPolarHBondContact O-CB 3.32Å; A872-K876 WeakPolarHBondContact O-CD 3.37Å; A872-K876 WeakPolarHBondContact O-CG 3.18Å; A872-K876 PolarHBondContact O-N 3.48Å; A872-K876 VanDerWaalsContact O-N 3.12Å; Q874-K876 VanDerWaalsContact C-N 3.3Å; Q874-K876 PolarHBondContact O-N 2.96Å; K876-T880 WeakPolarHBondContact O-CB 3.46Å; K876-T880 PolarHBondContact O-N 3.24Å; K876-T880 VanDerWaalsContact O-N 3.14Å; K876-T880 PolarHBondContact O-OG1 3.02Å
877	R	89.6	Confident	87.7	Confident	111 Å²	111	64.9 Å²	64.9	42%	0.419	37%	0.373	S	S	.	.	H	α-helix	trans	-63.2	-54.4	172.4	175.8	-164.6	-63.1	-76.5	0.2	110.2	Q873 Q874 Y879 T880 E881	Q873-R877 WeakPolarHBondContact O-CB 3.38Å; Q873-R877 PolarHBondContact O-N 3.29Å; Q874-R877 WeakPolarHBondContact O-CB 3.46Å; Q874-R877 PolarHBondContact O-N 3.41Å; Q874-R877 VanDerWaalsContact O-N 3.11Å; R877-Y879 VanDerWaalsContact C-N 3.25Å; R877-Y879 PolarHBondContact O-N 3.03Å; R877-T880 CarbonylContact O-C 3.37Å; R877-T880 WeakPolarHBondContact O-CA 3.29Å; R877-T880 WeakPolarHBondContact O-CB 3.47Å; R877-T880 PolarHBondContact O-N 3.24Å; R877-E881 WeakPolarHBondContact CD-OE1 3.35Å; R877-E881 HydrophobicContact CG-CG 4.3Å; R877-E881 WeakPolarHBondContact CG-OE1 3.46Å; R877-E881 IonicContact NH1-OE1 3.32Å; R877-E881 PolarHBondContact NH1-OE1 3.14Å; R877-E881 PolarHBondContact O-N 2.68Å
878	E	89.7	Confident	87.5	Confident	106 Å²	106	65 Å²	65	50%	0.495	37%	0.374	S	S	.	.	H	α-helix	trans	-56.9	-39.7	180	-71.8	170.9	-167.6	0	0	111.7	Q874 T880 E881 A882	Q874-E878 WeakPolarHBondContact CG-OE1 3.33Å; Q874-E878 PolarHBondContact NE2-OE1 2.9Å; Q874-E878 WeakPolarHBondContact O-CG 3.35Å; Q874-E878 PolarHBondContact O-N 3.44Å; E878-T880 VanDerWaalsContact C-N 3.32Å; E878-T880 PolarHBondContact O-N 3.37Å; E878-E881 PolarHBondContact O-N 2.74Å; E878-A882 WeakPolarHBondContact O-CB 3.48Å; E878-A882 PolarHBondContact O-N 3.45Å; E878-A882 VanDerWaalsContact O-N 3.08Å
879	Y	88.3	Confident	87.2	Confident	84 Å²	84	67.3 Å²	67.3	33%	0.329	39%	0.39	S	S	.	.	H	α-helix	trans	-65.2	-32.6	173.6	-165.7	-80.2	0	0	0	113.4	P836 R837 E875 R877 Y885	P836-Y879 HydrophobicContact CB-CD1 3.97Å; P836-Y879 HydrophobicContact CB-CD2 3.58Å; P836-Y879 HydrophobicContact CB-CE1 4.41Å; P836-Y879 HydrophobicContact CB-CE2 4.02Å; P836-Y879 HydrophobicContact CB-CG 3.56Å; P836-Y879 HydrophobicContact CG-CD2 4.21Å; P836-Y879 HydrophobicContact CG-CE2 4.38Å; R837-Y879 HydrophobicContact CG-CD1 4.05Å; R837-Y879 HydrophobicContact CG-CE1 3.35Å; E875-Y879 WeakPolarHBondContact O-CB 3.26Å; E875-Y879 PolarHBondContact O-N 3.49Å; E875-Y879 VanDerWaalsContact O-N 3.12Å; R877-Y879 VanDerWaalsContact C-N 3.25Å; R877-Y879 PolarHBondContact O-N 3.03Å; Y879-Y885 AromaticContact CD1-CD2 3.78Å; Y879-Y885 HydrophobicContact CD1-CD2 3.78Å; Y879-Y885 HydrophobicContact CD1-CE2 4.02Å; Y879-Y885 AromaticContact CE1-CD2 3.86Å; Y879-Y885 HydrophobicContact CE1-CD2 3.86Å; Y879-Y885 HydrophobicContact CE1-CE2 4.2Å; Y879-Y885 VanDerWaalsContact O-CD2 3.25Å; Y879-Y885 WeakPolarHBondContact O-CD2 3.45Å
880	T	87.5	Confident	87.2	Confident	53 Å²	53	69 Å²	69	33%	0.325	40%	0.395	S	S	.	.	H	α-helix	trans	-77.3	-32.9	178.1	-56.7	0	0	0	0	112.1	K876 R877 E878 A882 Y885	K876-T880 WeakPolarHBondContact O-CB 3.46Å; K876-T880 PolarHBondContact O-N 3.24Å; K876-T880 VanDerWaalsContact O-N 3.14Å; K876-T880 PolarHBondContact O-OG1 3.02Å; R877-T880 CarbonylContact O-C 3.37Å; R877-T880 WeakPolarHBondContact O-CA 3.29Å; R877-T880 WeakPolarHBondContact O-CB 3.47Å; R877-T880 PolarHBondContact O-N 3.24Å; E878-T880 VanDerWaalsContact C-N 3.32Å; E878-T880 PolarHBondContact O-N 3.37Å; T880-A882 VanDerWaalsContact C-N 3.34Å; T880-Y885 HydrophobicContact CG2-CD1 4.25Å; T880-Y885 HydrophobicContact CG2-CE1 3.85Å
881	E	88.4	Confident	87.2	Confident	130 Å²	130	68.5 Å²	68.5	61%	0.607	39%	0.392	S	S	*	.	H	α-helix	trans	-84.9	-7.2	178.9	-68.4	168.6	-172.8	0	0	112.4	R877 E878	R877-E881 WeakPolarHBondContact CD-OE1 3.35Å; R877-E881 HydrophobicContact CG-CG 4.3Å; R877-E881 WeakPolarHBondContact CG-OE1 3.46Å; R877-E881 IonicContact NH1-OE1 3.32Å; R877-E881 PolarHBondContact NH1-OE1 3.14Å; R877-E881 PolarHBondContact O-N 2.68Å; E878-E881 PolarHBondContact O-N 2.74Å
882	A	88.5	Confident	87.3	Confident	49 Å²	49	66 Å²	66	41%	0.405	39%	0.385	S	S	.	.	S	Bend	trans	-70.9	140.7	180	0	0	0	0	0	114.1	E878 T880 G884 Y885	E878-A882 WeakPolarHBondContact O-CB 3.48Å; E878-A882 PolarHBondContact O-N 3.45Å; E878-A882 VanDerWaalsContact O-N 3.08Å; T880-A882 VanDerWaalsContact C-N 3.34Å; A882-G884 PolarHBondContact O-N 3.07Å; A882-Y885 WeakPolarHBondContact O-CB 3.37Å; A882-Y885 PolarHBondContact O-N 3.32Å
883	A	76.3	Confident	87.4	Confident	113 Å²	113	73.4 Å²	73.4	93%	0.934	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	123.8	175.1	0	0	0	0	0	111.5
884	G	79.5	Confident	87.2	Confident	79 Å²	79	72.2 Å²	72.2	81%	0.814	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.7	8.1	-175.1	0	0	0	0	0	115.2	A882 S886	A882-G884 PolarHBondContact O-N 3.07Å; G884-S886 PolarHBondContact O-N 3.27Å
885	Y	84.4	Confident	86.5	Confident	62 Å²	62	77.1 Å²	77.1	24%	0.243	43%	0.434	C	S	.	.			trans	-51.7	138.2	170	172.1	-107.7	0	0	0	112	R837 Y879 T880 A882 P887	R837-Y885 HydrophobicContact CG-CE2 4.5Å; Y879-Y885 AromaticContact CD1-CD2 3.78Å; Y879-Y885 HydrophobicContact CD1-CD2 3.78Å; Y879-Y885 HydrophobicContact CD1-CE2 4.02Å; Y879-Y885 AromaticContact CE1-CD2 3.86Å; Y879-Y885 HydrophobicContact CE1-CD2 3.86Å; Y879-Y885 HydrophobicContact CE1-CE2 4.2Å; Y879-Y885 VanDerWaalsContact O-CD2 3.25Å; Y879-Y885 WeakPolarHBondContact O-CD2 3.45Å; T880-Y885 HydrophobicContact CG2-CD1 4.25Å; T880-Y885 HydrophobicContact CG2-CE1 3.85Å; A882-Y885 WeakPolarHBondContact O-CB 3.37Å; A882-Y885 PolarHBondContact O-N 3.32Å; Y885-P887 HydrophobicContact CE1-CB 4.22Å
886	S	82.8	Confident	85.6	Confident	64 Å²	64	79.2 Å²	79.2	45%	0.448	45%	0.452	S	S	.	.			trans	-133.3	123.6	172.4	55.7	0	0	0	0	110.6	R837 G884	R837-S886 PolarHBondContact NE-O 3.3Å; R837-S886 PolarHBondContact NH2-O 3.35Å; G884-S886 PolarHBondContact O-N 3.27Å
887	P	84.6	Confident	84	Confident	90 Å²	90	85.8 Å²	85.8	58%	0.584	48%	0.48	S	S	*	.			trans	-64	154.1	-175.8	26.3	-34.8	0	0	0	112.3	R837 Y885 S889	R837-P887 PolarHBondContact NH2-O 3.07Å; Y885-P887 HydrophobicContact CE1-CB 4.22Å; P887-S889 PolarHBondContact O-N 3.43Å; P887-S889 VanDerWaalsContact O-N 3.15Å
888	L	88.4	Confident	81.8	Confident	2 Å²	2	88.4 Å²	88.4	1%	0.01	50%	0.495	C	S	.	.			trans	-76.7	102.1	-179.4	-176.6	50.5	0	0	0	111	L761 L764 E835 R837 F838 T842 I890	L761-L888 HydrophobicContact CD1-CD2 3.81Å; L761-L888 HydrophobicContact CD1-CG 4.37Å; L764-L888 HydrophobicContact CD1-CD1 3.71Å; L764-L888 HydrophobicContact CD1-CD2 4.25Å; E835-L888 HydrophobicContact CG-CD2 4.39Å; R837-L888 HydrophobicContact CB-CB 4.07Å; F838-L888 HydrophobicContact CD2-CD2 4.34Å; T842-L888 HydrophobicContact CG2-CB 4.49Å; T842-L888 HydrophobicContact CG2-CD2 4.29Å; T842-L888 HydrophobicContact CG2-CG 4.49Å; L888-I890 PolarHBondContact O-N 2.9Å
889	S	88	Confident	79.7	Confident	51 Å²	51	90.4 Å²	90.4	36%	0.357	51%	0.508	S	S	.	.			trans	-71.8	115.7	173.2	173.4	0	0	0	0	111.1	P887 T891 A892	P887-S889 PolarHBondContact O-N 3.43Å; P887-S889 VanDerWaalsContact O-N 3.15Å; S889-T891 PolarHBondContact O-N 3.17Å; S889-T891 PolarHBondContact OG-OG1 3.2Å; S889-A892 PolarHBondContact O-N 3.35Å; S889-A892 PolarHBondContact OG-N 3.06Å
890	I	90.3	Very high	77	Confident	51 Å²	51	88.9 Å²	88.9	26%	0.262	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-20.1	179.6	59.6	159.9	0	0	0	113.4	L761 T842 M845 L846 L888	L761-I890 HydrophobicContact CD2-CB 4.44Å; L761-I890 HydrophobicContact CD2-CG2 4.3Å; T842-I890 HydrophobicContact CG2-CG2 4.22Å; M845-I890 HydrophobicContact CB-CD1 4.05Å; M845-I890 HydrophobicContact CE-CG2 4.36Å; L846-I890 HydrophobicContact CD1-CG2 4.34Å; L846-I890 HydrophobicContact CD2-CB 4.02Å; L846-I890 HydrophobicContact CD2-CD1 4.26Å; L846-I890 HydrophobicContact CD2-CG2 3.72Å; L846-I890 HydrophobicContact CG-CG2 3.93Å; L888-I890 PolarHBondContact O-N 2.9Å
891	T	88.8	Confident	74.8	Confident	113 Å²	113	94.6 Å²	94.6	69%	0.693	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-6.8	179.3	51.5	0	0	0	0	113.6	S889 K893	S889-T891 PolarHBondContact O-N 3.17Å; S889-T891 PolarHBondContact OG-OG1 3.2Å; T891-K893 PolarHBondContact O-N 3.05Å
892	A	90.1	Very high	72.5	Confident	24 Å²	24	94 Å²	94	20%	0.198	55%	0.549	C	S	.	.			trans	-61.5	135.6	-178.7	0	0	0	0	0	112.1	Q760 S889	Q760-A892 HydrophobicContact CB-CB 4.12Å; Q760-A892 WeakPolarHBondContact CB-O 3.43Å; Q760-A892 PolarHBondContact N-O 2.73Å; S889-A892 PolarHBondContact O-N 3.35Å; S889-A892 PolarHBondContact OG-N 3.06Å
893	K	91.7	Very high	70	Confident	157 Å²	157	97.8 Å²	97.8	68%	0.683	56%	0.558	S	S	*	*	B	Isolated β-bridge	trans	-107.6	134.4	178.2	-66.6	178.5	-177.8	174.4	0	110.9	T758 T891 K895	T758-K893 CarbonylContact O-C 3.55Å; T758-K893 WeakPolarHBondContact O-CA 3.36Å; T891-K893 PolarHBondContact O-N 3.05Å; K893-K895 PolarHBondContact O-N 3.05Å
894	V	86.3	Confident	68.3	Low	35 Å²	35	97.8 Å²	97.8	21%	0.212	54%	0.541	C	S	.	.	P	Polyproline II helix	trans	-68.1	117.3	172.5	-177.5	0	0	0	0	108.5	V749 L753 T758 Q760 H763	V749-V894 HydrophobicContact CG1-CG1 3.82Å; L753-V894 HydrophobicContact CD2-CB 4.4Å; T758-V894 PolarHBondContact O-N 3.41Å; Q760-V894 HydrophobicContact CB-CG2 4.1Å; Q760-V894 HydrophobicContact CG-CG2 4.49Å; H763-V894 HydrophobicContact CB-CG2 4.39Å
895	K	74.8	Confident	66.4	Low	184 Å²	184	99.4 Å²	99.4	80%	0.8	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-83.1	137.8	171.7	-65.4	-178.6	179.7	179.1	0	109	K893 K897	K893-K895 PolarHBondContact O-N 3.05Å; K895-K897 PolarHBondContact O-N 2.85Å
896	P	67.7	Low	64	Low	96 Å²	96	101.4 Å²	101.4	62%	0.623	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-61.3	137.9	171	26.4	-33.4	0	0	0	110	L753 K898	L753-P896 HydrophobicContact CD1-CB 4.13Å; P896-K898 PolarHBondContact O-N 2.96Å
897	K	58	Low	61.9	Low	148 Å²	148	104 Å²	104	64%	0.643	56%	0.559	S	S	*	*			trans	-63.2	100.8	172.1	-63.9	174.2	-178.4	172.8	0	108.4	K895 L899 D917	K895-K897 PolarHBondContact O-N 2.85Å; K897-L899 PolarHBondContact O-N 3.13Å; K897-L899 VanDerWaalsContact O-N 3.08Å; K897-D917 IonicContact NZ-OD1 3.92Å; K897-D917 PolarHBondContact NZ-OD1 3.09Å; K897-D917 IonicContact NZ-OD2 2.95Å; K897-D917 PolarHBondContact NZ-OD2 3.41Å
898	K	44.6	Very low	59.8	Low	165 Å²	165	111.3 Å²	111.3	72%	0.717	58%	0.575	S	S	*	*			trans	-59.9	113.4	164.7	-80.5	-161.6	-179.6	-169.8	0	106.5	E318 P896 G900	E318-K898 IonicContact OE1-NZ 2.72Å; E318-K898 PolarHBondContact OE1-NZ 2.85Å; E318-K898 VanDerWaalsContact OE1-NZ 3.15Å; P896-K898 PolarHBondContact O-N 2.96Å; K898-G900 PolarHBondContact O-N 3.34Å
899	L	44.9	Very low	57.5	Low	149 Å²	149	122.5 Å²	122.5	78%	0.78	62%	0.617	S	S	*	*			trans	-67.9	101.4	178.4	-78.9	168.9	0	0	0	109.4	K897	K897-L899 PolarHBondContact O-N 3.13Å; K897-L899 VanDerWaalsContact O-N 3.08Å
900	G	31	Very low	54.9	Low	51 Å²	51	127 Å²	127	53%	0.526	63%	0.626	S	S	.	*			trans	-65	137.1	177.3	0	0	0	0	0	111.8	K898 S902 Q903	K898-G900 PolarHBondContact O-N 3.34Å; G900-S902 PolarHBondContact O-N 3.2Å; G900-Q903 PolarHBondContact O-N 3.33Å
901	F	42.6	Very low	52.2	Low	174 Å²	174	134.8 Å²	134.8	76%	0.763	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-54.5	-20.4	-174.5	-72	-88.3	0	0	0	115	Q903 L904	F901-Q903 PolarHBondContact O-N 3.37Å; F901-Q903 VanDerWaalsContact O-N 3.08Å; F901-L904 HydrophobicContact CD1-CD1 4.12Å; F901-L904 PolarHBondContact O-N 3.26Å
902	S	38.3	Very low	49.6	Very low	118 Å²	118	135.8 Å²	135.8	83%	0.825	66%	0.661	S	S	*	*	G	3₁₀ helix	trans	-63	-10.8	-178.9	-46.9	0	0	0	0	115.9	G900	G900-S902 PolarHBondContact O-N 3.2Å
903	Q	37.9	Very low	47.1	Very low	128 Å²	128	140.1 Å²	140.1	60%	0.598	68%	0.68	S	S	*	*	G	3₁₀ helix	trans	-92.7	-0.7	177.7	-65.9	-161.4	-3.4	0	0	115	G900 F901 T905 N906 L907	G900-Q903 PolarHBondContact O-N 3.33Å; F901-Q903 PolarHBondContact O-N 3.37Å; F901-Q903 VanDerWaalsContact O-N 3.08Å; Q903-T905 PolarHBondContact O-N 3.25Å; Q903-T905 VanDerWaalsContact O-N 3.12Å; Q903-N906 PolarHBondContact O-N 3.25Å; Q903-L907 PolarHBondContact O-N 3.18Å
904	L	39.6	Very low	44.5	Very low	112 Å²	112	137.1 Å²	137.1	59%	0.586	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	-24.7	-177.2	-97	158.1	0	0	0	115	F901 L907	F901-L904 HydrophobicContact CD1-CD1 4.12Å; F901-L904 PolarHBondContact O-N 3.26Å; L904-L907 HydrophobicContact CD2-CD1 4.27Å
905	T	39.4	Very low	42.7	Very low	114 Å²	114	139.2 Å²	139.2	70%	0.699	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-31.4	175.9	47.4	0	0	0	0	113.3	Q903	Q903-T905 PolarHBondContact O-N 3.25Å; Q903-T905 VanDerWaalsContact O-N 3.12Å
906	N	35	Very low	41.4	Very low	104 Å²	104	135.4 Å²	135.4	56%	0.556	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-23.7	-178.3	-73.7	-24	0	0	0	113	Q903 R908 R909 R910	Q903-N906 PolarHBondContact O-N 3.25Å; N906-R908 PolarHBondContact O-N 3.02Å; N906-R908 VanDerWaalsContact O-N 3.16Å; N906-R909 PolarHBondContact O-N 3.11Å; N906-R910 PolarHBondContact O-N 3.19Å
907	L	37.3	Very low	41.4	Very low	119 Å²	119	134.7 Å²	134.7	62%	0.623	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-22.4	178.4	-72.9	174.8	0	0	0	113.4	Q903 L904 R909	Q903-L907 PolarHBondContact O-N 3.18Å; L904-L907 HydrophobicContact CD2-CD1 4.27Å; L907-R909 PolarHBondContact O-N 3.22Å
908	R	41.1	Very low	42.7	Very low	242 Å²	242	130.6 Å²	130.6	91%	0.913	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	1.7	179	-138.7	174	-168.3	163.3	3.9	114.5	N906	N906-R908 PolarHBondContact O-N 3.02Å; N906-R908 VanDerWaalsContact O-N 3.16Å
909	R	40.5	Very low	44.6	Very low	237 Å²	237	123.6 Å²	123.6	89%	0.894	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.1	-16.5	177.3	-98.6	-172.6	176.3	-176.8	-0.1	116.4	N906 L907	N906-R909 PolarHBondContact O-N 3.11Å; L907-R909 PolarHBondContact O-N 3.22Å
910	R	34.1	Very low	46.6	Very low	146 Å²	146	116.6 Å²	116.6	55%	0.551	58%	0.584	S	S	*	*			trans	-76.2	133.3	178	-74.9	-170.8	160.2	-118.2	-22.2	111.7	N906 E914	N906-R910 PolarHBondContact O-N 3.19Å; R910-E914 VanDerWaalsContact CD-OE2 3.26Å; R910-E914 WeakPolarHBondContact CD-OE2 3.44Å; R910-E914 VanDerWaalsContact CG-OE2 3.29Å; R910-E914 WeakPolarHBondContact CG-OE2 3.32Å; R910-E914 IonicContact CZ-OE1 2.73Å; R910-E914 IonicContact CZ-OE2 3.76Å; R910-E914 IonicContact NE-OE1 2.8Å; R910-E914 IonicContact NE-OE2 3.77Å; R910-E914 PolarHBondContact NE-OE2 3.32Å; R910-E914 IonicContact NH1-OE1 3.15Å; R910-E914 PolarHBondContact NH1-OE1 3.41Å; R910-E914 IonicContact NH1-OE2 3.57Å; R910-E914 PolarHBondContact NH1-OE2 3.12Å; R910-E914 IonicContact NH2-OE1 3.5Å; R910-E914 PolarHBondContact NH2-OE1 3.49Å; R910-E914 IonicContact NH2-OE2 2.77Å
911	R	32.2	Very low	48.9	Very low	214 Å²	214	116.6 Å²	116.6	81%	0.808	57%	0.574	S	S	*	*			trans	-78.6	158.1	170.9	-73.1	-79.9	-173.4	153.9	1	109.3	D913	R911-D913 PolarHBondContact O-N 3.42Å
912	P	34.2	Very low	50.1	Low	135 Å²	135	111.5 Å²	111.5	88%	0.877	55%	0.554	S	S	*	*	S	Bend	trans	-71.3	18.5	-176.5	-19.6	34.2	0	0	0	116.6
913	D	37.7	Very low	50.7	Low	114 Å²	114	111.5 Å²	111.5	61%	0.61	54%	0.542	S	S	*	.			trans	-143.5	67.4	-165.2	-146.5	59.6	0	0	0	109.4	K700 R911	K700-D913 IonicContact NZ-OD1 3.17Å; K700-D913 PolarHBondContact NZ-OD1 2.96Å; R911-D913 PolarHBondContact O-N 3.42Å
914	E	37.6	Very low	50.6	Low	94 Å²	94	110.9 Å²	110.9	44%	0.439	55%	0.547	S	S	.	.			trans	-122.6	127.8	169.9	-84	-176.7	83.5	0	0	110.1	R910 T916	R910-E914 VanDerWaalsContact CD-OE2 3.26Å; R910-E914 WeakPolarHBondContact CD-OE2 3.44Å; R910-E914 VanDerWaalsContact CG-OE2 3.29Å; R910-E914 WeakPolarHBondContact CG-OE2 3.32Å; R910-E914 IonicContact CZ-OE1 2.73Å; R910-E914 IonicContact CZ-OE2 3.76Å; R910-E914 IonicContact NE-OE1 2.8Å; R910-E914 IonicContact NE-OE2 3.77Å; R910-E914 PolarHBondContact NE-OE2 3.32Å; R910-E914 IonicContact NH1-OE1 3.15Å; R910-E914 PolarHBondContact NH1-OE1 3.41Å; R910-E914 IonicContact NH1-OE2 3.57Å; R910-E914 PolarHBondContact NH1-OE2 3.12Å; R910-E914 IonicContact NH2-OE1 3.5Å; R910-E914 PolarHBondContact NH2-OE1 3.49Å; R910-E914 IonicContact NH2-OE2 2.77Å; E914-T916 VanDerWaalsContact C-N 3.31Å; E914-T916 PolarHBondContact O-N 3.1Å; E914-T916 VanDerWaalsContact O-N 3.15Å
915	S	47.9	Very low	50.1	Low	80 Å²	80	111.1 Å²	111.1	56%	0.559	56%	0.557	S	S	*	*			trans	-86.2	23.2	-158.4	44.6	0	0	0	0	115.9	Y918	S915-Y918 VanDerWaalsContact O-CD2 3.26Å; S915-Y918 WeakPolarHBondContact O-CD2 3.35Å
916	T	48.7	Very low	49.3	Very low	103 Å²	103	110.1 Å²	110.1	63%	0.632	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-2.5	-160.7	55.5	0	0	0	0	116.8	E914	E914-T916 VanDerWaalsContact C-N 3.31Å; E914-T916 PolarHBondContact O-N 3.1Å; E914-T916 VanDerWaalsContact O-N 3.15Å
917	D	67.7	Low	49.1	Very low	82 Å²	82	111.3 Å²	111.3	44%	0.439	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	-118.8	16.9	-177.6	-113.9	-31.9	0	0	0	113.7	T748 K897	T748-D917 WeakPolarHBondContact CA-O 3.42Å; T748-D917 VanDerWaalsContact CB-O 3.31Å; T748-D917 WeakPolarHBondContact CB-O 3.35Å; K897-D917 IonicContact NZ-OD1 3.92Å; K897-D917 PolarHBondContact NZ-OD1 3.09Å; K897-D917 IonicContact NZ-OD2 2.95Å; K897-D917 PolarHBondContact NZ-OD2 3.41Å
918	Y	84.9	Confident	48.9	Very low	62 Å²	62	114 Å²	114	24%	0.243	58%	0.578	C	S	.	*	B	Isolated β-bridge	trans	-72.9	147	173	-61.4	-51.8	0	0	0	112.3	Y746 L747 T748 S915 C920	Y746-Y918 AromaticContact CD1-CE1 3.88Å; Y746-Y918 HydrophobicContact CD1-CE1 3.88Å; Y746-Y918 HydrophobicContact CD1-CE2 4.08Å; Y746-Y918 AromaticContact CD1-CZ 3.63Å; Y746-Y918 HydrophobicContact CG-CE1 4.44Å; Y746-Y918 WeakPolarHBondContact O-CD1 3.34Å; Y746-Y918 WeakPolarHBondContact O-CE1 3.47Å; L747-Y918 CarbonylContact O-C 3.18Å; L747-Y918 WeakPolarHBondContact O-CA 3.44Å; T748-Y918 HydrophobicContact CG2-CD1 4.03Å; T748-Y918 HydrophobicContact CG2-CE1 4.41Å; S915-Y918 VanDerWaalsContact O-CD2 3.26Å; S915-Y918 WeakPolarHBondContact O-CD2 3.35Å; Y918-C920 VanDerWaalsContact C-N 3.34Å; Y918-C920 PolarHBondContact O-N 2.69Å
919	V	84.2	Confident	48.2	Very low	17 Å²	17	108 Å²	108	10%	0.103	57%	0.573	C	S	.	*	S	Bend	trans	-63.4	-38.9	-179.3	172.9	0	0	0	0	111.9	L747 T748 L752 I766 K767 I770	L747-V919 HydrophobicContact CB-CG2 4.23Å; L747-V919 WeakPolarHBondContact O-CG2 3.33Å; L747-V919 PolarHBondContact O-N 3.05Å; T748-V919 VanDerWaalsContact C-CG2 3.47Å; L752-V919 HydrophobicContact CD1-CG1 4.08Å; L752-V919 HydrophobicContact CD1-CG2 3.58Å; L752-V919 HydrophobicContact CG-CG2 4Å; I766-V919 HydrophobicContact CG2-CG1 4.42Å; K767-V919 HydrophobicContact CB-CG1 3.97Å; K767-V919 WeakPolarHBondContact CG-O 3.48Å; I770-V919 HydrophobicContact CD1-CG1 4.42Å
920	C	87.4	Confident	47.9	Very low	3 Å²	3	100.7 Å²	100.7	2%	0.02	57%	0.572	C	S	.	*	S	Bend	trans	-135	95	171.3	-178.6	0	0	0	0	108.2	K767 I770 Y918	K767-C920 HydrophobicContact CG-CB 4.48Å; I770-C920 HydrophobicContact CB-CB 4.02Å; I770-C920 HydrophobicContact CG2-CB 3.72Å; Y918-C920 VanDerWaalsContact C-N 3.34Å; Y918-C920 PolarHBondContact O-N 2.69Å
921	P	78.1	Confident	47.6	Very low	50 Å²	50	103.1 Å²	103.1	33%	0.325	59%	0.589	S	S	.	*			trans	-57.1	147.6	177.7	-25.5	35.7	0	0	0	112.5
922	I	67.8	Low	47.4	Very low	67 Å²	67	98.3 Å²	98.3	34%	0.344	59%	0.589	S	S	.	*			trans	-83.4	118	174.6	-49.2	167.1	0	0	0	108.1	Q745 Y746 T924	Q745-I922 VanDerWaalsContact CD-CD1 3.45Å; Q745-I922 HydrophobicContact CG-CD1 3.61Å; Q745-I922 HydrophobicContact CG-CG1 3.94Å; Y746-I922 HydrophobicContact CE1-CD1 4.05Å; I922-T924 HydrophobicContact CG2-CG2 4.18Å; I922-T924 PolarHBondContact O-N 3.46Å
923	E	52.3	Low	47.1	Very low	119 Å²	119	101.1 Å²	101.1	56%	0.556	59%	0.593	S	S	*	*			trans	-77	87.9	170.8	-64.9	-163.6	142.5	0	0	110.4	S925 Y942	E923-S925 PolarHBondContact O-N 3.31Å; E923-S925 VanDerWaalsContact O-N 3.14Å; E923-Y942 HydrophobicContact CG-CD2 4.39Å
924	T	35.4	Very low	46.6	Very low	115 Å²	115	99.7 Å²	99.7	71%	0.706	60%	0.597	S	S	*	*			trans	-75	96.9	168.9	53.1	0	0	0	0	109.5	I922 S926	I922-T924 HydrophobicContact CG2-CG2 4.18Å; I922-T924 PolarHBondContact O-N 3.46Å; T924-S926 PolarHBondContact O-N 3.13Å
925	S	27.9	Very low	46.2	Very low	116 Å²	116	103.3 Å²	103.3	81%	0.811	62%	0.619	S	S	*	*			trans	-63.6	92.5	173.1	59.6	0	0	0	0	111	E923 P927	E923-S925 PolarHBondContact O-N 3.31Å; E923-S925 VanDerWaalsContact O-N 3.14Å; S925-P927 WeakPolarHBondContact O-CD 3.22Å
926	S	23.2	Very low	45.1	Very low	93 Å²	93	102.7 Å²	102.7	65%	0.65	63%	0.625	S	S	*	*			trans	-83.5	112.3	175	52.7	0	0	0	0	110.3	T924 E928	T924-S926 PolarHBondContact O-N 3.13Å; S926-E928 PolarHBondContact O-N 2.88Å
927	P	31	Very low	44.2	Very low	129 Å²	129	105 Å²	105	84%	0.838	64%	0.638	S	S	*	*			trans	-84.7	44	-170.8	36.9	-37.7	0	0	0	113	S925	S925-P927 WeakPolarHBondContact O-CD 3.22Å
928	E	32.8	Very low	42.1	Very low	176 Å²	176	109.8 Å²	109.8	82%	0.822	66%	0.658	S	S	*	*			trans	-156.2	76	-169.9	-137.5	166.9	-112.6	0	0	113.7	S926	S926-E928 PolarHBondContact O-N 2.88Å
929	S	27.5	Very low	39.3	Very low	115 Å²	115	114.2 Å²	114.2	80%	0.804	68%	0.683	S	S	*	*			trans	179.8	81.8	150.4	35.2	0	0	0	0	112.1	Q931	S929-Q931 PolarHBondContact O-N 3.42Å
930	G	33.8	Very low	36.6	Very low	85 Å²	85	117.4 Å²	117.4	88%	0.876	71%	0.705	S	S	*	*			trans	-79.2	97.4	171.8	0	0	0	0	0	112.2
931	Q	28	Very low	34	Very low	196 Å²	196	122.3 Å²	122.3	92%	0.916	74%	0.737	S	S	*	*			trans	-138	134.2	164.2	-96.3	178.4	13.6	0	0	111.3	S929	S929-Q931 PolarHBondContact O-N 3.42Å
932	S	27.6	Very low	32.3	Very low	113 Å²	113	122.7 Å²	122.7	79%	0.79	73%	0.733	S	S	*	*			trans	-83.8	135.8	-175.1	-179.2	0	0	0	0	111.9
933	M	26.5	Very low	30.6	Very low	195 Å²	195	122.9 Å²	122.9	96%	0.961	74%	0.744	S	S	*	*			trans	-133.8	136.3	153.5	-75.2	-162.9	165.9	0	0	109.2
934	A	28.8	Very low	30.1	Very low	84 Å²	84	119 Å²	119	69%	0.694	74%	0.736	S	S	*	*			trans	-102.1	157.5	-173.1	0	0	0	0	0	112.3
935	N	27.9	Very low	30.4	Very low	170 Å²	170	114.3 Å²	114.3	91%	0.909	71%	0.706	S	S	*	*			trans	60.3	100.6	169.7	-64.3	-7.2	0	0	0	116.8
936	G	25.2	Very low	31	Very low	67 Å²	67	119.3 Å²	119.3	69%	0.691	71%	0.707	S	S	*	*			trans	162.8	124	169.2	0	0	0	0	0	109.5	Q938	G936-Q938 PolarHBondContact O-N 3.15Å
937	V	29.4	Very low	31.7	Very low	150 Å²	150	117.4 Å²	117.4	91%	0.909	70%	0.701	S	S	*	*			trans	-72	94.7	-175.4	-179.2	0	0	0	0	110	M939	V937-M939 PolarHBondContact O-N 2.98Å
938	Q	23.4	Very low	32	Very low	184 Å²	184	114.1 Å²	114.1	86%	0.86	68%	0.677	S	S	*	*			trans	-79.5	112	171.3	-76.3	-171.2	-20	0	0	110.7	G936 C940	G936-Q938 PolarHBondContact O-N 3.15Å; Q938-C940 PolarHBondContact O-N 3.47Å; Q938-C940 VanDerWaalsContact O-N 3.09Å
939	M	27.9	Very low	31.8	Very low	154 Å²	154	110.3 Å²	110.3	76%	0.759	67%	0.67	S	S	*	*			trans	-67	99.9	161.7	-85.8	-73.6	-178.5	0	0	109.4	V937 P941	V937-M939 PolarHBondContact O-N 2.98Å; M939-P941 WeakPolarHBondContact O-CD 3.45Å
940	C	27.2	Very low	31.9	Very low	84 Å²	84	109.4 Å²	109.4	57%	0.568	66%	0.661	S	S	*	*			trans	-69.2	122.2	170.8	-173	0	0	0	0	109.6	Q938 Y942	Q938-C940 PolarHBondContact O-N 3.47Å; Q938-C940 VanDerWaalsContact O-N 3.09Å; C940-Y942 VanDerWaalsContact C-N 3.32Å; C940-Y942 PolarHBondContact O-N 3.39Å
941	P	32.1	Very low	31.8	Very low	107 Å²	107	113.1 Å²	113.1	70%	0.695	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-25.7	-169.5	-26.1	36.2	0	0	0	116.2	M939	M939-P941 WeakPolarHBondContact O-CD 3.45Å
942	Y	43.4	Very low	31.8	Very low	58 Å²	58	110.8 Å²	110.8	23%	0.227	65%	0.652	C	S	.	*	T	Hydrogen-bonded Turn	trans	-134.5	47.9	-178.9	-62.8	-80	0	0	0	113.6	H771 E923 C940 G944	H771-Y942 AromaticContact CE1-CD1 3.66Å; H771-Y942 AromaticContact ND1-CD1 3.5Å; H771-Y942 AromaticContact ND1-CE1 3.74Å; E923-Y942 HydrophobicContact CG-CD2 4.39Å; C940-Y942 VanDerWaalsContact C-N 3.32Å; C940-Y942 PolarHBondContact O-N 3.39Å; Y942-G944 PolarHBondContact O-N 3.18Å
943	A	31.6	Very low	31.7	Very low	71 Å²	71	112.9 Å²	112.9	59%	0.587	65%	0.654	S	S	*	*			trans	-67.7	89.5	144.8	0	0	0	0	0	108.4
944	G	40.4	Very low	31.8	Very low	37 Å²	37	115 Å²	115	38%	0.381	65%	0.652	S	S	.	*			trans	-58.8	149.3	157.1	0	0	0	0	0	109	Y942 R946	Y942-G944 PolarHBondContact O-N 3.18Å; G944-R946 PolarHBondContact O-N 3.21Å
945	F	42	Very low	31.6	Very low	16 Å²	16	119.3 Å²	119.3	7%	0.07	66%	0.658	C	S	.	*			trans	-37.4	128.6	-172.9	-58.7	-85.2	0	0	0	112.1	M833 Q871 A872 E875 G947 L948	M833-F945 HydrophobicContact CB-CE2 4Å; M833-F945 HydrophobicContact CE-CD2 4.43Å; M833-F945 HydrophobicContact CE-CE2 4.34Å; M833-F945 WeakPolarHBondContact O-CE2 3.38Å; M833-F945 WeakPolarHBondContact O-CZ 3.31Å; Q871-F945 HydrophobicContact CG-CB 4.35Å; A872-F945 VanDerWaalsContact CA-CE1 3.42Å; A872-F945 HydrophobicContact CB-CD1 3.68Å; A872-F945 HydrophobicContact CB-CD2 4.41Å; A872-F945 HydrophobicContact CB-CE1 3.45Å; A872-F945 VanDerWaalsContact CB-CE1 3.45Å; A872-F945 HydrophobicContact CB-CE2 4.21Å; A872-F945 HydrophobicContact CB-CG 4.18Å; A872-F945 HydrophobicContact CB-CZ 3.74Å; E875-F945 HydrophobicContact CB-CD1 3.85Å; E875-F945 HydrophobicContact CB-CE1 3.92Å; E875-F945 HydrophobicContact CG-CD1 4.15Å; E875-F945 WeakPolarHBondContact OE2-CA 3.49Å; E875-F945 VanDerWaalsContact OE2-CD1 3.28Å; E875-F945 WeakPolarHBondContact OE2-CD1 3.46Å; F945-G947 PolarHBondContact O-N 2.91Å; F945-L948 HydrophobicContact CB-CD1 4.21Å; F945-L948 PolarHBondContact O-N 3.45Å; F945-L948 HydrophobicContact CG-CD1 4.45Å; F945-L948 HydrophobicContact CD2-CD1 3.77Å; F945-L948 HydrophobicContact CB-CG 4.19Å
946	R	42.1	Very low	31.7	Very low	222 Å²	222	117 Å²	117	84%	0.838	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	69	-167.3	-62.4	-179	177	-126.3	7.8	113.4	Q871 E875 G944	Q871-R946 VanDerWaalsContact NE2-CA 3.32Å; Q871-R946 PolarHBondContact NE2-O 3.37Å; E875-R946 PolarHBondContact OE1-N 3.04Å; E875-R946 VanDerWaalsContact OE1-N 3.12Å; G944-R946 PolarHBondContact O-N 3.21Å
947	G	37	Very low	31.8	Very low	52 Å²	52	120.7 Å²	120.7	54%	0.536	66%	0.661	S	S	.	*	T	Hydrogen-bonded Turn	trans	164.1	-21.1	-165.3	0	0	0	0	0	114.8	F945 S949	F945-G947 PolarHBondContact O-N 2.91Å; G947-S949 PolarHBondContact O-N 2.92Å
948	L	37.6	Very low	31.8	Very low	60 Å²	60	124.7 Å²	124.7	31%	0.314	66%	0.66	S	S	.	*			trans	-79.1	38.6	178.2	-64.6	-174.4	0	0	0	114.3	M833 F945	M833-L948 HydrophobicContact CE-CD1 4.49Å; F945-L948 HydrophobicContact CB-CD1 4.21Å; F945-L948 PolarHBondContact O-N 3.45Å; F945-L948 HydrophobicContact CG-CD1 4.45Å; F945-L948 HydrophobicContact CD2-CD1 3.77Å; F945-L948 HydrophobicContact CB-CG 4.19Å
949	S	29.5	Very low	32.2	Very low	97 Å²	97	123.4 Å²	123.4	68%	0.678	66%	0.659	S	S	*	*			trans	-72.7	130.7	169.9	-64	0	0	0	0	110.3	G947 I951	G947-S949 PolarHBondContact O-N 2.92Å; S949-I951 PolarHBondContact O-N 3.23Å
950	P	29.1	Very low	32.2	Very low	96 Å²	96	125.4 Å²	125.4	62%	0.623	67%	0.666	S	S	*	*			trans	-60.8	123.6	170	-21.8	33.3	0	0	0	110.4	L952	P950-L952 PolarHBondContact O-N 2.96Å
951	I	31.3	Very low	32.3	Very low	162 Å²	162	128.4 Å²	128.4	83%	0.831	68%	0.682	S	S	*	*			trans	-70.9	113	172.9	-61.1	173.7	0	0	0	108	S949	S949-I951 PolarHBondContact O-N 3.23Å
952	L	27.7	Very low	32.1	Very low	147 Å²	147	126.3 Å²	126.3	77%	0.77	68%	0.679	S	S	*	*			trans	-130.1	129.9	163.8	-69.2	175.3	0	0	0	108	P950	P950-L952 PolarHBondContact O-N 2.96Å
953	D	26.2	Very low	31.4	Very low	157 Å²	157	132.5 Å²	132.5	84%	0.84	71%	0.71	S	S	*	*			trans	41.4	93.9	171.1	-55.8	-24.2	0	0	0	117.7
954	R	27.8	Very low	31.2	Very low	241 Å²	241	138.3 Å²	138.3	91%	0.909	72%	0.722	S	S	*	*			trans	-109.9	84.7	160.8	-168.9	177.1	-170	163.1	4.3	109.9
955	E	25.7	Very low	30.7	Very low	174 Å²	174	145.1 Å²	145.1	81%	0.813	74%	0.744	S	S	*	*			trans	-63.4	144.8	167.6	-76.2	-158.3	132.4	0	0	111.2	T957	E955-T957 PolarHBondContact O-N 3.38Å
956	P	29.3	Very low	30	Very low	122 Å²	122	150 Å²	150	79%	0.792	78%	0.78	S	S	*	*			trans	-87	101.6	177.8	33.5	-32.5	0	0	0	111.3	R958	P956-R958 PolarHBondContact O-N 3.29Å
957	T	26.9	Very low	29.6	Very low	143 Å²	143	148.4 Å²	148.4	88%	0.877	78%	0.779	S	S	*	*			trans	-65.4	115	168.2	41.3	0	0	0	0	110.7	E955	E955-T957 PolarHBondContact O-N 3.38Å
958	R	29.7	Very low	29.3	Very low	234 Å²	234	150.6 Å²	150.6	88%	0.883	79%	0.792	S	S	*	*			trans	-62.2	155.4	173.2	-80	174.7	159.1	162.2	-6.8	112.8	P956	P956-R958 PolarHBondContact O-N 3.29Å
959	D	30.9	Very low	29.5	Very low	157 Å²	157	154.5 Å²	154.5	84%	0.84	81%	0.813	S	S	*	*			trans	-54.2	144.7	170.1	-51.6	-88.9	0	0	0	113
960	Q	29.7	Very low	29.6	Very low	196 Å²	196	156.6 Å²	156.6	92%	0.916	82%	0.823	S	S	*	*			trans	-133.7	137.1	146.2	-79.8	-161.6	74.7	0	0	111.5
961	V	29.3	Very low	29.8	Very low	148 Å²	148	156.8 Å²	156.8	90%	0.897	83%	0.826	S	S	*	*			trans	-55.6	131	-179.3	179	0	0	0	0	111.1
962	G	27.1	Very low	31	Very low	62 Å²	62	158.8 Å²	158.8	64%	0.639	85%	0.85	S	S	*	*			trans	-84.8	-174.5	-179.4	0	0	0	0	0	114.6
963	H	27.7	Very low	31.2	Very low	188 Å²	188	159.4 Å²	159.4	87%	0.87	85%	0.854	S	S	*	*			trans	-141.3	151.6	170.2	-124.7	-101.7	0	0	0	112.5
964	K	28.9	Very low	31.5	Very low	193 Å²	193	159.5 Å²	159.5	84%	0.839	85%	0.854	S	S	*	*			trans	-59.5	137	-163.4	-57.9	167.6	-179.2	176	0	114.9
965	E	28.6	Very low	31.7	Very low	181 Å²	181	155 Å²	155	85%	0.846	85%	0.851	S	S	*	*			trans	-79.2	152.6	149.5	-68.6	-170.7	132.9	0	0	110.8
966	S	28.4	Very low	32	Very low	119 Å²	119	153.9 Å²	153.9	83%	0.832	85%	0.854	S	S	*	*			trans	-129.7	114.6	164.8	57.1	0	0	0	0	109.2
967	K	33.8	Very low	32.2	Very low	187 Å²	187	155.9 Å²	155.9	81%	0.813	86%	0.857	S	S	*	*			trans	-73.1	156.4	175.6	-71.7	-174.1	174.6	-175.3	0	112
968	A	30.8	Very low	32.6	Very low	99 Å²	99	156.7 Å²	156.7	82%	0.818	86%	0.856	S	S	*	*			trans	-123.1	149.1	148	0	0	0	0	0	107.4
969	D	40.7	Very low	32.8	Very low	141 Å²	141	151.2 Å²	151.2	75%	0.754	85%	0.854	S	S	*	*			trans	-88.3	158.2	-154.9	-57.3	-72.5	0	0	0	116.1
970	T	32.2	Very low	32.9	Very low	142 Å²	142	150.8 Å²	150.8	87%	0.871	86%	0.855	S	S	*	*			trans	-157.6	150.3	134.9	-5.3	0	0	0	0	111.6
971	S	33.5	Very low	33.2	Very low	100 Å²	100	147 Å²	147	70%	0.699	85%	0.85	S	S	*	*			trans	-147.8	176.3	172	-44.6	0	0	0	0	106
972	P	56.9	Low	33.5	Very low	204 Å²	204	146.9 Å²	146.9	100%	1.325	85%	0.846	S	S	*	*			cis	-83.3	0	30.3	-14.5	32.4	0	0	0	115.5

Retrieved 972 of 972 residues in 705.1 ms (Link to these results)

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