A0A093I8K7_STRCA Loading...

Ankyrin repeat and BTB/POZ domain-containing protein 2

May be involved in the initiation of hepatocyte growth.

AlphaFold DB , UniProt , Accession A0A093I8K7, Species STRCA (Struthio camelus australis), Gene n/a, Length 1,017 aa.

						>A0A093I8K7_STRCA|A0A093I8K7
MAGIYSSTLKTLEDLTLDSGYGAGDSCRSLSLSSSKSNSQAFTSSQHRGNWWYYSGSMNSRNNSWDTVNTVLPEDPEVADIFSKCPKLPDLEEYPWTDEDIGKILRKGQGDGNTRTFTQEAVRRLSQLLRRALIRISREAQRLSVMHSKCTRFEVQSAIKLIQSWSLSESCVLATVKALSLYSMSAGDGLRKGKSARCGLTFSVGRFFRWMVDTRISVRIHEYAAISLTSCMENLVEEIKARVLASQSPDGGGGEISAEILEMVINNDAELWGVLQPYEHLICGKNANGVLSLPAYFSPYNDGSVCSDGRADAYAQLELRTLEQSLLATCVGSISELSDLVSRAMHHMQCLNTLRPGMSPVRQTRQQQPISWSPDALHTLYYFLRCPQMESMENPNLDPPRMTLNNERPFMLLPPLMEWMRVAITYAEHRRSLTVDSDDIRQTARLLLPGLDCEPRQLKPECCFSSFRRLDAKAATEKFQQDLGFRMLNCGRTDLINQAIDALGPDGVNTMDDQGMTPLMYACAAGDEAMVQMLIDAGANLDIPVPSTSPRYPSVHPDSRHWTALTLAVLHGHISVVQLLLDAGAHVEGSAVNSGEDNYAETPLQLASAAGNYELVSLLLSRGADPLLSMLEVNGMSSSLHEDMNCFSHSAAHGHRNVLRKLLTQPQQLKGDVLSLEEILAEGVESDTSSQGSSSEGQVRLCKTRMKALQEAMYYSAEHGYVDITMELRSLGVPWKLHVWIESLRTTFYQSRYSVVQTLLREFVTIKEEDYNEELVNEGLQLMFDILKTSKNDSINQQLASIFTHCYGNSPIPSIPEIRKTLPARLDPHFLNNKEMSDVTFLVEGKLFYAHKVLLVTASNRFKTLMTNKTEQDSQGSKTVEISDMKYSIFKMLMQYLYYGGTESMEIPTTDILELLSAASLFQLDGLQRHCEILCAETISMENSVNIYKYAKIHNAPELASFCEGFFLKHMSSLLEQDSFKQLIYSRNSKVQGLDPLRDLQTALAGRLHSVYVTSRV
					

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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	30.2	Very low	28.9	Very low	251 Å²	251	136.5 Å²	136.5	100%	1.236	78%	0.775	S	S	*	*				0	105.6	0	-72.7	-165.7	-149.5	0	0	107.1
2	A	29.2	Very low	30.3	Very low	111 Å²	111	127.9 Å²	127.9	92%	0.917	73%	0.725	S	S	*	*			trans	-92.2	144.5	175.8	0	0	0	0	0	108.5
3	G	28.8	Very low	30.5	Very low	69 Å²	69	127.6 Å²	127.6	71%	0.711	71%	0.714	S	S	*	*			trans	131.6	132	168.8	0	0	0	0	0	113.3
4	I	25.9	Very low	31	Very low	158 Å²	158	128.6 Å²	128.6	81%	0.81	72%	0.717	S	S	*	*			trans	85.9	70	169.3	-40.9	163.4	0	0	0	114.5
5	Y	25	Very low	31.6	Very low	235 Å²	235	121.3 Å²	121.3	92%	0.922	68%	0.676	S	S	*	*			trans	-163	72.6	135.4	-87.6	-69.6	0	0	0	107
6	S	26.4	Very low	31.8	Very low	107 Å²	107	117.3 Å²	117.3	75%	0.748	66%	0.656	S	S	*	*			trans	-113.8	78.8	159.9	164.8	0	0	0	0	105.4	T8	S6-T8 VanDerWaalsContact C-N 3.34Å; S6-T8 PolarHBondContact O-N 3.14Å
7	S	24.6	Very low	32.1	Very low	102 Å²	102	114.5 Å²	114.5	71%	0.713	64%	0.639	S	S	*	*			trans	-71.1	102.7	156.4	51.4	0	0	0	0	105.5	L9	S7-L9 PolarHBondContact O-N 2.82Å
8	T	28.2	Very low	32.1	Very low	118 Å²	118	117.1 Å²	117.1	72%	0.724	65%	0.651	S	S	*	*			trans	-47.5	109.9	162.4	41.9	0	0	0	0	107.5	S6 K10	S6-T8 VanDerWaalsContact C-N 3.34Å; S6-T8 PolarHBondContact O-N 3.14Å; T8-K10 PolarHBondContact O-N 2.89Å
9	L	30.6	Very low	32	Very low	125 Å²	125	114.8 Å²	114.8	65%	0.654	64%	0.644	S	S	*	*			trans	-49.9	118.4	173.9	-81.8	146.5	0	0	0	108.1	S7 T11	S7-L9 PolarHBondContact O-N 2.82Å; L9-T11 HydrophobicContact CB-CG2 4.34Å; L9-T11 PolarHBondContact O-N 2.68Å
10	K	32.3	Very low	32.1	Very low	165 Å²	165	113.4 Å²	113.4	72%	0.717	66%	0.656	S	S	*	*			trans	-80.7	68.1	160.8	-72.2	-173.7	176.6	-174	0	107.8	T8	T8-K10 PolarHBondContact O-N 2.89Å
11	T	36.8	Very low	32.4	Very low	61 Å²	61	114.4 Å²	114.4	37%	0.374	65%	0.65	S	S	.	*			trans	-58.8	159.1	157.2	34	0	0	0	0	108.2	L9 E13	L9-T11 HydrophobicContact CB-CG2 4.34Å; L9-T11 PolarHBondContact O-N 2.68Å; T11-E13 PolarHBondContact O-N 3.35Å
12	L	45.2	Very low	32.3	Very low	33 Å²	33	105.6 Å²	105.6	17%	0.173	62%	0.623	C	S	.	*	S	Bend	trans	-67.1	46.6	179.3	-65	111.3	0	0	0	113.6	D14 L15 P89 L91 T214	L12-D14 PolarHBondContact O-N 3.27Å; L12-L15 HydrophobicContact CB-CB 4Å; L12-L15 HydrophobicContact CB-CD1 3.89Å; L12-L15 HydrophobicContact CB-CG 3.77Å; L12-L15 HydrophobicContact CD2-CD1 3.22Å; L12-L15 HydrophobicContact CD2-CD2 4.39Å; L12-L15 HydrophobicContact CD2-CG 3.48Å; L12-L15 VanDerWaalsContact CD2-CG 3.48Å; L12-L15 HydrophobicContact CG-CD1 4.08Å; L12-L15 HydrophobicContact CG-CG 4.22Å; L12-L15 WeakPolarHBondContact O-CB 3.36Å; L12-L15 PolarHBondContact O-N 3.24Å; L12-P89 HydrophobicContact CD2-CG 4.49Å; L12-L91 HydrophobicContact CD1-CD2 3.38Å; L12-L91 HydrophobicContact CD2-CD2 3.51Å; L12-L91 HydrophobicContact CD2-CG 4.28Å; L12-L91 HydrophobicContact CG-CD2 3.98Å; L12-T214 HydrophobicContact CD1-CG2 3.43Å; L12-T214 VanDerWaalsContact CD1-CG2 3.43Å
13	E	33.2	Very low	32.5	Very low	124 Å²	124	104.6 Å²	104.6	58%	0.579	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	-15.1	164.9	-65.6	-175.8	155.7	0	0	110.9	T11 T16	T11-E13 PolarHBondContact O-N 3.35Å; E13-T16 PolarHBondContact O-OG1 3.49Å
14	D	37.6	Very low	32.5	Very low	142 Å²	142	104.6 Å²	104.6	76%	0.759	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-0.7	169	-64	-27.1	0	0	0	113.7	L12	L12-D14 PolarHBondContact O-N 3.27Å
15	L	40.1	Very low	32.4	Very low	18 Å²	18	105.1 Å²	105.1	9%	0.094	62%	0.619	C	S	.	*	T	Hydrogen-bonded Turn	trans	-95.6	-20.4	165.8	-72.6	-169.6	0	0	0	113.3	L12 L17 P89 R138	L12-L15 HydrophobicContact CB-CB 4Å; L12-L15 HydrophobicContact CB-CD1 3.89Å; L12-L15 HydrophobicContact CB-CG 3.77Å; L12-L15 HydrophobicContact CD2-CD1 3.22Å; L12-L15 HydrophobicContact CD2-CD2 4.39Å; L12-L15 HydrophobicContact CD2-CG 3.48Å; L12-L15 VanDerWaalsContact CD2-CG 3.48Å; L12-L15 HydrophobicContact CG-CD1 4.08Å; L12-L15 HydrophobicContact CG-CG 4.22Å; L12-L15 WeakPolarHBondContact O-CB 3.36Å; L12-L15 PolarHBondContact O-N 3.24Å; L15-L17 PolarHBondContact O-N 3.36Å; L15-P89 HydrophobicContact CD2-CG 3.74Å; L15-P89 HydrophobicContact CG-CG 4.42Å; L15-R138 HydrophobicContact CD1-CG 4.38Å; L15-R138 HydrophobicContact CD2-CG 3.82Å; L15-R138 VanDerWaalsContact CD2-CZ 3.42Å
16	T	35.4	Very low	32.5	Very low	58 Å²	58	99.1 Å²	99.1	36%	0.356	61%	0.612	S	S	.	*	S	Bend	trans	-62.8	125.9	166.4	49.4	0	0	0	0	106.9	E13 D18	E13-T16 PolarHBondContact O-OG1 3.49Å; T16-D18 PolarHBondContact O-N 3.27Å
17	L	36.3	Very low	32.4	Very low	70 Å²	70	100 Å²	100	37%	0.366	62%	0.616	S	S	.	*			trans	-44.1	106.8	166.4	-66.5	161.8	0	0	0	106.8	L15 S19 P455	L15-L17 PolarHBondContact O-N 3.36Å; L17-S19 PolarHBondContact O-N 3Å; L17-P455 HydrophobicContact CD1-CG 3.67Å
18	D	31.8	Very low	32.3	Very low	160 Å²	160	106.5 Å²	106.5	86%	0.856	63%	0.625	S	S	*	*	S	Bend	trans	-69.8	84.3	-179.6	-166.6	16.3	0	0	0	107.5	T16	T16-D18 PolarHBondContact O-N 3.27Å
19	S	31.2	Very low	32	Very low	74 Å²	74	106.2 Å²	106.2	52%	0.517	63%	0.628	S	S	.	*	S	Bend	trans	164.6	100.2	158.1	37.5	0	0	0	0	110.5	L17 Y21	L17-S19 PolarHBondContact O-N 3Å; S19-Y21 VanDerWaalsContact C-N 3.3Å; S19-Y21 WeakPolarHBondContact O-CD2 3.36Å; S19-Y21 PolarHBondContact O-N 3.18Å
20	G	33.8	Very low	31.7	Very low	86 Å²	86	108.2 Å²	108.2	89%	0.887	64%	0.638	S	S	*	*			trans	56.5	12.4	143.8	0	0	0	0	0	121.6	G22	G20-G22 PolarHBondContact O-N 3.4Å
21	Y	38.7	Very low	31.2	Very low	136 Å²	136	106.2 Å²	106.2	53%	0.533	65%	0.646	S	S	.	*			trans	-94.4	29.5	-173.8	-74.2	-65.4	0	0	0	115.3	S19 E454	S19-Y21 VanDerWaalsContact C-N 3.3Å; S19-Y21 WeakPolarHBondContact O-CD2 3.36Å; S19-Y21 PolarHBondContact O-N 3.18Å; Y21-E454 PolarHBondContact OH-OE1 3.22Å
22	G	28.3	Very low	30.6	Very low	65 Å²	65	111.5 Å²	111.5	67%	0.67	67%	0.67	S	S	*	*	S	Bend	trans	-144.1	107.8	171.7	0	0	0	0	0	111.4	G20	G20-G22 PolarHBondContact O-N 3.4Å
23	A	32.3	Very low	29.5	Very low	91 Å²	91	115.5 Å²	115.5	75%	0.752	70%	0.701	S	S	*	*	S	Bend	trans	35.3	98.1	167.2	0	0	0	0	0	117.4
24	G	28.8	Very low	29.2	Very low	68 Å²	68	114.5 Å²	114.5	70%	0.701	71%	0.708	S	S	*	*			trans	131.9	75.3	161.6	0	0	0	0	0	113.9
25	D	24.5	Very low	28.7	Very low	169 Å²	169	112.6 Å²	112.6	90%	0.904	71%	0.706	S	S	*	*				174.8	130.8	120.5	-90.4	-24.7	0	0	0	111.8
26	S	26	Very low	27.9	Very low	110 Å²	110	121.7 Å²	121.7	77%	0.769	75%	0.745	S	S	*	*			trans	0.3	126.7	167	-162.6	0	0	0	0	118.9	R28	S26-R28 PolarHBondContact O-N 3.5Å
27	C	24.1	Very low	27.5	Very low	124 Å²	124	123.9 Å²	123.9	84%	0.838	76%	0.762	S	S	*	*			trans	-36.8	123.4	161.8	-53.6	0	0	0	0	113.3
28	R	23.1	Very low	26.9	Very low	239 Å²	239	128.3 Å²	128.3	90%	0.902	79%	0.787	S	S	*	*			trans	-140.7	113.4	144.2	-76.2	-162.6	177.2	179.5	0.4	110.9	S26	S26-R28 PolarHBondContact O-N 3.5Å
29	S	22.3	Very low	26.5	Very low	113 Å²	113	125.7 Å²	125.7	79%	0.79	78%	0.78	S	S	*	*			trans	-17.9	129.7	161.7	52.7	0	0	0	0	118.3
30	L	24.4	Very low	26.2	Very low	166 Å²	166	130.6 Å²	130.6	87%	0.869	80%	0.795	S	S	*	*			trans	8.2	124.5	141.6	-65.6	163.6	0	0	0	118.2
31	S	21.3	Very low	25.6	Very low	124 Å²	124	131.3 Å²	131.3	87%	0.867	79%	0.793	S	S	*	*			trans	-163.6	123.2	136.5	-76.7	0	0	0	0	111
32	L	25.1	Very low	24.8	Very low	171 Å²	171	134 Å²	134	90%	0.895	81%	0.807	S	S	*	*			trans	-47.1	129.2	164.4	-72.8	138.7	0	0	0	111.7
33	S	22	Very low	24.6	Very low	118 Å²	118	137.4 Å²	137.4	83%	0.825	82%	0.816	S	S	*	*			trans	179.4	120.2	137	-84.5	0	0	0	0	112.3
34	S	26.7	Very low	24.1	Very low	103 Å²	103	138.4 Å²	138.4	72%	0.72	82%	0.817	S	S	*	*			trans	13.9	141.9	134.8	-179.5	0	0	0	0	119.4
35	S	26.8	Very low	23.9	Very low	102 Å²	102	141.1 Å²	141.1	71%	0.713	83%	0.826	S	S	*	*			trans	76.5	103.7	149.4	40.6	0	0	0	0	118.6
36	K	23	Very low	23.8	Very low	209 Å²	209	141.7 Å²	141.7	91%	0.909	82%	0.823	S	S	*	*			trans	-127.7	103.5	138.8	-79.1	-172.8	178.9	174.3	0	110.2
37	S	26.6	Very low	23.6	Very low	104 Å²	104	144.1 Å²	144.1	73%	0.727	82%	0.822	S	S	*	*			trans	-56.4	140.8	157.4	38.3	0	0	0	0	110.9
38	N	24.1	Very low	23.6	Very low	163 Å²	163	149.6 Å²	149.6	87%	0.872	83%	0.825	S	S	*	*			trans	-140	101.8	150.1	-101.4	-13.8	0	0	0	110.4
39	S	23.2	Very low	23.5	Very low	104 Å²	104	141.5 Å²	141.5	73%	0.727	82%	0.815	S	S	*	*			trans	19.1	110	146.2	53.9	0	0	0	0	119.1
40	Q	24.3	Very low	23.7	Very low	177 Å²	177	143.1 Å²	143.1	83%	0.827	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-61.8	133.6	154.9	-70.6	175.9	-26.4	0	0	111
41	A	21.9	Very low	23.6	Very low	101 Å²	101	147 Å²	147	84%	0.835	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-90.1	125.1	153.5	0	0	0	0	0	108.3
42	F	23	Very low	23.9	Very low	192 Å²	192	152.4 Å²	152.4	84%	0.842	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-66.4	131.8	179.1	-85.9	-98.5	0	0	0	112.3
43	T	23.1	Very low	23.8	Very low	137 Å²	137	154.3 Å²	154.3	84%	0.84	82%	0.817	S	S	*	*			trans	-141.2	107	139.1	48.4	0	0	0	0	110.4
44	S	22.7	Very low	23.8	Very low	112 Å²	112	160 Å²	160	78%	0.783	82%	0.822	S	S	*	*			trans	-15.1	130.9	160.2	53.8	0	0	0	0	119.9
45	S	23.9	Very low	23.8	Very low	126 Å²	126	160.1 Å²	160.1	88%	0.881	82%	0.823	S	S	*	*				-156.2	147.6	124.4	57.7	0	0	0	0	112.9
46	Q	22.4	Very low	23.6	Very low	180 Å²	180	158.5 Å²	158.5	84%	0.841	82%	0.822	S	S	*	*			trans	-86.1	146.4	-158.2	-79.7	166.8	-28.8	0	0	116.5
47	H	22.2	Very low	23.9	Very low	162 Å²	162	154 Å²	154	75%	0.75	82%	0.817	S	S	*	*			trans	56.4	134.6	132.6	-84	-41.4	0	0	0	125.2
48	R	22.6	Very low	23.8	Very low	239 Å²	239	158.2 Å²	158.2	90%	0.902	83%	0.827	S	S	*	*			trans	76.9	136.9	145.7	-70.3	177.9	-171.5	-152.5	3.6	115.7
49	G	23	Very low	24	Very low	68 Å²	68	158.6 Å²	158.6	70%	0.701	83%	0.829	S	S	*	*			cis	173	152.6	1.8	0	0	0	0	0	109.3
50	N	26.1	Very low	24.1	Very low	148 Å²	148	158.7 Å²	158.7	79%	0.791	83%	0.83	S	S	*	*			trans	22.2	120.2	145	-102.3	25.9	0	0	0	118
51	W	22	Very low	24.3	Very low	247 Å²	247	161.6 Å²	161.6	94%	0.936	83%	0.833	S	S	*	*				-172.1	134.2	114.5	-87.3	8.4	0	0	0	113.2
52	W	26.8	Very low	24.7	Very low	237 Å²	237	163.8 Å²	163.8	90%	0.898	83%	0.831	S	S	*	*			trans	-88.6	145.7	163.3	-73.3	76.7	0	0	0	109.7
53	Y	23.2	Very low	24.9	Very low	211 Å²	211	161 Å²	161	83%	0.827	83%	0.825	S	S	*	*				151.2	115.4	129.9	-100.8	-85.5	0	0	0	110.8
54	Y	22.3	Very low	25.5	Very low	238 Å²	238	158.5 Å²	158.5	93%	0.933	81%	0.813	S	S	*	*			trans	-151.1	115.9	131.2	-121.2	-87	0	0	0	108.9
55	S	26.6	Very low	25.9	Very low	106 Å²	106	158.8 Å²	158.8	74%	0.741	80%	0.797	S	S	*	*			trans	-88.2	140	169.8	179.7	0	0	0	0	108.3
56	G	22.5	Very low	26.3	Very low	68 Å²	68	159.7 Å²	159.7	70%	0.701	79%	0.792	S	S	*	*			trans	-175	60.8	-179.1	0	0	0	0	0	114.7
57	S	29	Very low	27	Very low	113 Å²	113	155 Å²	155	79%	0.79	78%	0.776	S	S	*	*			trans	52.1	94.8	146.6	-179	0	0	0	0	119.1
58	M	25.6	Very low	27.6	Very low	194 Å²	194	149.8 Å²	149.8	96%	0.956	76%	0.755	S	S	*	*			trans	-141.7	90.9	146.5	-70.9	-177.3	71	0	0	109.5
59	N	27.9	Very low	28	Very low	171 Å²	171	145 Å²	145	91%	0.914	75%	0.748	S	S	*	*			trans	-123.7	94.8	172.8	-129.4	7.2	0	0	0	109
60	S	26	Very low	28.5	Very low	106 Å²	106	145.7 Å²	145.7	74%	0.741	74%	0.738	S	S	*	*			trans	-173.6	97.8	151.8	60.4	0	0	0	0	108.7
61	R	28.8	Very low	28.7	Very low	238 Å²	238	145.1 Å²	145.1	90%	0.898	74%	0.74	S	S	*	*				78.3	111.4	94	-85.6	-176.5	163.9	165.7	-3.3	114.7
62	N	29.4	Very low	29.3	Very low	146 Å²	146	137.9 Å²	137.9	78%	0.781	72%	0.719	S	S	*	*			trans	62.5	97.1	155.9	-66.8	5.4	0	0	0	118.4
63	N	26.8	Very low	29.6	Very low	135 Å²	135	130.7 Å²	130.7	72%	0.722	70%	0.703	S	S	*	*				171.3	130.4	127.1	-84.7	-19.8	0	0	0	110.1	W65	N63-W65 PolarHBondContact O-N 3.06Å
64	S	35.8	Very low	30	Very low	83 Å²	83	130.3 Å²	130.3	58%	0.58	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	45.6	-178	73.6	0	0	0	0	113.8
65	W	31.5	Very low	30.8	Very low	118 Å²	118	123.5 Å²	123.5	45%	0.447	69%	0.688	S	S	.	*	T	Hydrogen-bonded Turn	trans	-125.6	-3.6	-175.9	-68.4	89.2	0	0	0	114.2	N63	N63-W65 PolarHBondContact O-N 3.06Å
66	D	31	Very low	31.5	Very low	145 Å²	145	123.5 Å²	123.5	78%	0.775	69%	0.686	S	S	*	*			trans	-96.5	11.1	-173.7	-80.1	-25.4	0	0	0	115.2	V68	D66-V68 PolarHBondContact O-N 3.04Å; D66-V68 VanDerWaalsContact O-N 3.14Å
67	T	38.7	Very low	32.6	Very low	83 Å²	83	127 Å²	127	51%	0.509	68%	0.684	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.5	-3	-179.6	-23.5	0	0	0	0	113.9
68	V	34.3	Very low	33.4	Very low	52 Å²	52	124.2 Å²	124.2	32%	0.315	66%	0.662	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.2	-14.6	-172.2	-170.3	0	0	0	0	113	D66 Q324	D66-V68 PolarHBondContact O-N 3.04Å; D66-V68 VanDerWaalsContact O-N 3.14Å; V68-Q324 HydrophobicContact CG2-CG 4.37Å
69	N	31.8	Very low	34.5	Very low	139 Å²	139	118.4 Å²	118.4	74%	0.743	65%	0.645	S	S	*	*			trans	-136.6	65.5	-177.6	-77.5	-44.1	0	0	0	113.3	V71	N69-V71 PolarHBondContact O-N 2.99Å
70	T	32.9	Very low	35.6	Very low	81 Å²	81	115 Å²	115	50%	0.497	63%	0.626	S	S	.	*			trans	-89.9	92	155.9	44.7	0	0	0	0	108.4	L72	T70-L72 PolarHBondContact O-N 3.36Å; T70-L72 VanDerWaalsContact O-N 3.12Å
71	V	29.8	Very low	37.1	Very low	137 Å²	137	112.4 Å²	112.4	83%	0.83	60%	0.604	S	S	*	*			trans	-60.6	111.3	161.7	175.3	0	0	0	0	106.2	N69	N69-V71 PolarHBondContact O-N 2.99Å
72	L	35.6	Very low	38.7	Very low	94 Å²	94	102.7 Å²	102.7	49%	0.492	57%	0.568	S	S	.	*			trans	-83.5	141.4	174.8	-79.1	167.4	0	0	0	110.1	T70 M411	T70-L72 PolarHBondContact O-N 3.36Å; T70-L72 VanDerWaalsContact O-N 3.12Å; L72-M411 HydrophobicContact CD1-CG 4.07Å; L72-M411 HydrophobicContact CD1-SD 3.82Å
73	P	31.7	Very low	40.2	Very low	87 Å²	87	99.1 Å²	99.1	57%	0.565	56%	0.555	S	S	*	*			trans	-65.1	147.5	174.3	27.7	-32	0	0	0	110.5	D75	P73-D75 PolarHBondContact O-N 3.23Å
74	E	32.5	Very low	41.9	Very low	202 Å²	202	100.8 Å²	100.8	94%	0.944	56%	0.555	S	S	*	*			trans	-65.1	79.6	173.3	-64.5	-175.1	162.6	0	0	110.5
75	D	38.3	Very low	43.5	Very low	96 Å²	96	97.6 Å²	97.6	51%	0.513	53%	0.533	S	S	.	.			trans	-100	137.6	176	-95.6	-38.6	0	0	0	112	P73 E77 V78	P73-D75 PolarHBondContact O-N 3.23Å; D75-E77 PolarHBondContact O-N 3.22Å; D75-V78 PolarHBondContact O-N 3.47Å
76	P	42	Very low	45.5	Very low	106 Å²	106	94.5 Å²	94.5	69%	0.688	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-8.2	179.2	22.7	-31	0	0	0	114.9	V78	P76-V78 VanDerWaalsContact C-N 3.28Å; P76-V78 PolarHBondContact O-N 3.45Å
77	E	44.6	Very low	47.8	Very low	142 Å²	142	94 Å²	94	66%	0.664	52%	0.519	S	S	*	.	H	α-helix	trans	-69.2	-21.2	175.6	-63.9	-170	162.6	0	0	113.5	D75 A79 D80 I81	D75-E77 PolarHBondContact O-N 3.22Å; E77-A79 PolarHBondContact O-N 2.96Å; E77-D80 WeakPolarHBondContact O-CB 3.4Å; E77-D80 PolarHBondContact O-N 3.1Å; E77-I81 WeakPolarHBondContact O-CG1 3.34Å; E77-I81 PolarHBondContact O-N 3.26Å
78	V	47.2	Very low	49.9	Very low	53 Å²	53	90.8 Å²	90.8	32%	0.321	50%	0.499	S	S	.	.	H	α-helix	trans	-66.5	-37.7	179.4	-179.9	0	0	0	0	111.7	D75 P76 D80 I81 F82	D75-V78 PolarHBondContact O-N 3.47Å; P76-V78 VanDerWaalsContact C-N 3.28Å; P76-V78 PolarHBondContact O-N 3.45Å; V78-D80 VanDerWaalsContact C-N 3.31Å; V78-D80 PolarHBondContact O-N 3.48Å; V78-I81 PolarHBondContact O-N 3.29Å; V78-F82 HydrophobicContact CG1-CD2 4.26Å; V78-F82 HydrophobicContact CG1-CE2 4.04Å; V78-F82 WeakPolarHBondContact O-CD2 2.74Å; V78-F82 PolarHBondContact O-N 3.12Å
79	A	48.2	Very low	52	Low	72 Å²	72	90 Å²	90	60%	0.595	49%	0.494	S	S	*	.	H	α-helix	trans	-66.5	-34.8	175.2	0	0	0	0	0	111.9	E77 S83	E77-A79 PolarHBondContact O-N 2.96Å; A79-S83 WeakPolarHBondContact O-CB 3.48Å; A79-S83 PolarHBondContact O-N 3.3Å; A79-S83 VanDerWaalsContact O-N 3.13Å
80	D	51	Low	53.9	Low	99 Å²	99	90.7 Å²	90.7	53%	0.529	50%	0.498	S	S	.	.	H	α-helix	trans	-70.1	-28.8	178.2	-92.9	-7.6	0	0	0	113	E77 V78 S83	E77-D80 WeakPolarHBondContact O-CB 3.4Å; E77-D80 PolarHBondContact O-N 3.1Å; V78-D80 VanDerWaalsContact C-N 3.31Å; V78-D80 PolarHBondContact O-N 3.48Å; D80-S83 PolarHBondContact O-OG 3.05Å
81	I	57.4	Low	55.7	Low	53 Å²	53	87.3 Å²	87.3	27%	0.272	48%	0.477	S	S	.	.	H	α-helix	trans	-68.5	-51.5	175.8	-71.6	161.1	0	0	0	111.1	E77 V78 S83 K84 P409 L412	E77-I81 WeakPolarHBondContact O-CG1 3.34Å; E77-I81 PolarHBondContact O-N 3.26Å; V78-I81 PolarHBondContact O-N 3.29Å; I81-S83 VanDerWaalsContact C-N 3.27Å; I81-S83 PolarHBondContact O-N 3.48Å; I81-K84 PolarHBondContact O-N 2.84Å; I81-P409 HydrophobicContact CD1-CB 3.87Å; I81-P409 HydrophobicContact CD1-CG 3.64Å; I81-P409 HydrophobicContact CG1-CG 4.06Å; I81-P409 HydrophobicContact CG2-CB 4.36Å; I81-P409 HydrophobicContact CG2-CG 3.75Å; I81-L412 HydrophobicContact CG2-CD1 3.78Å; I81-L412 HydrophobicContact CG2-CG 4.5Å
82	F	61.8	Low	57.6	Low	33 Å²	33	88 Å²	88	15%	0.145	47%	0.471	C	S	.	.	H	α-helix	trans	-68.7	-26.5	-179.8	-75.6	-71.5	0	0	0	112.9	V78 K84 C85 Y278 I282 L412	V78-F82 HydrophobicContact CG1-CD2 4.26Å; V78-F82 HydrophobicContact CG1-CE2 4.04Å; V78-F82 WeakPolarHBondContact O-CD2 2.74Å; V78-F82 PolarHBondContact O-N 3.12Å; F82-K84 PolarHBondContact O-N 3.42Å; F82-C85 PolarHBondContact O-N 3.36Å; F82-Y278 HydrophobicContact CB-CE1 3.99Å; F82-Y278 WeakPolarHBondContact CB-OH 3.47Å; F82-Y278 HydrophobicContact CD1-CD2 4.37Å; F82-Y278 HydrophobicContact CD1-CE1 4.01Å; F82-Y278 AromaticContact CD1-CE2 3.77Å; F82-Y278 HydrophobicContact CD1-CE2 3.77Å; F82-Y278 AromaticContact CD1-CZ 3.58Å; F82-Y278 HydrophobicContact CE1-CE2 4.25Å; F82-Y278 HydrophobicContact CG-CE1 4.46Å; F82-Y278 AromaticContact CG-CZ 4Å; F82-Y278 WeakPolarHBondContact O-CE1 3.34Å; F82-I282 HydrophobicContact CE1-CD1 3.89Å; F82-L412 HydrophobicContact CD1-CD2 4.21Å; F82-L412 HydrophobicContact CE1-CD2 3.48Å; F82-L412 VanDerWaalsContact CE1-CD2 3.48Å; F82-L412 HydrophobicContact CZ-CD2 3.91Å
83	S	60.6	Low	59.6	Low	71 Å²	71	89.6 Å²	89.6	50%	0.497	48%	0.476	S	S	.	.	H	α-helix	trans	-62.8	-26.8	175	80.5	0	0	0	0	113.4	A79 D80 I81	A79-S83 WeakPolarHBondContact O-CB 3.48Å; A79-S83 PolarHBondContact O-N 3.3Å; A79-S83 VanDerWaalsContact O-N 3.13Å; D80-S83 PolarHBondContact O-OG 3.05Å; I81-S83 VanDerWaalsContact C-N 3.27Å; I81-S83 PolarHBondContact O-N 3.48Å
84	K	64.3	Low	62.1	Low	170 Å²	170	88.4 Å²	88.4	74%	0.739	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-9	-179.2	-66.5	171.8	-174	168.5	0	113.4	I81 F82	I81-K84 PolarHBondContact O-N 2.84Å; F82-K84 PolarHBondContact O-N 3.42Å
85	C	68.4	Low	64.8	Low	16 Å²	16	79 Å²	79	11%	0.108	42%	0.418	C	S	.	.	S	Bend	trans	-74.9	143.1	-179.9	-69.1	0	0	0	0	112	F82 K87 Y278	F82-C85 PolarHBondContact O-N 3.36Å; C85-K87 PolarHBondContact O-N 3.32Å; C85-Y278 HydrophobicContact CB-CD1 3.9Å; C85-Y278 HydrophobicContact CB-CE1 4.43Å
86	P	72.6	Confident	67.3	Low	54 Å²	54	74.7 Å²	74.7	35%	0.351	39%	0.394	S	S	.	.			trans	-57.4	138.3	171.6	-21.4	31.9	0	0	0	111.3	Y278 E279	P86-Y278 WeakPolarHBondContact O-CA 3.46Å; P86-E279 HydrophobicContact CB-CB 4.06Å; P86-E279 WeakPolarHBondContact CB-OE2 3.23Å; P86-E279 PolarHBondContact O-N 3.02Å
87	K	81.1	Confident	69.5	Low	134 Å²	134	72.2 Å²	72.2	58%	0.583	38%	0.377	S	S	*	.	B	Isolated β-bridge	trans	-107.6	150.8	179.5	-67	-178	-178.7	176.5	0	110.7	C85 P277	C85-K87 PolarHBondContact O-N 3.32Å; K87-P277 CarbonylContact C-O 3.59Å; K87-P277 VanDerWaalsContact CA-O 3.3Å; K87-P277 WeakPolarHBondContact CA-O 3.46Å
88	L	81.1	Confident	71.5	Confident	15 Å²	15	67.4 Å²	67.4	8%	0.079	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-61.7	146.6	171	-68.1	171.5	0	0	0	110.1	R131 I134 R135 P277	L88-R131 HydrophobicContact CD1-CB 4.2Å; L88-I134 HydrophobicContact CD2-CG2 4.11Å; L88-R135 HydrophobicContact CD1-CG 4.01Å; L88-P277 PolarHBondContact N-O 2.93Å
89	P	78.8	Confident	73.4	Confident	35 Å²	35	71.1 Å²	71.1	23%	0.227	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-65.1	144.4	173.9	26.7	-33.3	0	0	0	110	L12 L15 L91 I134	L12-P89 HydrophobicContact CD2-CG 4.49Å; L15-P89 HydrophobicContact CD2-CG 3.74Å; L15-P89 HydrophobicContact CG-CG 4.42Å; P89-L91 PolarHBondContact O-N 3.21Å; P89-I134 WeakPolarHBondContact O-CD1 3.4Å
90	D	72.7	Confident	75.3	Confident	155 Å²	155	68.3 Å²	68.3	83%	0.829	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-78.5	121.1	174.1	-73.2	-39	0	0	0	109.6	E92	D90-E92 PolarHBondContact O-N 3.09Å
91	L	71.1	Confident	77.2	Confident	10 Å²	10	63.6 Å²	63.6	5%	0.052	32%	0.319	C	S	.	.			trans	-76.5	115.3	173.4	-84.6	170.3	0	0	0	110.6	L12 P89 R130 L133 I134 W210	L12-L91 HydrophobicContact CD1-CD2 3.38Å; L12-L91 HydrophobicContact CD2-CD2 3.51Å; L12-L91 HydrophobicContact CD2-CG 4.28Å; L12-L91 HydrophobicContact CG-CD2 3.98Å; P89-L91 PolarHBondContact O-N 3.21Å; L91-R130 HydrophobicContact CD1-CB 4.48Å; L91-L133 HydrophobicContact CD1-CD2 4.29Å; L91-I134 HydrophobicContact CB-CD1 4.41Å; L91-I134 HydrophobicContact CD1-CD1 3.6Å; L91-I134 HydrophobicContact CD1-CG1 3.21Å; L91-I134 HydrophobicContact CG-CD1 3.63Å; L91-I134 HydrophobicContact CG-CG1 3.66Å; L91-W210 HydrophobicContact CD1-CZ2 4.02Å; L91-W210 HydrophobicContact CD2-CZ2 4.06Å
92	E	68.3	Low	78.6	Confident	150 Å²	150	61.2 Å²	61.2	70%	0.701	31%	0.308	S	S	*	.	S	Bend	trans	-73.9	-36.9	169.2	-65.3	-171.9	175.9	0	0	111.5	D90	D90-E92 PolarHBondContact O-N 3.09Å
93	E	77.3	Confident	79.9	Confident	129 Å²	129	64.6 Å²	64.6	60%	0.603	32%	0.322	S	S	*	.			trans	-118.5	135.5	-179.9	-65.1	-171.8	172.1	0	0	112.7	W210	E93-W210 PolarHBondContact O-NE1 3.48Å
94	Y	84.5	Confident	81.2	Confident	62 Å²	62	61.2 Å²	61.2	24%	0.243	30%	0.299	C	S	.	.			trans	-145	154.5	-178.6	51.8	-83.9	0	0	0	110.9	W96 R130	Y94-W96 VanDerWaalsContact C-N 3.28Å; Y94-W96 AromaticContact CD2-CD1 3.59Å; Y94-W96 AromaticContact CD2-CD2 3.97Å; Y94-W96 HydrophobicContact CD2-CD2 3.97Å; Y94-W96 AromaticContact CD2-CE2 3.66Å; Y94-W96 AromaticContact CD2-CG 3.93Å; Y94-W96 HydrophobicContact CD2-CG 3.93Å; Y94-W96 HydrophobicContact CD2-CZ2 4.31Å; Y94-W96 AromaticContact CD2-NE1 3.38Å; Y94-W96 WeakPolarHBondContact CD2-O 3.41Å; Y94-W96 AromaticContact CE2-CD1 3.66Å; Y94-W96 HydrophobicContact CE2-CG 4.38Å; Y94-W96 AromaticContact CE2-NE1 3.57Å; Y94-W96 WeakPolarHBondContact CE2-O 3.28Å; Y94-W96 PolarHBondContact O-N 3.23Å; Y94-R130 HydrophobicContact CG-CG 4.45Å; Y94-R130 PolarHBondContact OH-NH2 3.16Å
95	P	89.2	Confident	82.2	Confident	5 Å²	5	53.3 Å²	53.3	3%	0.032	27%	0.265	C	S	.	.	S	Bend	trans	-80.4	5.3	-164.4	29.7	-34.6	0	0	0	115.7	L133 R206 F207 W210	P95-L133 HydrophobicContact CG-CD2 4.2Å; P95-R206 HydrophobicContact CB-CB 4.2Å; P95-R206 WeakPolarHBondContact O-CB 3.42Å; P95-R206 PolarHBondContact O-NE 3.47Å; P95-R206 PolarHBondContact O-NH1 3.48Å; P95-F207 HydrophobicContact CB-CB 4.44Å; P95-F207 HydrophobicContact CB-CD1 4.32Å; P95-F207 HydrophobicContact CB-CD2 3.67Å; P95-F207 HydrophobicContact CB-CE2 3.95Å; P95-F207 HydrophobicContact CB-CG 3.88Å; P95-F207 HydrophobicContact CB-CZ 4.42Å; P95-F207 HydrophobicContact CG-CD1 3.72Å; P95-F207 HydrophobicContact CG-CD2 3.73Å; P95-F207 HydrophobicContact CG-CE1 3.64Å; P95-F207 HydrophobicContact CG-CE2 3.64Å; P95-F207 HydrophobicContact CG-CG 3.79Å; P95-F207 HydrophobicContact CG-CZ 3.61Å; P95-W210 HydrophobicContact CB-CB 4.01Å; P95-W210 HydrophobicContact CB-CG 4.31Å; P95-W210 HydrophobicContact CG-CB 4.4Å; P95-W210 HydrophobicContact CG-CD2 4.41Å; P95-W210 HydrophobicContact CG-CG 4.26Å
96	W	91.2	Very high	82.9	Confident	5 Å²	5	58.8 Å²	58.8	2%	0.019	28%	0.283	C	S	.	.			trans	-127.7	161	-179.6	60.8	79.8	0	0	0	112.2	Y94 D100 I101 S126 L129 R130 L133 F202 F207 M232	Y94-W96 VanDerWaalsContact C-N 3.28Å; Y94-W96 AromaticContact CD2-CD1 3.59Å; Y94-W96 AromaticContact CD2-CD2 3.97Å; Y94-W96 HydrophobicContact CD2-CD2 3.97Å; Y94-W96 AromaticContact CD2-CE2 3.66Å; Y94-W96 AromaticContact CD2-CG 3.93Å; Y94-W96 HydrophobicContact CD2-CG 3.93Å; Y94-W96 HydrophobicContact CD2-CZ2 4.31Å; Y94-W96 AromaticContact CD2-NE1 3.38Å; Y94-W96 WeakPolarHBondContact CD2-O 3.41Å; Y94-W96 AromaticContact CE2-CD1 3.66Å; Y94-W96 HydrophobicContact CE2-CG 4.38Å; Y94-W96 AromaticContact CE2-NE1 3.57Å; Y94-W96 WeakPolarHBondContact CE2-O 3.28Å; Y94-W96 PolarHBondContact O-N 3.23Å; W96-D100 HydrophobicContact CB-CB 4.5Å; W96-I101 HydrophobicContact CG-CD1 4.46Å; W96-S126 PolarHBondContact NE1-OG 3.26Å; W96-L129 HydrophobicContact CH2-CB 4.26Å; W96-L129 HydrophobicContact CZ2-CB 3.92Å; W96-R130 HydrophobicContact CZ2-CG 4.07Å; W96-L133 HydrophobicContact CH2-CB 4.02Å; W96-L133 HydrophobicContact CH2-CD2 3.79Å; W96-L133 HydrophobicContact CH2-CG 4.4Å; W96-L133 HydrophobicContact CZ3-CB 4.4Å; W96-L133 HydrophobicContact CZ3-CD1 4.38Å; W96-L133 HydrophobicContact CZ3-CD2 3.69Å; W96-L133 HydrophobicContact CZ3-CG 4.37Å; W96-F202 HydrophobicContact CB-CD1 3.89Å; W96-F202 HydrophobicContact CB-CE1 3.61Å; W96-F202 HydrophobicContact CB-CZ 4.31Å; W96-F202 HydrophobicContact CG-CE1 4.12Å; W96-F202 HydrophobicContact CG-CZ 4.39Å; W96-F207 HydrophobicContact CE3-CE1 4.46Å; W96-F207 HydrophobicContact CE3-CE2 4.03Å; W96-F207 AromaticContact CE3-CZ 3.57Å; W96-F207 HydrophobicContact CE3-CZ 3.57Å; W96-F207 HydrophobicContact CZ3-CE1 4.24Å; W96-F207 AromaticContact CZ3-CZ 3.72Å; W96-F207 HydrophobicContact CZ3-CZ 3.72Å; W96-M232 HydrophobicContact CH2-CE 3.79Å; W96-M232 HydrophobicContact CZ3-CE 4.03Å
97	T	88.3	Confident	83.2	Confident	54 Å²	54	60.2 Å²	60.2	33%	0.331	28%	0.284	S	S	.	.			trans	-102.9	162	167.5	68.6	0	0	0	0	110.5	E99 D100 I101	T97-E99 PolarHBondContact O-N 3.44Å; T97-E99 PolarHBondContact OG1-N 2.96Å; T97-D100 PolarHBondContact N-OD2 2.93Å; T97-D100 WeakPolarHBondContact O-CB 3.26Å; T97-D100 PolarHBondContact O-N 3.18Å; T97-D100 VanDerWaalsContact O-N 3.1Å; T97-D100 PolarHBondContact OG1-N 3.25Å; T97-D100 PolarHBondContact OG1-OD2 2.89Å; T97-I101 PolarHBondContact O-N 2.87Å
98	D	87.4	Confident	82.3	Confident	40 Å²	40	57.8 Å²	57.8	21%	0.214	30%	0.296	C	S	.	.	H	α-helix	trans	-63.9	-25.9	175	-65.2	-17	0	0	0	111.6	D100 G102 V122 S126	D98-D100 VanDerWaalsContact C-N 3.34Å; D98-G102 PolarHBondContact O-N 3.2Å; D98-G102 VanDerWaalsContact O-N 3.08Å; D98-V122 HydrophobicContact CB-CG1 4.42Å; D98-V122 VanDerWaalsContact O-CG1 3.29Å; D98-V122 WeakPolarHBondContact O-CG1 3.35Å; D98-S126 VanDerWaalsContact OD1-CB 3.3Å; D98-S126 WeakPolarHBondContact OD1-CB 3.37Å; D98-S126 PolarHBondContact OD1-OG 3.01Å
99	E	86.1	Confident	81.2	Confident	131 Å²	131	60.1 Å²	60.1	61%	0.612	31%	0.307	S	S	*	.	H	α-helix	trans	-65.7	-36.9	173.3	-62.8	-175.6	176.9	0	0	112.2	T97 G102 K103	T97-E99 PolarHBondContact O-N 3.44Å; T97-E99 PolarHBondContact OG1-N 2.96Å; E99-G102 PolarHBondContact O-N 3.17Å; E99-K103 WeakPolarHBondContact O-CG 3.4Å; E99-K103 PolarHBondContact O-N 2.95Å
100	D	89.1	Confident	79.9	Confident	13 Å²	13	61.1 Å²	61.1	7%	0.07	32%	0.323	C	S	.	.	H	α-helix	trans	-66	-43.3	179.6	-59.3	-42.6	0	0	0	111.1	W96 T97 D98 G102 K103 I104 F202 R206	W96-D100 HydrophobicContact CB-CB 4.5Å; T97-D100 PolarHBondContact N-OD2 2.93Å; T97-D100 WeakPolarHBondContact O-CB 3.26Å; T97-D100 PolarHBondContact O-N 3.18Å; T97-D100 VanDerWaalsContact O-N 3.1Å; T97-D100 PolarHBondContact OG1-N 3.25Å; T97-D100 PolarHBondContact OG1-OD2 2.89Å; D98-D100 VanDerWaalsContact C-N 3.34Å; D100-G102 VanDerWaalsContact C-N 3.32Å; D100-G102 PolarHBondContact O-N 2.91Å; D100-K103 WeakPolarHBondContact O-CB 3.44Å; D100-K103 PolarHBondContact O-N 3.17Å; D100-I104 WeakPolarHBondContact O-CG1 3.35Å; D100-I104 PolarHBondContact O-N 2.82Å; D100-I104 VanDerWaalsContact O-N 3.14Å; D100-F202 HydrophobicContact CB-CD1 3.82Å; D100-F202 HydrophobicContact CB-CE1 3.76Å; D100-R206 IonicContact OD1-NH2 3.55Å; D100-R206 IonicContact OD2-CZ 2.74Å; D100-R206 IonicContact OD2-NH1 3.61Å; D100-R206 PolarHBondContact OD2-NH1 3.12Å; D100-R206 IonicContact OD2-NH2 3.65Å; D100-R206 PolarHBondContact OD2-NH2 3.09Å
101	I	89.9	Confident	78.7	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-61.8	-43.7	173.4	-65.2	170.6	0	0	0	110.1	W96 T97 K103 I104 L105 V122 L125 S126 L129 F202 V236	W96-I101 HydrophobicContact CG-CD1 4.46Å; T97-I101 PolarHBondContact O-N 2.87Å; I101-K103 VanDerWaalsContact C-N 3.28Å; I101-K103 PolarHBondContact O-N 2.97Å; I101-I104 PolarHBondContact O-N 3.49Å; I101-L105 HydrophobicContact CG2-CD1 3.9Å; I101-L105 HydrophobicContact CG2-CG 4.27Å; I101-L105 WeakPolarHBondContact O-CG 3.27Å; I101-L105 PolarHBondContact O-N 3.46Å; I101-V122 HydrophobicContact CB-CG1 4.02Å; I101-V122 HydrophobicContact CG2-CG1 3.91Å; I101-L125 HydrophobicContact CG2-CD2 4.04Å; I101-S126 VanDerWaalsContact CD1-CB 3.4Å; I101-L129 HydrophobicContact CD1-CD1 4.24Å; I101-F202 HydrophobicContact CG1-CE1 4.08Å; I101-F202 HydrophobicContact CG1-CZ 3.93Å; I101-V236 HydrophobicContact CG2-CG1 4.46Å
102	G	87.3	Confident	77.5	Confident	3 Å²	3	65.1 Å²	65.1	3%	0.031	36%	0.359	C	S	.	.	H	α-helix	trans	-57.6	-39	175.4	0	0	0	0	0	113	D98 E99 D100 L105 R106	D98-G102 PolarHBondContact O-N 3.2Å; D98-G102 VanDerWaalsContact O-N 3.08Å; E99-G102 PolarHBondContact O-N 3.17Å; D100-G102 VanDerWaalsContact C-N 3.32Å; D100-G102 PolarHBondContact O-N 2.91Å; G102-L105 PolarHBondContact O-N 3.01Å; G102-R106 VanDerWaalsContact C-CZ 3.46Å; G102-R106 WeakPolarHBondContact O-CG 3.43Å; G102-R106 PolarHBondContact O-N 3.42Å; G102-R106 VanDerWaalsContact O-N 3.15Å; G102-R106 PolarHBondContact O-NH1 3.27Å
103	K	87.7	Confident	76.7	Confident	104 Å²	104	65.9 Å²	65.9	45%	0.452	37%	0.368	S	S	.	.	H	α-helix	trans	-64.1	-43.9	175.9	-71.8	171.4	-174.1	169.9	0	111.6	E99 D100 I101 R106 K107 T201	E99-K103 WeakPolarHBondContact O-CG 3.4Å; E99-K103 PolarHBondContact O-N 2.95Å; D100-K103 WeakPolarHBondContact O-CB 3.44Å; D100-K103 PolarHBondContact O-N 3.17Å; I101-K103 VanDerWaalsContact C-N 3.28Å; I101-K103 PolarHBondContact O-N 2.97Å; K103-R106 PolarHBondContact O-N 3.12Å; K103-K107 PolarHBondContact O-N 3.37Å; K103-T201 HydrophobicContact CB-CG2 3.85Å; K103-T201 HydrophobicContact CD-CG2 4.46Å
104	I	87.9	Confident	75.7	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.005	36%	0.361	C	S	.	.	H	α-helix	trans	-63.8	-43.4	177.5	-62.8	161.5	0	0	0	110.6	D100 I101 R106 K107 T201 F202 E233 V236 E237	D100-I104 WeakPolarHBondContact O-CG1 3.35Å; D100-I104 PolarHBondContact O-N 2.82Å; D100-I104 VanDerWaalsContact O-N 3.14Å; I101-I104 PolarHBondContact O-N 3.49Å; I104-R106 PolarHBondContact O-N 3.24Å; I104-K107 WeakPolarHBondContact O-CB 3.37Å; I104-K107 PolarHBondContact O-N 3.11Å; I104-T201 HydrophobicContact CG1-CG2 3.92Å; I104-F202 HydrophobicContact CD1-CD1 3.79Å; I104-F202 HydrophobicContact CD1-CD2 3.87Å; I104-F202 HydrophobicContact CD1-CE1 3.43Å; I104-F202 VanDerWaalsContact CD1-CE1 3.43Å; I104-F202 HydrophobicContact CD1-CE2 3.53Å; I104-F202 HydrophobicContact CD1-CG 3.99Å; I104-F202 HydrophobicContact CD1-CZ 3.29Å; I104-E233 HydrophobicContact CD1-CB 4.45Å; I104-E233 HydrophobicContact CD1-CG 3.89Å; I104-E233 HydrophobicContact CG1-CG 4.17Å; I104-E233 HydrophobicContact CG2-CG 4.22Å; I104-V236 HydrophobicContact CB-CG1 4.12Å; I104-V236 HydrophobicContact CG2-CB 4.04Å; I104-V236 HydrophobicContact CG2-CG1 3.59Å; I104-E237 HydrophobicContact CG2-CG 3.95Å
105	L	86.2	Confident	75	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.021	36%	0.358	C	S	.	.	H	α-helix	trans	-63.4	-27.7	178.4	-68.3	172.8	0	0	0	112.7	I101 G102 F117 V122 L125 V236 K240	I101-L105 HydrophobicContact CG2-CD1 3.9Å; I101-L105 HydrophobicContact CG2-CG 4.27Å; I101-L105 WeakPolarHBondContact O-CG 3.27Å; I101-L105 PolarHBondContact O-N 3.46Å; G102-L105 PolarHBondContact O-N 3.01Å; L105-F117 HydrophobicContact CB-CD2 4Å; L105-F117 HydrophobicContact CB-CE2 4.42Å; L105-F117 HydrophobicContact CD1-CB 4.14Å; L105-F117 HydrophobicContact CD1-CD1 4.22Å; L105-F117 HydrophobicContact CD1-CD2 4.22Å; L105-F117 HydrophobicContact CD1-CG 3.94Å; L105-F117 HydrophobicContact CD2-CD2 4.22Å; L105-F117 HydrophobicContact CD2-CE1 4.43Å; L105-F117 HydrophobicContact CD2-CE2 3.98Å; L105-F117 HydrophobicContact CD2-CZ 4.09Å; L105-F117 HydrophobicContact CG-CD2 4.38Å; L105-V122 HydrophobicContact CD1-CG2 3.89Å; L105-L125 HydrophobicContact CD1-CD2 4.17Å; L105-L125 HydrophobicContact CD2-CD2 4.2Å; L105-V236 HydrophobicContact CD2-CG1 3.8Å; L105-V236 HydrophobicContact CG-CG1 4.15Å; L105-K240 HydrophobicContact CD2-CB 3.91Å; L105-K240 HydrophobicContact CD2-CD 4.2Å; L105-K240 HydrophobicContact CD2-CG 4.35Å; L105-K240 VanDerWaalsContact O-CE 3.32Å; L105-K240 WeakPolarHBondContact O-CE 3.48Å; L105-K240 PolarHBondContact O-NZ 2.69Å
106	R	83.3	Confident	74.4	Confident	131 Å²	131	65.5 Å²	65.5	49%	0.494	38%	0.375	S	S	.	.	H	α-helix	trans	-84.2	-18.4	172.6	-68.9	-175.7	-63.9	-90.9	1.9	114	G102 K103 I104 G108 Q109	G102-R106 VanDerWaalsContact C-CZ 3.46Å; G102-R106 WeakPolarHBondContact O-CG 3.43Å; G102-R106 PolarHBondContact O-N 3.42Å; G102-R106 VanDerWaalsContact O-N 3.15Å; G102-R106 PolarHBondContact O-NH1 3.27Å; K103-R106 PolarHBondContact O-N 3.12Å; I104-R106 PolarHBondContact O-N 3.24Å; R106-G108 PolarHBondContact O-N 3.38Å; R106-Q109 WeakPolarHBondContact O-CB 3.37Å; R106-Q109 WeakPolarHBondContact O-CG 3.13Å; R106-Q109 PolarHBondContact O-N 3.08Å
107	K	78.3	Confident	74	Confident	84 Å²	84	66.6 Å²	66.6	37%	0.365	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	130.6	-179.6	-163.1	174	178.6	174.1	0	110.5	K103 I104 G199 T201 E233 K240	K103-K107 PolarHBondContact O-N 3.37Å; I104-K107 WeakPolarHBondContact O-CB 3.37Å; I104-K107 PolarHBondContact O-N 3.11Å; K107-G199 PolarHBondContact NZ-O 3.35Å; K107-T201 PolarHBondContact NZ-OG1 3.35Å; K107-T201 VanDerWaalsContact NZ-OG1 3.13Å; K107-E233 IonicContact NZ-OE1 3.44Å; K107-E233 PolarHBondContact NZ-OE1 3.39Å; K107-K240 PolarHBondContact O-NZ 3.49Å
108	G	62	Low	74	Confident	82 Å²	82	65.5 Å²	65.5	85%	0.845	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	83	6.6	-178.5	0	0	0	0	0	115.9	R106 G110	R106-G108 PolarHBondContact O-N 3.38Å; G108-G110 PolarHBondContact O-N 2.77Å
109	Q	59.5	Low	74	Confident	65 Å²	65	69.8 Å²	69.8	30%	0.304	39%	0.392	S	S	.	.			trans	-77	111.4	167.6	-69.3	-179.8	-29.9	0	0	109.1	R106 R115	R106-Q109 WeakPolarHBondContact O-CB 3.37Å; R106-Q109 WeakPolarHBondContact O-CG 3.13Å; R106-Q109 PolarHBondContact O-N 3.08Å; Q109-R115 PolarHBondContact NE2-O 3.49Å
110	G	51.8	Low	74.1	Confident	55 Å²	55	67.9 Å²	67.9	57%	0.567	38%	0.383	S	S	*	.			trans	-69	159.2	162.3	0	0	0	0	0	110.1	G108 G112	G108-G110 PolarHBondContact O-N 2.77Å; G110-G112 PolarHBondContact O-N 3.4Å
111	D	47.3	Very low	74.1	Confident	190 Å²	190	67.3 Å²	67.3	100%	1.016	38%	0.38	S	S	*	.	S	Bend	trans	-57.2	4.8	-178.1	-86.4	-24.4	0	0	0	115.7
112	G	44.4	Very low	74.1	Confident	59 Å²	59	67.5 Å²	67.5	61%	0.608	38%	0.382	S	S	*	.	S	Bend	trans	-106.6	102.5	177.4	0	0	0	0	0	113.2	G110 T114	G110-G112 PolarHBondContact O-N 3.4Å; G112-T114 PolarHBondContact O-N 3.13Å; G112-T114 VanDerWaalsContact O-N 3.13Å
113	N	52.1	Low	74.3	Confident	166 Å²	166	72.5 Å²	72.5	89%	0.888	40%	0.399	S	S	*	.			trans	39.4	56.6	149.2	-146.5	38.5	0	0	0	117.6
114	T	57.2	Low	74.5	Confident	74 Å²	74	70.9 Å²	70.9	45%	0.454	39%	0.39	S	S	.	.			trans	-106.4	137.1	168.9	11.2	0	0	0	0	110.9	G112	G112-T114 PolarHBondContact O-N 3.13Å; G112-T114 VanDerWaalsContact O-N 3.13Å
115	R	68.4	Low	74.7	Confident	51 Å²	51	70.9 Å²	70.9	19%	0.192	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-56.6	137.8	-176.3	-63	178.9	-177.1	174.8	11.7	111.5	Q109 G251 G254 I256	Q109-R115 PolarHBondContact NE2-O 3.49Å; R115-G251 PolarHBondContact NH2-O 3.47Å; R115-G254 WeakPolarHBondContact CB-O 3.37Å; R115-G254 WeakPolarHBondContact CD-O 3.5Å; R115-G254 VanDerWaalsContact CG-O 3.26Å; R115-G254 WeakPolarHBondContact CG-O 3.47Å; R115-I256 HydrophobicContact CB-CD1 4.46Å; R115-I256 HydrophobicContact CB-CG1 4.35Å
116	T	76.8	Confident	74.9	Confident	63 Å²	63	70.7 Å²	70.7	39%	0.387	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-93.7	147.3	178.7	46.4	0	0	0	0	111.2	E255 I256	T116-E255 CarbonylContact O-C 3.56Å; T116-E255 WeakPolarHBondContact O-CA 3.22Å; T116-I256 PolarHBondContact O-N 3.1Å
117	F	83.4	Confident	75.2	Confident	29 Å²	29	67 Å²	67	13%	0.127	38%	0.378	C	S	.	.	B	Isolated β-bridge	trans	-80.3	135.3	171.7	-75.7	-99.7	0	0	0	110.1	L105 A121 V122 K240 V243 I256	L105-F117 HydrophobicContact CB-CD2 4Å; L105-F117 HydrophobicContact CB-CE2 4.42Å; L105-F117 HydrophobicContact CD1-CB 4.14Å; L105-F117 HydrophobicContact CD1-CD1 4.22Å; L105-F117 HydrophobicContact CD1-CD2 4.22Å; L105-F117 HydrophobicContact CD1-CG 3.94Å; L105-F117 HydrophobicContact CD2-CD2 4.22Å; L105-F117 HydrophobicContact CD2-CE1 4.43Å; L105-F117 HydrophobicContact CD2-CE2 3.98Å; L105-F117 HydrophobicContact CD2-CZ 4.09Å; L105-F117 HydrophobicContact CG-CD2 4.38Å; F117-A121 HydrophobicContact CD1-CB 4.4Å; F117-V122 HydrophobicContact CB-CG2 4.27Å; F117-K240 HydrophobicContact CE2-CG 4.09Å; F117-K240 HydrophobicContact CZ-CB 4.38Å; F117-K240 HydrophobicContact CZ-CG 4.2Å; F117-V243 HydrophobicContact CE1-CG1 4.29Å; F117-V243 HydrophobicContact CZ-CG1 4.32Å; F117-I256 HydrophobicContact CD1-CB 4Å; F117-I256 HydrophobicContact CD1-CD1 4.3Å; F117-I256 HydrophobicContact CD1-CG2 3.86Å; F117-I256 HydrophobicContact CD2-CD1 4.06Å; F117-I256 HydrophobicContact CE1-CB 4.22Å; F117-I256 HydrophobicContact CE1-CD1 3.94Å; F117-I256 HydrophobicContact CE1-CG2 3.77Å; F117-I256 HydrophobicContact CE2-CD1 3.67Å; F117-I256 HydrophobicContact CG-CB 4.34Å; F117-I256 HydrophobicContact CG-CD1 4.36Å; F117-I256 HydrophobicContact CZ-CD1 3.61Å; F117-I256 HydrophobicContact CZ-CG2 4.5Å
118	T	87.7	Confident	75.8	Confident	31 Å²	31	63.4 Å²	63.4	19%	0.19	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-66.7	150.8	172.8	56.5	0	0	0	0	111.3	E120 A121 V122 E255 I256	T118-E120 PolarHBondContact O-N 3.38Å; T118-A121 WeakPolarHBondContact O-CB 3.28Å; T118-A121 PolarHBondContact O-N 2.97Å; T118-A121 WeakPolarHBondContact OG1-CB 3.47Å; T118-A121 PolarHBondContact OG1-N 3.4Å; T118-V122 WeakPolarHBondContact O-CG2 3.4Å; T118-V122 PolarHBondContact O-N 3.2Å; T118-V122 VanDerWaalsContact O-N 3.08Å; T118-E255 HydrophobicContact CG2-CB 3.75Å; T118-I256 WeakPolarHBondContact CG2-O 3.43Å; T118-I256 PolarHBondContact N-O 3.48Å; T118-I256 VanDerWaalsContact N-O 3.08Å; T118-I256 PolarHBondContact OG1-O 3.05Å
119	Q	87.7	Confident	77.2	Confident	130 Å²	130	59.6 Å²	59.6	61%	0.607	32%	0.323	S	S	*	.	H	α-helix	trans	-58.9	-33.4	178.3	-171.5	65.2	23	0	0	112.4	V122 R123	Q119-V122 PolarHBondContact O-N 3.18Å; Q119-R123 PolarHBondContact O-N 3.37Å
120	E	89.1	Confident	78.7	Confident	91 Å²	91	59 Å²	59	43%	0.425	32%	0.318	S	S	.	.	H	α-helix	trans	-68.9	-38.3	176.4	-174.8	56.1	-159.1	0	0	111.9	T118 V122 R123 R124 A258	T118-E120 PolarHBondContact O-N 3.38Å; E120-V122 VanDerWaalsContact C-N 3.34Å; E120-V122 PolarHBondContact O-N 3.22Å; E120-R123 PolarHBondContact O-N 3.27Å; E120-R123 IonicContact OE1-CZ 2.82Å; E120-R123 IonicContact OE1-NE 3.18Å; E120-R123 IonicContact OE1-NH2 3.73Å; E120-R123 PolarHBondContact OE1-NH2 2.9Å; E120-R123 IonicContact OE2-CZ 3.06Å; E120-R123 IonicContact OE2-NE 3.09Å; E120-R123 PolarHBondContact OE2-NE 3.39Å; E120-R123 IonicContact OE2-NH2 3.89Å; E120-R123 PolarHBondContact OE2-NH2 3.11Å; E120-R124 WeakPolarHBondContact O-CB 3.2Å; E120-R124 PolarHBondContact O-N 2.94Å; E120-A258 HydrophobicContact CG-CB 4.29Å
121	A	88	Confident	80.6	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.008	30%	0.302	C	S	.	.	H	α-helix	trans	-63.5	-39.5	172.8	0	0	0	0	0	111.9	F117 T118 R124 L125 A258	F117-A121 HydrophobicContact CD1-CB 4.4Å; T118-A121 WeakPolarHBondContact O-CB 3.28Å; T118-A121 PolarHBondContact O-N 2.97Å; T118-A121 WeakPolarHBondContact OG1-CB 3.47Å; T118-A121 PolarHBondContact OG1-N 3.4Å; A121-R124 PolarHBondContact O-N 2.83Å; A121-L125 WeakPolarHBondContact O-CB 3.32Å; A121-L125 PolarHBondContact O-N 3.43Å; A121-A258 HydrophobicContact CB-CB 4.36Å
122	V	91	Very high	82.7	Confident	4 Å²	4	50.2 Å²	50.2	2%	0.024	25%	0.253	C	S	.	.	H	α-helix	trans	-61.7	-48.2	175.2	178.6	0	0	0	0	111.1	D98 I101 L105 F117 T118 Q119 E120 R124 L125 S126	D98-V122 HydrophobicContact CB-CG1 4.42Å; D98-V122 VanDerWaalsContact O-CG1 3.29Å; D98-V122 WeakPolarHBondContact O-CG1 3.35Å; I101-V122 HydrophobicContact CB-CG1 4.02Å; I101-V122 HydrophobicContact CG2-CG1 3.91Å; L105-V122 HydrophobicContact CD1-CG2 3.89Å; F117-V122 HydrophobicContact CB-CG2 4.27Å; T118-V122 WeakPolarHBondContact O-CG2 3.4Å; T118-V122 PolarHBondContact O-N 3.2Å; T118-V122 VanDerWaalsContact O-N 3.08Å; Q119-V122 PolarHBondContact O-N 3.18Å; E120-V122 VanDerWaalsContact C-N 3.34Å; E120-V122 PolarHBondContact O-N 3.22Å; V122-R124 VanDerWaalsContact C-N 3.29Å; V122-R124 PolarHBondContact O-N 2.95Å; V122-L125 PolarHBondContact O-N 3.01Å; V122-S126 WeakPolarHBondContact O-CB 3.43Å; V122-S126 PolarHBondContact O-N 3.08Å
123	R	90.9	Very high	85.1	Confident	108 Å²	108	47.4 Å²	47.4	41%	0.408	22%	0.224	S	C	.	.	H	α-helix	trans	-61.1	-40.3	177.6	-168.7	-179.9	74.9	99.2	3	111.5	Q119 E120 S126 Q127	Q119-R123 PolarHBondContact O-N 3.37Å; E120-R123 PolarHBondContact O-N 3.27Å; E120-R123 IonicContact OE1-CZ 2.82Å; E120-R123 IonicContact OE1-NE 3.18Å; E120-R123 IonicContact OE1-NH2 3.73Å; E120-R123 PolarHBondContact OE1-NH2 2.9Å; E120-R123 IonicContact OE2-CZ 3.06Å; E120-R123 IonicContact OE2-NE 3.09Å; E120-R123 PolarHBondContact OE2-NE 3.39Å; E120-R123 IonicContact OE2-NH2 3.89Å; E120-R123 PolarHBondContact OE2-NH2 3.11Å; R123-S126 WeakPolarHBondContact O-CB 3.44Å; R123-S126 PolarHBondContact O-N 3.08Å; R123-Q127 WeakPolarHBondContact O-CG 3.38Å; R123-Q127 PolarHBondContact O-N 3.3Å; R123-Q127 VanDerWaalsContact O-N 3.14Å
124	R	91.1	Very high	86.9	Confident	69 Å²	69	39.7 Å²	39.7	26%	0.26	18%	0.183	S	C	.	.	H	α-helix	trans	-68.1	-44	178.5	-171.8	53.3	170.7	177.6	-5.8	112.3	E120 A121 V122 S126 Q127 L128 A258 E262	E120-R124 WeakPolarHBondContact O-CB 3.2Å; E120-R124 PolarHBondContact O-N 2.94Å; A121-R124 PolarHBondContact O-N 2.83Å; V122-R124 VanDerWaalsContact C-N 3.29Å; V122-R124 PolarHBondContact O-N 2.95Å; R124-S126 VanDerWaalsContact C-N 3.32Å; R124-S126 PolarHBondContact O-N 3.37Å; R124-Q127 WeakPolarHBondContact O-CB 3.47Å; R124-Q127 PolarHBondContact O-N 3.45Å; R124-L128 WeakPolarHBondContact O-CG 3.35Å; R124-L128 PolarHBondContact O-N 3.2Å; R124-L128 VanDerWaalsContact O-N 3.13Å; R124-A258 HydrophobicContact CB-CB 4.39Å; R124-E262 IonicContact CZ-OE1 2.92Å; R124-E262 IonicContact NE-OE1 2.68Å; R124-E262 PolarHBondContact NE-OE1 3.46Å; R124-E262 IonicContact NH2-OE1 3.31Å; R124-E262 PolarHBondContact NH2-OE1 3.31Å
125	L	91.6	Very high	88.5	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-59.4	-44.1	173.8	-176.2	59.5	0	0	0	111.3	I101 L105 A121 V122 Q127 L128 L129 V236 I239 L261	I101-L125 HydrophobicContact CG2-CD2 4.04Å; L105-L125 HydrophobicContact CD1-CD2 4.17Å; L105-L125 HydrophobicContact CD2-CD2 4.2Å; A121-L125 WeakPolarHBondContact O-CB 3.32Å; A121-L125 PolarHBondContact O-N 3.43Å; V122-L125 PolarHBondContact O-N 3.01Å; L125-Q127 VanDerWaalsContact C-N 3.3Å; L125-Q127 PolarHBondContact O-N 3.47Å; L125-L128 PolarHBondContact O-N 3.08Å; L125-L128 VanDerWaalsContact O-N 3.14Å; L125-L129 HydrophobicContact CD1-CD1 4.24Å; L125-L129 HydrophobicContact CD1-CG 4.22Å; L125-L129 HydrophobicContact CG-CD1 3.86Å; L125-L129 HydrophobicContact CG-CG 4.32Å; L125-L129 VanDerWaalsContact O-CG 3.31Å; L125-L129 WeakPolarHBondContact O-CG 3.12Å; L125-L129 PolarHBondContact O-N 3.47Å; L125-V236 HydrophobicContact CD2-CG1 4.26Å; L125-I239 HydrophobicContact CD1-CD1 3.82Å; L125-I239 HydrophobicContact CD1-CG2 4.01Å; L125-L261 HydrophobicContact CB-CD2 3.91Å; L125-L261 HydrophobicContact CD1-CD1 4.48Å; L125-L261 HydrophobicContact CD1-CD2 4.45Å
126	S	91.9	Very high	89.6	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-53.4	-45.2	174.6	-171.2	0	0	0	0	111.8	W96 D98 I101 V122 R123 R124 R130	W96-S126 PolarHBondContact NE1-OG 3.26Å; D98-S126 VanDerWaalsContact OD1-CB 3.3Å; D98-S126 WeakPolarHBondContact OD1-CB 3.37Å; D98-S126 PolarHBondContact OD1-OG 3.01Å; I101-S126 VanDerWaalsContact CD1-CB 3.4Å; V122-S126 WeakPolarHBondContact O-CB 3.43Å; V122-S126 PolarHBondContact O-N 3.08Å; R123-S126 WeakPolarHBondContact O-CB 3.44Å; R123-S126 PolarHBondContact O-N 3.08Å; R124-S126 VanDerWaalsContact C-N 3.32Å; R124-S126 PolarHBondContact O-N 3.37Å; S126-R130 WeakPolarHBondContact O-CG 3.01Å; S126-R130 PolarHBondContact O-N 3.07Å
127	Q	89.6	Confident	90.4	Very high	53 Å²	53	31.4 Å²	31.4	25%	0.248	14%	0.137	C	C	.	.	H	α-helix	trans	-64.6	-41.1	177.1	-69.8	172.6	-2.5	0	0	113.2	R123 R124 L125	R123-Q127 WeakPolarHBondContact O-CG 3.38Å; R123-Q127 PolarHBondContact O-N 3.3Å; R123-Q127 VanDerWaalsContact O-N 3.14Å; R124-Q127 WeakPolarHBondContact O-CB 3.47Å; R124-Q127 PolarHBondContact O-N 3.45Å; L125-Q127 VanDerWaalsContact C-N 3.3Å; L125-Q127 PolarHBondContact O-N 3.47Å
128	L	90.6	Very high	90.7	Very high	10 Å²	10	31.9 Å²	31.9	5%	0.052	14%	0.138	C	C	.	.	H	α-helix	trans	-68.2	-41.2	179.7	-66.4	175.5	0	0	0	111.3	R124 L125 R130 R131 I265 L275	R124-L128 WeakPolarHBondContact O-CG 3.35Å; R124-L128 PolarHBondContact O-N 3.2Å; R124-L128 VanDerWaalsContact O-N 3.13Å; L125-L128 PolarHBondContact O-N 3.08Å; L125-L128 VanDerWaalsContact O-N 3.14Å; L128-R130 VanDerWaalsContact C-N 3.26Å; L128-R130 PolarHBondContact O-N 3.34Å; L128-R131 WeakPolarHBondContact O-CB 3.45Å; L128-R131 PolarHBondContact O-N 2.83Å; L128-R131 VanDerWaalsContact O-N 3.09Å; L128-I265 HydrophobicContact CD1-CD1 3.58Å; L128-L275 HydrophobicContact CB-CB 4.45Å; L128-L275 HydrophobicContact CB-CD1 4.42Å; L128-L275 HydrophobicContact CB-CD2 4.17Å; L128-L275 WeakPolarHBondContact O-CD2 3.47Å
129	L	92.1	Very high	90.9	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-63.6	-28	179.6	-71.7	169.6	0	0	0	113.5	W96 I101 L125 R131 A132 L133 M232 L235 V236 I239	W96-L129 HydrophobicContact CH2-CB 4.26Å; W96-L129 HydrophobicContact CZ2-CB 3.92Å; I101-L129 HydrophobicContact CD1-CD1 4.24Å; L125-L129 HydrophobicContact CD1-CD1 4.24Å; L125-L129 HydrophobicContact CD1-CG 4.22Å; L125-L129 HydrophobicContact CG-CD1 3.86Å; L125-L129 HydrophobicContact CG-CG 4.32Å; L125-L129 VanDerWaalsContact O-CG 3.31Å; L125-L129 WeakPolarHBondContact O-CG 3.12Å; L125-L129 PolarHBondContact O-N 3.47Å; L129-R131 PolarHBondContact O-N 3.44Å; L129-A132 PolarHBondContact O-N 2.89Å; L129-L133 PolarHBondContact O-N 2.85Å; L129-M232 HydrophobicContact CB-CE 3.99Å; L129-M232 HydrophobicContact CD2-CE 4.13Å; L129-M232 WeakPolarHBondContact O-CE 3.45Å; L129-L235 HydrophobicContact CD2-CB 4.43Å; L129-L235 HydrophobicContact CD2-CD2 3.63Å; L129-L235 HydrophobicContact CD2-CG 3.95Å; L129-V236 HydrophobicContact CD1-CG2 3.46Å; L129-V236 VanDerWaalsContact CD1-CG2 3.46Å; L129-V236 HydrophobicContact CD2-CG2 4.44Å; L129-I239 HydrophobicContact CD2-CD1 4.27Å
130	R	91	Very high	91.1	Very high	54 Å²	54	24.8 Å²	24.8	20%	0.204	10%	0.103	C	C	.	.	H	α-helix	trans	-56.6	-37.6	173.3	-66.9	172.9	-157.5	-168.6	6.5	111.6	L91 Y94 W96 S126 L128 L133 I134	L91-R130 HydrophobicContact CD1-CB 4.48Å; Y94-R130 HydrophobicContact CG-CG 4.45Å; Y94-R130 PolarHBondContact OH-NH2 3.16Å; W96-R130 HydrophobicContact CZ2-CG 4.07Å; S126-R130 WeakPolarHBondContact O-CG 3.01Å; S126-R130 PolarHBondContact O-N 3.07Å; L128-R130 VanDerWaalsContact C-N 3.26Å; L128-R130 PolarHBondContact O-N 3.34Å; R130-L133 PolarHBondContact O-N 3.06Å; R130-I134 VanDerWaalsContact O-CG1 3.28Å; R130-I134 WeakPolarHBondContact O-CG1 3.32Å; R130-I134 PolarHBondContact O-N 3.41Å
131	R	90.9	Very high	91.3	Very high	59 Å²	59	21.8 Å²	21.8	22%	0.223	9%	0.089	C	C	.	.	H	α-helix	trans	-67.6	-43.3	-179.8	-60.3	168.1	179.6	177.6	-0	111.1	L88 L128 L129 L133 I134 R135 L275	L88-R131 HydrophobicContact CD1-CB 4.2Å; L128-R131 WeakPolarHBondContact O-CB 3.45Å; L128-R131 PolarHBondContact O-N 2.83Å; L128-R131 VanDerWaalsContact O-N 3.09Å; L129-R131 PolarHBondContact O-N 3.44Å; R131-L133 VanDerWaalsContact C-N 3.35Å; R131-L133 PolarHBondContact O-N 3.35Å; R131-I134 PolarHBondContact O-N 3.44Å; R131-R135 VanDerWaalsContact O-CG 3.32Å; R131-R135 WeakPolarHBondContact O-CG 3.4Å; R131-R135 PolarHBondContact O-N 3.17Å; R131-R135 VanDerWaalsContact O-N 3.1Å; R131-L275 WeakPolarHBondContact CD-O 3.4Å; R131-L275 PolarHBondContact NH1-O 3.22Å
132	A	91.8	Very high	91.4	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-60.2	-44.8	174	0	0	0	0	0	111.5	L129 I134 R135 I136 M232 L235 V274 L275	L129-A132 PolarHBondContact O-N 2.89Å; A132-I134 PolarHBondContact O-N 3.19Å; A132-R135 PolarHBondContact O-N 3.2Å; A132-I136 WeakPolarHBondContact O-CG1 3.25Å; A132-I136 PolarHBondContact O-N 3.34Å; A132-M232 HydrophobicContact CB-CE 4.39Å; A132-L235 HydrophobicContact CB-CD2 3.8Å; A132-V274 HydrophobicContact CB-CG1 3.72Å; A132-L275 HydrophobicContact CB-CD2 4.21Å
133	L	93.1	Very high	91.3	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-58.6	-48.4	177.5	-179	69.9	0	0	0	112	L91 P95 W96 L129 R130 R131 R135 I136 S137 F207 W210 L228 M232	L91-L133 HydrophobicContact CD1-CD2 4.29Å; P95-L133 HydrophobicContact CG-CD2 4.2Å; W96-L133 HydrophobicContact CH2-CB 4.02Å; W96-L133 HydrophobicContact CH2-CD2 3.79Å; W96-L133 HydrophobicContact CH2-CG 4.4Å; W96-L133 HydrophobicContact CZ3-CB 4.4Å; W96-L133 HydrophobicContact CZ3-CD1 4.38Å; W96-L133 HydrophobicContact CZ3-CD2 3.69Å; W96-L133 HydrophobicContact CZ3-CG 4.37Å; L129-L133 PolarHBondContact O-N 2.85Å; R130-L133 PolarHBondContact O-N 3.06Å; R131-L133 VanDerWaalsContact C-N 3.35Å; R131-L133 PolarHBondContact O-N 3.35Å; L133-R135 PolarHBondContact O-N 3.34Å; L133-I136 PolarHBondContact O-N 2.92Å; L133-S137 VanDerWaalsContact O-CB 3.25Å; L133-S137 WeakPolarHBondContact O-CB 3.44Å; L133-S137 PolarHBondContact O-N 3.03Å; L133-S137 PolarHBondContact O-OG 3.46Å; L133-F207 HydrophobicContact CD1-CE1 3.85Å; L133-W210 HydrophobicContact CD1-CH2 4.13Å; L133-W210 HydrophobicContact CD1-CZ3 3.97Å; L133-W210 HydrophobicContact CD2-CD2 4.43Å; L133-W210 HydrophobicContact CD2-CE3 4.43Å; L133-W210 HydrophobicContact CD2-CH2 3.67Å; L133-W210 HydrophobicContact CD2-CZ2 3.63Å; L133-W210 HydrophobicContact CD2-CZ3 4.07Å; L133-W210 HydrophobicContact CG-CH2 3.63Å; L133-W210 HydrophobicContact CG-CZ2 4.09Å; L133-W210 HydrophobicContact CG-CZ3 4Å; L133-L228 HydrophobicContact CD1-CD1 4.13Å; L133-L228 HydrophobicContact CD1-CD2 4Å; L133-L228 HydrophobicContact CD1-CG 4.15Å; L133-M232 HydrophobicContact CB-CE 4.04Å; L133-M232 HydrophobicContact CB-SD 4.31Å; L133-M232 HydrophobicContact CD1-CG 4.18Å; L133-M232 HydrophobicContact CD1-SD 4.3Å
134	I	90.4	Very high	91.3	Very high	5 Å²	5	18.8 Å²	18.8	3%	0.026	8%	0.079	C	C	.	.	H	α-helix	trans	-60.8	-46.9	-179.9	-65.5	164	0	0	0	110.6	L88 P89 L91 R130 R131 A132 I136 S137 R138	L88-I134 HydrophobicContact CD2-CG2 4.11Å; P89-I134 WeakPolarHBondContact O-CD1 3.4Å; L91-I134 HydrophobicContact CB-CD1 4.41Å; L91-I134 HydrophobicContact CD1-CD1 3.6Å; L91-I134 HydrophobicContact CD1-CG1 3.21Å; L91-I134 HydrophobicContact CG-CD1 3.63Å; L91-I134 HydrophobicContact CG-CG1 3.66Å; R130-I134 VanDerWaalsContact O-CG1 3.28Å; R130-I134 WeakPolarHBondContact O-CG1 3.32Å; R130-I134 PolarHBondContact O-N 3.41Å; R131-I134 PolarHBondContact O-N 3.44Å; A132-I134 PolarHBondContact O-N 3.19Å; I134-I136 PolarHBondContact O-N 3.02Å; I134-S137 PolarHBondContact O-N 3.34Å; I134-R138 HydrophobicContact CG2-CG 4.14Å; I134-R138 WeakPolarHBondContact O-CB 3.5Å; I134-R138 WeakPolarHBondContact O-CG 3.47Å; I134-R138 PolarHBondContact O-N 3.16Å
135	R	90.9	Very high	91.1	Very high	9 Å²	9	18.1 Å²	18.1	3%	0.034	8%	0.082	C	C	.	.	H	α-helix	trans	-56.8	-53.5	179.3	-70	175.9	-174.7	-73.8	2.8	110	L88 R131 A132 L133 S137 R138 E139 I162 V274 Q276 Y278 E279 H280	L88-R135 HydrophobicContact CD1-CG 4.01Å; R131-R135 VanDerWaalsContact O-CG 3.32Å; R131-R135 WeakPolarHBondContact O-CG 3.4Å; R131-R135 PolarHBondContact O-N 3.17Å; R131-R135 VanDerWaalsContact O-N 3.1Å; A132-R135 PolarHBondContact O-N 3.2Å; L133-R135 PolarHBondContact O-N 3.34Å; R135-S137 VanDerWaalsContact C-N 3.25Å; R135-S137 PolarHBondContact O-N 2.91Å; R135-R138 PolarHBondContact O-N 3.09Å; R135-E139 PolarHBondContact O-N 3.03Å; R135-E139 VanDerWaalsContact O-N 3.12Å; R135-I162 HydrophobicContact CB-CD1 3.85Å; R135-I162 HydrophobicContact CB-CG1 4.26Å; R135-I162 HydrophobicContact CB-CG2 3.95Å; R135-I162 WeakPolarHBondContact O-CD1 3.32Å; R135-V274 WeakPolarHBondContact CD-O 3.37Å; R135-V274 PolarHBondContact NE-O 2.9Å; R135-Q276 PolarHBondContact NH2-O 3.04Å; R135-Y278 PolarHBondContact NH1-O 3.03Å; R135-Y278 VanDerWaalsContact NH1-O 3.09Å; R135-Y278 PolarHBondContact NH2-O 3.44Å; R135-E279 PolarHBondContact NH1-O 3.33Å; R135-E279 VanDerWaalsContact NH1-O 3.17Å; R135-H280 PolarHBondContact NH1-O 2.91Å; R135-H280 VanDerWaalsContact NH1-O 3.11Å
136	I	92.9	Very high	90.7	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-60.9	-40.4	-176.8	-63.7	168.2	0	0	0	110.5	A132 L133 I134 A140 A158 I159 I162 L228 M232	A132-I136 WeakPolarHBondContact O-CG1 3.25Å; A132-I136 PolarHBondContact O-N 3.34Å; L133-I136 PolarHBondContact O-N 2.92Å; I134-I136 PolarHBondContact O-N 3.02Å; I136-A140 VanDerWaalsContact O-CB 3.28Å; I136-A140 WeakPolarHBondContact O-CB 2.87Å; I136-A140 PolarHBondContact O-N 3Å; I136-A158 HydrophobicContact CG2-CB 4.17Å; I136-A158 WeakPolarHBondContact O-CB 3.3Å; I136-I159 HydrophobicContact CD1-CG1 4.46Å; I136-I159 HydrophobicContact CG2-CG1 4.1Å; I136-I162 HydrophobicContact CB-CD1 4.11Å; I136-I162 HydrophobicContact CG1-CB 4.44Å; I136-I162 HydrophobicContact CG1-CD1 3.77Å; I136-I162 HydrophobicContact CG1-CG2 4.38Å; I136-I162 VanDerWaalsContact N-CD1 3.26Å; I136-L228 HydrophobicContact CB-CD1 4.32Å; I136-L228 HydrophobicContact CG2-CD1 3.67Å; I136-M232 HydrophobicContact CD1-SD 4.45Å
137	S	92.3	Very high	90.2	Very high	4 Å²	4	20 Å²	20	3%	0.028	9%	0.091	C	C	.	.	H	α-helix	trans	-70.7	-39.7	-178.7	-54.8	0	0	0	0	112.8	L133 I134 R135 A140 Q141 W210	L133-S137 VanDerWaalsContact O-CB 3.25Å; L133-S137 WeakPolarHBondContact O-CB 3.44Å; L133-S137 PolarHBondContact O-N 3.03Å; L133-S137 PolarHBondContact O-OG 3.46Å; I134-S137 PolarHBondContact O-N 3.34Å; R135-S137 VanDerWaalsContact C-N 3.25Å; R135-S137 PolarHBondContact O-N 2.91Å; S137-A140 PolarHBondContact O-N 3.44Å; S137-Q141 VanDerWaalsContact O-CB 3.3Å; S137-Q141 WeakPolarHBondContact O-CB 3.22Å; S137-Q141 PolarHBondContact O-N 3.5Å; S137-W210 VanDerWaalsContact OG-CH2 3.27Å; S137-W210 WeakPolarHBondContact OG-CH2 3.48Å; S137-W210 VanDerWaalsContact OG-CZ3 3.26Å; S137-W210 WeakPolarHBondContact OG-CZ3 3.42Å
138	R	90.1	Very high	90	Very high	40 Å²	40	18.7 Å²	18.7	15%	0.151	9%	0.088	C	C	.	.	H	α-helix	trans	-60.4	-45.5	174.5	-80.2	179	172.2	-147.2	-16.1	111.6	L15 I134 R135 Q141 R142 E279	L15-R138 HydrophobicContact CD1-CG 4.38Å; L15-R138 HydrophobicContact CD2-CG 3.82Å; L15-R138 VanDerWaalsContact CD2-CZ 3.42Å; I134-R138 HydrophobicContact CG2-CG 4.14Å; I134-R138 WeakPolarHBondContact O-CB 3.5Å; I134-R138 WeakPolarHBondContact O-CG 3.47Å; I134-R138 PolarHBondContact O-N 3.16Å; R135-R138 PolarHBondContact O-N 3.09Å; R138-Q141 WeakPolarHBondContact O-CB 3.34Å; R138-Q141 PolarHBondContact O-N 3.3Å; R138-R142 WeakPolarHBondContact O-CG 3.34Å; R138-R142 PolarHBondContact O-N 3.32Å; R138-E279 IonicContact CZ-OE1 3.48Å; R138-E279 IonicContact NH1-OE1 3.36Å; R138-E279 PolarHBondContact NH1-OE1 3.45Å
139	E	91.7	Very high	89.8	Confident	9 Å²	9	18.9 Å²	18.9	4%	0.042	9%	0.088	C	C	.	.	H	α-helix	trans	-70.9	-39.9	179	-63.4	-53	146.4	0	0	111.7	R135 Q141 R142 L143 A158 I162 R445 L446	R135-E139 PolarHBondContact O-N 3.03Å; R135-E139 VanDerWaalsContact O-N 3.12Å; E139-Q141 VanDerWaalsContact C-N 3.29Å; E139-Q141 PolarHBondContact O-N 2.8Å; E139-R142 PolarHBondContact O-N 3.25Å; E139-L143 WeakPolarHBondContact O-CB 3.26Å; E139-L143 VanDerWaalsContact O-CG 3.29Å; E139-L143 WeakPolarHBondContact O-CG 3.41Å; E139-L143 PolarHBondContact O-N 2.94Å; E139-A158 HydrophobicContact CB-CB 3.94Å; E139-I162 HydrophobicContact CB-CD1 3.95Å; E139-I162 HydrophobicContact CG-CD1 3.63Å; E139-I162 HydrophobicContact CG-CG1 4.01Å; E139-R445 IonicContact OE1-CZ 3.93Å; E139-R445 VanDerWaalsContact OE1-CZ 3.23Å; E139-R445 IonicContact OE1-NH1 3.46Å; E139-R445 PolarHBondContact OE1-NH1 3.09Å; E139-R445 IonicContact OE1-NH2 3.09Å; E139-R445 PolarHBondContact OE1-NH2 3.08Å; E139-R445 IonicContact OE2-CZ 3.2Å; E139-R445 IonicContact OE2-NH2 3.01Å; E139-R445 PolarHBondContact OE2-NH2 3.27Å; E139-L446 HydrophobicContact CG-CD1 4.36Å
140	A	93.1	Very high	89.8	Confident	2 Å²	2	18.9 Å²	18.9	2%	0.017	9%	0.088	C	C	.	.	H	α-helix	trans	-60.6	-39.8	173.1	0	0	0	0	0	111.9	I136 S137 S144 V155 A158 I216	I136-A140 VanDerWaalsContact O-CB 3.28Å; I136-A140 WeakPolarHBondContact O-CB 2.87Å; I136-A140 PolarHBondContact O-N 3Å; S137-A140 PolarHBondContact O-N 3.44Å; A140-S144 VanDerWaalsContact O-CB 3.3Å; A140-S144 WeakPolarHBondContact O-CB 3.42Å; A140-S144 PolarHBondContact O-N 2.61Å; A140-V155 HydrophobicContact CB-CG2 4.37Å; A140-A158 HydrophobicContact CB-CB 3.99Å; A140-I216 HydrophobicContact CB-CG2 4.32Å
141	Q	91.9	Very high	89.7	Confident	29 Å²	29	16.5 Å²	16.5	14%	0.136	8%	0.08	C	C	.	.	H	α-helix	trans	-60.3	-50.8	175.1	172.8	174.4	43.6	0	0	110.9	S137 R138 E139 L143 S144 V145 R215 I216	S137-Q141 VanDerWaalsContact O-CB 3.3Å; S137-Q141 WeakPolarHBondContact O-CB 3.22Å; S137-Q141 PolarHBondContact O-N 3.5Å; R138-Q141 WeakPolarHBondContact O-CB 3.34Å; R138-Q141 PolarHBondContact O-N 3.3Å; E139-Q141 VanDerWaalsContact C-N 3.29Å; E139-Q141 PolarHBondContact O-N 2.8Å; Q141-L143 PolarHBondContact O-N 2.95Å; Q141-S144 PolarHBondContact O-N 3.5Å; Q141-S144 VanDerWaalsContact O-N 3.15Å; Q141-S144 PolarHBondContact O-OG 3.25Å; Q141-V145 PolarHBondContact O-N 3.08Å; Q141-R215 PolarHBondContact NE2-O 3.15Å; Q141-I216 VanDerWaalsContact CA-O 3.28Å; Q141-I216 WeakPolarHBondContact CA-O 3.45Å; Q141-I216 HydrophobicContact CB-CG2 4.02Å; Q141-I216 WeakPolarHBondContact CB-O 3.45Å; Q141-I216 VanDerWaalsContact CG-O 3.26Å; Q141-I216 WeakPolarHBondContact CG-O 3.29Å
142	R	90.3	Very high	89.6	Confident	29 Å²	29	17.9 Å²	17.9	11%	0.109	9%	0.085	C	C	.	.	H	α-helix	trans	-62.1	-41.7	179.8	-70.2	180	66.1	91.7	10.4	112.8	R138 E139 S144 V145 C453 P455	R138-R142 WeakPolarHBondContact O-CG 3.34Å; R138-R142 PolarHBondContact O-N 3.32Å; E139-R142 PolarHBondContact O-N 3.25Å; R142-S144 VanDerWaalsContact C-N 3.31Å; R142-V145 WeakPolarHBondContact O-CB 3.21Å; R142-V145 WeakPolarHBondContact O-CG2 3.25Å; R142-V145 PolarHBondContact O-N 3.05Å; R142-C453 PolarHBondContact NH2-O 2.8Å; R142-P455 HydrophobicContact CG-CG 4.49Å
143	L	89.9	Confident	89.4	Confident	17 Å²	17	19.3 Å²	19.3	9%	0.089	9%	0.091	C	C	.	.	H	α-helix	trans	-65.4	-35.8	175.4	-67.9	177.6	0	0	0	111.8	E139 Q141 V145 E154 A158 L161 Y426	E139-L143 WeakPolarHBondContact O-CB 3.26Å; E139-L143 VanDerWaalsContact O-CG 3.29Å; E139-L143 WeakPolarHBondContact O-CG 3.41Å; E139-L143 PolarHBondContact O-N 2.94Å; Q141-L143 PolarHBondContact O-N 2.95Å; L143-V145 PolarHBondContact O-N 3.25Å; L143-E154 HydrophobicContact CB-CB 4.22Å; L143-E154 HydrophobicContact CB-CG 4.13Å; L143-A158 HydrophobicContact CD1-CB 4.47Å; L143-L161 HydrophobicContact CD1-CD1 3.96Å; L143-Y426 HydrophobicContact CD2-CD1 4.12Å; L143-Y426 HydrophobicContact CD2-CE1 3.95Å
144	S	89.8	Confident	89.4	Confident	4 Å²	4	19.4 Å²	19.4	3%	0.028	9%	0.092	C	C	.	.	H	α-helix	trans	-69.5	-15.7	-179.7	80.9	0	0	0	0	114.5	A140 Q141 R142 M146 H147 S148 K149 I216 S217	A140-S144 VanDerWaalsContact O-CB 3.3Å; A140-S144 WeakPolarHBondContact O-CB 3.42Å; A140-S144 PolarHBondContact O-N 2.61Å; Q141-S144 PolarHBondContact O-N 3.5Å; Q141-S144 VanDerWaalsContact O-N 3.15Å; Q141-S144 PolarHBondContact O-OG 3.25Å; R142-S144 VanDerWaalsContact C-N 3.31Å; S144-M146 VanDerWaalsContact C-N 3.29Å; S144-M146 PolarHBondContact O-N 2.85Å; S144-H147 PolarHBondContact O-N 2.76Å; S144-S148 WeakPolarHBondContact O-CA 3.5Å; S144-S148 PolarHBondContact O-N 3.27Å; S144-K149 WeakPolarHBondContact CB-O 3.37Å; S144-K149 PolarHBondContact O-N 3.4Å; S144-I216 PolarHBondContact OG-O 2.75Å; S144-S217 WeakPolarHBondContact OG-CB 3.26Å; S144-S217 PolarHBondContact OG-OG 3.45Å
145	V	87.3	Confident	89.5	Confident	55 Å²	55	19.2 Å²	19.2	33%	0.333	9%	0.091	S	C	.	.	G	3₁₀ helix	trans	-59	-40	-179.1	175.5	0	0	0	0	111.5	Q141 R142 L143 H147 S148 P455	Q141-V145 PolarHBondContact O-N 3.08Å; R142-V145 WeakPolarHBondContact O-CB 3.21Å; R142-V145 WeakPolarHBondContact O-CG2 3.25Å; R142-V145 PolarHBondContact O-N 3.05Å; L143-V145 PolarHBondContact O-N 3.25Å; V145-H147 VanDerWaalsContact C-N 3.26Å; V145-H147 PolarHBondContact O-N 2.71Å; V145-S148 PolarHBondContact O-N 3.33Å; V145-P455 HydrophobicContact CB-CB 4.19Å; V145-P455 HydrophobicContact CG1-CB 4.28Å; V145-P455 HydrophobicContact CG2-CB 4.17Å; V145-P455 HydrophobicContact CG2-CG 4.37Å
146	M	83.6	Confident	89.6	Confident	26 Å²	26	20 Å²	20	13%	0.128	10%	0.095	C	C	.	.	G	3₁₀ helix	trans	-59.2	-35.8	-176.7	-175.4	-171.6	-62.7	0	0	113.2	S144 R456 L458	S144-M146 VanDerWaalsContact C-N 3.29Å; S144-M146 PolarHBondContact O-N 2.85Å; M146-R456 HydrophobicContact CE-CB 4.43Å; M146-R456 HydrophobicContact CE-CG 4.19Å; M146-L458 HydrophobicContact CG-CB 4.1Å; M146-L458 HydrophobicContact CG-CD1 4.21Å; M146-L458 HydrophobicContact SD-CD1 4.44Å
147	H	81.5	Confident	89.5	Confident	14 Å²	14	20.8 Å²	20.8	7%	0.065	10%	0.1	C	C	.	.	G	3₁₀ helix	trans	-117.1	5.7	-177	-61.9	103.5	0	0	0	112.9	S144 V145 K149 H556 L570	S144-H147 PolarHBondContact O-N 2.76Å; V145-H147 VanDerWaalsContact C-N 3.26Å; V145-H147 PolarHBondContact O-N 2.71Å; H147-K149 PolarHBondContact O-N 3.33Å; H147-H556 AromaticContact CE1-CD2 3.82Å; H147-H556 AromaticContact CE1-CG 3.72Å; H147-H556 AromaticContact CE1-ND1 3.94Å; H147-H556 AromaticContact NE2-CG 3.83Å; H147-L570 WeakPolarHBondContact O-CD1 3.43Å; H147-L570 VanDerWaalsContact O-CD2 3.25Å; H147-L570 WeakPolarHBondContact O-CD2 3.32Å; H147-L570 VanDerWaalsContact O-CG 3.32Å; H147-L570 WeakPolarHBondContact O-CG 3.37Å
148	S	85.3	Confident	89.6	Confident	25 Å²	25	20.6 Å²	20.6	18%	0.175	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.1	30.6	-175.5	-60.8	0	0	0	0	114.3	S144 V145 R219 L570	S144-S148 WeakPolarHBondContact O-CA 3.5Å; S144-S148 PolarHBondContact O-N 3.27Å; V145-S148 PolarHBondContact O-N 3.33Å; S148-R219 PolarHBondContact O-NH1 3Å; S148-L570 WeakPolarHBondContact CB-O 3.43Å
149	K	86.7	Confident	89.8	Confident	15 Å²	15	18.7 Å²	18.7	7%	0.065	9%	0.092	C	C	.	.			trans	-149.8	133.4	-175.4	-173.2	-180	-175.6	175.7	0	109.5	S144 H147 T151 S217 R219 E601	S144-K149 WeakPolarHBondContact CB-O 3.37Å; S144-K149 PolarHBondContact O-N 3.4Å; H147-K149 PolarHBondContact O-N 3.33Å; K149-T151 HydrophobicContact CD-CG2 3.92Å; K149-T151 HydrophobicContact CG-CG2 3.93Å; K149-S217 WeakPolarHBondContact CA-OG 3.34Å; K149-S217 PolarHBondContact N-OG 3.06Å; K149-R219 WeakPolarHBondContact CA-O 3.42Å; K149-R219 HydrophobicContact CB-CB 4.43Å; K149-R219 HydrophobicContact CG-CB 4.21Å; K149-E601 IonicContact NZ-OE1 3.47Å; K149-E601 PolarHBondContact NZ-OE1 3.05Å; K149-E601 IonicContact NZ-OE2 3.58Å; K149-E601 PolarHBondContact NZ-OE2 3.08Å
150	C	90.9	Very high	89.7	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.103	C	C	.	.	B	Isolated β-bridge	trans	-102.9	113.8	172.7	-174.6	0	0	0	0	109.8	R219 I220 H221	C150-R219 PolarHBondContact N-O 3Å; C150-I220 HydrophobicContact CB-CG1 4.3Å; C150-H221 PolarHBondContact O-N 2.99Å
151	T	89.1	Confident	89.7	Confident	5 Å²	5	21.4 Å²	21.4	3%	0.031	10%	0.103	C	C	.	.			trans	-112.7	-174.4	175.6	80.2	0	0	0	0	110.9	K149 F153 E154 V155 H221 A224 D558	K149-T151 HydrophobicContact CD-CG2 3.92Å; K149-T151 HydrophobicContact CG-CG2 3.93Å; T151-F153 PolarHBondContact O-N 3.47Å; T151-F153 WeakPolarHBondContact OG1-CD2 3.5Å; T151-F153 PolarHBondContact OG1-N 2.96Å; T151-F153 VanDerWaalsContact OG1-N 3.11Å; T151-E154 VanDerWaalsContact CA-OE2 3.28Å; T151-E154 WeakPolarHBondContact CA-OE2 3.35Å; T151-E154 VanDerWaalsContact CB-OE2 3.28Å; T151-E154 WeakPolarHBondContact CB-OE2 3.43Å; T151-E154 PolarHBondContact N-OE2 3.05Å; T151-E154 PolarHBondContact OG1-OE2 3.13Å; T151-V155 PolarHBondContact O-N 3.44Å; T151-H221 HydrophobicContact CG2-CB 4.35Å; T151-A224 WeakPolarHBondContact O-CB 3.14Å; T151-D558 WeakPolarHBondContact CG2-OD2 3.32Å; T151-D558 PolarHBondContact OG1-OD2 3.49Å
152	R	88.8	Confident	89.6	Confident	87 Å²	87	20 Å²	20	33%	0.328	10%	0.097	S	C	.	.	H	α-helix	trans	-60.4	-28.4	172.9	68.7	179.3	-173.6	138.3	-3.9	112.7	Q156	R152-Q156 VanDerWaalsContact O-CB 3.27Å; R152-Q156 WeakPolarHBondContact O-CB 3.44Å; R152-Q156 WeakPolarHBondContact O-CG 3.25Å; R152-Q156 PolarHBondContact O-N 3.42Å
153	F	88.7	Confident	89.4	Confident	31 Å²	31	18.7 Å²	18.7	14%	0.136	9%	0.092	C	C	.	.	H	α-helix	trans	-71.2	-43.8	-175.3	-61.6	-63.9	0	0	0	111.4	T151 V155 Q156 S157 P557	T151-F153 PolarHBondContact O-N 3.47Å; T151-F153 WeakPolarHBondContact OG1-CD2 3.5Å; T151-F153 PolarHBondContact OG1-N 2.96Å; T151-F153 VanDerWaalsContact OG1-N 3.11Å; F153-V155 PolarHBondContact O-N 2.87Å; F153-Q156 PolarHBondContact O-N 3.28Å; F153-S157 WeakPolarHBondContact O-CB 3.49Å; F153-S157 PolarHBondContact O-N 3.01Å; F153-S157 PolarHBondContact O-OG 3.22Å; F153-P557 HydrophobicContact CE2-CB 3.78Å; F153-P557 HydrophobicContact CE2-CG 4.1Å; F153-P557 HydrophobicContact CZ-CB 4.01Å; F153-P557 HydrophobicContact CZ-CG 4.06Å
154	E	91.5	Very high	89.2	Confident	1 Å²	1	18.3 Å²	18.3	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-62.1	-44	175.7	-67.4	66	-138.6	0	0	110.6	L143 T151 S157 A158 H429 H556	L143-E154 HydrophobicContact CB-CB 4.22Å; L143-E154 HydrophobicContact CB-CG 4.13Å; T151-E154 VanDerWaalsContact CA-OE2 3.28Å; T151-E154 WeakPolarHBondContact CA-OE2 3.35Å; T151-E154 VanDerWaalsContact CB-OE2 3.28Å; T151-E154 WeakPolarHBondContact CB-OE2 3.43Å; T151-E154 PolarHBondContact N-OE2 3.05Å; T151-E154 PolarHBondContact OG1-OE2 3.13Å; E154-S157 PolarHBondContact O-N 3.43Å; E154-A158 VanDerWaalsContact O-CB 3.32Å; E154-A158 WeakPolarHBondContact O-CB 3.48Å; E154-A158 PolarHBondContact O-N 3.03Å; E154-H429 IonicContact OE1-CE1 3.35Å; E154-H556 IonicContact OE1-CE1 3.26Å; E154-H556 IonicContact OE1-NE2 3.92Å
155	V	93.5	Very high	88.7	Confident	1 Å²	1	20.2 Å²	20.2	1%	0.006	10%	0.097	C	C	.	.	H	α-helix	trans	-66.7	-44.2	178.4	178.5	0	0	0	0	111.5	A140 T151 F153 S157 A158 I159 M211 A224 L228	A140-V155 HydrophobicContact CB-CG2 4.37Å; T151-V155 PolarHBondContact O-N 3.44Å; F153-V155 PolarHBondContact O-N 2.87Å; V155-S157 PolarHBondContact O-N 3.24Å; V155-A158 PolarHBondContact O-N 2.93Å; V155-I159 HydrophobicContact CG1-CD1 3.99Å; V155-I159 HydrophobicContact CG1-CG1 4.48Å; V155-I159 VanDerWaalsContact O-CG1 3.23Å; V155-I159 WeakPolarHBondContact O-CG1 3.38Å; V155-I159 PolarHBondContact O-N 3.3Å; V155-M211 HydrophobicContact CG2-CE 4.46Å; V155-A224 HydrophobicContact CG2-CB 3.87Å; V155-L228 HydrophobicContact CG1-CB 4.11Å; V155-L228 HydrophobicContact CG1-CD1 4.48Å
156	Q	92.3	Very high	88.5	Confident	27 Å²	27	19.1 Å²	19.1	13%	0.126	9%	0.092	C	C	.	.	H	α-helix	trans	-63.9	-40.7	177.4	-76.6	179.6	-9.2	0	0	112.3	R152 F153 I159 K160 T175	R152-Q156 VanDerWaalsContact O-CB 3.27Å; R152-Q156 WeakPolarHBondContact O-CB 3.44Å; R152-Q156 WeakPolarHBondContact O-CG 3.25Å; R152-Q156 PolarHBondContact O-N 3.42Å; F153-Q156 PolarHBondContact O-N 3.28Å; Q156-I159 PolarHBondContact O-N 3.34Å; Q156-K160 WeakPolarHBondContact O-CG 3.47Å; Q156-K160 PolarHBondContact O-N 3.18Å; Q156-T175 PolarHBondContact NE2-OG1 3.44Å; Q156-T175 VanDerWaalsContact NE2-OG1 3.11Å
157	S	91.9	Very high	88.6	Confident	15 Å²	15	18 Å²	18	11%	0.105	9%	0.086	C	C	.	.	H	α-helix	trans	-64.3	-42.9	172.9	-73	0	0	0	0	111.3	F153 E154 V155 I159 K160 L161 H429	F153-S157 WeakPolarHBondContact O-CB 3.49Å; F153-S157 PolarHBondContact O-N 3.01Å; F153-S157 PolarHBondContact O-OG 3.22Å; E154-S157 PolarHBondContact O-N 3.43Å; V155-S157 PolarHBondContact O-N 3.24Å; S157-I159 PolarHBondContact O-N 2.94Å; S157-K160 CarbonylContact O-C 3.05Å; S157-K160 WeakPolarHBondContact O-CB 3.45Å; S157-K160 PolarHBondContact O-N 3.43Å; S157-L161 VanDerWaalsContact O-CG 3.27Å; S157-L161 WeakPolarHBondContact O-CG 3.25Å; S157-L161 PolarHBondContact O-N 3.47Å; S157-H429 WeakPolarHBondContact CB-ND1 3.4Å; S157-H429 PolarHBondContact OG-ND1 3.35Å
158	A	94.4	Very high	88.9	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-59.9	-43.2	175.1	0	0	0	0	0	112.6	I136 E139 A140 L143 E154 V155 K160 L161 I162	I136-A158 HydrophobicContact CG2-CB 4.17Å; I136-A158 WeakPolarHBondContact O-CB 3.3Å; E139-A158 HydrophobicContact CB-CB 3.94Å; A140-A158 HydrophobicContact CB-CB 3.99Å; L143-A158 HydrophobicContact CD1-CB 4.47Å; E154-A158 VanDerWaalsContact O-CB 3.32Å; E154-A158 WeakPolarHBondContact O-CB 3.48Å; E154-A158 PolarHBondContact O-N 3.03Å; V155-A158 PolarHBondContact O-N 2.93Å; A158-K160 VanDerWaalsContact C-N 3.33Å; A158-K160 PolarHBondContact O-N 2.89Å; A158-L161 PolarHBondContact O-N 3.46Å; A158-L161 VanDerWaalsContact O-N 3.16Å; A158-I162 WeakPolarHBondContact O-CD1 3.26Å; A158-I162 PolarHBondContact O-N 3.45Å; A158-I162 VanDerWaalsContact O-N 3.1Å
159	I	92.9	Very high	89	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-56.9	-48.8	173.9	-68.3	163.8	0	0	0	110.3	I136 V155 Q156 S157 L161 I162 Q163 C171 T175 C231	I136-I159 HydrophobicContact CD1-CG1 4.46Å; I136-I159 HydrophobicContact CG2-CG1 4.1Å; V155-I159 HydrophobicContact CG1-CD1 3.99Å; V155-I159 HydrophobicContact CG1-CG1 4.48Å; V155-I159 VanDerWaalsContact O-CG1 3.23Å; V155-I159 WeakPolarHBondContact O-CG1 3.38Å; V155-I159 PolarHBondContact O-N 3.3Å; Q156-I159 PolarHBondContact O-N 3.34Å; S157-I159 PolarHBondContact O-N 2.94Å; I159-L161 VanDerWaalsContact C-N 3.31Å; I159-L161 PolarHBondContact O-N 3.21Å; I159-I162 PolarHBondContact O-N 3.32Å; I159-Q163 HydrophobicContact CG2-CG 4.47Å; I159-Q163 WeakPolarHBondContact O-CB 3.15Å; I159-Q163 PolarHBondContact O-N 2.84Å; I159-C171 HydrophobicContact CG2-CB 3.82Å; I159-T175 HydrophobicContact CD1-CG2 4.4Å; I159-C231 HydrophobicContact CD1-CB 3.55Å; I159-C231 HydrophobicContact CG1-CB 4.2Å
160	K	91.1	Very high	89.1	Confident	67 Å²	67	20 Å²	20	29%	0.291	10%	0.098	S	C	.	.	H	α-helix	trans	-63.7	-30.8	177.1	-75.7	-179	169.8	-167.3	0	113.9	Q156 S157 A158 R421 T425 E428	Q156-K160 WeakPolarHBondContact O-CG 3.47Å; Q156-K160 PolarHBondContact O-N 3.18Å; S157-K160 CarbonylContact O-C 3.05Å; S157-K160 WeakPolarHBondContact O-CB 3.45Å; S157-K160 PolarHBondContact O-N 3.43Å; A158-K160 VanDerWaalsContact C-N 3.33Å; A158-K160 PolarHBondContact O-N 2.89Å; K160-R421 PolarHBondContact O-NH1 3.14Å; K160-T425 HydrophobicContact CB-CG2 3.61Å; K160-T425 HydrophobicContact CD-CG2 4.22Å; K160-E428 IonicContact NZ-OE2 3.21Å; K160-E428 PolarHBondContact NZ-OE2 2.72Å
161	L	91.5	Very high	89.1	Confident	1 Å²	1	20.1 Å²	20.1	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-72.4	-39.9	178.5	-71.7	169	0	0	0	111.5	L143 S157 A158 I159 R421 V422 T425 Y426 L446	L143-L161 HydrophobicContact CD1-CD1 3.96Å; S157-L161 VanDerWaalsContact O-CG 3.27Å; S157-L161 WeakPolarHBondContact O-CG 3.25Å; S157-L161 PolarHBondContact O-N 3.47Å; A158-L161 PolarHBondContact O-N 3.46Å; A158-L161 VanDerWaalsContact O-N 3.16Å; I159-L161 VanDerWaalsContact C-N 3.31Å; I159-L161 PolarHBondContact O-N 3.21Å; L161-R421 VanDerWaalsContact C-NH1 3.33Å; L161-R421 PolarHBondContact O-NH1 3.02Å; L161-R421 PolarHBondContact O-NH2 3.05Å; L161-V422 HydrophobicContact CD2-CB 4.48Å; L161-V422 HydrophobicContact CD2-CG1 3.76Å; L161-T425 HydrophobicContact CD2-CG2 3.73Å; L161-T425 HydrophobicContact CG-CG2 3.83Å; L161-Y426 HydrophobicContact CD1-CD1 4.25Å; L161-Y426 HydrophobicContact CD1-CE1 3.65Å; L161-Y426 HydrophobicContact CD2-CD1 4.24Å; L161-Y426 HydrophobicContact CD2-CD2 3.84Å; L161-Y426 HydrophobicContact CD2-CE1 4.09Å; L161-Y426 HydrophobicContact CD2-CE2 3.68Å; L161-Y426 HydrophobicContact CD2-CG 4.12Å; L161-L446 HydrophobicContact CB-CD2 4.15Å
162	I	90.7	Very high	89.1	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-92.4	-38.8	-171.2	-69.8	151.9	0	0	0	113.4	R135 I136 E139 A158 I159 V274 L281	R135-I162 HydrophobicContact CB-CD1 3.85Å; R135-I162 HydrophobicContact CB-CG1 4.26Å; R135-I162 HydrophobicContact CB-CG2 3.95Å; R135-I162 WeakPolarHBondContact O-CD1 3.32Å; I136-I162 HydrophobicContact CB-CD1 4.11Å; I136-I162 HydrophobicContact CG1-CB 4.44Å; I136-I162 HydrophobicContact CG1-CD1 3.77Å; I136-I162 HydrophobicContact CG1-CG2 4.38Å; I136-I162 VanDerWaalsContact N-CD1 3.26Å; E139-I162 HydrophobicContact CB-CD1 3.95Å; E139-I162 HydrophobicContact CG-CD1 3.63Å; E139-I162 HydrophobicContact CG-CG1 4.01Å; A158-I162 WeakPolarHBondContact O-CD1 3.26Å; A158-I162 PolarHBondContact O-N 3.45Å; A158-I162 VanDerWaalsContact O-N 3.1Å; I159-I162 PolarHBondContact O-N 3.32Å; I162-V274 HydrophobicContact CG2-CG1 4.09Å; I162-V274 HydrophobicContact CG2-CG2 4.29Å; I162-L281 HydrophobicContact CG2-CD1 4.17Å; I162-L281 WeakPolarHBondContact O-CD2 3.39Å
163	Q	86.9	Confident	89.2	Confident	1 Å²	1	22.8 Å²	22.8	1%	0.005	12%	0.12	C	C	.	.	S	Bend	trans	-85.2	156.6	-177.8	-63.4	-173.3	-9.1	0	0	111.1	I159 L167 C171 C231 R421	I159-Q163 HydrophobicContact CG2-CG 4.47Å; I159-Q163 WeakPolarHBondContact O-CB 3.15Å; I159-Q163 PolarHBondContact O-N 2.84Å; Q163-L167 HydrophobicContact CB-CB 3.98Å; Q163-L167 VanDerWaalsContact OE1-C 3.31Å; Q163-L167 PolarHBondContact OE1-O 3.1Å; Q163-C171 PolarHBondContact OE1-SG 2.94Å; Q163-C231 PolarHBondContact NE2-SG 3.16Å; Q163-R421 PolarHBondContact O-NH1 2.9Å; Q163-R421 VanDerWaalsContact O-NH1 3.11Å
164	S	84.3	Confident	89.3	Confident	9 Å²	9	22.3 Å²	22.3	6%	0.063	12%	0.122	C	C	.	.			trans	-59.9	163.6	168.4	69.3	0	0	0	0	110.7	S166 L167 S168 E270	S164-S166 PolarHBondContact O-N 2.91Å; S164-S166 PolarHBondContact OG-OG 3.36Å; S164-L167 PolarHBondContact O-N 3.4Å; S164-L167 WeakPolarHBondContact OG-CB 3.48Å; S164-L167 WeakPolarHBondContact OG-CG 3.47Å; S164-S168 VanDerWaalsContact O-CB 3.29Å; S164-S168 WeakPolarHBondContact O-CB 3.43Å; S164-S168 PolarHBondContact O-N 3.5Å; S164-S168 PolarHBondContact O-OG 2.92Å; S164-E270 WeakPolarHBondContact OG-CB 3.36Å
165	W	80.8	Confident	89.3	Confident	43 Å²	43	22.3 Å²	22.3	16%	0.163	12%	0.122	C	C	.	.	H	α-helix	trans	-52.3	-52.9	-178.3	-168.3	-74.4	0	0	0	112.9	S168 E169 F297 M348 R421	W165-S168 PolarHBondContact O-N 3.45Å; W165-S168 PolarHBondContact O-OG 3.45Å; W165-E169 PolarHBondContact NE1-OE1 3.42Å; W165-E169 PolarHBondContact O-N 3.07Å; W165-F297 HydrophobicContact CB-CE2 4.33Å; W165-F297 AromaticContact CD2-CE2 3.97Å; W165-F297 HydrophobicContact CD2-CE2 3.97Å; W165-F297 HydrophobicContact CD2-CZ 4.2Å; W165-F297 HydrophobicContact CE3-CE2 4.23Å; W165-F297 HydrophobicContact CE3-CZ 4.35Å; W165-F297 AromaticContact CG-CE2 4Å; W165-F297 HydrophobicContact CG-CE2 4Å; W165-M348 HydrophobicContact CH2-CE 3.72Å; W165-M348 HydrophobicContact CZ3-CE 3.57Å; W165-R421 HydrophobicContact CE3-CG 4.1Å; W165-R421 HydrophobicContact CZ3-CG 4.47Å
166	S	81.5	Confident	89.1	Confident	32 Å²	32	24.9 Å²	24.9	22%	0.224	14%	0.137	C	C	.	.	H	α-helix	trans	-61.3	-49	-179.5	49.7	0	0	0	0	113	S164 S168 E169 S170 E270	S164-S166 PolarHBondContact O-N 2.91Å; S164-S166 PolarHBondContact OG-OG 3.36Å; S166-S168 VanDerWaalsContact C-N 3.32Å; S166-S168 PolarHBondContact O-N 3.06Å; S166-E169 PolarHBondContact O-N 3.06Å; S166-S170 PolarHBondContact O-N 3.02Å; S166-E270 PolarHBondContact OG-OE1 3.13Å; S166-E270 PolarHBondContact OG-OE2 3.48Å
167	L	86.5	Confident	89.1	Confident	2 Å²	2	30.4 Å²	30.4	1%	0.01	16%	0.161	C	C	.	.	H	α-helix	trans	-61.9	-41.9	177.7	-72.5	177.4	0	0	0	111.3	Q163 S164 S170 C171 E238 R242 E270 L271	Q163-L167 HydrophobicContact CB-CB 3.98Å; Q163-L167 VanDerWaalsContact OE1-C 3.31Å; Q163-L167 PolarHBondContact OE1-O 3.1Å; S164-L167 PolarHBondContact O-N 3.4Å; S164-L167 WeakPolarHBondContact OG-CB 3.48Å; S164-L167 WeakPolarHBondContact OG-CG 3.47Å; L167-S170 PolarHBondContact O-N 3.18Å; L167-C171 WeakPolarHBondContact O-CB 3.15Å; L167-C171 PolarHBondContact O-N 3.15Å; L167-C171 PolarHBondContact O-SG 2.85Å; L167-E238 HydrophobicContact CD2-CG 3.58Å; L167-R242 VanDerWaalsContact CD2-NH2 3.27Å; L167-E270 HydrophobicContact CD1-CB 3.79Å; L167-E270 WeakPolarHBondContact CD1-O 3.43Å; L167-E270 HydrophobicContact CG-CB 4.3Å; L167-L271 HydrophobicContact CD1-CD2 3.86Å; L167-L271 HydrophobicContact CD2-CD2 4.31Å
168	S	88.4	Confident	89.1	Confident	10 Å²	10	29.9 Å²	29.9	7%	0.07	16%	0.157	C	C	.	.	H	α-helix	trans	-65.6	-40.9	178.8	77.6	0	0	0	0	112.2	S164 W165 S166 C171 V172	S164-S168 VanDerWaalsContact O-CB 3.29Å; S164-S168 WeakPolarHBondContact O-CB 3.43Å; S164-S168 PolarHBondContact O-N 3.5Å; S164-S168 PolarHBondContact O-OG 2.92Å; W165-S168 PolarHBondContact O-N 3.45Å; W165-S168 PolarHBondContact O-OG 3.45Å; S166-S168 VanDerWaalsContact C-N 3.32Å; S166-S168 PolarHBondContact O-N 3.06Å; S168-C171 PolarHBondContact O-N 3.22Å; S168-V172 WeakPolarHBondContact O-CB 3.35Å; S168-V172 WeakPolarHBondContact O-CG2 3.43Å; S168-V172 PolarHBondContact O-N 3.49Å
169	E	85.8	Confident	88.8	Confident	53 Å²	53	30.5 Å²	30.5	25%	0.248	16%	0.161	C	C	.	.	H	α-helix	trans	-63	-46.9	175.1	-76.6	-163.5	-177.4	0	0	111.1	W165 S166 V172 L173 R355	W165-E169 PolarHBondContact NE1-OE1 3.42Å; W165-E169 PolarHBondContact O-N 3.07Å; S166-E169 PolarHBondContact O-N 3.06Å; E169-V172 PolarHBondContact O-N 3.46Å; E169-L173 WeakPolarHBondContact O-CB 3.31Å; E169-L173 VanDerWaalsContact O-CG 3.27Å; E169-L173 WeakPolarHBondContact O-CG 3.27Å; E169-L173 PolarHBondContact O-N 3.13Å; E169-R355 IonicContact OE1-NH2 2.59Å; E169-R355 IonicContact OE2-CZ 3.91Å; E169-R355 IonicContact OE2-NH1 2.8Å; E169-R355 IonicContact OE2-NH2 3.77Å; E169-R355 PolarHBondContact OE2-NH2 3.48Å
170	S	89.6	Confident	88.6	Confident	35 Å²	35	33.2 Å²	33.2	25%	0.245	18%	0.179	C	C	.	.	H	α-helix	trans	-57.6	-49.9	176.7	-179.4	0	0	0	0	111.4	S166 L167 V172 L173 A174 N234	S166-S170 PolarHBondContact O-N 3.02Å; L167-S170 PolarHBondContact O-N 3.18Å; S170-V172 PolarHBondContact O-N 2.85Å; S170-L173 PolarHBondContact O-N 3.49Å; S170-A174 PolarHBondContact O-N 2.91Å; S170-N234 PolarHBondContact OG-ND2 3.05Å
171	C	91.2	Very high	88.5	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.007	18%	0.182	C	C	.	.	H	α-helix	trans	-63.5	-42.9	178.7	-71.2	0	0	0	0	112.4	I159 Q163 L167 S168 L173 A174 T175 C231 N234	I159-C171 HydrophobicContact CG2-CB 3.82Å; Q163-C171 PolarHBondContact OE1-SG 2.94Å; L167-C171 WeakPolarHBondContact O-CB 3.15Å; L167-C171 PolarHBondContact O-N 3.15Å; L167-C171 PolarHBondContact O-SG 2.85Å; S168-C171 PolarHBondContact O-N 3.22Å; C171-L173 VanDerWaalsContact C-N 3.35Å; C171-L173 PolarHBondContact O-N 3.16Å; C171-A174 WeakPolarHBondContact O-CB 3.39Å; C171-A174 PolarHBondContact O-N 3.34Å; C171-T175 WeakPolarHBondContact O-CG2 3.4Å; C171-T175 PolarHBondContact O-N 3.15Å; C171-C231 HydrophobicContact CB-CB 4.37Å; C171-N234 PolarHBondContact N-ND2 3.47Å; C171-N234 PolarHBondContact SG-ND2 3.33Å; C171-N234 VanDerWaalsContact SG-ND2 3.43Å
172	V	89.1	Confident	88.2	Confident	29 Å²	29	33.2 Å²	33.2	18%	0.176	18%	0.182	C	C	.	.	H	α-helix	trans	-64	-40.4	177.4	171	0	0	0	0	110.8	S168 E169 S170 T175 V176	S168-V172 WeakPolarHBondContact O-CB 3.35Å; S168-V172 WeakPolarHBondContact O-CG2 3.43Å; S168-V172 PolarHBondContact O-N 3.49Å; E169-V172 PolarHBondContact O-N 3.46Å; S170-V172 PolarHBondContact O-N 2.85Å; V172-T175 PolarHBondContact O-N 3.25Å; V172-T175 PolarHBondContact O-OG1 3.11Å; V172-V176 WeakPolarHBondContact O-CG2 3.16Å; V172-V176 PolarHBondContact O-N 2.96Å
173	L	90.1	Very high	87.8	Confident	119 Å²	119	34.6 Å²	34.6	62%	0.623	19%	0.192	S	C	*	.	H	α-helix	trans	-62.5	-42.9	174.7	-72.7	170.8	0	0	0	112	E169 S170 C171 T175 V176 K177	E169-L173 WeakPolarHBondContact O-CB 3.31Å; E169-L173 VanDerWaalsContact O-CG 3.27Å; E169-L173 WeakPolarHBondContact O-CG 3.27Å; E169-L173 PolarHBondContact O-N 3.13Å; S170-L173 PolarHBondContact O-N 3.49Å; C171-L173 VanDerWaalsContact C-N 3.35Å; C171-L173 PolarHBondContact O-N 3.16Å; L173-T175 VanDerWaalsContact C-N 3.31Å; L173-T175 PolarHBondContact O-N 3.22Å; L173-V176 PolarHBondContact O-N 3.33Å; L173-K177 PolarHBondContact O-N 3.21Å
174	A	91.4	Very high	87.5	Confident	22 Å²	22	42.3 Å²	42.3	18%	0.182	23%	0.23	C	C	.	.	H	α-helix	trans	-59.7	-41.2	173.5	0	0	0	0	0	111.7	S170 C171 V176 K177 A178 N234	S170-A174 PolarHBondContact O-N 2.91Å; C171-A174 WeakPolarHBondContact O-CB 3.39Å; C171-A174 PolarHBondContact O-N 3.34Å; A174-V176 PolarHBondContact O-N 3.26Å; A174-K177 PolarHBondContact O-N 3.41Å; A174-A178 PolarHBondContact O-N 2.97Å; A174-N234 HydrophobicContact CB-CB 3.81Å
175	T	91	Very high	87	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.7	-41.8	175.9	74.1	0	0	0	0	112.2	Q156 I159 C171 V172 L173 K177 A178 L179 S227 S230	Q156-T175 PolarHBondContact NE2-OG1 3.44Å; Q156-T175 VanDerWaalsContact NE2-OG1 3.11Å; I159-T175 HydrophobicContact CD1-CG2 4.4Å; C171-T175 WeakPolarHBondContact O-CG2 3.4Å; C171-T175 PolarHBondContact O-N 3.15Å; V172-T175 PolarHBondContact O-N 3.25Å; V172-T175 PolarHBondContact O-OG1 3.11Å; L173-T175 VanDerWaalsContact C-N 3.31Å; L173-T175 PolarHBondContact O-N 3.22Å; T175-K177 VanDerWaalsContact C-N 3.35Å; T175-K177 PolarHBondContact O-N 3.31Å; T175-A178 PolarHBondContact O-N 2.92Å; T175-L179 WeakPolarHBondContact O-CB 3.45Å; T175-L179 VanDerWaalsContact O-CG 3.29Å; T175-L179 WeakPolarHBondContact O-CG 3.42Å; T175-L179 PolarHBondContact O-N 2.88Å; T175-S227 WeakPolarHBondContact CG2-O 3.22Å; T175-S230 WeakPolarHBondContact CA-OG 3.48Å; T175-S230 VanDerWaalsContact CG2-OG 3.32Å; T175-S230 WeakPolarHBondContact CG2-OG 3.32Å
176	V	90.2	Very high	86	Confident	55 Å²	55	43.2 Å²	43.2	33%	0.333	25%	0.245	S	C	.	.	H	α-helix	trans	-64.9	-41.3	178.4	172.4	0	0	0	0	110.6	V172 L173 A174 L179 S180	V172-V176 WeakPolarHBondContact O-CG2 3.16Å; V172-V176 PolarHBondContact O-N 2.96Å; L173-V176 PolarHBondContact O-N 3.33Å; A174-V176 PolarHBondContact O-N 3.26Å; V176-L179 PolarHBondContact O-N 3.12Å; V176-S180 WeakPolarHBondContact O-CB 3.31Å; V176-S180 PolarHBondContact O-N 3.19Å; V176-S180 PolarHBondContact O-OG 3.27Å
177	K	91.8	Very high	84.9	Confident	144 Å²	144	45.6 Å²	45.6	63%	0.626	27%	0.274	S	S	*	.	H	α-helix	trans	-61.5	-46.4	175.2	-177.8	-174.2	176.1	-173.4	0	111.9	L173 A174 T175 S180 L181	L173-K177 PolarHBondContact O-N 3.21Å; A174-K177 PolarHBondContact O-N 3.41Å; T175-K177 VanDerWaalsContact C-N 3.35Å; T175-K177 PolarHBondContact O-N 3.31Å; K177-S180 WeakPolarHBondContact CA-OG 3.49Å; K177-S180 PolarHBondContact O-N 3.47Å; K177-S180 PolarHBondContact O-OG 3.37Å; K177-L181 HydrophobicContact CG-CD1 4.45Å; K177-L181 WeakPolarHBondContact O-CG 3.43Å; K177-L181 PolarHBondContact O-N 2.94Å
178	A	91.4	Very high	83.7	Confident	3 Å²	3	48.1 Å²	48.1	3%	0.025	29%	0.288	C	S	.	.	H	α-helix	trans	-62.8	-45.8	178.6	0	0	0	0	0	111.6	A174 T175 S180 L181 Y182 C198 L200 I226	A174-A178 PolarHBondContact O-N 2.97Å; T175-A178 PolarHBondContact O-N 2.92Å; A178-S180 VanDerWaalsContact C-N 3.34Å; A178-S180 PolarHBondContact O-N 3.31Å; A178-L181 PolarHBondContact O-N 3.05Å; A178-Y182 PolarHBondContact O-N 3.35Å; A178-C198 HydrophobicContact CB-CB 4.34Å; A178-L200 HydrophobicContact CB-CD1 4.34Å; A178-L200 HydrophobicContact CB-CD2 4.45Å; A178-I226 HydrophobicContact CB-CG2 4.02Å
179	L	88.5	Confident	82.3	Confident	14 Å²	14	48 Å²	48	7%	0.073	29%	0.289	C	S	.	.	H	α-helix	trans	-64.4	-36.3	176.9	-70.5	171.4	0	0	0	112.5	T175 V176 Y182 S183 Y223 I226	T175-L179 WeakPolarHBondContact O-CB 3.45Å; T175-L179 VanDerWaalsContact O-CG 3.29Å; T175-L179 WeakPolarHBondContact O-CG 3.42Å; T175-L179 PolarHBondContact O-N 2.88Å; V176-L179 PolarHBondContact O-N 3.12Å; L179-Y182 WeakPolarHBondContact O-CB 3.42Å; L179-Y182 PolarHBondContact O-N 3.03Å; L179-S183 PolarHBondContact O-N 2.82Å; L179-S183 PolarHBondContact O-OG 3.16Å; L179-Y223 HydrophobicContact CD2-CD1 3.66Å; L179-Y223 HydrophobicContact CD2-CE1 4.37Å; L179-Y223 HydrophobicContact CD2-CG 3.81Å; L179-I226 HydrophobicContact CD2-CB 4.12Å; L179-I226 HydrophobicContact CD2-CD1 4.24Å; L179-I226 HydrophobicContact CD2-CG2 3.86Å; L179-I226 HydrophobicContact CG-CG2 4.25Å
180	S	88.7	Confident	81.2	Confident	56 Å²	56	47.6 Å²	47.6	39%	0.392	29%	0.288	S	S	.	.	H	α-helix	trans	-66.7	-41.1	175.7	60.9	0	0	0	0	112	V176 K177 A178 Y182 S183 M184	V176-S180 WeakPolarHBondContact O-CB 3.31Å; V176-S180 PolarHBondContact O-N 3.19Å; V176-S180 PolarHBondContact O-OG 3.27Å; K177-S180 WeakPolarHBondContact CA-OG 3.49Å; K177-S180 PolarHBondContact O-N 3.47Å; K177-S180 PolarHBondContact O-OG 3.37Å; A178-S180 VanDerWaalsContact C-N 3.34Å; A178-S180 PolarHBondContact O-N 3.31Å; S180-Y182 VanDerWaalsContact C-N 3.32Å; S180-Y182 PolarHBondContact O-N 3.4Å; S180-S183 PolarHBondContact O-N 3.18Å; S180-M184 VanDerWaalsContact O-CG 3.31Å; S180-M184 WeakPolarHBondContact O-CG 3.07Å; S180-M184 PolarHBondContact O-N 3.34Å
181	L	88.3	Confident	80.3	Confident	66 Å²	66	52.9 Å²	52.9	35%	0.346	30%	0.303	S	S	.	.	H	α-helix	trans	-64.2	-40	175.6	-71	172.9	0	0	0	111.5	K177 A178 S183 M184 S185 R197 C198	K177-L181 HydrophobicContact CG-CD1 4.45Å; K177-L181 WeakPolarHBondContact O-CG 3.43Å; K177-L181 PolarHBondContact O-N 2.94Å; A178-L181 PolarHBondContact O-N 3.05Å; L181-S183 PolarHBondContact O-N 3.24Å; L181-M184 PolarHBondContact O-N 3.31Å; L181-S185 WeakPolarHBondContact O-CB 3.42Å; L181-S185 PolarHBondContact O-N 3.16Å; L181-S185 VanDerWaalsContact O-N 3.12Å; L181-S185 PolarHBondContact O-OG 3.42Å; L181-R197 CarbonylContact C-O 3.51Å; L181-R197 VanDerWaalsContact C-O 3.3Å; L181-C198 WeakPolarHBondContact CD1-O 3.22Å
182	Y	85.8	Confident	79.6	Confident	3 Å²	3	57.3 Å²	57.3	1%	0.012	32%	0.322	C	S	.	.	H	α-helix	trans	-59.6	-46.7	175.1	-171.7	-104.8	0	0	0	112.3	A178 L179 S180 S185 K194 R197 E222 Y223 I226 E642	A178-Y182 PolarHBondContact O-N 3.35Å; L179-Y182 WeakPolarHBondContact O-CB 3.42Å; L179-Y182 PolarHBondContact O-N 3.03Å; S180-Y182 VanDerWaalsContact C-N 3.32Å; S180-Y182 PolarHBondContact O-N 3.4Å; Y182-S185 PolarHBondContact O-N 2.92Å; Y182-S185 VanDerWaalsContact O-N 3.15Å; Y182-K194 HydrophobicContact CE2-CB 4.44Å; Y182-K194 HydrophobicContact CE2-CG 4.32Å; Y182-R197 HydrophobicContact CD2-CB 4Å; Y182-R197 HydrophobicContact CE2-CB 4.46Å; Y182-R197 VanDerWaalsContact CE2-CZ 3.48Å; Y182-R197 PolarHBondContact N-O 3.26Å; Y182-R197 PolarHBondContact O-NH2 2.85Å; Y182-R197 PolarHBondContact OH-NH1 3.19Å; Y182-E222 WeakPolarHBondContact CE1-OE1 3.37Å; Y182-E222 PolarHBondContact OH-OE1 3.35Å; Y182-E222 PolarHBondContact OH-OE2 3.06Å; Y182-E222 VanDerWaalsContact OH-OE2 3.07Å; Y182-Y223 AromaticContact CD1-CE1 3.91Å; Y182-Y223 HydrophobicContact CD1-CE1 3.91Å; Y182-Y223 AromaticContact CE1-CE1 3.89Å; Y182-Y223 HydrophobicContact CE1-CE1 3.89Å; Y182-I226 HydrophobicContact CD1-CD1 4.17Å; Y182-I226 HydrophobicContact CD2-CD1 4.02Å; Y182-I226 HydrophobicContact CE1-CD1 4.37Å; Y182-I226 HydrophobicContact CE2-CD1 4.22Å; Y182-I226 HydrophobicContact CG-CD1 3.97Å; Y182-E642 PolarHBondContact OH-OE2 3.47Å
183	S	81.8	Confident	79.3	Confident	30 Å²	30	56.2 Å²	56.2	21%	0.21	32%	0.316	C	S	.	.	H	α-helix	trans	-67.2	-39.8	-179.5	-51.3	0	0	0	0	112	L179 S180 L181 S185 A186	L179-S183 PolarHBondContact O-N 2.82Å; L179-S183 PolarHBondContact O-OG 3.16Å; S180-S183 PolarHBondContact O-N 3.18Å; L181-S183 PolarHBondContact O-N 3.24Å; S183-S185 PolarHBondContact O-N 3.46Å; S183-A186 WeakPolarHBondContact O-CB 3.45Å; S183-A186 PolarHBondContact O-N 3.23Å
184	M	80.9	Confident	79.1	Confident	163 Å²	163	50.6 Å²	50.6	80%	0.803	29%	0.287	S	S	*	.	H	α-helix	trans	-65.8	-22.3	174.3	-70.7	-180	69.4	0	0	112.9	S180 L181	S180-M184 VanDerWaalsContact O-CG 3.31Å; S180-M184 WeakPolarHBondContact O-CG 3.07Å; S180-M184 PolarHBondContact O-N 3.34Å; L181-M184 PolarHBondContact O-N 3.31Å
185	S	74.6	Confident	78.9	Confident	37 Å²	37	50.4 Å²	50.4	26%	0.259	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	13.5	-178.1	-54.4	0	0	0	0	113.6	L181 Y182 S183 G187 D188 R197	L181-S185 WeakPolarHBondContact O-CB 3.42Å; L181-S185 PolarHBondContact O-N 3.16Å; L181-S185 VanDerWaalsContact O-N 3.12Å; L181-S185 PolarHBondContact O-OG 3.42Å; Y182-S185 PolarHBondContact O-N 2.92Å; Y182-S185 VanDerWaalsContact O-N 3.15Å; S183-S185 PolarHBondContact O-N 3.46Å; S185-G187 VanDerWaalsContact C-N 3.26Å; S185-G187 PolarHBondContact O-N 2.72Å; S185-D188 PolarHBondContact O-N 3.09Å; S185-D188 VanDerWaalsContact O-N 3.1Å; S185-R197 PolarHBondContact O-NE 3.46Å
186	A	60.4	Low	78.7	Confident	34 Å²	34	53.5 Å²	53.5	28%	0.281	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-58.3	-32.5	-176	0	0	0	0	0	113.8	S183 D188 G189	S183-A186 WeakPolarHBondContact O-CB 3.45Å; S183-A186 PolarHBondContact O-N 3.23Å; A186-D188 VanDerWaalsContact C-N 3.25Å; A186-D188 PolarHBondContact O-N 3.12Å; A186-G189 PolarHBondContact O-N 3.24Å
187	G	57.4	Low	78.5	Confident	82 Å²	82	51.2 Å²	51.2	85%	0.845	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-69	-17.1	177.3	0	0	0	0	0	115.3	S185	S185-G187 VanDerWaalsContact C-N 3.26Å; S185-G187 PolarHBondContact O-N 2.72Å
188	D	60.9	Low	78.2	Confident	54 Å²	54	44.5 Å²	44.5	29%	0.289	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-99.3	8.1	179.9	-95.8	-6.2	0	0	0	112.4	S185 A186 L190 R191 K192	S185-D188 PolarHBondContact O-N 3.09Å; S185-D188 VanDerWaalsContact O-N 3.1Å; A186-D188 VanDerWaalsContact C-N 3.25Å; A186-D188 PolarHBondContact O-N 3.12Å; D188-L190 PolarHBondContact O-N 3.39Å; D188-R191 PolarHBondContact O-N 3.42Å; D188-K192 WeakPolarHBondContact OD2-CE 3.38Å; D188-K192 IonicContact OD2-NZ 3.03Å; D188-K192 PolarHBondContact OD2-NZ 3.07Å
189	G	58.6	Low	78	Confident	9 Å²	9	46.4 Å²	46.4	9%	0.093	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-19	-158.3	0	0	0	0	0	117.6	A186 Y714	A186-G189 PolarHBondContact O-N 3.24Å; G189-Y714 WeakPolarHBondContact O-CE2 3.2Å; G189-Y714 PolarHBondContact O-OH 3Å
190	L	64.2	Low	78.1	Confident	44 Å²	44	47 Å²	47	23%	0.23	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	1.4	178.6	-60.7	167.4	0	0	0	113.3	D188 E711 Y714 K736	D188-L190 PolarHBondContact O-N 3.39Å; L190-E711 HydrophobicContact CD1-CG 4.29Å; L190-E711 HydrophobicContact CD2-CG 4.35Å; L190-Y714 HydrophobicContact CD2-CD1 4.04Å; L190-Y714 HydrophobicContact CD2-CD2 3.97Å; L190-Y714 HydrophobicContact CD2-CG 3.59Å; L190-K736 HydrophobicContact CB-CD 3.76Å
191	R	69.9	Low	78.2	Confident	146 Å²	146	46.3 Å²	46.3	55%	0.551	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-17.6	-177.1	-69.5	-177.5	171.3	178.2	-4.6	113.8	D188	D188-R191 PolarHBondContact O-N 3.42Å
192	K	77.6	Confident	78.4	Confident	93 Å²	93	43.3 Å²	43.3	40%	0.404	27%	0.267	S	S	.	.	S	Bend	trans	-136.8	151.9	-177.6	-69	174.8	179.8	157.7	0	110.9	D188 R197 Y714	D188-K192 WeakPolarHBondContact OD2-CE 3.38Å; D188-K192 IonicContact OD2-NZ 3.03Å; D188-K192 PolarHBondContact OD2-NZ 3.07Å; K192-R197 HydrophobicContact CB-CG 4.14Å; K192-Y714 PolarHBondContact O-OH 3.02Å
193	G	82.1	Confident	78.7	Confident	6 Å²	6	44 Å²	44	6%	0.062	27%	0.273	C	S	.	.			trans	-66.4	153.3	173.4	0	0	0	0	0	113.4	S195 A196 R197 H738	G193-S195 PolarHBondContact O-N 3.4Å; G193-A196 PolarHBondContact O-N 2.95Å; G193-R197 WeakPolarHBondContact O-CG 3.45Å; G193-R197 PolarHBondContact O-N 3.42Å; G193-R197 VanDerWaalsContact O-N 3.12Å; G193-H738 WeakPolarHBondContact CA-CE1 3.43Å; G193-H738 WeakPolarHBondContact CA-NE2 3.4Å; G193-H738 PolarHBondContact N-CE1 3.16Å; G193-H738 PolarHBondContact N-ND1 2.95Å
194	K	85.1	Confident	79.2	Confident	1 Å²	1	42.6 Å²	42.6	0%	0.004	26%	0.263	C	S	.	.	H	α-helix	trans	-58.9	-38.9	-178.4	-68.4	-173.9	178.7	-161.2	0	112.2	Y182 R197 C198 V204 E222 Y714 Y715 E718 H719	Y182-K194 HydrophobicContact CE2-CB 4.44Å; Y182-K194 HydrophobicContact CE2-CG 4.32Å; K194-R197 PolarHBondContact O-N 3.4Å; K194-C198 PolarHBondContact O-N 3.45Å; K194-C198 VanDerWaalsContact O-N 3.07Å; K194-C198 PolarHBondContact O-SG 3.2Å; K194-V204 HydrophobicContact CB-CB 4.18Å; K194-V204 HydrophobicContact CB-CG1 4.33Å; K194-E222 IonicContact NZ-OE2 3.74Å; K194-E222 PolarHBondContact NZ-OE2 2.82Å; K194-Y714 HydrophobicContact CG-CE1 4.35Å; K194-Y715 VanDerWaalsContact CE-CD1 3.41Å; K194-E718 WeakPolarHBondContact CB-OE2 3.36Å; K194-E718 HydrophobicContact CG-CG 4.48Å; K194-E718 WeakPolarHBondContact CG-OE2 3.18Å; K194-E718 PolarHBondContact N-OE2 3.36Å; K194-H719 PolarHBondContact NZ-NE2 3.45Å
195	S	88.3	Confident	79.6	Confident	19 Å²	19	34.9 Å²	34.9	13%	0.133	23%	0.225	C	C	.	.	H	α-helix	trans	-63.5	-44.2	-179.8	-40.8	0	0	0	0	111.7	G193 R197 C198 G199 L200 F202 S203 V204	G193-S195 PolarHBondContact O-N 3.4Å; S195-R197 PolarHBondContact O-N 3.05Å; S195-C198 PolarHBondContact O-N 3.01Å; S195-G199 PolarHBondContact O-N 3.32Å; S195-G199 VanDerWaalsContact O-N 3.1Å; S195-L200 PolarHBondContact O-N 3.23Å; S195-F202 WeakPolarHBondContact CB-O 3.41Å; S195-F202 PolarHBondContact OG-O 3.45Å; S195-S203 WeakPolarHBondContact OG-CA 3.21Å; S195-V204 PolarHBondContact OG-N 3.22Å
196	A	86	Confident	80.4	Confident	65 Å²	65	37 Å²	37	54%	0.537	23%	0.227	S	C	.	.	H	α-helix	trans	-64.4	-40.1	176.7	0	0	0	0	0	111.8	G193 C198 G199	G193-A196 PolarHBondContact O-N 2.95Å; A196-C198 VanDerWaalsContact C-N 3.26Å; A196-C198 PolarHBondContact O-N 2.98Å; A196-G199 PolarHBondContact O-N 2.77Å; A196-G199 VanDerWaalsContact O-N 3.12Å
197	R	86	Confident	82	Confident	6 Å²	6	35.4 Å²	35.4	2%	0.023	21%	0.214	C	C	.	.	H	α-helix	trans	-63.7	-30.5	175.4	-67.4	173.6	60.7	-163.7	-4.2	113.1	L181 Y182 S185 K192 G193 K194 S195 E642	L181-R197 CarbonylContact C-O 3.51Å; L181-R197 VanDerWaalsContact C-O 3.3Å; Y182-R197 HydrophobicContact CD2-CB 4Å; Y182-R197 HydrophobicContact CE2-CB 4.46Å; Y182-R197 VanDerWaalsContact CE2-CZ 3.48Å; Y182-R197 PolarHBondContact N-O 3.26Å; Y182-R197 PolarHBondContact O-NH2 2.85Å; Y182-R197 PolarHBondContact OH-NH1 3.19Å; S185-R197 PolarHBondContact O-NE 3.46Å; K192-R197 HydrophobicContact CB-CG 4.14Å; G193-R197 WeakPolarHBondContact O-CG 3.45Å; G193-R197 PolarHBondContact O-N 3.42Å; G193-R197 VanDerWaalsContact O-N 3.12Å; K194-R197 PolarHBondContact O-N 3.4Å; S195-R197 PolarHBondContact O-N 3.05Å; R197-E642 IonicContact CZ-OE1 3.42Å; R197-E642 IonicContact NH1-OE1 2.81Å; R197-E642 PolarHBondContact NH1-OE1 3.08Å; R197-E642 IonicContact NH1-OE2 3.42Å; R197-E642 IonicContact NH2-OE1 3.93Å; R197-E642 PolarHBondContact NH2-OE1 3.14Å
198	C	85.9	Confident	83.7	Confident	3 Å²	3	31.7 Å²	31.7	2%	0.02	17%	0.174	C	C	.	.	H	α-helix	trans	-85.5	-10.4	175.7	-60.9	0	0	0	0	113.5	A178 L181 K194 S195 A196 L200	A178-C198 HydrophobicContact CB-CB 4.34Å; L181-C198 WeakPolarHBondContact CD1-O 3.22Å; K194-C198 PolarHBondContact O-N 3.45Å; K194-C198 VanDerWaalsContact O-N 3.07Å; K194-C198 PolarHBondContact O-SG 3.2Å; S195-C198 PolarHBondContact O-N 3.01Å; A196-C198 VanDerWaalsContact C-N 3.26Å; A196-C198 PolarHBondContact O-N 2.98Å; C198-L200 VanDerWaalsContact C-N 3.27Å; C198-L200 HydrophobicContact CB-CB 4.33Å; C198-L200 HydrophobicContact CB-CD1 3.68Å; C198-L200 HydrophobicContact CB-CG 3.69Å; C198-L200 PolarHBondContact O-N 3.05Å
199	G	87.8	Confident	85.2	Confident	44 Å²	44	32.5 Å²	32.5	45%	0.454	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	22.8	-170.6	0	0	0	0	0	114.1	K107 S195 A196	K107-G199 PolarHBondContact NZ-O 3.35Å; S195-G199 PolarHBondContact O-N 3.32Å; S195-G199 VanDerWaalsContact O-N 3.1Å; A196-G199 PolarHBondContact O-N 2.77Å; A196-G199 VanDerWaalsContact O-N 3.12Å
200	L	90.9	Very high	86.8	Confident	25 Å²	25	32.8 Å²	32.8	13%	0.131	17%	0.172	C	C	.	.			trans	-95.6	145.3	-178.3	-62.9	174.6	0	0	0	110.8	A178 S195 C198 V204 T229	A178-L200 HydrophobicContact CB-CD1 4.34Å; A178-L200 HydrophobicContact CB-CD2 4.45Å; S195-L200 PolarHBondContact O-N 3.23Å; C198-L200 VanDerWaalsContact C-N 3.27Å; C198-L200 HydrophobicContact CB-CB 4.33Å; C198-L200 HydrophobicContact CB-CD1 3.68Å; C198-L200 HydrophobicContact CB-CG 3.69Å; C198-L200 PolarHBondContact O-N 3.05Å; L200-V204 HydrophobicContact CD1-CG2 3.97Å; L200-T229 HydrophobicContact CD1-CG2 3.98Å
201	T	90.2	Very high	88.2	Confident	43 Å²	43	30.8 Å²	30.8	26%	0.264	16%	0.161	S	C	.	.	S	Bend	trans	-86.5	-36.8	176.6	-39	0	0	0	0	110.6	K103 I104 K107 E233	K103-T201 HydrophobicContact CB-CG2 3.85Å; K103-T201 HydrophobicContact CD-CG2 4.46Å; I104-T201 HydrophobicContact CG1-CG2 3.92Å; K107-T201 PolarHBondContact NZ-OG1 3.35Å; K107-T201 VanDerWaalsContact NZ-OG1 3.13Å; T201-E233 WeakPolarHBondContact CA-OE2 3.5Å; T201-E233 PolarHBondContact N-OE1 3.15Å; T201-E233 VanDerWaalsContact N-OE1 3.16Å; T201-E233 PolarHBondContact N-OE2 3.47Å; T201-E233 PolarHBondContact OG1-OE1 3.49Å
202	F	92.5	Very high	89.1	Confident	2 Å²	2	25 Å²	25	1%	0.009	14%	0.142	C	C	.	.	S	Bend	trans	-70.5	145.7	172.7	-74.4	-35.6	0	0	0	112.1	W96 D100 I101 I104 S195 V204 F207 T229 M232 E233 V236	W96-F202 HydrophobicContact CB-CD1 3.89Å; W96-F202 HydrophobicContact CB-CE1 3.61Å; W96-F202 HydrophobicContact CB-CZ 4.31Å; W96-F202 HydrophobicContact CG-CE1 4.12Å; W96-F202 HydrophobicContact CG-CZ 4.39Å; D100-F202 HydrophobicContact CB-CD1 3.82Å; D100-F202 HydrophobicContact CB-CE1 3.76Å; I101-F202 HydrophobicContact CG1-CE1 4.08Å; I101-F202 HydrophobicContact CG1-CZ 3.93Å; I104-F202 HydrophobicContact CD1-CD1 3.79Å; I104-F202 HydrophobicContact CD1-CD2 3.87Å; I104-F202 HydrophobicContact CD1-CE1 3.43Å; I104-F202 VanDerWaalsContact CD1-CE1 3.43Å; I104-F202 HydrophobicContact CD1-CE2 3.53Å; I104-F202 HydrophobicContact CD1-CG 3.99Å; I104-F202 HydrophobicContact CD1-CZ 3.29Å; S195-F202 WeakPolarHBondContact CB-O 3.41Å; S195-F202 PolarHBondContact OG-O 3.45Å; F202-V204 PolarHBondContact O-N 3.4Å; F202-F207 HydrophobicContact CB-CE2 4.03Å; F202-F207 HydrophobicContact CD2-CE2 4.26Å; F202-F207 HydrophobicContact CD2-CZ 4.47Å; F202-F207 HydrophobicContact CG-CE2 4.19Å; F202-T229 HydrophobicContact CB-CG2 3.49Å; F202-T229 VanDerWaalsContact CB-CG2 3.49Å; F202-M232 HydrophobicContact CD2-CB 4.47Å; F202-M232 HydrophobicContact CE2-CB 4.24Å; F202-E233 HydrophobicContact CD2-CB 3.89Å; F202-E233 HydrophobicContact CE2-CB 4.24Å; F202-E233 PolarHBondContact N-OE2 2.99Å; F202-V236 HydrophobicContact CE2-CG2 4.42Å; F202-V236 HydrophobicContact CZ-CG2 4.38Å
203	S	90.8	Very high	89.7	Confident	18 Å²	18	24 Å²	24	13%	0.126	14%	0.141	C	C	.	.			trans	-76.3	109.5	178.8	172.1	0	0	0	0	111.1	S195 G205 R206 F207	S195-S203 WeakPolarHBondContact OG-CA 3.21Å; S203-G205 PolarHBondContact O-N 3.15Å; S203-R206 PolarHBondContact O-N 3.23Å; S203-R206 PolarHBondContact OG-N 2.7Å; S203-F207 WeakPolarHBondContact O-CD2 3.34Å; S203-F207 PolarHBondContact O-N 3.27Å
204	V	92.6	Very high	89.9	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.006	14%	0.142	C	C	.	.	H	α-helix	trans	-59.1	-37.6	175.3	176.9	0	0	0	0	111	K194 S195 L200 F202 F207 F208 A225 I226 T229	K194-V204 HydrophobicContact CB-CB 4.18Å; K194-V204 HydrophobicContact CB-CG1 4.33Å; S195-V204 PolarHBondContact OG-N 3.22Å; L200-V204 HydrophobicContact CD1-CG2 3.97Å; F202-V204 PolarHBondContact O-N 3.4Å; V204-F207 PolarHBondContact O-N 3.31Å; V204-F208 PolarHBondContact O-N 2.94Å; V204-A225 HydrophobicContact CG1-CB 4.26Å; V204-I226 HydrophobicContact CG1-CG1 3.64Å; V204-I226 HydrophobicContact CG2-CG1 4.34Å; V204-T229 HydrophobicContact CG2-CG2 4.14Å
205	G	90.1	Very high	90.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65	-40.8	178.8	0	0	0	0	0	113.7	S203 F208 R209 E718	S203-G205 PolarHBondContact O-N 3.15Å; G205-F208 PolarHBondContact O-N 2.95Å; G205-R209 WeakPolarHBondContact O-CB 3.37Å; G205-R209 PolarHBondContact O-N 2.94Å; G205-E718 VanDerWaalsContact CA-O 3.27Å; G205-E718 WeakPolarHBondContact CA-O 3.49Å
206	R	91.4	Very high	90.1	Very high	82 Å²	82	31.8 Å²	31.8	31%	0.309	17%	0.168	S	C	.	.	H	α-helix	trans	-64.5	-40.7	172.7	-77.8	-169.2	-75.9	158.9	-1.9	112.3	P95 D100 S203 R209 W210	P95-R206 HydrophobicContact CB-CB 4.2Å; P95-R206 WeakPolarHBondContact O-CB 3.42Å; P95-R206 PolarHBondContact O-NE 3.47Å; P95-R206 PolarHBondContact O-NH1 3.48Å; D100-R206 IonicContact OD1-NH2 3.55Å; D100-R206 IonicContact OD2-CZ 2.74Å; D100-R206 IonicContact OD2-NH1 3.61Å; D100-R206 PolarHBondContact OD2-NH1 3.12Å; D100-R206 IonicContact OD2-NH2 3.65Å; D100-R206 PolarHBondContact OD2-NH2 3.09Å; S203-R206 PolarHBondContact O-N 3.23Å; S203-R206 PolarHBondContact OG-N 2.7Å; R206-R209 PolarHBondContact O-N 3.02Å; R206-W210 VanDerWaalsContact O-CB 3.26Å; R206-W210 WeakPolarHBondContact O-CB 3.46Å; R206-W210 PolarHBondContact O-N 3.27Å
207	F	94	Very high	90.2	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62	-46.7	173.3	-91.2	-97.8	0	0	0	111.2	P95 W96 L133 F202 S203 V204 R209 W210 M211 L228 T229 M232	P95-F207 HydrophobicContact CB-CB 4.44Å; P95-F207 HydrophobicContact CB-CD1 4.32Å; P95-F207 HydrophobicContact CB-CD2 3.67Å; P95-F207 HydrophobicContact CB-CE2 3.95Å; P95-F207 HydrophobicContact CB-CG 3.88Å; P95-F207 HydrophobicContact CB-CZ 4.42Å; P95-F207 HydrophobicContact CG-CD1 3.72Å; P95-F207 HydrophobicContact CG-CD2 3.73Å; P95-F207 HydrophobicContact CG-CE1 3.64Å; P95-F207 HydrophobicContact CG-CE2 3.64Å; P95-F207 HydrophobicContact CG-CG 3.79Å; P95-F207 HydrophobicContact CG-CZ 3.61Å; W96-F207 HydrophobicContact CE3-CE1 4.46Å; W96-F207 HydrophobicContact CE3-CE2 4.03Å; W96-F207 AromaticContact CE3-CZ 3.57Å; W96-F207 HydrophobicContact CE3-CZ 3.57Å; W96-F207 HydrophobicContact CZ3-CE1 4.24Å; W96-F207 AromaticContact CZ3-CZ 3.72Å; W96-F207 HydrophobicContact CZ3-CZ 3.72Å; L133-F207 HydrophobicContact CD1-CE1 3.85Å; F202-F207 HydrophobicContact CB-CE2 4.03Å; F202-F207 HydrophobicContact CD2-CE2 4.26Å; F202-F207 HydrophobicContact CD2-CZ 4.47Å; F202-F207 HydrophobicContact CG-CE2 4.19Å; S203-F207 WeakPolarHBondContact O-CD2 3.34Å; S203-F207 PolarHBondContact O-N 3.27Å; V204-F207 PolarHBondContact O-N 3.31Å; F207-R209 PolarHBondContact O-N 2.69Å; F207-W210 PolarHBondContact O-N 3.17Å; F207-M211 VanDerWaalsContact O-CG 3.23Å; F207-M211 WeakPolarHBondContact O-CG 3.42Å; F207-M211 PolarHBondContact O-N 3.44Å; F207-L228 HydrophobicContact CD1-CB 4.48Å; F207-L228 HydrophobicContact CD1-CD2 4.03Å; F207-L228 HydrophobicContact CD1-CG 3.97Å; F207-L228 HydrophobicContact CE1-CD2 4.46Å; F207-L228 HydrophobicContact CE1-CG 4.11Å; F207-T229 VanDerWaalsContact CB-OG1 3.29Å; F207-T229 WeakPolarHBondContact CB-OG1 3.4Å; F207-T229 HydrophobicContact CD2-CG2 3.96Å; F207-T229 HydrophobicContact CE2-CG2 4.12Å; F207-T229 HydrophobicContact CG-CG2 4.45Å; F207-T229 VanDerWaalsContact CG-OG1 3.27Å; F207-T229 WeakPolarHBondContact CG-OG1 3.32Å; F207-M232 HydrophobicContact CE1-CB 4.35Å; F207-M232 HydrophobicContact CE1-CG 3.87Å; F207-M232 HydrophobicContact CZ-CB 4.02Å; F207-M232 HydrophobicContact CZ-CG 4.02Å
208	F	93.8	Very high	90.3	Very high	4 Å²	4	33 Å²	33	2%	0.018	17%	0.17	C	C	.	.	H	α-helix	trans	-57.2	-49.9	176.9	-171.8	-77.9	0	0	0	111.4	V204 G205 W210 M211 V212 I220 A225 A652 H653 H719	V204-F208 PolarHBondContact O-N 2.94Å; G205-F208 PolarHBondContact O-N 2.95Å; F208-W210 VanDerWaalsContact C-N 3.34Å; F208-W210 PolarHBondContact O-N 2.79Å; F208-M211 PolarHBondContact O-N 2.64Å; F208-V212 HydrophobicContact CD1-CG2 3.94Å; F208-V212 HydrophobicContact CE1-CG2 3.62Å; F208-V212 HydrophobicContact CZ-CG2 4.41Å; F208-V212 WeakPolarHBondContact O-CG2 3.43Å; F208-V212 PolarHBondContact O-N 2.71Å; F208-V212 VanDerWaalsContact O-N 3.08Å; F208-I220 HydrophobicContact CD2-CG2 4.08Å; F208-I220 HydrophobicContact CE2-CB 4.22Å; F208-I220 HydrophobicContact CE2-CG2 3.81Å; F208-I220 VanDerWaalsContact CE2-O 3.31Å; F208-I220 WeakPolarHBondContact CE2-O 3.4Å; F208-I220 HydrophobicContact CZ-CB 4.27Å; F208-I220 HydrophobicContact CZ-CG2 4.32Å; F208-I220 WeakPolarHBondContact CZ-O 3.28Å; F208-A225 HydrophobicContact CB-CB 3.83Å; F208-A225 HydrophobicContact CD2-CB 3.84Å; F208-A225 HydrophobicContact CG-CB 4.32Å; F208-A652 VanDerWaalsContact CE1-O 3.27Å; F208-A652 WeakPolarHBondContact CE1-O 3.49Å; F208-H653 AromaticContact CZ-CE1 3.73Å; F208-H653 AromaticContact CZ-NE2 3.9Å; F208-H719 HydrophobicContact CD1-CB 4.46Å; F208-H719 AromaticContact CD1-CE1 3.25Å; F208-H719 WeakPolarHBondContact CD1-CE1 3.12Å; F208-H719 AromaticContact CD1-CG 3.68Å; F208-H719 AromaticContact CD1-ND1 3.14Å; F208-H719 WeakPolarHBondContact CD1-ND1 3.43Å; F208-H719 AromaticContact CD1-NE2 3.84Å; F208-H719 AromaticContact CD2-CE1 3.83Å; F208-H719 AromaticContact CE1-CE1 3.39Å; F208-H719 WeakPolarHBondContact CE1-CE1 3.35Å; F208-H719 AromaticContact CE1-ND1 3.33Å; F208-H719 VanDerWaalsContact CE1-ND1 3.33Å; F208-H719 WeakPolarHBondContact CE1-ND1 3.45Å; F208-H719 AromaticContact CE2-CE1 3.94Å; F208-H719 AromaticContact CG-CE1 3.49Å; F208-H719 VanDerWaalsContact CG-CE1 3.49Å; F208-H719 WeakPolarHBondContact CG-CE1 3.37Å; F208-H719 AromaticContact CG-ND1 3.82Å; F208-H719 AromaticContact CG-NE2 3.68Å; F208-H719 AromaticContact CZ-CE1 3.73Å
209	R	91.8	Very high	90.5	Very high	71 Å²	71	33.4 Å²	33.4	27%	0.268	17%	0.171	S	C	.	.	H	α-helix	trans	-58.2	-47.6	177.5	-169	-160.6	174.5	89.1	2.1	111.4	G205 R206 F207 M211 V212 D213 H719 G720	G205-R209 WeakPolarHBondContact O-CB 3.37Å; G205-R209 PolarHBondContact O-N 2.94Å; R206-R209 PolarHBondContact O-N 3.02Å; F207-R209 PolarHBondContact O-N 2.69Å; R209-M211 VanDerWaalsContact C-N 3.32Å; R209-M211 PolarHBondContact O-N 3.47Å; R209-V212 WeakPolarHBondContact O-CB 3.48Å; R209-V212 PolarHBondContact O-N 3Å; R209-V212 VanDerWaalsContact O-N 3.09Å; R209-D213 WeakPolarHBondContact CG-OD2 3.35Å; R209-D213 IonicContact CZ-OD2 3.2Å; R209-D213 IonicContact NE-OD2 2.82Å; R209-D213 PolarHBondContact NE-OD2 3.25Å; R209-D213 VanDerWaalsContact NE-OD2 3.09Å; R209-D213 WeakPolarHBondContact O-CB 3.5Å; R209-D213 PolarHBondContact O-N 3.13Å; R209-H719 WeakPolarHBondContact CB-O 3.47Å; R209-H719 WeakPolarHBondContact CD-O 3.29Å; R209-H719 WeakPolarHBondContact CG-O 3.28Å; R209-H719 PolarHBondContact NH1-O 2.57Å; R209-G720 VanDerWaalsContact NH1-C 3.27Å; R209-G720 PolarHBondContact NH1-O 3.42Å
210	W	92.5	Very high	90.6	Very high	16 Å²	16	31.7 Å²	31.7	6%	0.061	15%	0.151	C	C	.	.	H	α-helix	trans	-59.3	-42	177.4	179.9	87	0	0	0	111.7	L91 E93 P95 L133 S137 R206 F207 F208 V212 D213 T214 I216 L228	L91-W210 HydrophobicContact CD1-CZ2 4.02Å; L91-W210 HydrophobicContact CD2-CZ2 4.06Å; E93-W210 PolarHBondContact O-NE1 3.48Å; P95-W210 HydrophobicContact CB-CB 4.01Å; P95-W210 HydrophobicContact CB-CG 4.31Å; P95-W210 HydrophobicContact CG-CB 4.4Å; P95-W210 HydrophobicContact CG-CD2 4.41Å; P95-W210 HydrophobicContact CG-CG 4.26Å; L133-W210 HydrophobicContact CD1-CH2 4.13Å; L133-W210 HydrophobicContact CD1-CZ3 3.97Å; L133-W210 HydrophobicContact CD2-CD2 4.43Å; L133-W210 HydrophobicContact CD2-CE3 4.43Å; L133-W210 HydrophobicContact CD2-CH2 3.67Å; L133-W210 HydrophobicContact CD2-CZ2 3.63Å; L133-W210 HydrophobicContact CD2-CZ3 4.07Å; L133-W210 HydrophobicContact CG-CH2 3.63Å; L133-W210 HydrophobicContact CG-CZ2 4.09Å; L133-W210 HydrophobicContact CG-CZ3 4Å; S137-W210 VanDerWaalsContact OG-CH2 3.27Å; S137-W210 WeakPolarHBondContact OG-CH2 3.48Å; S137-W210 VanDerWaalsContact OG-CZ3 3.26Å; S137-W210 WeakPolarHBondContact OG-CZ3 3.42Å; R206-W210 VanDerWaalsContact O-CB 3.26Å; R206-W210 WeakPolarHBondContact O-CB 3.46Å; R206-W210 PolarHBondContact O-N 3.27Å; F207-W210 PolarHBondContact O-N 3.17Å; F208-W210 VanDerWaalsContact C-N 3.34Å; F208-W210 PolarHBondContact O-N 2.79Å; W210-V212 VanDerWaalsContact C-N 3.28Å; W210-V212 PolarHBondContact O-N 2.74Å; W210-D213 PolarHBondContact O-N 3.23Å; W210-T214 HydrophobicContact CD2-CG2 3.98Å; W210-T214 HydrophobicContact CG-CG2 4.28Å; W210-T214 HydrophobicContact CH2-CG2 4.5Å; W210-T214 HydrophobicContact CZ2-CG2 3.88Å; W210-T214 VanDerWaalsContact O-CB 3.31Å; W210-T214 WeakPolarHBondContact O-CB 3.45Å; W210-T214 VanDerWaalsContact O-CG2 3.22Å; W210-T214 WeakPolarHBondContact O-CG2 3.34Å; W210-T214 PolarHBondContact O-N 2.96Å; W210-T214 PolarHBondContact O-OG1 2.75Å; W210-I216 HydrophobicContact CZ3-CD1 3.9Å; W210-L228 HydrophobicContact CZ3-CD2 4.31Å
211	M	92.3	Very high	90.5	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-61.2	-36.4	175.7	-65.7	179.9	70.3	0	0	112.3	V155 F207 F208 R209 T214 R215 I216 I220 A224 A225 L228	V155-M211 HydrophobicContact CG2-CE 4.46Å; F207-M211 VanDerWaalsContact O-CG 3.23Å; F207-M211 WeakPolarHBondContact O-CG 3.42Å; F207-M211 PolarHBondContact O-N 3.44Å; F208-M211 PolarHBondContact O-N 2.64Å; R209-M211 VanDerWaalsContact C-N 3.32Å; R209-M211 PolarHBondContact O-N 3.47Å; M211-T214 PolarHBondContact O-OG1 3.24Å; M211-R215 PolarHBondContact O-N 3.28Å; M211-I216 HydrophobicContact CB-CD1 3.78Å; M211-I216 HydrophobicContact CB-CG1 4.44Å; M211-I216 HydrophobicContact CE-CD1 3.93Å; M211-I216 HydrophobicContact CE-CG2 4.41Å; M211-I216 HydrophobicContact CG-CD1 3.6Å; M211-I216 PolarHBondContact O-N 2.9Å; M211-I216 VanDerWaalsContact O-N 3.13Å; M211-I220 HydrophobicContact CB-CD1 3.58Å; M211-I220 HydrophobicContact CB-CG1 4.46Å; M211-I220 HydrophobicContact CB-CG2 4.42Å; M211-I220 HydrophobicContact CE-CG2 3.93Å; M211-I220 WeakPolarHBondContact O-CD1 3.37Å; M211-I220 HydrophobicContact SD-CG2 4.16Å; M211-A224 HydrophobicContact CE-CB 4.16Å; M211-A225 HydrophobicContact SD-CB 4.05Å; M211-L228 HydrophobicContact CE-CD2 4.44Å; M211-L228 HydrophobicContact CG-CD2 3.98Å; M211-L228 HydrophobicContact SD-CD2 3.86Å
212	V	90.5	Very high	90.3	Very high	25 Å²	25	30.4 Å²	30.4	15%	0.152	14%	0.141	C	C	.	.	H	α-helix	trans	-71.8	-50.1	176.6	176	0	0	0	0	111.1	F208 R209 W210 T214 R215 I220	F208-V212 HydrophobicContact CD1-CG2 3.94Å; F208-V212 HydrophobicContact CE1-CG2 3.62Å; F208-V212 HydrophobicContact CZ-CG2 4.41Å; F208-V212 WeakPolarHBondContact O-CG2 3.43Å; F208-V212 PolarHBondContact O-N 2.71Å; F208-V212 VanDerWaalsContact O-N 3.08Å; R209-V212 WeakPolarHBondContact O-CB 3.48Å; R209-V212 PolarHBondContact O-N 3Å; R209-V212 VanDerWaalsContact O-N 3.09Å; W210-V212 VanDerWaalsContact C-N 3.28Å; W210-V212 PolarHBondContact O-N 2.74Å; V212-T214 VanDerWaalsContact C-N 3.26Å; V212-T214 PolarHBondContact O-N 2.64Å; V212-R215 PolarHBondContact O-N 3.35Å; V212-I220 HydrophobicContact CB-CD1 4.26Å; V212-I220 HydrophobicContact CG2-CD1 3.61Å
213	D	89.1	Confident	90.2	Very high	71 Å²	71	31.2 Å²	31.2	38%	0.38	14%	0.144	S	C	.	.	H	α-helix	trans	-62.4	-34.7	-178.9	-71.8	-19.6	0	0	0	111.3	R209 W210 R215	R209-D213 WeakPolarHBondContact CG-OD2 3.35Å; R209-D213 IonicContact CZ-OD2 3.2Å; R209-D213 IonicContact NE-OD2 2.82Å; R209-D213 PolarHBondContact NE-OD2 3.25Å; R209-D213 VanDerWaalsContact NE-OD2 3.09Å; R209-D213 WeakPolarHBondContact O-CB 3.5Å; R209-D213 PolarHBondContact O-N 3.13Å; W210-D213 PolarHBondContact O-N 3.23Å; D213-R215 VanDerWaalsContact C-N 3.31Å
214	T	87.4	Confident	90.2	Very high	14 Å²	14	30.4 Å²	30.4	9%	0.086	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-1.9	174.9	59.2	0	0	0	0	114.4	L12 W210 M211 V212 I216	L12-T214 HydrophobicContact CD1-CG2 3.43Å; L12-T214 VanDerWaalsContact CD1-CG2 3.43Å; W210-T214 HydrophobicContact CD2-CG2 3.98Å; W210-T214 HydrophobicContact CG-CG2 4.28Å; W210-T214 HydrophobicContact CH2-CG2 4.5Å; W210-T214 HydrophobicContact CZ2-CG2 3.88Å; W210-T214 VanDerWaalsContact O-CB 3.31Å; W210-T214 WeakPolarHBondContact O-CB 3.45Å; W210-T214 VanDerWaalsContact O-CG2 3.22Å; W210-T214 WeakPolarHBondContact O-CG2 3.34Å; W210-T214 PolarHBondContact O-N 2.96Å; W210-T214 PolarHBondContact O-OG1 2.75Å; M211-T214 PolarHBondContact O-OG1 3.24Å; V212-T214 VanDerWaalsContact C-N 3.26Å; V212-T214 PolarHBondContact O-N 2.64Å; T214-I216 VanDerWaalsContact C-N 3.34Å; T214-I216 PolarHBondContact O-N 3.37Å
215	R	88.3	Confident	90.2	Very high	171 Å²	171	30.3 Å²	30.3	65%	0.645	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.3	45.1	178.8	-56.7	-174.3	-178.2	177.7	4.1	113.8	Q141 M211 V212 D213 S217	Q141-R215 PolarHBondContact NE2-O 3.15Å; M211-R215 PolarHBondContact O-N 3.28Å; V212-R215 PolarHBondContact O-N 3.35Å; D213-R215 VanDerWaalsContact C-N 3.31Å; R215-S217 PolarHBondContact O-N 2.8Å
216	I	88.2	Confident	90.4	Very high	6 Å²	6	30.3 Å²	30.3	3%	0.031	14%	0.138	C	C	.	.	S	Bend	trans	-56.1	-40.7	172.4	-65.3	179.5	0	0	0	110.2	A140 Q141 S144 W210 M211 T214	A140-I216 HydrophobicContact CB-CG2 4.32Å; Q141-I216 VanDerWaalsContact CA-O 3.28Å; Q141-I216 WeakPolarHBondContact CA-O 3.45Å; Q141-I216 HydrophobicContact CB-CG2 4.02Å; Q141-I216 WeakPolarHBondContact CB-O 3.45Å; Q141-I216 VanDerWaalsContact CG-O 3.26Å; Q141-I216 WeakPolarHBondContact CG-O 3.29Å; S144-I216 PolarHBondContact OG-O 2.75Å; W210-I216 HydrophobicContact CZ3-CD1 3.9Å; M211-I216 HydrophobicContact CB-CD1 3.78Å; M211-I216 HydrophobicContact CB-CG1 4.44Å; M211-I216 HydrophobicContact CE-CD1 3.93Å; M211-I216 HydrophobicContact CE-CG2 4.41Å; M211-I216 HydrophobicContact CG-CD1 3.6Å; M211-I216 PolarHBondContact O-N 2.9Å; M211-I216 VanDerWaalsContact O-N 3.13Å; T214-I216 VanDerWaalsContact C-N 3.34Å; T214-I216 PolarHBondContact O-N 3.37Å
217	S	89.3	Confident	90.5	Very high	14 Å²	14	26.4 Å²	26.4	10%	0.098	12%	0.123	C	C	.	.			trans	-152.5	158.2	171.1	-166.4	0	0	0	0	109.9	S144 K149 R215 R219	S144-S217 WeakPolarHBondContact OG-CB 3.26Å; S144-S217 PolarHBondContact OG-OG 3.45Å; K149-S217 WeakPolarHBondContact CA-OG 3.34Å; K149-S217 PolarHBondContact N-OG 3.06Å; R215-S217 PolarHBondContact O-N 2.8Å; S217-R219 WeakPolarHBondContact CB-O 3.24Å; S217-R219 PolarHBondContact O-N 3.29Å; S217-R219 PolarHBondContact OG-O 2.93Å
218	V	87.2	Confident	90.6	Very high	83 Å²	83	26.6 Å²	26.6	50%	0.503	12%	0.124	S	C	.	.	S	Bend	trans	-59.5	-31.4	174.1	178.6	0	0	0	0	110.8	A610	V218-A610 HydrophobicContact CG1-CB 3.56Å
219	R	89.1	Confident	90.7	Very high	11 Å²	11	26.4 Å²	26.4	4%	0.042	12%	0.123	C	C	.	.	S	Bend	trans	-131.7	132	179.3	-58.6	174.4	-163	81.4	-1.2	109.5	S148 K149 C150 S217 V569 L570 L606 A609 A610	S148-R219 PolarHBondContact O-NH1 3Å; K149-R219 WeakPolarHBondContact CA-O 3.42Å; K149-R219 HydrophobicContact CB-CB 4.43Å; K149-R219 HydrophobicContact CG-CB 4.21Å; C150-R219 PolarHBondContact N-O 3Å; S217-R219 WeakPolarHBondContact CB-O 3.24Å; S217-R219 PolarHBondContact O-N 3.29Å; S217-R219 PolarHBondContact OG-O 2.93Å; R219-V569 PolarHBondContact NH2-O 3.28Å; R219-V569 VanDerWaalsContact NH2-O 3.14Å; R219-L570 PolarHBondContact NH1-O 3.02Å; R219-L570 PolarHBondContact NH2-O 3.46Å; R219-L606 PolarHBondContact NE-O 3.12Å; R219-A609 HydrophobicContact CG-CB 4.02Å; R219-A610 HydrophobicContact CG-CB 4.34Å
220	I	90.9	Very high	90.8	Very high	7 Å²	7	23.1 Å²	23.1	4%	0.036	11%	0.112	C	C	.	.	B	Isolated β-bridge	trans	-126	122.2	-178.2	-66.2	154.7	0	0	0	107.5	C150 F208 M211 V212 A224 H653	C150-I220 HydrophobicContact CB-CG1 4.3Å; F208-I220 HydrophobicContact CD2-CG2 4.08Å; F208-I220 HydrophobicContact CE2-CB 4.22Å; F208-I220 HydrophobicContact CE2-CG2 3.81Å; F208-I220 VanDerWaalsContact CE2-O 3.31Å; F208-I220 WeakPolarHBondContact CE2-O 3.4Å; F208-I220 HydrophobicContact CZ-CB 4.27Å; F208-I220 HydrophobicContact CZ-CG2 4.32Å; F208-I220 WeakPolarHBondContact CZ-O 3.28Å; M211-I220 HydrophobicContact CB-CD1 3.58Å; M211-I220 HydrophobicContact CB-CG1 4.46Å; M211-I220 HydrophobicContact CB-CG2 4.42Å; M211-I220 HydrophobicContact CE-CG2 3.93Å; M211-I220 WeakPolarHBondContact O-CD1 3.37Å; M211-I220 HydrophobicContact SD-CG2 4.16Å; V212-I220 HydrophobicContact CB-CD1 4.26Å; V212-I220 HydrophobicContact CG2-CD1 3.61Å; I220-A224 HydrophobicContact CG2-CB 4.35Å; I220-H653 PolarHBondContact N-CE1 2.89Å; I220-H653 VanDerWaalsContact N-CE1 3.26Å; I220-H653 PolarHBondContact O-NE2 2.64Å
221	H	88.3	Confident	91	Very high	39 Å²	39	22.4 Å²	22.4	18%	0.181	11%	0.109	C	C	.	.			trans	-81.3	145.7	174	-164.9	-84	0	0	0	110	C150 T151 Y223 A224	C150-H221 PolarHBondContact O-N 2.99Å; T151-H221 HydrophobicContact CG2-CB 4.35Å; H221-Y223 VanDerWaalsContact C-N 3.28Å; H221-Y223 AromaticContact CE1-CD2 3.4Å; H221-Y223 VanDerWaalsContact CE1-CD2 3.4Å; H221-Y223 WeakPolarHBondContact CE1-CD2 3.37Å; H221-Y223 AromaticContact CE1-CE2 3.73Å; H221-Y223 AromaticContact CE1-CG 3.56Å; H221-Y223 AromaticContact ND1-CD2 3.66Å; H221-Y223 AromaticContact ND1-CG 3.5Å; H221-Y223 PolarHBondContact ND1-N 3.18Å; H221-Y223 VanDerWaalsContact ND1-N 3.17Å; H221-Y223 PolarHBondContact O-N 3.24Å; H221-A224 WeakPolarHBondContact O-CB 3.26Å; H221-A224 PolarHBondContact O-N 3.09Å
222	E	86.7	Confident	91.1	Very high	2 Å²	2	22.4 Å²	22.4	1%	0.009	11%	0.109	C	C	.	.	H	α-helix	trans	-60.8	-35.3	-179	56.3	172.3	-162.5	0	0	113.6	Y182 K194 A224 A225 I226 M644	Y182-E222 WeakPolarHBondContact CE1-OE1 3.37Å; Y182-E222 PolarHBondContact OH-OE1 3.35Å; Y182-E222 PolarHBondContact OH-OE2 3.06Å; Y182-E222 VanDerWaalsContact OH-OE2 3.07Å; K194-E222 IonicContact NZ-OE2 3.74Å; K194-E222 PolarHBondContact NZ-OE2 2.82Å; E222-A224 PolarHBondContact O-N 2.88Å; E222-A225 WeakPolarHBondContact O-CB 3.48Å; E222-A225 PolarHBondContact O-N 3.3Å; E222-A225 VanDerWaalsContact O-N 3.07Å; E222-I226 WeakPolarHBondContact O-CG1 3.2Å; E222-I226 PolarHBondContact O-N 3.49Å; E222-M644 HydrophobicContact CB-CE 4.12Å; E222-M644 HydrophobicContact CG-CE 3.95Å; E222-M644 VanDerWaalsContact OE2-CE 3.25Å; E222-M644 WeakPolarHBondContact OE2-CE 3.27Å
223	Y	89.1	Confident	91.3	Very high	20 Å²	20	21.4 Å²	21.4	8%	0.078	10%	0.103	C	C	.	.	H	α-helix	trans	-61.7	-26	173.7	-60.1	-16.5	0	0	0	113.5	L179 Y182 H221 I226 S227 L640 H641	L179-Y223 HydrophobicContact CD2-CD1 3.66Å; L179-Y223 HydrophobicContact CD2-CE1 4.37Å; L179-Y223 HydrophobicContact CD2-CG 3.81Å; Y182-Y223 AromaticContact CD1-CE1 3.91Å; Y182-Y223 HydrophobicContact CD1-CE1 3.91Å; Y182-Y223 AromaticContact CE1-CE1 3.89Å; Y182-Y223 HydrophobicContact CE1-CE1 3.89Å; H221-Y223 VanDerWaalsContact C-N 3.28Å; H221-Y223 AromaticContact CE1-CD2 3.4Å; H221-Y223 VanDerWaalsContact CE1-CD2 3.4Å; H221-Y223 WeakPolarHBondContact CE1-CD2 3.37Å; H221-Y223 AromaticContact CE1-CE2 3.73Å; H221-Y223 AromaticContact CE1-CG 3.56Å; H221-Y223 AromaticContact ND1-CD2 3.66Å; H221-Y223 AromaticContact ND1-CG 3.5Å; H221-Y223 PolarHBondContact ND1-N 3.18Å; H221-Y223 VanDerWaalsContact ND1-N 3.17Å; H221-Y223 PolarHBondContact O-N 3.24Å; Y223-I226 HydrophobicContact CD1-CD1 4.23Å; Y223-S227 VanDerWaalsContact O-CB 3.28Å; Y223-S227 WeakPolarHBondContact O-CB 3.49Å; Y223-S227 PolarHBondContact O-N 3.44Å; Y223-S227 PolarHBondContact O-OG 2.78Å; Y223-L640 PolarHBondContact OH-O 3.04Å; Y223-H641 AromaticContact CE2-CE1 3.9Å; Y223-H641 AromaticContact CE2-ND1 3.59Å; Y223-H641 AromaticContact CZ-ND1 3.79Å; Y223-H641 PolarHBondContact OH-ND1 3.36Å
224	A	91.7	Very high	91.5	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-66.9	-46.6	172.6	0	0	0	0	0	110.2	T151 V155 M211 I220 H221 E222 S227 L228	T151-A224 WeakPolarHBondContact O-CB 3.14Å; V155-A224 HydrophobicContact CG2-CB 3.87Å; M211-A224 HydrophobicContact CE-CB 4.16Å; I220-A224 HydrophobicContact CG2-CB 4.35Å; H221-A224 WeakPolarHBondContact O-CB 3.26Å; H221-A224 PolarHBondContact O-N 3.09Å; E222-A224 PolarHBondContact O-N 2.88Å; A224-S227 PolarHBondContact O-N 2.97Å; A224-L228 PolarHBondContact O-N 2.95Å
225	A	93.6	Very high	91.8	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-63.5	-42.1	176.6	0	0	0	0	0	112.2	V204 F208 M211 E222 S227 L228 T229	V204-A225 HydrophobicContact CG1-CB 4.26Å; F208-A225 HydrophobicContact CB-CB 3.83Å; F208-A225 HydrophobicContact CD2-CB 3.84Å; F208-A225 HydrophobicContact CG-CB 4.32Å; M211-A225 HydrophobicContact SD-CB 4.05Å; E222-A225 WeakPolarHBondContact O-CB 3.48Å; E222-A225 PolarHBondContact O-N 3.3Å; E222-A225 VanDerWaalsContact O-N 3.07Å; A225-S227 VanDerWaalsContact C-N 3.33Å; A225-S227 PolarHBondContact O-N 3.43Å; A225-L228 PolarHBondContact O-N 3.03Å; A225-T229 VanDerWaalsContact O-CB 3.31Å; A225-T229 WeakPolarHBondContact O-CB 3.32Å; A225-T229 PolarHBondContact O-N 2.94Å; A225-T229 PolarHBondContact O-OG1 2.9Å
226	I	93.3	Very high	92.1	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-62	-42.5	174.6	-65	168.1	0	0	0	110.6	A178 L179 Y182 V204 E222 Y223 T229 S230	A178-I226 HydrophobicContact CB-CG2 4.02Å; L179-I226 HydrophobicContact CD2-CB 4.12Å; L179-I226 HydrophobicContact CD2-CD1 4.24Å; L179-I226 HydrophobicContact CD2-CG2 3.86Å; L179-I226 HydrophobicContact CG-CG2 4.25Å; Y182-I226 HydrophobicContact CD1-CD1 4.17Å; Y182-I226 HydrophobicContact CD2-CD1 4.02Å; Y182-I226 HydrophobicContact CE1-CD1 4.37Å; Y182-I226 HydrophobicContact CE2-CD1 4.22Å; Y182-I226 HydrophobicContact CG-CD1 3.97Å; V204-I226 HydrophobicContact CG1-CG1 3.64Å; V204-I226 HydrophobicContact CG2-CG1 4.34Å; E222-I226 WeakPolarHBondContact O-CG1 3.2Å; E222-I226 PolarHBondContact O-N 3.49Å; Y223-I226 HydrophobicContact CD1-CD1 4.23Å; I226-T229 PolarHBondContact O-N 3.49Å; I226-S230 WeakPolarHBondContact O-CB 3.44Å; I226-S230 PolarHBondContact O-N 3.11Å; I226-S230 PolarHBondContact O-OG 2.95Å
227	S	94.1	Very high	92.3	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-64.6	-42	179.2	-59.8	0	0	0	0	111.9	T175 Y223 A224 A225 S230 C231	T175-S227 WeakPolarHBondContact CG2-O 3.22Å; Y223-S227 VanDerWaalsContact O-CB 3.28Å; Y223-S227 WeakPolarHBondContact O-CB 3.49Å; Y223-S227 PolarHBondContact O-N 3.44Å; Y223-S227 PolarHBondContact O-OG 2.78Å; A224-S227 PolarHBondContact O-N 2.97Å; A225-S227 VanDerWaalsContact C-N 3.33Å; A225-S227 PolarHBondContact O-N 3.43Å; S227-S230 PolarHBondContact O-OG 2.99Å; S227-C231 VanDerWaalsContact O-CB 3.27Å; S227-C231 WeakPolarHBondContact O-CB 3.11Å; S227-C231 PolarHBondContact O-N 2.96Å; S227-C231 VanDerWaalsContact O-N 3.08Å
228	L	95.3	Very high	92.3	Very high	3 Å²	3	15.1 Å²	15.1	2%	0.016	8%	0.076	C	C	.	.	H	α-helix	trans	-67.8	-44.6	177.1	-173	59.5	0	0	0	111.3	L133 I136 V155 F207 W210 M211 A224 A225 C231 M232	L133-L228 HydrophobicContact CD1-CD1 4.13Å; L133-L228 HydrophobicContact CD1-CD2 4Å; L133-L228 HydrophobicContact CD1-CG 4.15Å; I136-L228 HydrophobicContact CB-CD1 4.32Å; I136-L228 HydrophobicContact CG2-CD1 3.67Å; V155-L228 HydrophobicContact CG1-CB 4.11Å; V155-L228 HydrophobicContact CG1-CD1 4.48Å; F207-L228 HydrophobicContact CD1-CB 4.48Å; F207-L228 HydrophobicContact CD1-CD2 4.03Å; F207-L228 HydrophobicContact CD1-CG 3.97Å; F207-L228 HydrophobicContact CE1-CD2 4.46Å; F207-L228 HydrophobicContact CE1-CG 4.11Å; W210-L228 HydrophobicContact CZ3-CD2 4.31Å; M211-L228 HydrophobicContact CE-CD2 4.44Å; M211-L228 HydrophobicContact CG-CD2 3.98Å; M211-L228 HydrophobicContact SD-CD2 3.86Å; A224-L228 PolarHBondContact O-N 2.95Å; A225-L228 PolarHBondContact O-N 3.03Å; L228-C231 PolarHBondContact O-N 3.03Å; L228-M232 WeakPolarHBondContact O-CG 3.27Å; L228-M232 PolarHBondContact O-N 2.79Å
229	T	95.9	Very high	92.5	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-62	-48.7	-179.9	-53.3	0	0	0	0	111.5	L200 F202 V204 F207 A225 I226 C231 M232 E233	L200-T229 HydrophobicContact CD1-CG2 3.98Å; F202-T229 HydrophobicContact CB-CG2 3.49Å; F202-T229 VanDerWaalsContact CB-CG2 3.49Å; V204-T229 HydrophobicContact CG2-CG2 4.14Å; F207-T229 VanDerWaalsContact CB-OG1 3.29Å; F207-T229 WeakPolarHBondContact CB-OG1 3.4Å; F207-T229 HydrophobicContact CD2-CG2 3.96Å; F207-T229 HydrophobicContact CE2-CG2 4.12Å; F207-T229 HydrophobicContact CG-CG2 4.45Å; F207-T229 VanDerWaalsContact CG-OG1 3.27Å; F207-T229 WeakPolarHBondContact CG-OG1 3.32Å; A225-T229 VanDerWaalsContact O-CB 3.31Å; A225-T229 WeakPolarHBondContact O-CB 3.32Å; A225-T229 PolarHBondContact O-N 2.94Å; A225-T229 PolarHBondContact O-OG1 2.9Å; I226-T229 PolarHBondContact O-N 3.49Å; T229-C231 VanDerWaalsContact C-N 3.34Å; T229-C231 PolarHBondContact O-N 3.09Å; T229-M232 PolarHBondContact O-N 2.85Å; T229-E233 PolarHBondContact O-N 3.04Å
230	S	95.3	Very high	92.5	Very high	3 Å²	3	12.1 Å²	12.1	2%	0.021	6%	0.057	C	C	.	.	H	α-helix	trans	-65.2	-36	178.8	52	0	0	0	0	112.6	T175 I226 S227 N234	T175-S230 WeakPolarHBondContact CA-OG 3.48Å; T175-S230 VanDerWaalsContact CG2-OG 3.32Å; T175-S230 WeakPolarHBondContact CG2-OG 3.32Å; I226-S230 WeakPolarHBondContact O-CB 3.44Å; I226-S230 PolarHBondContact O-N 3.11Å; I226-S230 PolarHBondContact O-OG 2.95Å; S227-S230 PolarHBondContact O-OG 2.99Å; S230-N234 VanDerWaalsContact O-CB 3.26Å; S230-N234 WeakPolarHBondContact O-CB 3.32Å; S230-N234 PolarHBondContact O-N 3.43Å
231	C	94.9	Very high	92.4	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-62.6	-45.9	173.4	177.5	0	0	0	0	112.1	I159 Q163 C171 S227 L228 T229 N234 L235	I159-C231 HydrophobicContact CD1-CB 3.55Å; I159-C231 HydrophobicContact CG1-CB 4.2Å; Q163-C231 PolarHBondContact NE2-SG 3.16Å; C171-C231 HydrophobicContact CB-CB 4.37Å; S227-C231 VanDerWaalsContact O-CB 3.27Å; S227-C231 WeakPolarHBondContact O-CB 3.11Å; S227-C231 PolarHBondContact O-N 2.96Å; S227-C231 VanDerWaalsContact O-N 3.08Å; L228-C231 PolarHBondContact O-N 3.03Å; T229-C231 VanDerWaalsContact C-N 3.34Å; T229-C231 PolarHBondContact O-N 3.09Å; C231-N234 PolarHBondContact O-N 2.98Å; C231-L235 WeakPolarHBondContact O-CB 3.44Å; C231-L235 PolarHBondContact O-N 3.42Å
232	M	95	Very high	92.4	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.005	7%	0.074	C	C	.	.	H	α-helix	trans	-66.9	-38.4	179.1	-66	-54.7	-62.1	0	0	112.4	W96 L129 A132 L133 I136 F202 F207 L228 T229 L235 V236	W96-M232 HydrophobicContact CH2-CE 3.79Å; W96-M232 HydrophobicContact CZ3-CE 4.03Å; L129-M232 HydrophobicContact CB-CE 3.99Å; L129-M232 HydrophobicContact CD2-CE 4.13Å; L129-M232 WeakPolarHBondContact O-CE 3.45Å; A132-M232 HydrophobicContact CB-CE 4.39Å; L133-M232 HydrophobicContact CB-CE 4.04Å; L133-M232 HydrophobicContact CB-SD 4.31Å; L133-M232 HydrophobicContact CD1-CG 4.18Å; L133-M232 HydrophobicContact CD1-SD 4.3Å; I136-M232 HydrophobicContact CD1-SD 4.45Å; F202-M232 HydrophobicContact CD2-CB 4.47Å; F202-M232 HydrophobicContact CE2-CB 4.24Å; F207-M232 HydrophobicContact CE1-CB 4.35Å; F207-M232 HydrophobicContact CE1-CG 3.87Å; F207-M232 HydrophobicContact CZ-CB 4.02Å; F207-M232 HydrophobicContact CZ-CG 4.02Å; L228-M232 WeakPolarHBondContact O-CG 3.27Å; L228-M232 PolarHBondContact O-N 2.79Å; T229-M232 PolarHBondContact O-N 2.85Å; M232-L235 PolarHBondContact O-N 2.86Å; M232-V236 WeakPolarHBondContact O-CG2 3.42Å; M232-V236 PolarHBondContact O-N 3.29Å
233	E	94.7	Very high	92.4	Very high	5 Å²	5	14.3 Å²	14.3	2%	0.023	7%	0.073	C	C	.	.	H	α-helix	trans	-65.2	-44.3	174	-174.5	157.9	155.5	0	0	111.3	I104 K107 T201 F202 T229 L235 V236 E237	I104-E233 HydrophobicContact CD1-CB 4.45Å; I104-E233 HydrophobicContact CD1-CG 3.89Å; I104-E233 HydrophobicContact CG1-CG 4.17Å; I104-E233 HydrophobicContact CG2-CG 4.22Å; K107-E233 IonicContact NZ-OE1 3.44Å; K107-E233 PolarHBondContact NZ-OE1 3.39Å; T201-E233 WeakPolarHBondContact CA-OE2 3.5Å; T201-E233 PolarHBondContact N-OE1 3.15Å; T201-E233 VanDerWaalsContact N-OE1 3.16Å; T201-E233 PolarHBondContact N-OE2 3.47Å; T201-E233 PolarHBondContact OG1-OE1 3.49Å; F202-E233 HydrophobicContact CD2-CB 3.89Å; F202-E233 HydrophobicContact CE2-CB 4.24Å; F202-E233 PolarHBondContact N-OE2 2.99Å; T229-E233 PolarHBondContact O-N 3.04Å; E233-L235 VanDerWaalsContact C-N 3.32Å; E233-L235 PolarHBondContact O-N 3.24Å; E233-V236 WeakPolarHBondContact O-CB 3.41Å; E233-V236 PolarHBondContact O-N 3.45Å; E233-V236 VanDerWaalsContact O-N 3.16Å; E233-E237 PolarHBondContact O-N 2.95Å
234	N	94.4	Very high	92.2	Very high	20 Å²	20	16.6 Å²	16.6	11%	0.107	9%	0.087	C	C	.	.	H	α-helix	trans	-63.6	-36.4	177	-169.2	75	0	0	0	112.4	S170 C171 A174 S230 C231 V236 E237 E238	S170-N234 PolarHBondContact OG-ND2 3.05Å; C171-N234 PolarHBondContact N-ND2 3.47Å; C171-N234 PolarHBondContact SG-ND2 3.33Å; C171-N234 VanDerWaalsContact SG-ND2 3.43Å; A174-N234 HydrophobicContact CB-CB 3.81Å; S230-N234 VanDerWaalsContact O-CB 3.26Å; S230-N234 WeakPolarHBondContact O-CB 3.32Å; S230-N234 PolarHBondContact O-N 3.43Å; C231-N234 PolarHBondContact O-N 2.98Å; N234-V236 VanDerWaalsContact C-N 3.3Å; N234-V236 PolarHBondContact O-N 3.36Å; N234-E237 PolarHBondContact O-N 3.34Å; N234-E238 WeakPolarHBondContact O-CB 3.25Å; N234-E238 PolarHBondContact O-N 3.42Å
235	L	93.4	Very high	91.8	Very high	3 Å²	3	20.6 Å²	20.6	2%	0.016	12%	0.12	C	C	.	.	H	α-helix	trans	-63.6	-37.1	175.8	-172.2	63.1	0	0	0	111.7	L129 A132 C231 M232 E233 I239 L271	L129-L235 HydrophobicContact CD2-CB 4.43Å; L129-L235 HydrophobicContact CD2-CD2 3.63Å; L129-L235 HydrophobicContact CD2-CG 3.95Å; A132-L235 HydrophobicContact CB-CD2 3.8Å; C231-L235 WeakPolarHBondContact O-CB 3.44Å; C231-L235 PolarHBondContact O-N 3.42Å; M232-L235 PolarHBondContact O-N 2.86Å; E233-L235 VanDerWaalsContact C-N 3.32Å; E233-L235 PolarHBondContact O-N 3.24Å; L235-I239 HydrophobicContact CD1-CD1 4.45Å; L235-I239 HydrophobicContact CG-CD1 4.12Å; L235-I239 WeakPolarHBondContact O-CB 3.47Å; L235-I239 WeakPolarHBondContact O-CD1 3.33Å; L235-I239 WeakPolarHBondContact O-CG1 3.2Å; L235-I239 PolarHBondContact O-N 2.88Å; L235-L271 HydrophobicContact CD1-CD2 4.08Å
236	V	93.6	Very high	91.2	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-64	-45.4	172.6	176.3	0	0	0	0	110.8	I101 I104 L105 L125 L129 F202 M232 E233 N234 K240	I101-V236 HydrophobicContact CG2-CG1 4.46Å; I104-V236 HydrophobicContact CB-CG1 4.12Å; I104-V236 HydrophobicContact CG2-CB 4.04Å; I104-V236 HydrophobicContact CG2-CG1 3.59Å; L105-V236 HydrophobicContact CD2-CG1 3.8Å; L105-V236 HydrophobicContact CG-CG1 4.15Å; L125-V236 HydrophobicContact CD2-CG1 4.26Å; L129-V236 HydrophobicContact CD1-CG2 3.46Å; L129-V236 VanDerWaalsContact CD1-CG2 3.46Å; L129-V236 HydrophobicContact CD2-CG2 4.44Å; F202-V236 HydrophobicContact CE2-CG2 4.42Å; F202-V236 HydrophobicContact CZ-CG2 4.38Å; M232-V236 WeakPolarHBondContact O-CG2 3.42Å; M232-V236 PolarHBondContact O-N 3.29Å; E233-V236 WeakPolarHBondContact O-CB 3.41Å; E233-V236 PolarHBondContact O-N 3.45Å; E233-V236 VanDerWaalsContact O-N 3.16Å; N234-V236 VanDerWaalsContact C-N 3.3Å; N234-V236 PolarHBondContact O-N 3.36Å; V236-K240 WeakPolarHBondContact O-CB 3.21Å; V236-K240 PolarHBondContact O-N 3.11Å
237	E	91.8	Very high	90.3	Very high	74 Å²	74	26 Å²	26	35%	0.346	15%	0.152	S	C	.	.	H	α-helix	trans	-63.7	-40.5	179.4	-69.8	-175.7	171.7	0	0	112.1	I104 E233 N234 K240 A241	I104-E237 HydrophobicContact CG2-CG 3.95Å; E233-E237 PolarHBondContact O-N 2.95Å; N234-E237 PolarHBondContact O-N 3.34Å; E237-K240 WeakPolarHBondContact O-CB 3.48Å; E237-K240 PolarHBondContact O-N 2.95Å; E237-A241 WeakPolarHBondContact O-CB 3.31Å; E237-A241 PolarHBondContact O-N 3.1Å
238	E	90.5	Very high	88.7	Confident	47 Å²	47	29.6 Å²	29.6	22%	0.22	18%	0.177	C	C	.	.	H	α-helix	trans	-68.8	-43.7	178.5	-172	65.6	-152	0	0	111.9	L167 N234 K240 A241 R242	L167-E238 HydrophobicContact CD2-CG 3.58Å; N234-E238 WeakPolarHBondContact O-CB 3.25Å; N234-E238 PolarHBondContact O-N 3.42Å; E238-K240 VanDerWaalsContact C-N 3.3Å; E238-K240 PolarHBondContact O-N 2.93Å; E238-A241 PolarHBondContact O-N 3.35Å; E238-R242 WeakPolarHBondContact O-CG 3.29Å; E238-R242 PolarHBondContact O-N 3.08Å; E238-R242 IonicContact OE1-CZ 3.89Å; E238-R242 IonicContact OE1-NE 2.79Å; E238-R242 PolarHBondContact OE1-NE 2.92Å; E238-R242 IonicContact OE1-NH2 3.32Å; E238-R242 PolarHBondContact OE1-NH2 3.16Å
239	I	90.9	Very high	87	Confident	2 Å²	2	35.7 Å²	35.7	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-60.3	-43.9	173.7	-68.3	166.7	0	0	0	109.8	L125 L129 L235 A241 R242 V243 L261 L271 L275	L125-I239 HydrophobicContact CD1-CD1 3.82Å; L125-I239 HydrophobicContact CD1-CG2 4.01Å; L129-I239 HydrophobicContact CD2-CD1 4.27Å; L235-I239 HydrophobicContact CD1-CD1 4.45Å; L235-I239 HydrophobicContact CG-CD1 4.12Å; L235-I239 WeakPolarHBondContact O-CB 3.47Å; L235-I239 WeakPolarHBondContact O-CD1 3.33Å; L235-I239 WeakPolarHBondContact O-CG1 3.2Å; L235-I239 PolarHBondContact O-N 2.88Å; I239-A241 PolarHBondContact O-N 3.46Å; I239-R242 PolarHBondContact O-N 2.72Å; I239-V243 HydrophobicContact CG2-CG2 4.29Å; I239-V243 WeakPolarHBondContact O-CB 3.15Å; I239-V243 WeakPolarHBondContact O-CG2 3.29Å; I239-V243 PolarHBondContact O-N 3.12Å; I239-L261 HydrophobicContact CG2-CD1 3.66Å; I239-L271 HydrophobicContact CD1-CD2 4.47Å; I239-L271 HydrophobicContact CG1-CD1 3.93Å; I239-L271 HydrophobicContact CG1-CD2 3.9Å; I239-L275 HydrophobicContact CD1-CD1 4.28Å
240	K	89.7	Confident	84.9	Confident	29 Å²	29	43.2 Å²	43.2	13%	0.126	26%	0.257	C	S	.	.	H	α-helix	trans	-58.1	-47.5	174.6	169.9	-178	168.2	-179.3	0	111.5	L105 K107 F117 V236 E237 E238 R242 V243 L244	L105-K240 HydrophobicContact CD2-CB 3.91Å; L105-K240 HydrophobicContact CD2-CD 4.2Å; L105-K240 HydrophobicContact CD2-CG 4.35Å; L105-K240 VanDerWaalsContact O-CE 3.32Å; L105-K240 WeakPolarHBondContact O-CE 3.48Å; L105-K240 PolarHBondContact O-NZ 2.69Å; K107-K240 PolarHBondContact O-NZ 3.49Å; F117-K240 HydrophobicContact CE2-CG 4.09Å; F117-K240 HydrophobicContact CZ-CB 4.38Å; F117-K240 HydrophobicContact CZ-CG 4.2Å; V236-K240 WeakPolarHBondContact O-CB 3.21Å; V236-K240 PolarHBondContact O-N 3.11Å; E237-K240 WeakPolarHBondContact O-CB 3.48Å; E237-K240 PolarHBondContact O-N 2.95Å; E238-K240 VanDerWaalsContact C-N 3.3Å; E238-K240 PolarHBondContact O-N 2.93Å; K240-R242 PolarHBondContact O-N 2.92Å; K240-V243 PolarHBondContact O-N 2.85Å; K240-L244 HydrophobicContact CG-CD1 3.91Å; K240-L244 HydrophobicContact CG-CG 4.46Å; K240-L244 WeakPolarHBondContact O-CB 3.42Å; K240-L244 VanDerWaalsContact O-CG 3.3Å; K240-L244 WeakPolarHBondContact O-CG 3.39Å; K240-L244 PolarHBondContact O-N 2.88Å
241	A	88.6	Confident	82.8	Confident	50 Å²	50	44.6 Å²	44.6	41%	0.413	27%	0.271	S	S	.	.	H	α-helix	trans	-60	-44.5	-179.2	0	0	0	0	0	111.8	E237 E238 I239 L244 A245	E237-A241 WeakPolarHBondContact O-CB 3.31Å; E237-A241 PolarHBondContact O-N 3.1Å; E238-A241 PolarHBondContact O-N 3.35Å; I239-A241 PolarHBondContact O-N 3.46Å; A241-L244 PolarHBondContact O-N 2.92Å; A241-A245 WeakPolarHBondContact O-CB 3.25Å; A241-A245 PolarHBondContact O-N 3.43Å
242	R	87.3	Confident	80.6	Confident	43 Å²	43	47.7 Å²	47.7	16%	0.162	30%	0.304	C	S	.	.	H	α-helix	trans	-68.7	-39	179.1	-65.8	178.1	-166.7	-169.4	-4	112.9	L167 E238 I239 K240 A245 S246 V264 D268 E270	L167-R242 VanDerWaalsContact CD2-NH2 3.27Å; E238-R242 WeakPolarHBondContact O-CG 3.29Å; E238-R242 PolarHBondContact O-N 3.08Å; E238-R242 IonicContact OE1-CZ 3.89Å; E238-R242 IonicContact OE1-NE 2.79Å; E238-R242 PolarHBondContact OE1-NE 2.92Å; E238-R242 IonicContact OE1-NH2 3.32Å; E238-R242 PolarHBondContact OE1-NH2 3.16Å; I239-R242 PolarHBondContact O-N 2.72Å; K240-R242 PolarHBondContact O-N 2.92Å; R242-A245 PolarHBondContact O-N 3.17Å; R242-S246 PolarHBondContact O-N 3.36Å; R242-V264 HydrophobicContact CB-CG1 4.3Å; R242-D268 WeakPolarHBondContact CD-OD2 3.38Å; R242-D268 IonicContact CZ-OD2 2.87Å; R242-D268 IonicContact NE-OD2 3.12Å; R242-D268 IonicContact NH1-OD1 3.82Å; R242-D268 IonicContact NH1-OD2 2.9Å; R242-D268 PolarHBondContact NH1-OD2 3.17Å; R242-E270 IonicContact CZ-OE2 2.94Å; R242-E270 IonicContact NH1-OE2 2.72Å; R242-E270 PolarHBondContact NH1-OE2 3.31Å; R242-E270 IonicContact NH2-OE2 2.7Å; R242-E270 PolarHBondContact NH2-OE2 3.11Å
243	V	87.7	Confident	78.7	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-62.7	-43.8	174.2	171.5	0	0	0	0	110.8	F117 I239 K240 S246 I256 I260 L261 V264	F117-V243 HydrophobicContact CE1-CG1 4.29Å; F117-V243 HydrophobicContact CZ-CG1 4.32Å; I239-V243 HydrophobicContact CG2-CG2 4.29Å; I239-V243 WeakPolarHBondContact O-CB 3.15Å; I239-V243 WeakPolarHBondContact O-CG2 3.29Å; I239-V243 PolarHBondContact O-N 3.12Å; K240-V243 PolarHBondContact O-N 2.85Å; V243-S246 PolarHBondContact O-N 3.31Å; V243-S246 PolarHBondContact O-OG 3.12Å; V243-I256 HydrophobicContact CG1-CD1 4.22Å; V243-I256 HydrophobicContact CG1-CG2 3.84Å; V243-I260 HydrophobicContact CG1-CG2 4.39Å; V243-L261 HydrophobicContact CG2-CD1 3.76Å; V243-V264 HydrophobicContact CG2-CB 4.13Å; V243-V264 HydrophobicContact CG2-CG1 4.05Å; V243-V264 HydrophobicContact CG2-CG2 4.29Å
244	L	84.7	Confident	77.3	Confident	68 Å²	68	52.5 Å²	52.5	36%	0.356	36%	0.355	S	S	.	.	H	α-helix	trans	-65.9	-38.5	176.6	-69.1	173.5	0	0	0	112.4	K240 A241 S246 Q247 I256	K240-L244 HydrophobicContact CG-CD1 3.91Å; K240-L244 HydrophobicContact CG-CG 4.46Å; K240-L244 WeakPolarHBondContact O-CB 3.42Å; K240-L244 VanDerWaalsContact O-CG 3.3Å; K240-L244 WeakPolarHBondContact O-CG 3.39Å; K240-L244 PolarHBondContact O-N 2.88Å; A241-L244 PolarHBondContact O-N 2.92Å; L244-S246 VanDerWaalsContact C-N 3.34Å; L244-S246 PolarHBondContact O-N 3.03Å; L244-Q247 PolarHBondContact O-N 3.43Å; L244-I256 HydrophobicContact CD2-CD1 3.93Å
245	A	83.4	Confident	76.5	Confident	85 Å²	85	57.7 Å²	57.7	70%	0.702	38%	0.378	S	S	*	.	H	α-helix	trans	-68.3	-29.9	178	0	0	0	0	0	113.6	A241 R242 Q247	A241-A245 WeakPolarHBondContact O-CB 3.25Å; A241-A245 PolarHBondContact O-N 3.43Å; R242-A245 PolarHBondContact O-N 3.17Å; A245-Q247 PolarHBondContact O-N 3.01Å
246	S	80.1	Confident	75.9	Confident	59 Å²	59	57.7 Å²	57.7	41%	0.413	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-13	177.8	76	0	0	0	0	114.2	R242 V243 L244 V264	R242-S246 PolarHBondContact O-N 3.36Å; V243-S246 PolarHBondContact O-N 3.31Å; V243-S246 PolarHBondContact O-OG 3.12Å; L244-S246 VanDerWaalsContact C-N 3.34Å; L244-S246 PolarHBondContact O-N 3.03Å; S246-V264 VanDerWaalsContact OG-CG2 3.31Å; S246-V264 WeakPolarHBondContact OG-CG2 3.24Å
247	Q	74.4	Confident	75.6	Confident	54 Å²	54	59.5 Å²	59.5	25%	0.252	39%	0.391	S	S	.	.	S	Bend	trans	-98.7	131.9	-175	-66.8	-68	-42.2	0	0	110.2	L244 A245 I260	L244-Q247 PolarHBondContact O-N 3.43Å; A245-Q247 PolarHBondContact O-N 3.01Å; Q247-I260 VanDerWaalsContact NE2-CG2 3.26Å
248	S	61	Low	75.4	Confident	75 Å²	75	56.8 Å²	56.8	52%	0.524	38%	0.381	S	S	.	.			trans	-67.2	142.7	176.9	56.9	0	0	0	0	111.4	D250 G251	S248-D250 PolarHBondContact O-N 2.56Å; S248-G251 PolarHBondContact O-N 3.19Å
249	P	58.8	Low	75.2	Confident	131 Å²	131	62 Å²	62	85%	0.851	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-19.2	179.1	22.6	-31.8	0	0	0	113.8
250	D	53	Low	74.9	Confident	159 Å²	159	64 Å²	64	85%	0.85	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-3.8	179.9	-73.9	-22.7	0	0	0	114.4	S248 G252	S248-D250 PolarHBondContact O-N 2.56Å; D250-G252 PolarHBondContact O-N 3.22Å
251	G	49.9	Very low	74.8	Confident	31 Å²	31	62.6 Å²	62.6	32%	0.32	41%	0.41	S	S	.	.	S	Bend	trans	-72.1	126	174	0	0	0	0	0	110.8	R115 S248	R115-G251 PolarHBondContact NH2-O 3.47Å; S248-G251 PolarHBondContact O-N 3.19Å
252	G	49.3	Very low	74.8	Confident	66 Å²	66	63.1 Å²	63.1	68%	0.68	40%	0.404	S	S	*	.			trans	-50.5	154.7	175	0	0	0	0	0	112.9	D250 G254	D250-G252 PolarHBondContact O-N 3.22Å; G252-G254 PolarHBondContact O-N 3.27Å
253	G	56.2	Low	74.8	Confident	67 Å²	67	65.6 Å²	65.6	69%	0.691	42%	0.418	S	S	*	.	S	Bend	trans	-64.9	59.6	-174.6	0	0	0	0	0	115.5
254	G	64.3	Low	74.8	Confident	40 Å²	40	66.3 Å²	66.3	41%	0.412	42%	0.423	S	S	.	.			trans	-83.2	149.7	174.2	0	0	0	0	0	112.4	R115 G252	R115-G254 WeakPolarHBondContact CB-O 3.37Å; R115-G254 WeakPolarHBondContact CD-O 3.5Å; R115-G254 VanDerWaalsContact CG-O 3.26Å; R115-G254 WeakPolarHBondContact CG-O 3.47Å; G252-G254 PolarHBondContact O-N 3.27Å
255	E	77.1	Confident	74.9	Confident	129 Å²	129	63.2 Å²	63.2	60%	0.603	41%	0.407	S	S	*	.			trans	-65.8	149.2	174.6	-55.4	-172.2	144.6	0	0	111.5	T116 T118 S257	T116-E255 CarbonylContact O-C 3.56Å; T116-E255 WeakPolarHBondContact O-CA 3.22Å; T118-E255 HydrophobicContact CG2-CB 3.75Å; E255-S257 PolarHBondContact O-N 3.07Å
256	I	81.6	Confident	75.1	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.01	39%	0.389	C	S	.	.	B	Isolated β-bridge	trans	-81.2	114.6	178.1	-60	167.5	0	0	0	108.9	R115 T116 F117 T118 V243 L244 I260	R115-I256 HydrophobicContact CB-CD1 4.46Å; R115-I256 HydrophobicContact CB-CG1 4.35Å; T116-I256 PolarHBondContact O-N 3.1Å; F117-I256 HydrophobicContact CD1-CB 4Å; F117-I256 HydrophobicContact CD1-CD1 4.3Å; F117-I256 HydrophobicContact CD1-CG2 3.86Å; F117-I256 HydrophobicContact CD2-CD1 4.06Å; F117-I256 HydrophobicContact CE1-CB 4.22Å; F117-I256 HydrophobicContact CE1-CD1 3.94Å; F117-I256 HydrophobicContact CE1-CG2 3.77Å; F117-I256 HydrophobicContact CE2-CD1 3.67Å; F117-I256 HydrophobicContact CG-CB 4.34Å; F117-I256 HydrophobicContact CG-CD1 4.36Å; F117-I256 HydrophobicContact CZ-CD1 3.61Å; F117-I256 HydrophobicContact CZ-CG2 4.5Å; T118-I256 WeakPolarHBondContact CG2-O 3.43Å; T118-I256 PolarHBondContact N-O 3.48Å; T118-I256 VanDerWaalsContact N-O 3.08Å; T118-I256 PolarHBondContact OG1-O 3.05Å; V243-I256 HydrophobicContact CG1-CD1 4.22Å; V243-I256 HydrophobicContact CG1-CG2 3.84Å; L244-I256 HydrophobicContact CD2-CD1 3.93Å; I256-I260 HydrophobicContact CG2-CG2 4.46Å
257	S	86.8	Confident	75.3	Confident	38 Å²	38	63.6 Å²	63.6	27%	0.266	39%	0.392	S	S	.	.			trans	-80.3	162.3	176.9	71.8	0	0	0	0	112.3	E255 E259 I260 L261	E255-S257 PolarHBondContact O-N 3.07Å; S257-E259 PolarHBondContact O-N 2.9Å; S257-I260 PolarHBondContact O-N 3.03Å; S257-L261 PolarHBondContact O-N 3.38Å
258	A	87.1	Confident	75.8	Confident	18 Å²	18	62.5 Å²	62.5	15%	0.149	39%	0.388	C	S	.	.	H	α-helix	trans	-62.9	-29.4	175.4	0	0	0	0	0	112.7	E120 A121 R124 L261 E262	E120-A258 HydrophobicContact CG-CB 4.29Å; A121-A258 HydrophobicContact CB-CB 4.36Å; R124-A258 HydrophobicContact CB-CB 4.39Å; A258-L261 WeakPolarHBondContact O-CB 3.22Å; A258-L261 PolarHBondContact O-N 3.39Å; A258-E262 WeakPolarHBondContact O-CG 3.28Å; A258-E262 PolarHBondContact O-N 2.97Å
259	E	86.5	Confident	76.7	Confident	155 Å²	155	59.4 Å²	59.4	72%	0.724	37%	0.367	S	S	*	.	H	α-helix	trans	-67.6	-42.4	179.8	-63.5	171.4	178.5	0	0	112	S257 L261 E262 M263	S257-E259 PolarHBondContact O-N 2.9Å; E259-L261 VanDerWaalsContact C-N 3.31Å; E259-L261 PolarHBondContact O-N 3.37Å; E259-E262 PolarHBondContact O-N 3.04Å; E259-M263 WeakPolarHBondContact O-CB 3.27Å; E259-M263 PolarHBondContact O-N 3.33Å
260	I	86.1	Confident	77.9	Confident	44 Å²	44	54.6 Å²	54.6	23%	0.226	33%	0.333	C	S	.	.	H	α-helix	trans	-62.9	-42.4	176.1	-66	169.4	0	0	0	110	V243 Q247 I256 S257 M263 V264	V243-I260 HydrophobicContact CG1-CG2 4.39Å; Q247-I260 VanDerWaalsContact NE2-CG2 3.26Å; I256-I260 HydrophobicContact CG2-CG2 4.46Å; S257-I260 PolarHBondContact O-N 3.03Å; I260-M263 PolarHBondContact O-N 3.06Å; I260-V264 WeakPolarHBondContact O-CG2 3.4Å; I260-V264 PolarHBondContact O-N 2.89Å; I260-V264 VanDerWaalsContact O-N 3.09Å
261	L	87.7	Confident	79.6	Confident	0 Å²	0	47 Å²	47	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-59	-49.3	176.7	174.8	68.2	0	0	0	111.3	L125 I239 V243 S257 A258 E259 V264 I265	L125-L261 HydrophobicContact CB-CD2 3.91Å; L125-L261 HydrophobicContact CD1-CD1 4.48Å; L125-L261 HydrophobicContact CD1-CD2 4.45Å; I239-L261 HydrophobicContact CG2-CD1 3.66Å; V243-L261 HydrophobicContact CG2-CD1 3.76Å; S257-L261 PolarHBondContact O-N 3.38Å; A258-L261 WeakPolarHBondContact O-CB 3.22Å; A258-L261 PolarHBondContact O-N 3.39Å; E259-L261 VanDerWaalsContact C-N 3.31Å; E259-L261 PolarHBondContact O-N 3.37Å; L261-V264 PolarHBondContact O-N 3.26Å; L261-I265 HydrophobicContact CD1-CD1 3.94Å; L261-I265 HydrophobicContact CG-CD1 3.98Å; L261-I265 WeakPolarHBondContact O-CG1 3.47Å; L261-I265 PolarHBondContact O-N 3.33Å; L261-I265 VanDerWaalsContact O-N 3.11Å
262	E	87.5	Confident	81.3	Confident	62 Å²	62	46.9 Å²	46.9	29%	0.29	28%	0.282	S	S	.	.	H	α-helix	trans	-65.6	-39.7	179.2	-72.4	-170.5	160.4	0	0	112.6	R124 A258 E259 V264 I265 N266	R124-E262 IonicContact CZ-OE1 2.92Å; R124-E262 IonicContact NE-OE1 2.68Å; R124-E262 PolarHBondContact NE-OE1 3.46Å; R124-E262 IonicContact NH2-OE1 3.31Å; R124-E262 PolarHBondContact NH2-OE1 3.31Å; A258-E262 WeakPolarHBondContact O-CG 3.28Å; A258-E262 PolarHBondContact O-N 2.97Å; E259-E262 PolarHBondContact O-N 3.04Å; E262-V264 VanDerWaalsContact C-N 3.32Å; E262-V264 PolarHBondContact O-N 3.2Å; E262-I265 PolarHBondContact O-N 3.43Å; E262-N266 WeakPolarHBondContact O-CB 3.41Å; E262-N266 PolarHBondContact O-N 2.95Å; E262-N266 PolarHBondContact O-ND2 3.42Å
263	M	87.7	Confident	82.9	Confident	94 Å²	94	43.9 Å²	43.9	46%	0.463	25%	0.252	S	S	.	.	H	α-helix	trans	-59	-43.9	176.7	-176.7	-165.2	70	0	0	111.6	E259 I260 N266 N267	E259-M263 WeakPolarHBondContact O-CB 3.27Å; E259-M263 PolarHBondContact O-N 3.33Å; I260-M263 PolarHBondContact O-N 3.06Å; M263-N266 PolarHBondContact O-N 3.48Å; M263-N267 PolarHBondContact O-N 3.26Å; M263-N267 PolarHBondContact O-ND2 3.4Å
264	V	87.3	Confident	84.4	Confident	15 Å²	15	41 Å²	41	9%	0.091	22%	0.22	C	C	.	.	H	α-helix	trans	-64.6	-46	177.5	173	0	0	0	0	110.7	R242 V243 S246 I260 L261 E262 N266 N267 D268	R242-V264 HydrophobicContact CB-CG1 4.3Å; V243-V264 HydrophobicContact CG2-CB 4.13Å; V243-V264 HydrophobicContact CG2-CG1 4.05Å; V243-V264 HydrophobicContact CG2-CG2 4.29Å; S246-V264 VanDerWaalsContact OG-CG2 3.31Å; S246-V264 WeakPolarHBondContact OG-CG2 3.24Å; I260-V264 WeakPolarHBondContact O-CG2 3.4Å; I260-V264 PolarHBondContact O-N 2.89Å; I260-V264 VanDerWaalsContact O-N 3.09Å; L261-V264 PolarHBondContact O-N 3.26Å; E262-V264 VanDerWaalsContact C-N 3.32Å; E262-V264 PolarHBondContact O-N 3.2Å; V264-N266 VanDerWaalsContact C-N 3.31Å; V264-N266 PolarHBondContact O-N 3.2Å; V264-N267 PolarHBondContact O-N 3.26Å; V264-D268 WeakPolarHBondContact O-CB 3.49Å; V264-D268 PolarHBondContact O-N 2.97Å; V264-D268 VanDerWaalsContact O-N 3.1Å
265	I	87.6	Confident	85.6	Confident	4 Å²	4	39.1 Å²	39.1	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-62.3	-39	178.6	-68.5	168.5	0	0	0	111.5	L128 L261 E262 N267 W272 L275	L128-I265 HydrophobicContact CD1-CD1 3.58Å; L261-I265 HydrophobicContact CD1-CD1 3.94Å; L261-I265 HydrophobicContact CG-CD1 3.98Å; L261-I265 WeakPolarHBondContact O-CG1 3.47Å; L261-I265 PolarHBondContact O-N 3.33Å; L261-I265 VanDerWaalsContact O-N 3.11Å; E262-I265 PolarHBondContact O-N 3.43Å; I265-N267 VanDerWaalsContact C-N 3.35Å; I265-W272 WeakPolarHBondContact O-CB 3.4Å; I265-L275 HydrophobicContact CD1-CD1 3.92Å; I265-L275 HydrophobicContact CG1-CD1 4.21Å; I265-L275 HydrophobicContact CG2-CD1 3.78Å
266	N	86.8	Confident	86	Confident	62 Å²	62	34.3 Å²	34.3	33%	0.332	18%	0.179	S	C	.	.	H	α-helix	trans	-69.9	-31.2	-179.2	-72.5	-21.9	0	0	0	113.1	E262 M263 V264 A287	E262-N266 WeakPolarHBondContact O-CB 3.41Å; E262-N266 PolarHBondContact O-N 2.95Å; E262-N266 PolarHBondContact O-ND2 3.42Å; M263-N266 PolarHBondContact O-N 3.48Å; V264-N266 VanDerWaalsContact C-N 3.31Å; V264-N266 PolarHBondContact O-N 3.2Å; N266-A287 HydrophobicContact CB-CB 3.82Å; N266-A287 VanDerWaalsContact O-CB 3.26Å; N266-A287 WeakPolarHBondContact O-CB 3.49Å; N266-A287 PolarHBondContact O-N 2.91Å
267	N	85.5	Confident	86.1	Confident	90 Å²	90	35.6 Å²	35.6	48%	0.481	19%	0.187	S	C	.	.	H	α-helix	trans	-85.9	-20.2	179.4	-71.5	-39.8	0	0	0	113.3	M263 V264 I265	M263-N267 PolarHBondContact O-N 3.26Å; M263-N267 PolarHBondContact O-ND2 3.4Å; V264-N267 PolarHBondContact O-N 3.26Å; I265-N267 VanDerWaalsContact C-N 3.35Å
268	D	84.2	Confident	86	Confident	30 Å²	30	35.5 Å²	35.5	16%	0.16	18%	0.181	C	C	.	.			trans	-88.9	111.6	179.7	-173	-19.3	0	0	0	111.6	R242 V264 E270 L271 W272	R242-D268 WeakPolarHBondContact CD-OD2 3.38Å; R242-D268 IonicContact CZ-OD2 2.87Å; R242-D268 IonicContact NE-OD2 3.12Å; R242-D268 IonicContact NH1-OD1 3.82Å; R242-D268 IonicContact NH1-OD2 2.9Å; R242-D268 PolarHBondContact NH1-OD2 3.17Å; V264-D268 WeakPolarHBondContact O-CB 3.49Å; V264-D268 PolarHBondContact O-N 2.97Å; V264-D268 VanDerWaalsContact O-N 3.1Å; D268-E270 PolarHBondContact O-N 3.35Å; D268-E270 WeakPolarHBondContact OD1-CB 3.22Å; D268-E270 PolarHBondContact OD1-N 3.35Å; D268-L271 HydrophobicContact CB-CB 4.24Å; D268-L271 HydrophobicContact CB-CD1 4.34Å; D268-L271 HydrophobicContact CB-CG 4.47Å; D268-L271 PolarHBondContact O-N 2.89Å; D268-L271 PolarHBondContact OD1-N 3.07Å; D268-L271 WeakPolarHBondContact OD2-CD1 3.44Å; D268-L271 WeakPolarHBondContact OD2-CG 3.5Å; D268-W272 VanDerWaalsContact O-CB 3.22Å; D268-W272 WeakPolarHBondContact O-CB 3.37Å; D268-W272 PolarHBondContact O-N 2.92Å
269	A	80.5	Confident	85.6	Confident	11 Å²	11	39 Å²	39	9%	0.091	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-16.5	-179.9	0	0	0	0	0	114.8	K285 N286 S292	A269-K285 WeakPolarHBondContact CA-O 3.3Å; A269-N286 HydrophobicContact CB-CB 4.41Å; A269-S292 WeakPolarHBondContact CB-OG 3.47Å
270	E	84.1	Confident	85.4	Confident	29 Å²	29	31.9 Å²	31.9	14%	0.136	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-35.3	176.6	-60.3	-175.8	163.9	0	0	111.8	S164 S166 L167 R242 D268	S164-E270 WeakPolarHBondContact OG-CB 3.36Å; S166-E270 PolarHBondContact OG-OE1 3.13Å; S166-E270 PolarHBondContact OG-OE2 3.48Å; L167-E270 HydrophobicContact CD1-CB 3.79Å; L167-E270 WeakPolarHBondContact CD1-O 3.43Å; L167-E270 HydrophobicContact CG-CB 4.3Å; R242-E270 IonicContact CZ-OE2 2.94Å; R242-E270 IonicContact NH1-OE2 2.72Å; R242-E270 PolarHBondContact NH1-OE2 3.31Å; R242-E270 IonicContact NH2-OE2 2.7Å; R242-E270 PolarHBondContact NH2-OE2 3.11Å; D268-E270 PolarHBondContact O-N 3.35Å; D268-E270 WeakPolarHBondContact OD1-CB 3.22Å; D268-E270 PolarHBondContact OD1-N 3.35Å
271	L	87.1	Confident	85.4	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.005	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-38.5	-177.9	-69	176.5	0	0	0	112.9	L167 L235 I239 D268 G273 V274 L275	L167-L271 HydrophobicContact CD1-CD2 3.86Å; L167-L271 HydrophobicContact CD2-CD2 4.31Å; L235-L271 HydrophobicContact CD1-CD2 4.08Å; I239-L271 HydrophobicContact CD1-CD2 4.47Å; I239-L271 HydrophobicContact CG1-CD1 3.93Å; I239-L271 HydrophobicContact CG1-CD2 3.9Å; D268-L271 HydrophobicContact CB-CB 4.24Å; D268-L271 HydrophobicContact CB-CD1 4.34Å; D268-L271 HydrophobicContact CB-CG 4.47Å; D268-L271 PolarHBondContact O-N 2.89Å; D268-L271 PolarHBondContact OD1-N 3.07Å; D268-L271 WeakPolarHBondContact OD2-CD1 3.44Å; D268-L271 WeakPolarHBondContact OD2-CG 3.5Å; L271-G273 VanDerWaalsContact C-N 3.31Å; L271-G273 PolarHBondContact O-N 2.99Å; L271-V274 PolarHBondContact O-N 3.07Å; L271-L275 HydrophobicContact CB-CD1 4.5Å; L271-L275 WeakPolarHBondContact O-CG 3.37Å; L271-L275 PolarHBondContact O-N 3.45Å
272	W	86.2	Confident	85	Confident	27 Å²	27	30.5 Å²	30.5	10%	0.102	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-49.6	-170.4	-179.4	71.7	0	0	0	111.9	I265 D268 L275 Q276 I282 K285 A287	I265-W272 WeakPolarHBondContact O-CB 3.4Å; D268-W272 VanDerWaalsContact O-CB 3.22Å; D268-W272 WeakPolarHBondContact O-CB 3.37Å; D268-W272 PolarHBondContact O-N 2.92Å; W272-L275 PolarHBondContact O-N 3.2Å; W272-Q276 HydrophobicContact CD2-CG 4.14Å; W272-Q276 HydrophobicContact CZ2-CG 4.05Å; W272-Q276 VanDerWaalsContact NE1-NE2 3.16Å; W272-Q276 VanDerWaalsContact O-CG 3.27Å; W272-Q276 WeakPolarHBondContact O-CG 3.25Å; W272-Q276 PolarHBondContact O-N 2.97Å; W272-Q276 PolarHBondContact O-NE2 3.08Å; W272-I282 HydrophobicContact CE3-CG2 4.19Å; W272-I282 HydrophobicContact CH2-CD1 4.14Å; W272-I282 HydrophobicContact CH2-CG2 4.22Å; W272-I282 HydrophobicContact CZ3-CB 4.18Å; W272-I282 HydrophobicContact CZ3-CD1 4.3Å; W272-I282 HydrophobicContact CZ3-CG2 3.44Å; W272-I282 VanDerWaalsContact CZ3-CG2 3.44Å; W272-K285 VanDerWaalsContact CE3-O 3.28Å; W272-A287 HydrophobicContact CZ2-CB 4.41Å
273	G	82.4	Confident	84.5	Confident	3 Å²	3	28.1 Å²	28.1	3%	0.031	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-50.1	-178.1	0	0	0	0	0	115.6	L271 L275 Q276 I282	L271-G273 VanDerWaalsContact C-N 3.31Å; L271-G273 PolarHBondContact O-N 2.99Å; G273-L275 PolarHBondContact O-N 3.38Å; G273-Q276 PolarHBondContact O-N 2.65Å; G273-I282 WeakPolarHBondContact CA-O 3.36Å
274	V	88.1	Confident	83.9	Confident	6 Å²	6	24 Å²	24	4%	0.036	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-33.7	-177.3	179.6	0	0	0	0	111	A132 R135 I162 L271	A132-V274 HydrophobicContact CB-CG1 3.72Å; R135-V274 WeakPolarHBondContact CD-O 3.37Å; R135-V274 PolarHBondContact NE-O 2.9Å; I162-V274 HydrophobicContact CG2-CG1 4.09Å; I162-V274 HydrophobicContact CG2-CG2 4.29Å; L271-V274 PolarHBondContact O-N 3.07Å
275	L	89.2	Confident	83.5	Confident	1 Å²	1	23.6 Å²	23.6	1%	0.005	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	1.4	-175	-57.8	178	0	0	0	113.7	L128 R131 A132 I239 I265 L271 W272 G273	L128-L275 HydrophobicContact CB-CB 4.45Å; L128-L275 HydrophobicContact CB-CD1 4.42Å; L128-L275 HydrophobicContact CB-CD2 4.17Å; L128-L275 WeakPolarHBondContact O-CD2 3.47Å; R131-L275 WeakPolarHBondContact CD-O 3.4Å; R131-L275 PolarHBondContact NH1-O 3.22Å; A132-L275 HydrophobicContact CB-CD2 4.21Å; I239-L275 HydrophobicContact CD1-CD1 4.28Å; I265-L275 HydrophobicContact CD1-CD1 3.92Å; I265-L275 HydrophobicContact CG1-CD1 4.21Å; I265-L275 HydrophobicContact CG2-CD1 3.78Å; L271-L275 HydrophobicContact CB-CD1 4.5Å; L271-L275 WeakPolarHBondContact O-CG 3.37Å; L271-L275 PolarHBondContact O-N 3.45Å; W272-L275 PolarHBondContact O-N 3.2Å; G273-L275 PolarHBondContact O-N 3.38Å
276	Q	87.2	Confident	83.2	Confident	28 Å²	28	24.5 Å²	24.5	13%	0.131	13%	0.128	C	C	.	.	S	Bend	trans	-76.4	153.4	175.1	-72	-34.6	-64.9	0	0	112.9	R135 W272 G273 Y278 I282	R135-Q276 PolarHBondContact NH2-O 3.04Å; W272-Q276 HydrophobicContact CD2-CG 4.14Å; W272-Q276 HydrophobicContact CZ2-CG 4.05Å; W272-Q276 VanDerWaalsContact NE1-NE2 3.16Å; W272-Q276 VanDerWaalsContact O-CG 3.27Å; W272-Q276 WeakPolarHBondContact O-CG 3.25Å; W272-Q276 PolarHBondContact O-N 2.97Å; W272-Q276 PolarHBondContact O-NE2 3.08Å; G273-Q276 PolarHBondContact O-N 2.65Å; Q276-Y278 VanDerWaalsContact C-N 3.3Å; Q276-Y278 HydrophobicContact CB-CD2 3.81Å; Q276-Y278 HydrophobicContact CB-CE2 4.16Å; Q276-Y278 HydrophobicContact CG-CD2 4.4Å; Q276-Y278 HydrophobicContact CG-CE2 4.37Å; Q276-Y278 PolarHBondContact O-N 3.24Å; Q276-I282 HydrophobicContact CG-CD1 4.47Å
277	P	83.6	Confident	82.8	Confident	30 Å²	30	23.5 Å²	23.5	20%	0.195	13%	0.128	C	C	.	.	S	Bend	trans	-80.3	-2.5	-176.9	33.4	-36	0	0	0	114.4	K87 L88	K87-P277 CarbonylContact C-O 3.59Å; K87-P277 VanDerWaalsContact CA-O 3.3Å; K87-P277 WeakPolarHBondContact CA-O 3.46Å; L88-P277 PolarHBondContact N-O 2.93Å
278	Y	83.2	Confident	82.2	Confident	35 Å²	35	24.8 Å²	24.8	14%	0.137	14%	0.135	C	C	.	.	B	Isolated β-bridge	trans	-77.9	149.9	-174.7	-50.8	-68.2	0	0	0	112.7	F82 C85 P86 R135 Q276 H280 I282	F82-Y278 HydrophobicContact CB-CE1 3.99Å; F82-Y278 WeakPolarHBondContact CB-OH 3.47Å; F82-Y278 HydrophobicContact CD1-CD2 4.37Å; F82-Y278 HydrophobicContact CD1-CE1 4.01Å; F82-Y278 AromaticContact CD1-CE2 3.77Å; F82-Y278 HydrophobicContact CD1-CE2 3.77Å; F82-Y278 AromaticContact CD1-CZ 3.58Å; F82-Y278 HydrophobicContact CE1-CE2 4.25Å; F82-Y278 HydrophobicContact CG-CE1 4.46Å; F82-Y278 AromaticContact CG-CZ 4Å; F82-Y278 WeakPolarHBondContact O-CE1 3.34Å; C85-Y278 HydrophobicContact CB-CD1 3.9Å; C85-Y278 HydrophobicContact CB-CE1 4.43Å; P86-Y278 WeakPolarHBondContact O-CA 3.46Å; R135-Y278 PolarHBondContact NH1-O 3.03Å; R135-Y278 VanDerWaalsContact NH1-O 3.09Å; R135-Y278 PolarHBondContact NH2-O 3.44Å; Q276-Y278 VanDerWaalsContact C-N 3.3Å; Q276-Y278 HydrophobicContact CB-CD2 3.81Å; Q276-Y278 HydrophobicContact CB-CE2 4.16Å; Q276-Y278 HydrophobicContact CG-CD2 4.4Å; Q276-Y278 HydrophobicContact CG-CE2 4.37Å; Q276-Y278 PolarHBondContact O-N 3.24Å; Y278-H280 AromaticContact CG-CE1 3.97Å; Y278-I282 HydrophobicContact CD2-CD1 3.5Å; Y278-I282 VanDerWaalsContact CD2-CD1 3.5Å; Y278-I282 HydrophobicContact CE2-CD1 3.93Å; Y278-I282 HydrophobicContact CG-CD1 4.46Å
279	E	79.1	Confident	81.5	Confident	92 Å²	92	24.4 Å²	24.4	43%	0.43	14%	0.138	S	C	.	.	S	Bend	trans	-64.5	-48.4	178.1	176.5	161.2	-134.6	0	0	112.7	P86 R135 R138	P86-E279 HydrophobicContact CB-CB 4.06Å; P86-E279 WeakPolarHBondContact CB-OE2 3.23Å; P86-E279 PolarHBondContact O-N 3.02Å; R135-E279 PolarHBondContact NH1-O 3.33Å; R135-E279 VanDerWaalsContact NH1-O 3.17Å; R138-E279 IonicContact CZ-OE1 3.48Å; R138-E279 IonicContact NH1-OE1 3.36Å; R138-E279 PolarHBondContact NH1-OE1 3.45Å
280	H	82.7	Confident	81.3	Confident	5 Å²	5	27.9 Å²	27.9	2%	0.023	16%	0.158	C	C	.	.	S	Bend	trans	-64.9	152	172.8	67	-75.9	0	0	0	110.8	R135 Y278 P449	R135-H280 PolarHBondContact NH1-O 2.91Å; R135-H280 VanDerWaalsContact NH1-O 3.11Å; Y278-H280 AromaticContact CG-CE1 3.97Å; H280-P449 HydrophobicContact CB-CB 4.5Å
281	L	85.6	Confident	81	Confident	2 Å²	2	28.2 Å²	28.2	1%	0.01	16%	0.161	C	C	.	.			trans	-91.4	118.8	179.2	-176.5	69	0	0	0	109.6	I162 C283 L446 L447	I162-L281 HydrophobicContact CG2-CD1 4.17Å; I162-L281 WeakPolarHBondContact O-CD2 3.39Å; L281-C283 WeakPolarHBondContact CD2-SG 3.48Å; L281-C283 WeakPolarHBondContact CG-SG 3.38Å; L281-L446 HydrophobicContact CB-CD1 4.07Å; L281-L446 HydrophobicContact CB-CG 4.14Å; L281-L446 WeakPolarHBondContact CB-O 3.47Å; L281-L446 HydrophobicContact CD2-CD1 4.42Å; L281-L446 HydrophobicContact CD2-CD2 4.18Å; L281-L446 HydrophobicContact CD2-CG 4.17Å; L281-L446 PolarHBondContact N-O 3.44Å; L281-L447 HydrophobicContact CB-CD2 4.48Å; L281-L447 HydrophobicContact CD2-CD2 4.34Å
282	I	80.2	Confident	80.3	Confident	14 Å²	14	30.5 Å²	30.5	7%	0.072	18%	0.176	C	C	.	.			trans	-90.7	108.1	174.8	-53.7	171.9	0	0	0	107.7	F82 W272 G273 Q276 Y278	F82-I282 HydrophobicContact CE1-CD1 3.89Å; W272-I282 HydrophobicContact CE3-CG2 4.19Å; W272-I282 HydrophobicContact CH2-CD1 4.14Å; W272-I282 HydrophobicContact CH2-CG2 4.22Å; W272-I282 HydrophobicContact CZ3-CB 4.18Å; W272-I282 HydrophobicContact CZ3-CD1 4.3Å; W272-I282 HydrophobicContact CZ3-CG2 3.44Å; W272-I282 VanDerWaalsContact CZ3-CG2 3.44Å; G273-I282 WeakPolarHBondContact CA-O 3.36Å; Q276-I282 HydrophobicContact CG-CD1 4.47Å; Y278-I282 HydrophobicContact CD2-CD1 3.5Å; Y278-I282 VanDerWaalsContact CD2-CD1 3.5Å; Y278-I282 HydrophobicContact CE2-CD1 3.93Å; Y278-I282 HydrophobicContact CG-CD1 4.46Å
283	C	76.7	Confident	79.6	Confident	11 Å²	11	30.2 Å²	30.2	7%	0.074	18%	0.177	C	C	.	.			trans	-114.5	152	-178.5	-75.7	0	0	0	0	113.4	L281 K285 E418	L281-C283 WeakPolarHBondContact CD2-SG 3.48Å; L281-C283 WeakPolarHBondContact CG-SG 3.38Å; C283-K285 VanDerWaalsContact C-N 3.29Å; C283-K285 PolarHBondContact O-N 3.4Å; C283-E418 HydrophobicContact CB-CB 4.2Å; C283-E418 HydrophobicContact CB-CG 3.54Å; C283-E418 VanDerWaalsContact CB-OE2 3.32Å; C283-E418 WeakPolarHBondContact CB-OE2 3.47Å
284	G	74.4	Confident	79	Confident	8 Å²	8	30.4 Å²	30.4	8%	0.082	18%	0.178	C	C	.	.	S	Bend	trans	73.6	16.2	169	0	0	0	0	0	114.7	L291 S292	G284-L291 WeakPolarHBondContact O-CA 3.28Å; G284-S292 PolarHBondContact O-N 3.2Å
285	K	78.8	Confident	77.9	Confident	6 Å²	6	32.5 Å²	32.5	3%	0.026	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	-137.1	148.4	179.2	-63.5	-178.5	-170.6	177.6	0	111.1	A269 W272 C283 V290 L291 F410 M411 L413	A269-K285 WeakPolarHBondContact CA-O 3.3Å; W272-K285 VanDerWaalsContact CE3-O 3.28Å; C283-K285 VanDerWaalsContact C-N 3.29Å; C283-K285 PolarHBondContact O-N 3.4Å; K285-V290 VanDerWaalsContact CA-O 3.3Å; K285-V290 WeakPolarHBondContact CA-O 3.46Å; K285-L291 HydrophobicContact CD-CD2 4.06Å; K285-L291 HydrophobicContact CD-CG 4.47Å; K285-L291 HydrophobicContact CG-CD2 3.54Å; K285-L291 HydrophobicContact CG-CG 4.09Å; K285-F410 PolarHBondContact NZ-O 3.24Å; K285-M411 PolarHBondContact NZ-O 2.85Å; K285-L413 VanDerWaalsContact CE-O 3.3Å; K285-L413 WeakPolarHBondContact CE-O 3.4Å; K285-L413 PolarHBondContact NZ-O 3.17Å
286	N	81.2	Confident	76.5	Confident	24 Å²	24	35.7 Å²	35.7	13%	0.128	21%	0.208	C	C	.	.			trans	-89	179.8	169.2	67.4	10.3	0	0	0	111.7	A269 N288 G289 V290	A269-N286 HydrophobicContact CB-CB 4.41Å; N286-N288 PolarHBondContact O-N 3Å; N286-N288 VanDerWaalsContact O-N 3.1Å; N286-N288 WeakPolarHBondContact OD1-CB 3.45Å; N286-N288 PolarHBondContact OD1-N 2.85Å; N286-N288 VanDerWaalsContact OD1-N 3.11Å; N286-G289 PolarHBondContact O-N 3.43Å; N286-G289 PolarHBondContact OD1-N 3.21Å; N286-V290 PolarHBondContact N-O 3.29Å; N286-V290 WeakPolarHBondContact OD1-CB 3.38Å; N286-V290 PolarHBondContact OD1-N 3.27Å
287	A	78.3	Confident	75.3	Confident	40 Å²	40	35.4 Å²	35.4	33%	0.331	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-25.4	179	0	0	0	0	0	113.9	N266 W272 G289	N266-A287 HydrophobicContact CB-CB 3.82Å; N266-A287 VanDerWaalsContact O-CB 3.26Å; N266-A287 WeakPolarHBondContact O-CB 3.49Å; N266-A287 PolarHBondContact O-N 2.91Å; W272-A287 HydrophobicContact CZ2-CB 4.41Å; A287-G289 VanDerWaalsContact C-N 3.28Å
288	N	73.6	Confident	74.2	Confident	117 Å²	117	35.9 Å²	35.9	63%	0.626	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.4	1.1	178.8	-57.8	-16.7	0	0	0	112.5	N286 V290	N286-N288 PolarHBondContact O-N 3Å; N286-N288 VanDerWaalsContact O-N 3.1Å; N286-N288 WeakPolarHBondContact OD1-CB 3.45Å; N286-N288 PolarHBondContact OD1-N 2.85Å; N286-N288 VanDerWaalsContact OD1-N 3.11Å; N288-V290 VanDerWaalsContact C-N 3.29Å; N288-V290 HydrophobicContact CB-CG2 4.3Å; N288-V290 PolarHBondContact O-N 3.07Å
289	G	69.9	Low	72.7	Confident	22 Å²	22	36.1 Å²	36.1	23%	0.227	22%	0.216	C	C	.	.			trans	77.8	7.8	-179.1	0	0	0	0	0	114.9	N286 A287 L291	N286-G289 PolarHBondContact O-N 3.43Å; N286-G289 PolarHBondContact OD1-N 3.21Å; A287-G289 VanDerWaalsContact C-N 3.28Å; G289-L291 PolarHBondContact O-N 3.4Å
290	V	75.3	Confident	71.5	Confident	84 Å²	84	38.8 Å²	38.8	51%	0.509	22%	0.223	S	C	.	.			trans	-73.1	122.5	178.9	-178.8	0	0	0	0	109.1	K285 N286 N288	K285-V290 VanDerWaalsContact CA-O 3.3Å; K285-V290 WeakPolarHBondContact CA-O 3.46Å; N286-V290 PolarHBondContact N-O 3.29Å; N286-V290 WeakPolarHBondContact OD1-CB 3.38Å; N286-V290 PolarHBondContact OD1-N 3.27Å; N288-V290 VanDerWaalsContact C-N 3.29Å; N288-V290 HydrophobicContact CB-CG2 4.3Å; N288-V290 PolarHBondContact O-N 3.07Å
291	L	78.1	Confident	69.7	Low	37 Å²	37	44 Å²	44	19%	0.194	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-69.8	132.5	173.9	-78	168.8	0	0	0	110.3	G284 K285 G289 L327 T329 P415	G284-L291 WeakPolarHBondContact O-CA 3.28Å; K285-L291 HydrophobicContact CD-CD2 4.06Å; K285-L291 HydrophobicContact CD-CG 4.47Å; K285-L291 HydrophobicContact CG-CD2 3.54Å; K285-L291 HydrophobicContact CG-CG 4.09Å; G289-L291 PolarHBondContact O-N 3.4Å; L291-L327 HydrophobicContact CB-CD2 4.08Å; L291-T329 HydrophobicContact CD1-CG2 4.04Å; L291-P415 HydrophobicContact CD2-CB 3.99Å; L291-P415 HydrophobicContact CD2-CG 3.84Å
292	S	73.4	Confident	67.5	Low	48 Å²	48	50.8 Å²	50.8	34%	0.336	29%	0.288	S	S	.	.			trans	-139.7	140.6	175.2	66.2	0	0	0	0	111.4	A269 G284	A269-S292 WeakPolarHBondContact CB-OG 3.47Å; G284-S292 PolarHBondContact O-N 3.2Å
293	L	71.6	Confident	65.6	Low	21 Å²	21	54 Å²	54	11%	0.11	32%	0.324	C	S	.	.			trans	-81	144.7	169.5	-67.2	175.7	0	0	0	110.6	F297 E323 L326 L327	L293-F297 HydrophobicContact CB-CB 4.47Å; L293-E323 HydrophobicContact CD1-CB 3.9Å; L293-E323 HydrophobicContact CD1-CG 3.63Å; L293-L326 HydrophobicContact CD1-CD1 4.44Å; L293-L326 HydrophobicContact CD2-CB 3.84Å; L293-L326 HydrophobicContact CD2-CD1 4.36Å; L293-L327 HydrophobicContact CD1-CG 4.41Å; L293-L327 HydrophobicContact CD2-CD2 3.61Å; L293-L327 HydrophobicContact CD2-CG 4.04Å; L293-L327 HydrophobicContact CG-CD1 4.36Å; L293-L327 HydrophobicContact CG-CD2 3.78Å; L293-L327 HydrophobicContact CG-CG 3.98Å
294	P	68.6	Low	63.7	Low	7 Å²	7	57.8 Å²	57.8	5%	0.045	35%	0.351	C	S	.	.			trans	-52	145.5	169.6	-25.2	33.5	0	0	0	110.8	Y296 F297 S298 M417	P294-Y296 PolarHBondContact O-N 3.19Å; P294-F297 HydrophobicContact CB-CD2 4.35Å; P294-F297 HydrophobicContact CG-CD2 4.31Å; P294-F297 PolarHBondContact O-N 2.96Å; P294-S298 PolarHBondContact O-N 2.84Å; P294-S298 VanDerWaalsContact O-N 3.08Å; P294-M417 HydrophobicContact CG-CE 3.82Å
295	A	64.7	Low	61.9	Low	50 Å²	50	63.6 Å²	63.6	41%	0.413	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-24.5	-178.6	0	0	0	0	0	113.5	S298	A295-S298 WeakPolarHBondContact O-CB 3.31Å; A295-S298 PolarHBondContact O-N 3.2Å
296	Y	60.5	Low	59.7	Low	68 Å²	68	67.9 Å²	67.9	27%	0.267	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-33.4	174.2	-178.7	-102.4	0	0	0	114.1	P294 L351	P294-Y296 PolarHBondContact O-N 3.19Å; Y296-L351 HydrophobicContact CE1-CD1 4.47Å
297	F	61.1	Low	57.8	Low	23 Å²	23	72 Å²	72	10%	0.101	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-4.3	175.3	-66.4	-72.3	0	0	0	112.2	W165 L293 P294 P299 M348 L351	W165-F297 HydrophobicContact CB-CE2 4.33Å; W165-F297 AromaticContact CD2-CE2 3.97Å; W165-F297 HydrophobicContact CD2-CE2 3.97Å; W165-F297 HydrophobicContact CD2-CZ 4.2Å; W165-F297 HydrophobicContact CE3-CE2 4.23Å; W165-F297 HydrophobicContact CE3-CZ 4.35Å; W165-F297 AromaticContact CG-CE2 4Å; W165-F297 HydrophobicContact CG-CE2 4Å; L293-F297 HydrophobicContact CB-CB 4.47Å; P294-F297 HydrophobicContact CB-CD2 4.35Å; P294-F297 HydrophobicContact CG-CD2 4.31Å; P294-F297 PolarHBondContact O-N 2.96Å; F297-P299 VanDerWaalsContact O-CD 3.3Å; F297-P299 WeakPolarHBondContact O-CD 3.31Å; F297-M348 HydrophobicContact CE1-CG 4Å; F297-M348 HydrophobicContact CZ-CE 4.37Å; F297-M348 HydrophobicContact CZ-CG 4.37Å; F297-L351 HydrophobicContact CD1-CD1 3.81Å; F297-L351 HydrophobicContact CE1-CD1 3.8Å
298	S	61	Low	56	Low	39 Å²	39	76.1 Å²	76.1	27%	0.273	46%	0.461	S	S	.	.			trans	-71.9	116.1	175.5	-177.3	0	0	0	0	109.4	P294 A295 Y300 N301	P294-S298 PolarHBondContact O-N 2.84Å; P294-S298 VanDerWaalsContact O-N 3.08Å; A295-S298 WeakPolarHBondContact O-CB 3.31Å; A295-S298 PolarHBondContact O-N 3.2Å; S298-Y300 PolarHBondContact O-N 2.72Å; S298-N301 PolarHBondContact O-N 2.98Å
299	P	52.4	Low	54.7	Low	41 Å²	41	73.7 Å²	73.7	27%	0.266	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-3.7	-176.1	17.2	-17.8	0	0	0	114.1	F297 L319	F297-P299 VanDerWaalsContact O-CD 3.3Å; F297-P299 WeakPolarHBondContact O-CD 3.31Å; P299-L319 HydrophobicContact CB-CB 3.96Å; P299-L319 HydrophobicContact CB-CD1 3.84Å; P299-L319 HydrophobicContact CB-CD2 4.13Å; P299-L319 HydrophobicContact CB-CG 4.18Å; P299-L319 HydrophobicContact CG-CB 4.21Å
300	Y	53.2	Low	53.7	Low	147 Å²	147	83.6 Å²	83.6	58%	0.576	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-4.6	-171.5	-59.9	-71.4	0	0	0	114.3	S298	S298-Y300 PolarHBondContact O-N 2.72Å
301	N	45.6	Very low	52.2	Low	114 Å²	114	83.1 Å²	83.1	61%	0.61	50%	0.5	S	S	*	.	S	Bend	trans	-94.1	-13	-169.5	-153.4	38.4	0	0	0	114.2	S298	S298-N301 PolarHBondContact O-N 2.98Å
302	D	39	Very low	51	Low	145 Å²	145	84 Å²	84	78%	0.775	51%	0.505	S	S	*	.			trans	-91.8	106.1	177.1	-140.6	-2.2	0	0	0	109.5	S304	D302-S304 PolarHBondContact O-N 3.17Å
303	G	41.2	Very low	50.2	Low	81 Å²	81	84.6 Å²	84.6	84%	0.835	51%	0.513	S	S	*	.			trans	-66.6	19.7	-178.9	0	0	0	0	0	115.2	V305	G303-V305 PolarHBondContact O-N 2.95Å
304	S	36.8	Very low	49.5	Very low	91 Å²	91	91 Å²	91	64%	0.636	54%	0.536	S	S	*	.			trans	-91.3	77.2	172.2	-179.4	0	0	0	0	109.9	D302 C306	D302-S304 PolarHBondContact O-N 3.17Å; S304-C306 VanDerWaalsContact C-N 3.27Å; S304-C306 PolarHBondContact O-N 3.48Å
305	V	34.8	Very low	49.1	Very low	130 Å²	130	92.5 Å²	92.5	79%	0.788	55%	0.549	S	S	*	.			trans	-64.9	92.2	160.7	-177.6	0	0	0	0	107.4	G303 S307	G303-V305 PolarHBondContact O-N 2.95Å; V305-S307 PolarHBondContact O-N 3.35Å
306	C	34.1	Very low	49	Very low	97 Å²	97	95.3 Å²	95.3	66%	0.655	55%	0.554	S	S	*	*			trans	-73.9	109.2	164.5	-159	0	0	0	0	106.6	S304 D308	S304-C306 VanDerWaalsContact C-N 3.27Å; S304-C306 PolarHBondContact O-N 3.48Å; C306-D308 PolarHBondContact O-N 2.87Å
307	S	41	Very low	49.2	Very low	110 Å²	110	97.1 Å²	97.1	77%	0.769	57%	0.568	S	S	*	*			trans	-70.5	89.1	-175.9	170.2	0	0	0	0	111.6	V305	V305-S307 PolarHBondContact O-N 3.35Å
308	D	39.9	Very low	49.4	Very low	126 Å²	126	99.8 Å²	99.8	67%	0.674	58%	0.58	S	S	*	*			trans	-154.6	99.5	156.5	-141.5	-4.6	0	0	0	115	C306 R310	C306-D308 PolarHBondContact O-N 2.87Å; D308-R310 VanDerWaalsContact C-N 3.32Å; D308-R310 PolarHBondContact O-N 3.32Å
309	G	47.3	Very low	49.6	Very low	67 Å²	67	101 Å²	101	69%	0.691	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	24.5	-158.3	0	0	0	0	0	119.8
310	R	48.2	Very low	50.4	Low	229 Å²	229	105.9 Å²	105.9	86%	0.864	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.5	-32.1	169.7	-75.4	-170.9	-173.9	176.3	3.4	114.4	D308 D312	D308-R310 VanDerWaalsContact C-N 3.32Å; D308-R310 PolarHBondContact O-N 3.32Å; R310-D312 VanDerWaalsContact C-N 3.28Å
311	A	43.5	Very low	51.2	Low	75 Å²	75	101.1 Å²	101.1	62%	0.62	58%	0.583	S	S	*	*	H	α-helix	trans	-70.4	-31.6	168.8	0	0	0	0	0	110.9	A313 Y314 A315	A311-A313 VanDerWaalsContact C-N 3.34Å; A311-A313 PolarHBondContact O-N 3.21Å; A311-Y314 PolarHBondContact O-N 2.9Å; A311-A315 PolarHBondContact O-N 3.26Å; A311-A315 VanDerWaalsContact O-N 3.16Å
312	D	53.3	Low	52.4	Low	55 Å²	55	96.6 Å²	96.6	29%	0.294	56%	0.559	S	S	.	*	H	α-helix	trans	-62.8	-33.1	177.6	-70.9	-23.2	0	0	0	113.8	R310 Q316	R310-D312 VanDerWaalsContact C-N 3.28Å; D312-Q316 WeakPolarHBondContact O-CB 3.21Å; D312-Q316 WeakPolarHBondContact O-CG 3.15Å; D312-Q316 PolarHBondContact O-N 3.19Å
313	A	55.7	Low	54	Low	61 Å²	61	92.4 Å²	92.4	50%	0.504	54%	0.535	S	S	.	.	H	α-helix	trans	-72.3	-36.3	-177.9	0	0	0	0	0	112.7	A311 L317	A311-A313 VanDerWaalsContact C-N 3.34Å; A311-A313 PolarHBondContact O-N 3.21Å; A313-L317 WeakPolarHBondContact O-CB 3.38Å; A313-L317 PolarHBondContact O-N 2.73Å
314	Y	57.8	Low	55.5	Low	154 Å²	154	92 Å²	92	60%	0.604	51%	0.511	S	S	*	.	H	α-helix	trans	-73.6	-43.7	176.1	-170	-99.5	0	0	0	110.7	A311 Q316 L317 E318	A311-Y314 PolarHBondContact O-N 2.9Å; Y314-Q316 PolarHBondContact O-N 3.39Å; Y314-L317 PolarHBondContact O-N 3.49Å; Y314-E318 HydrophobicContact CD1-CG 4.26Å; Y314-E318 VanDerWaalsContact CE1-CD 3.47Å; Y314-E318 HydrophobicContact CE1-CG 4.03Å; Y314-E318 WeakPolarHBondContact CE1-OE1 3.38Å; Y314-E318 PolarHBondContact O-N 3.5Å
315	A	60.3	Low	57.5	Low	39 Å²	39	87.8 Å²	87.8	32%	0.322	48%	0.481	S	S	.	.	H	α-helix	trans	-61.1	-42.9	173.7	0	0	0	0	0	111.9	A311 L317 E318 L319	A311-A315 PolarHBondContact O-N 3.26Å; A311-A315 VanDerWaalsContact O-N 3.16Å; A315-L317 VanDerWaalsContact C-N 3.33Å; A315-L317 PolarHBondContact O-N 3.23Å; A315-E318 PolarHBondContact O-N 3.38Å; A315-L319 WeakPolarHBondContact O-CB 3.26Å; A315-L319 WeakPolarHBondContact O-CD1 3.38Å; A315-L319 WeakPolarHBondContact O-CG 3.37Å; A315-L319 PolarHBondContact O-N 3.11Å
316	Q	62	Low	59.6	Low	110 Å²	110	81.8 Å²	81.8	51%	0.514	45%	0.445	S	S	.	.	H	α-helix	trans	-65.3	-33.8	175.1	-75.8	171.2	9.9	0	0	112.9	D312 Y314 R320	D312-Q316 WeakPolarHBondContact O-CB 3.21Å; D312-Q316 WeakPolarHBondContact O-CG 3.15Å; D312-Q316 PolarHBondContact O-N 3.19Å; Y314-Q316 PolarHBondContact O-N 3.39Å; Q316-R320 WeakPolarHBondContact O-CG 3.3Å; Q316-R320 PolarHBondContact O-N 2.82Å
317	L	65.1	Low	61.8	Low	105 Å²	105	77.8 Å²	77.8	55%	0.55	42%	0.417	S	S	.	.	H	α-helix	trans	-70.5	-43.9	175	-173.7	67.7	0	0	0	111.4	A313 Y314 A315 L319 R320 T321	A313-L317 WeakPolarHBondContact O-CB 3.38Å; A313-L317 PolarHBondContact O-N 2.73Å; Y314-L317 PolarHBondContact O-N 3.49Å; A315-L317 VanDerWaalsContact C-N 3.33Å; A315-L317 PolarHBondContact O-N 3.23Å; L317-L319 VanDerWaalsContact C-N 3.31Å; L317-L319 PolarHBondContact O-N 3Å; L317-R320 PolarHBondContact O-N 3.47Å; L317-T321 WeakPolarHBondContact O-CG2 3.48Å; L317-T321 PolarHBondContact O-N 3.27Å; L317-T321 PolarHBondContact O-OG1 3.08Å
318	E	65.8	Low	63.7	Low	79 Å²	79	73.5 Å²	73.5	37%	0.369	39%	0.388	S	S	.	.	H	α-helix	trans	-61	-38.6	172.9	-75.1	-171.9	153.3	0	0	112.1	Y314 A315 T321 L322	Y314-E318 HydrophobicContact CD1-CG 4.26Å; Y314-E318 VanDerWaalsContact CE1-CD 3.47Å; Y314-E318 HydrophobicContact CE1-CG 4.03Å; Y314-E318 WeakPolarHBondContact CE1-OE1 3.38Å; Y314-E318 PolarHBondContact O-N 3.5Å; A315-E318 PolarHBondContact O-N 3.38Å; E318-T321 WeakPolarHBondContact CA-OG1 3.38Å; E318-T321 PolarHBondContact O-OG1 2.93Å; E318-L322 VanDerWaalsContact O-CB 3.25Å; E318-L322 WeakPolarHBondContact O-CB 3.24Å; E318-L322 PolarHBondContact O-N 3.31Å
319	L	65.5	Low	65.6	Low	66 Å²	66	67.8 Å²	67.8	35%	0.346	36%	0.358	S	S	.	.	H	α-helix	trans	-68.3	-39	176.7	-71.7	166.6	0	0	0	112.3	P299 A315 L317 L322 E323	P299-L319 HydrophobicContact CB-CB 3.96Å; P299-L319 HydrophobicContact CB-CD1 3.84Å; P299-L319 HydrophobicContact CB-CD2 4.13Å; P299-L319 HydrophobicContact CB-CG 4.18Å; P299-L319 HydrophobicContact CG-CB 4.21Å; A315-L319 WeakPolarHBondContact O-CB 3.26Å; A315-L319 WeakPolarHBondContact O-CD1 3.38Å; A315-L319 WeakPolarHBondContact O-CG 3.37Å; A315-L319 PolarHBondContact O-N 3.11Å; L317-L319 VanDerWaalsContact C-N 3.31Å; L317-L319 PolarHBondContact O-N 3Å; L319-L322 PolarHBondContact O-N 3.08Å; L319-E323 WeakPolarHBondContact O-CB 3.46Å; L319-E323 PolarHBondContact O-N 3.4Å
320	R	68.6	Low	67	Low	143 Å²	143	66.3 Å²	66.3	54%	0.54	34%	0.336	S	S	.	.	H	α-helix	trans	-68.3	-40.4	174.8	-79.5	-177.3	177.8	172.8	3.1	112.8	Q316 L317 L322 E323 Q324	Q316-R320 WeakPolarHBondContact O-CG 3.3Å; Q316-R320 PolarHBondContact O-N 2.82Å; L317-R320 PolarHBondContact O-N 3.47Å; R320-L322 VanDerWaalsContact C-N 3.32Å; R320-E323 PolarHBondContact O-N 3Å; R320-Q324 WeakPolarHBondContact O-CG 3.39Å; R320-Q324 PolarHBondContact O-N 2.89Å
321	T	69.3	Low	68.4	Low	47 Å²	47	55.6 Å²	55.6	29%	0.288	30%	0.296	S	S	.	.	H	α-helix	trans	-69.2	-33.7	176.4	56.6	0	0	0	0	111.3	L317 E318 S325	L317-T321 WeakPolarHBondContact O-CG2 3.48Å; L317-T321 PolarHBondContact O-N 3.27Å; L317-T321 PolarHBondContact O-OG1 3.08Å; E318-T321 WeakPolarHBondContact CA-OG1 3.38Å; E318-T321 PolarHBondContact O-OG1 2.93Å; T321-S325 WeakPolarHBondContact O-CB 3.47Å; T321-S325 PolarHBondContact O-N 3.32Å
322	L	71	Confident	69.8	Low	19 Å²	19	52.9 Å²	52.9	10%	0.099	28%	0.276	C	S	.	.	H	α-helix	trans	-64.2	-47.2	170.8	-175.9	71.4	0	0	0	111.6	E318 L319 R320 Q324 S325 L326 H347	E318-L322 VanDerWaalsContact O-CB 3.25Å; E318-L322 WeakPolarHBondContact O-CB 3.24Å; E318-L322 PolarHBondContact O-N 3.31Å; L319-L322 PolarHBondContact O-N 3.08Å; R320-L322 VanDerWaalsContact C-N 3.32Å; L322-Q324 VanDerWaalsContact C-N 3.33Å; L322-Q324 PolarHBondContact O-N 2.88Å; L322-S325 WeakPolarHBondContact CA-OG 3.31Å; L322-S325 WeakPolarHBondContact O-CB 3.46Å; L322-S325 PolarHBondContact O-N 2.78Å; L322-S325 PolarHBondContact O-OG 3.45Å; L322-L326 HydrophobicContact CD1-CG 4.49Å; L322-L326 HydrophobicContact CG-CD1 4.12Å; L322-L326 HydrophobicContact CG-CG 4.43Å; L322-L326 WeakPolarHBondContact O-CG 3.41Å; L322-L326 PolarHBondContact O-N 3.42Å; L322-H347 HydrophobicContact CD1-CB 3.91Å; L322-H347 VanDerWaalsContact CD1-CD2 3.46Å; L322-H347 WeakPolarHBondContact CD1-CD2 3.49Å; L322-H347 HydrophobicContact CD2-CB 3.66Å; L322-H347 HydrophobicContact CG-CB 4.45Å
323	E	73.3	Confident	71.1	Confident	56 Å²	56	52.2 Å²	52.2	26%	0.262	28%	0.276	S	S	.	.	H	α-helix	trans	-57.4	-46.8	177	169.8	167.7	-150.9	0	0	111.3	L293 L319 R320 S325 L326 L327	L293-E323 HydrophobicContact CD1-CB 3.9Å; L293-E323 HydrophobicContact CD1-CG 3.63Å; L319-E323 WeakPolarHBondContact O-CB 3.46Å; L319-E323 PolarHBondContact O-N 3.4Å; R320-E323 PolarHBondContact O-N 3Å; E323-S325 VanDerWaalsContact C-N 3.32Å; E323-S325 PolarHBondContact O-N 2.85Å; E323-L326 PolarHBondContact O-N 2.91Å; E323-L327 HydrophobicContact CG-CD1 4.02Å; E323-L327 WeakPolarHBondContact O-CB 3.38Å; E323-L327 VanDerWaalsContact O-CG 3.31Å; E323-L327 WeakPolarHBondContact O-CG 3.35Å; E323-L327 PolarHBondContact O-N 2.91Å
324	Q	73.1	Confident	72.4	Confident	73 Å²	73	52 Å²	52	34%	0.341	27%	0.265	S	S	.	.	H	α-helix	trans	-61.1	-39.2	173.7	-71.4	179.1	-20.5	0	0	112.5	V68 R320 L322 A328	V68-Q324 HydrophobicContact CG2-CG 4.37Å; R320-Q324 WeakPolarHBondContact O-CG 3.39Å; R320-Q324 PolarHBondContact O-N 2.89Å; L322-Q324 VanDerWaalsContact C-N 3.33Å; L322-Q324 PolarHBondContact O-N 2.88Å; Q324-A328 PolarHBondContact O-N 3.48Å; Q324-A328 VanDerWaalsContact O-N 3.16Å
325	S	77.3	Confident	73.6	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.014	26%	0.264	C	S	.	.	H	α-helix	trans	-65.9	-39.2	178	74.8	0	0	0	0	113	T321 L322 E323 A328 L340	T321-S325 WeakPolarHBondContact O-CB 3.47Å; T321-S325 PolarHBondContact O-N 3.32Å; L322-S325 WeakPolarHBondContact CA-OG 3.31Å; L322-S325 WeakPolarHBondContact O-CB 3.46Å; L322-S325 PolarHBondContact O-N 2.78Å; L322-S325 PolarHBondContact O-OG 3.45Å; E323-S325 VanDerWaalsContact C-N 3.32Å; E323-S325 PolarHBondContact O-N 2.85Å; S325-A328 WeakPolarHBondContact O-CB 3.47Å; S325-L340 VanDerWaalsContact CB-CD2 3.46Å
326	L	79.3	Confident	74.8	Confident	4 Å²	4	49.4 Å²	49.4	2%	0.021	26%	0.261	C	S	.	.	H	α-helix	trans	-74.4	-32.1	-179.4	-73.1	177.8	0	0	0	111.9	L293 L322 E323 A344 P415 L416 M417	L293-L326 HydrophobicContact CD1-CD1 4.44Å; L293-L326 HydrophobicContact CD2-CB 3.84Å; L293-L326 HydrophobicContact CD2-CD1 4.36Å; L322-L326 HydrophobicContact CD1-CG 4.49Å; L322-L326 HydrophobicContact CG-CD1 4.12Å; L322-L326 HydrophobicContact CG-CG 4.43Å; L322-L326 WeakPolarHBondContact O-CG 3.41Å; L322-L326 PolarHBondContact O-N 3.42Å; E323-L326 PolarHBondContact O-N 2.91Å; L326-A344 HydrophobicContact CD2-CB 3.71Å; L326-P415 WeakPolarHBondContact O-CB 3.47Å; L326-L416 PolarHBondContact O-N 3.12Å; L326-M417 HydrophobicContact CB-CB 4.04Å; L326-M417 HydrophobicContact CB-CG 4.48Å; L326-M417 HydrophobicContact CD2-CB 3.95Å; L326-M417 HydrophobicContact CD2-CG 3.96Å; L326-M417 PolarHBondContact O-N 3.18Å
327	L	81.1	Confident	75.9	Confident	14 Å²	14	44.1 Å²	44.1	7%	0.073	24%	0.237	C	C	.	.	H	α-helix	trans	-84.6	-5	177.9	-67.2	-178.1	0	0	0	114.1	L291 L293 E323 T329 P415	L291-L327 HydrophobicContact CB-CD2 4.08Å; L293-L327 HydrophobicContact CD1-CG 4.41Å; L293-L327 HydrophobicContact CD2-CD2 3.61Å; L293-L327 HydrophobicContact CD2-CG 4.04Å; L293-L327 HydrophobicContact CG-CD1 4.36Å; L293-L327 HydrophobicContact CG-CD2 3.78Å; L293-L327 HydrophobicContact CG-CG 3.98Å; E323-L327 HydrophobicContact CG-CD1 4.02Å; E323-L327 WeakPolarHBondContact O-CB 3.38Å; E323-L327 VanDerWaalsContact O-CG 3.31Å; E323-L327 WeakPolarHBondContact O-CG 3.35Å; E323-L327 PolarHBondContact O-N 2.91Å; L327-T329 PolarHBondContact O-N 3.39Å; L327-P415 HydrophobicContact CD2-CB 4.38Å
328	A	81.6	Confident	76.8	Confident	20 Å²	20	41.2 Å²	41.2	17%	0.165	23%	0.225	C	C	.	.			trans	-59.7	128.4	178	0	0	0	0	0	111.4	Q324 S325 L416	Q324-A328 PolarHBondContact O-N 3.48Å; Q324-A328 VanDerWaalsContact O-N 3.16Å; S325-A328 WeakPolarHBondContact O-CB 3.47Å; A328-L416 WeakPolarHBondContact O-CB 3.48Å; A328-L416 PolarHBondContact O-N 3.38Å
329	T	78.4	Confident	77.7	Confident	5 Å²	5	41 Å²	41	3%	0.031	23%	0.226	C	C	.	.			trans	-103.6	-19.5	179.4	51.5	0	0	0	0	113.3	L291 L327 L384 F410 L413	L291-T329 HydrophobicContact CD1-CG2 4.04Å; L327-T329 PolarHBondContact O-N 3.39Å; T329-L384 WeakPolarHBondContact O-CD2 3.03Å; T329-F410 WeakPolarHBondContact OG1-CE2 3.33Å; T329-L413 HydrophobicContact CG2-CB 4.47Å
330	C	76.7	Confident	78.6	Confident	36 Å²	36	38.2 Å²	38.2	24%	0.243	21%	0.212	C	C	.	.			trans	-139	153.6	178.9	-64.7	0	0	0	0	110.3	L384 C386	C330-L384 CarbonylContact C-O 3.6Å; C330-L384 VanDerWaalsContact CA-O 3.24Å; C330-L384 WeakPolarHBondContact CA-O 3.5Å; C330-C386 HydrophobicContact CB-CB 4.3Å
331	V	78.5	Confident	79.4	Confident	4 Å²	4	31.6 Å²	31.6	2%	0.024	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-133.8	146.2	178.4	-171	0	0	0	0	111.1	S333 E336 L337 L340 L384	V331-S333 WeakPolarHBondContact CG1-O 3.49Å; V331-E336 HydrophobicContact CG1-CB 3.86Å; V331-E336 HydrophobicContact CG1-CG 3.72Å; V331-E336 WeakPolarHBondContact CG1-OE2 3.41Å; V331-L337 HydrophobicContact CG1-CB 3.94Å; V331-L337 HydrophobicContact CG2-CD1 4.07Å; V331-L340 HydrophobicContact CG1-CD1 4.4Å; V331-L340 HydrophobicContact CG2-CD1 4.17Å; V331-L384 HydrophobicContact CG2-CB 4.32Å; V331-L384 HydrophobicContact CG2-CD1 4.27Å; V331-L384 PolarHBondContact N-O 3.19Å
332	G	73.3	Confident	80.1	Confident	19 Å²	19	32.6 Å²	32.6	20%	0.196	20%	0.196	C	C	.	.	S	Bend	trans	-83.5	-42.7	-178.4	0	0	0	0	0	114.3	E336 Y381	G332-E336 WeakPolarHBondContact CA-OE2 3.42Å; G332-E336 PolarHBondContact N-OE2 3.2Å; G332-Y381 PolarHBondContact O-OH 3.19Å
333	S	79.9	Confident	80.5	Confident	40 Å²	40	35.7 Å²	35.7	28%	0.28	21%	0.206	S	C	.	.			trans	-136	158.4	-176.8	69	0	0	0	0	113.5	V331 S335 E336 L337 Y381	V331-S333 WeakPolarHBondContact CG1-O 3.49Å; S333-S335 VanDerWaalsContact C-N 3.29Å; S333-S335 PolarHBondContact O-N 3.34Å; S333-S335 PolarHBondContact OG-OG 3.36Å; S333-E336 PolarHBondContact N-OE2 2.92Å; S333-E336 PolarHBondContact O-N 2.92Å; S333-E336 VanDerWaalsContact OG-CB 3.23Å; S333-E336 WeakPolarHBondContact OG-CB 3.35Å; S333-E336 PolarHBondContact OG-N 3.03Å; S333-E336 VanDerWaalsContact OG-N 3.14Å; S333-L337 PolarHBondContact O-N 2.96Å; S333-Y381 VanDerWaalsContact C-CE2 3.45Å
334	I	83.3	Confident	80.7	Confident	56 Å²	56	33 Å²	33	29%	0.287	19%	0.194	S	C	.	.	H	α-helix	trans	-66.2	-31.4	175.1	-168.3	165.3	0	0	0	112.7	L337 S338 H378 Y381	I334-L337 PolarHBondContact O-N 3.4Å; I334-S338 WeakPolarHBondContact O-CB 3.39Å; I334-S338 PolarHBondContact O-N 3.21Å; I334-H378 HydrophobicContact CD1-CB 4.36Å; I334-H378 WeakPolarHBondContact CD1-CE1 3.43Å; I334-H378 WeakPolarHBondContact CD1-ND1 3.38Å; I334-Y381 HydrophobicContact CB-CD2 4.47Å; I334-Y381 HydrophobicContact CB-CG 4.31Å
335	S	83.1	Confident	81	Confident	83 Å²	83	30.5 Å²	30.5	58%	0.58	18%	0.182	S	C	*	.	H	α-helix	trans	-65.2	-42.4	174.2	40.7	0	0	0	0	111.8	S333 S338 D339	S333-S335 VanDerWaalsContact C-N 3.29Å; S333-S335 PolarHBondContact O-N 3.34Å; S333-S335 PolarHBondContact OG-OG 3.36Å; S335-S338 PolarHBondContact O-N 3.05Å; S335-D339 WeakPolarHBondContact O-CB 3.45Å; S335-D339 PolarHBondContact O-N 3.24Å
336	E	83.9	Confident	80.9	Confident	56 Å²	56	36 Å²	36	26%	0.262	21%	0.208	S	C	.	.	H	α-helix	trans	-63.1	-46.6	174.9	-179.5	-173.3	-169.1	0	0	110.7	V331 G332 S333 S338 D339 L340	V331-E336 HydrophobicContact CG1-CB 3.86Å; V331-E336 HydrophobicContact CG1-CG 3.72Å; V331-E336 WeakPolarHBondContact CG1-OE2 3.41Å; G332-E336 WeakPolarHBondContact CA-OE2 3.42Å; G332-E336 PolarHBondContact N-OE2 3.2Å; S333-E336 PolarHBondContact N-OE2 2.92Å; S333-E336 PolarHBondContact O-N 2.92Å; S333-E336 VanDerWaalsContact OG-CB 3.23Å; S333-E336 WeakPolarHBondContact OG-CB 3.35Å; S333-E336 PolarHBondContact OG-N 3.03Å; S333-E336 VanDerWaalsContact OG-N 3.14Å; E336-S338 VanDerWaalsContact C-N 3.35Å; E336-S338 PolarHBondContact O-N 2.72Å; E336-D339 PolarHBondContact O-N 3.45Å; E336-L340 HydrophobicContact CG-CD1 4.06Å; E336-L340 HydrophobicContact CG-CG 4.48Å; E336-L340 VanDerWaalsContact O-CG 3.27Å; E336-L340 WeakPolarHBondContact O-CG 3.35Å; E336-L340 PolarHBondContact O-N 3.36Å
337	L	85.3	Confident	80.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-59.2	-46.4	176.4	179	63.1	0	0	0	111.7	V331 S333 I334 D339 L340 V341 L380 L384 L416	V331-L337 HydrophobicContact CG1-CB 3.94Å; V331-L337 HydrophobicContact CG2-CD1 4.07Å; S333-L337 PolarHBondContact O-N 2.96Å; I334-L337 PolarHBondContact O-N 3.4Å; L337-D339 VanDerWaalsContact C-N 3.26Å; L337-D339 PolarHBondContact O-N 3.38Å; L337-L340 PolarHBondContact O-N 2.96Å; L337-V341 HydrophobicContact CD1-CG2 3.97Å; L337-V341 HydrophobicContact CG-CG2 4.35Å; L337-V341 WeakPolarHBondContact O-CB 3.37Å; L337-V341 WeakPolarHBondContact O-CG2 3.15Å; L337-V341 PolarHBondContact O-N 2.72Å; L337-L380 HydrophobicContact CD1-CD2 3.95Å; L337-L380 HydrophobicContact CD1-CG 4.34Å; L337-L380 HydrophobicContact CD2-CB 4.09Å; L337-L380 HydrophobicContact CD2-CD2 4.11Å; L337-L380 HydrophobicContact CD2-CG 3.96Å; L337-L380 HydrophobicContact CG-CD2 4.41Å; L337-L384 HydrophobicContact CD1-CD1 3.78Å; L337-L416 HydrophobicContact CD1-CD1 4.03Å
338	S	85.9	Confident	80	Confident	43 Å²	43	38.6 Å²	38.6	30%	0.301	22%	0.22	S	C	.	.	H	α-helix	trans	-60	-38.9	178.8	-175.7	0	0	0	0	111.7	I334 S335 E336 S342	I334-S338 WeakPolarHBondContact O-CB 3.39Å; I334-S338 PolarHBondContact O-N 3.21Å; S335-S338 PolarHBondContact O-N 3.05Å; E336-S338 VanDerWaalsContact C-N 3.35Å; E336-S338 PolarHBondContact O-N 2.72Å; S338-S342 VanDerWaalsContact O-CB 3.25Å; S338-S342 WeakPolarHBondContact O-CB 3.21Å; S338-S342 PolarHBondContact O-N 2.74Å; S338-S342 PolarHBondContact O-OG 2.96Å
339	D	83.2	Confident	79.3	Confident	74 Å²	74	41 Å²	41	40%	0.396	23%	0.227	S	C	.	.	H	α-helix	trans	-70.8	-44.2	178.3	-176.5	40.3	0	0	0	111.7	S335 E336 L337 S342 R343	S335-D339 WeakPolarHBondContact O-CB 3.45Å; S335-D339 PolarHBondContact O-N 3.24Å; E336-D339 PolarHBondContact O-N 3.45Å; L337-D339 VanDerWaalsContact C-N 3.26Å; L337-D339 PolarHBondContact O-N 3.38Å; D339-S342 PolarHBondContact O-N 3.32Å; D339-R343 PolarHBondContact O-N 2.92Å; D339-R343 IonicContact OD1-CZ 2.82Å; D339-R343 IonicContact OD1-NH1 2.63Å; D339-R343 PolarHBondContact OD1-NH1 2.99Å; D339-R343 IonicContact OD2-CZ 2.66Å; D339-R343 IonicContact OD2-NH1 2.66Å; D339-R343 PolarHBondContact OD2-NH1 3.37Å; D339-R343 IonicContact OD2-NH2 3.09Å; D339-R343 PolarHBondContact OD2-NH2 3.3Å
340	L	84.8	Confident	78.4	Confident	9 Å²	9	43.2 Å²	43.2	5%	0.047	24%	0.243	C	C	.	.	H	α-helix	trans	-59.3	-50.3	174.6	-68.1	169.6	0	0	0	111.9	S325 V331 E336 L337 S342 R343 A344 L416	S325-L340 VanDerWaalsContact CB-CD2 3.46Å; V331-L340 HydrophobicContact CG1-CD1 4.4Å; V331-L340 HydrophobicContact CG2-CD1 4.17Å; E336-L340 HydrophobicContact CG-CD1 4.06Å; E336-L340 HydrophobicContact CG-CG 4.48Å; E336-L340 VanDerWaalsContact O-CG 3.27Å; E336-L340 WeakPolarHBondContact O-CG 3.35Å; E336-L340 PolarHBondContact O-N 3.36Å; L337-L340 PolarHBondContact O-N 2.96Å; L340-S342 VanDerWaalsContact C-N 3.31Å; L340-S342 PolarHBondContact O-N 2.87Å; L340-R343 PolarHBondContact O-N 3.32Å; L340-A344 WeakPolarHBondContact O-CB 3.27Å; L340-A344 PolarHBondContact O-N 3.44Å; L340-L416 HydrophobicContact CB-CD2 3.93Å
341	V	85.7	Confident	77.3	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.024	25%	0.248	C	C	.	.	H	α-helix	trans	-61.6	-41.1	177.6	173	0	0	0	0	110.6	L337 A344 M345 W372 L377 L380 L416 M420	L337-V341 HydrophobicContact CD1-CG2 3.97Å; L337-V341 HydrophobicContact CG-CG2 4.35Å; L337-V341 WeakPolarHBondContact O-CB 3.37Å; L337-V341 WeakPolarHBondContact O-CG2 3.15Å; L337-V341 PolarHBondContact O-N 2.72Å; V341-A344 PolarHBondContact O-N 3.22Å; V341-M345 HydrophobicContact CG1-CG 4.18Å; V341-M345 VanDerWaalsContact O-CB 3.32Å; V341-M345 WeakPolarHBondContact O-CB 3.2Å; V341-M345 WeakPolarHBondContact O-CG 3.41Å; V341-M345 PolarHBondContact O-N 2.88Å; V341-W372 HydrophobicContact CG1-CD2 3.98Å; V341-W372 HydrophobicContact CG1-CG 4.12Å; V341-W372 HydrophobicContact CG1-CZ2 4.32Å; V341-L377 HydrophobicContact CB-CD2 4.49Å; V341-L377 HydrophobicContact CG1-CD2 4.44Å; V341-L377 HydrophobicContact CG2-CD2 4.38Å; V341-L380 HydrophobicContact CG2-CD2 4.33Å; V341-L416 HydrophobicContact CG2-CD1 4.41Å; V341-M420 HydrophobicContact CG1-CE 4.38Å; V341-M420 HydrophobicContact CG2-SD 4.48Å
342	S	82.9	Confident	76.1	Confident	68 Å²	68	48.4 Å²	48.4	48%	0.476	27%	0.268	S	S	.	.	H	α-helix	trans	-64.3	-45	179.3	-62.3	0	0	0	0	112.3	S338 D339 L340 M345 H346	S338-S342 VanDerWaalsContact O-CB 3.25Å; S338-S342 WeakPolarHBondContact O-CB 3.21Å; S338-S342 PolarHBondContact O-N 2.74Å; S338-S342 PolarHBondContact O-OG 2.96Å; D339-S342 PolarHBondContact O-N 3.32Å; L340-S342 VanDerWaalsContact C-N 3.31Å; L340-S342 PolarHBondContact O-N 2.87Å; S342-M345 PolarHBondContact O-N 3.34Å; S342-H346 PolarHBondContact O-N 3.39Å
343	R	79.6	Confident	74.6	Confident	83 Å²	83	53 Å²	53	31%	0.313	29%	0.292	S	S	.	.	H	α-helix	trans	-61	-50.9	174.7	-77.9	-166.9	-74.1	-100.7	-6.1	111.6	D339 L340 M345 H346 H347	D339-R343 PolarHBondContact O-N 2.92Å; D339-R343 IonicContact OD1-CZ 2.82Å; D339-R343 IonicContact OD1-NH1 2.63Å; D339-R343 PolarHBondContact OD1-NH1 2.99Å; D339-R343 IonicContact OD2-CZ 2.66Å; D339-R343 IonicContact OD2-NH1 2.66Å; D339-R343 PolarHBondContact OD2-NH1 3.37Å; D339-R343 IonicContact OD2-NH2 3.09Å; D339-R343 PolarHBondContact OD2-NH2 3.3Å; L340-R343 PolarHBondContact O-N 3.32Å; R343-M345 VanDerWaalsContact C-N 3.32Å; R343-M345 PolarHBondContact O-N 2.95Å; R343-H346 PolarHBondContact O-N 2.79Å; R343-H347 PolarHBondContact O-CD2 3.14Å; R343-H347 VanDerWaalsContact O-CD2 3.28Å; R343-H347 PolarHBondContact O-N 2.81Å; R343-H347 VanDerWaalsContact O-N 3.09Å
344	A	78.8	Confident	72.6	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-57.8	-44.8	179.4	0	0	0	0	0	111.8	L326 L340 V341 H346 H347 M348 M420	L326-A344 HydrophobicContact CD2-CB 3.71Å; L340-A344 WeakPolarHBondContact O-CB 3.27Å; L340-A344 PolarHBondContact O-N 3.44Å; V341-A344 PolarHBondContact O-N 3.22Å; A344-H346 PolarHBondContact O-N 3.29Å; A344-H347 PolarHBondContact O-N 3.08Å; A344-M348 VanDerWaalsContact O-CG 3.31Å; A344-M348 WeakPolarHBondContact O-CG 3.12Å; A344-M348 PolarHBondContact O-N 2.92Å; A344-M420 HydrophobicContact CB-CE 3.57Å; A344-M420 HydrophobicContact CB-SD 3.67Å
345	M	78.8	Confident	70.6	Confident	20 Å²	20	60.6 Å²	60.6	10%	0.099	32%	0.32	C	S	.	.	H	α-helix	trans	-63	-40.2	176.9	-73.9	-60.9	-69.9	0	0	113	V341 S342 R343 Q349 I370 M420 I424	V341-M345 HydrophobicContact CG1-CG 4.18Å; V341-M345 VanDerWaalsContact O-CB 3.32Å; V341-M345 WeakPolarHBondContact O-CB 3.2Å; V341-M345 WeakPolarHBondContact O-CG 3.41Å; V341-M345 PolarHBondContact O-N 2.88Å; S342-M345 PolarHBondContact O-N 3.34Å; R343-M345 VanDerWaalsContact C-N 3.32Å; R343-M345 PolarHBondContact O-N 2.95Å; M345-Q349 WeakPolarHBondContact O-CG 3.35Å; M345-Q349 PolarHBondContact O-N 3.01Å; M345-Q349 VanDerWaalsContact O-N 3.08Å; M345-Q349 PolarHBondContact O-NE2 2.8Å; M345-I370 HydrophobicContact CE-CB 4.13Å; M345-I370 VanDerWaalsContact CE-O 3.3Å; M345-I370 WeakPolarHBondContact CE-O 3.37Å; M345-M420 HydrophobicContact CG-CE 3.7Å; M345-M420 HydrophobicContact SD-CE 3.61Å; M345-I424 HydrophobicContact CE-CD1 4.22Å; M345-I424 HydrophobicContact SD-CD1 3.61Å
346	H	75.4	Confident	68.1	Low	118 Å²	118	62.9 Å²	62.9	55%	0.546	33%	0.333	S	S	.	.	H	α-helix	trans	-61.4	-45.7	176.6	-176.6	-88.3	0	0	0	111.4	S342 R343 A344 Q349 C350	S342-H346 PolarHBondContact O-N 3.39Å; R343-H346 PolarHBondContact O-N 2.79Å; A344-H346 PolarHBondContact O-N 3.29Å; H346-Q349 PolarHBondContact O-N 3.39Å; H346-C350 PolarHBondContact O-N 3.08Å; H346-C350 VanDerWaalsContact O-N 3.14Å; H346-C350 PolarHBondContact O-SG 2.89Å; H346-C350 VanDerWaalsContact O-SG 3.33Å
347	H	70.9	Confident	66.1	Low	50 Å²	50	64.1 Å²	64.1	23%	0.231	36%	0.361	C	S	.	.	H	α-helix	trans	-66.8	-42.6	178.3	-79.5	-81.7	0	0	0	113.2	L322 R343 A344 Q349 C350 L351	L322-H347 HydrophobicContact CD1-CB 3.91Å; L322-H347 VanDerWaalsContact CD1-CD2 3.46Å; L322-H347 WeakPolarHBondContact CD1-CD2 3.49Å; L322-H347 HydrophobicContact CD2-CB 3.66Å; L322-H347 HydrophobicContact CG-CB 4.45Å; R343-H347 PolarHBondContact O-CD2 3.14Å; R343-H347 VanDerWaalsContact O-CD2 3.28Å; R343-H347 PolarHBondContact O-N 2.81Å; R343-H347 VanDerWaalsContact O-N 3.09Å; A344-H347 PolarHBondContact O-N 3.08Å; H347-Q349 PolarHBondContact O-N 3.46Å; H347-C350 PolarHBondContact O-N 2.96Å; H347-L351 PolarHBondContact O-N 3.33Å; H347-L351 VanDerWaalsContact O-N 3.12Å
348	M	70.1	Confident	63.7	Low	22 Å²	22	68.7 Å²	68.7	11%	0.108	38%	0.383	C	S	.	.	H	α-helix	trans	-60.2	-34.7	175.5	-70.8	177	73.2	0	0	112.3	W165 F297 A344 N352 M420 I424	W165-M348 HydrophobicContact CH2-CE 3.72Å; W165-M348 HydrophobicContact CZ3-CE 3.57Å; F297-M348 HydrophobicContact CE1-CG 4Å; F297-M348 HydrophobicContact CZ-CE 4.37Å; F297-M348 HydrophobicContact CZ-CG 4.37Å; A344-M348 VanDerWaalsContact O-CG 3.31Å; A344-M348 WeakPolarHBondContact O-CG 3.12Å; A344-M348 PolarHBondContact O-N 2.92Å; M348-N352 PolarHBondContact O-N 3.47Å; M348-N352 PolarHBondContact O-ND2 2.97Å; M348-M420 HydrophobicContact SD-CE 4.12Å; M348-I424 HydrophobicContact CE-CD1 4.49Å
349	Q	67.2	Low	61.2	Low	71 Å²	71	70 Å²	70	33%	0.332	39%	0.392	S	S	.	.	H	α-helix	trans	-68	-43.4	175.3	-72.9	163.4	28	0	0	111.9	M345 H346 H347 L351 N352 T353 P369	M345-Q349 WeakPolarHBondContact O-CG 3.35Å; M345-Q349 PolarHBondContact O-N 3.01Å; M345-Q349 VanDerWaalsContact O-N 3.08Å; M345-Q349 PolarHBondContact O-NE2 2.8Å; H346-Q349 PolarHBondContact O-N 3.39Å; H347-Q349 PolarHBondContact O-N 3.46Å; Q349-L351 PolarHBondContact O-N 3.36Å; Q349-N352 PolarHBondContact O-N 3.11Å; Q349-T353 PolarHBondContact O-N 3.38Å; Q349-P369 VanDerWaalsContact CD-CB 3.46Å; Q349-P369 HydrophobicContact CG-CB 4.41Å
350	C	58.5	Low	58.8	Low	52 Å²	52	71 Å²	71	35%	0.351	40%	0.403	S	S	.	.	H	α-helix	trans	-60.9	-42.7	177.6	-67.2	0	0	0	0	112.4	H346 H347 N352 T353	H346-C350 PolarHBondContact O-N 3.08Å; H346-C350 VanDerWaalsContact O-N 3.14Å; H346-C350 PolarHBondContact O-SG 2.89Å; H346-C350 VanDerWaalsContact O-SG 3.33Å; H347-C350 PolarHBondContact O-N 2.96Å; C350-N352 VanDerWaalsContact C-N 3.27Å; C350-N352 PolarHBondContact O-N 3.29Å; C350-T353 PolarHBondContact O-N 2.82Å; C350-T353 VanDerWaalsContact O-N 3.08Å; C350-T353 PolarHBondContact O-OG1 3.47Å
351	L	54.7	Low	56.3	Low	66 Å²	66	76.5 Å²	76.5	35%	0.346	44%	0.436	S	S	.	.	H	α-helix	trans	-62.4	-31.7	179.4	-70.7	170.4	0	0	0	113.3	Y296 F297 H347 Q349 T353	Y296-L351 HydrophobicContact CE1-CD1 4.47Å; F297-L351 HydrophobicContact CD1-CD1 3.81Å; F297-L351 HydrophobicContact CE1-CD1 3.8Å; H347-L351 PolarHBondContact O-N 3.33Å; H347-L351 VanDerWaalsContact O-N 3.12Å; Q349-L351 PolarHBondContact O-N 3.36Å; L351-T353 VanDerWaalsContact C-N 3.34Å
352	N	52.4	Low	54	Low	83 Å²	83	83.6 Å²	83.6	44%	0.444	46%	0.463	S	S	.	.	H	α-helix	trans	-73.4	-22.4	175.8	-78.7	-32.6	0	0	0	113.6	M348 Q349 C350	M348-N352 PolarHBondContact O-N 3.47Å; M348-N352 PolarHBondContact O-ND2 2.97Å; Q349-N352 PolarHBondContact O-N 3.11Å; C350-N352 VanDerWaalsContact C-N 3.27Å; C350-N352 PolarHBondContact O-N 3.29Å
353	T	43.2	Very low	51.7	Low	115 Å²	115	85.6 Å²	85.6	71%	0.706	47%	0.465	S	S	*	.	H	α-helix	trans	-82	-16.7	-178.5	61	0	0	0	0	114.6	Q349 C350 L351	Q349-T353 PolarHBondContact O-N 3.38Å; C350-T353 PolarHBondContact O-N 2.82Å; C350-T353 VanDerWaalsContact O-N 3.08Å; C350-T353 PolarHBondContact O-OG1 3.47Å; L351-T353 VanDerWaalsContact C-N 3.34Å
354	L	37.8	Very low	49.4	Very low	135 Å²	135	87.2 Å²	87.2	71%	0.707	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	0.8	-171.4	-86.5	146.1	0	0	0	115.5	P356	L354-P356 VanDerWaalsContact O-CD 3.24Å; L354-P356 WeakPolarHBondContact O-CD 3.45Å
355	R	40.8	Very low	47.6	Very low	121 Å²	121	95.4 Å²	95.4	46%	0.457	52%	0.515	S	S	.	.			trans	-78.4	117	-179.1	-80.6	-172	174.1	176.9	2.3	112.7	E169	E169-R355 IonicContact OE1-NH2 2.59Å; E169-R355 IonicContact OE2-CZ 3.91Å; E169-R355 IonicContact OE2-NH1 2.8Å; E169-R355 IonicContact OE2-NH2 3.77Å; E169-R355 PolarHBondContact OE2-NH2 3.48Å
356	P	31.2	Very low	45.8	Very low	131 Å²	131	101.8 Å²	101.8	85%	0.851	55%	0.545	S	S	*	.	S	Bend	trans	-85.9	121.9	167.1	2.1	18.9	0	0	0	109.5	L354	L354-P356 VanDerWaalsContact O-CD 3.24Å; L354-P356 WeakPolarHBondContact O-CD 3.45Å
357	G	41.1	Very low	44.3	Very low	82 Å²	82	103.4 Å²	103.4	85%	0.845	55%	0.552	S	S	*	*			trans	131.3	2.5	167.7	0	0	0	0	0	118.2
358	M	35.6	Very low	43.5	Very low	96 Å²	96	106.4 Å²	106.4	47%	0.473	57%	0.566	S	S	.	*			trans	-91.6	135.4	173.3	-63.6	-158.9	76.8	0	0	111.9
359	S	33.4	Very low	43.2	Very low	69 Å²	69	107.3 Å²	107.3	48%	0.483	57%	0.574	S	S	.	*			trans	-57.8	144.8	-178.2	61.3	0	0	0	0	113	V361 R362	S359-V361 PolarHBondContact O-N 3.39Å; S359-R362 PolarHBondContact O-N 3.16Å
360	P	31	Very low	43.7	Very low	95 Å²	95	105.3 Å²	105.3	62%	0.617	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-60.3	-22.5	-171.9	-22	31.8	0	0	0	115.6	R362 Q363	P360-R362 VanDerWaalsContact C-N 3.32Å; P360-R362 PolarHBondContact O-N 2.93Å; P360-Q363 WeakPolarHBondContact O-CB 3.42Å; P360-Q363 PolarHBondContact O-N 3.2Å
361	V	32.8	Very low	44.8	Very low	125 Å²	125	104.7 Å²	104.7	76%	0.758	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-73.4	-20.6	-173.7	-177.5	0	0	0	0	113.1	S359	S359-V361 PolarHBondContact O-N 3.39Å
362	R	37.9	Very low	46.3	Very low	153 Å²	153	102.6 Å²	102.6	58%	0.577	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-84.5	-10.2	173.2	-72.1	-171.3	-177	-169.3	3.3	113.6	S359 P360 T364	S359-R362 PolarHBondContact O-N 3.16Å; P360-R362 VanDerWaalsContact C-N 3.32Å; P360-R362 PolarHBondContact O-N 2.93Å; R362-T364 PolarHBondContact O-N 3.31Å
363	Q	34.6	Very low	47.9	Very low	111 Å²	111	100 Å²	100	52%	0.519	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-23.8	-173.9	-69.9	177.8	-27.3	0	0	113.8	P360 R365	P360-Q363 WeakPolarHBondContact O-CB 3.42Å; P360-Q363 PolarHBondContact O-N 3.2Å; Q363-R365 PolarHBondContact O-N 3.04Å
364	T	30.3	Very low	49.9	Very low	116 Å²	116	97.8 Å²	97.8	71%	0.712	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-18.1	-173	22.4	0	0	0	0	115.3	R362	R362-T364 PolarHBondContact O-N 3.31Å
365	R	41.5	Very low	52.1	Low	172 Å²	172	96.3 Å²	96.3	65%	0.649	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-19.7	179.8	-77.6	-170	-173.9	-171	4.6	115.3	Q363 Q367 T548	Q363-R365 PolarHBondContact O-N 3.04Å; R365-Q367 VanDerWaalsContact C-N 3.33Å; R365-Q367 PolarHBondContact O-N 3.21Å; R365-T548 VanDerWaalsContact NH2-CB 3.29Å
366	Q	42.3	Very low	54.3	Low	155 Å²	155	90.6 Å²	90.6	72%	0.724	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	5.8	-179.5	-81.9	-175.9	-26.5	0	0	114.3
367	Q	43	Very low	57	Low	152 Å²	152	85.4 Å²	85.4	71%	0.71	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-0.7	-173	-77.8	-176.7	-2.3	0	0	115.8	R365	R365-Q367 VanDerWaalsContact C-N 3.33Å; R365-Q367 PolarHBondContact O-N 3.21Å
368	Q	54.8	Low	59.2	Low	112 Å²	112	86.9 Å²	86.9	52%	0.523	45%	0.446	S	S	.	.	S	Bend	trans	-105.4	114.2	174.4	-64.3	-156.7	11.7	0	0	111.2	I370 L433	Q368-I370 PolarHBondContact O-N 2.86Å; Q368-L433 HydrophobicContact CB-CD1 4.08Å; Q368-L433 HydrophobicContact CB-CD2 4.22Å
369	P	63.8	Low	61.6	Low	41 Å²	41	83.6 Å²	83.6	27%	0.266	43%	0.431	S	S	.	.			trans	-64.1	129.8	179.1	26.1	-35.4	0	0	0	110.5	Q349 S371	Q349-P369 VanDerWaalsContact CD-CB 3.46Å; Q349-P369 HydrophobicContact CG-CB 4.41Å; P369-S371 PolarHBondContact O-N 2.89Å
370	I	76.3	Confident	64.1	Low	29 Å²	29	80.3 Å²	80.3	15%	0.149	41%	0.408	C	S	.	.			trans	-60.5	129.7	175.2	-65.5	171	0	0	0	108.5	M345 Q368 I424 E428 L433 V435	M345-I370 HydrophobicContact CE-CB 4.13Å; M345-I370 VanDerWaalsContact CE-O 3.3Å; M345-I370 WeakPolarHBondContact CE-O 3.37Å; Q368-I370 PolarHBondContact O-N 2.86Å; I370-I424 HydrophobicContact CD1-CG2 3.62Å; I370-E428 HydrophobicContact CD1-CG 3.96Å; I370-L433 WeakPolarHBondContact CA-O 3.32Å; I370-V435 HydrophobicContact CG2-CG2 3.69Å
371	S	83	Confident	66.7	Low	39 Å²	39	78 Å²	78	27%	0.273	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	151.7	-178.2	60.1	0	0	0	0	111.1	P369 L433 T434 V435	P369-S371 PolarHBondContact O-N 2.89Å; S371-L433 PolarHBondContact N-O 3.32Å; S371-L433 PolarHBondContact OG-O 3.44Å; S371-T434 CarbonylContact O-C 3.55Å; S371-T434 WeakPolarHBondContact O-CA 3.06Å; S371-T434 WeakPolarHBondContact OG-CG2 3.41Å; S371-V435 PolarHBondContact O-N 3.35Å
372	W	86.2	Confident	69.1	Low	23 Å²	23	79 Å²	79	9%	0.087	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	129	178.6	-72.8	64.8	0	0	0	109.9	V341 A376 L377 L380 M420 A423 V435 I440	V341-W372 HydrophobicContact CG1-CD2 3.98Å; V341-W372 HydrophobicContact CG1-CG 4.12Å; V341-W372 HydrophobicContact CG1-CZ2 4.32Å; W372-A376 HydrophobicContact CE3-CB 4.15Å; W372-L377 HydrophobicContact CB-CD2 4.15Å; W372-L377 HydrophobicContact CB-CG 4.15Å; W372-L377 HydrophobicContact CD2-CD2 4.31Å; W372-L377 HydrophobicContact CE3-CD2 3.86Å; W372-L377 HydrophobicContact CG-CD2 4.45Å; W372-L380 HydrophobicContact CH2-CD2 4.07Å; W372-L380 HydrophobicContact CZ3-CD2 3.7Å; W372-M420 HydrophobicContact CH2-CG 4.4Å; W372-M420 HydrophobicContact CZ2-CB 4.45Å; W372-M420 HydrophobicContact CZ2-CG 4.1Å; W372-A423 HydrophobicContact CH2-CB 3.98Å; W372-A423 HydrophobicContact CZ2-CB 4.46Å; W372-V435 HydrophobicContact CD2-CB 4.1Å; W372-V435 HydrophobicContact CD2-CG1 4.31Å; W372-V435 HydrophobicContact CD2-CG2 4.35Å; W372-V435 HydrophobicContact CE3-CB 4.34Å; W372-V435 HydrophobicContact CE3-CG1 4.1Å; W372-V435 HydrophobicContact CG-CB 4.36Å; W372-V435 HydrophobicContact CH2-CG1 4.37Å; W372-V435 HydrophobicContact CZ2-CG2 4.46Å; W372-V435 HydrophobicContact CZ3-CG1 4.16Å; W372-I440 HydrophobicContact CE3-CD1 4.35Å; W372-I440 HydrophobicContact CH2-CD1 3.81Å; W372-I440 HydrophobicContact CZ3-CD1 3.39Å; W372-I440 HydrophobicContact CZ3-CG1 4.37Å
373	S	85.2	Confident	71.2	Confident	28 Å²	28	72.8 Å²	72.8	20%	0.196	36%	0.356	C	S	.	.			trans	-68.4	150.7	171.9	64.3	0	0	0	0	110.5	D375 A376 L377 V435	S373-D375 PolarHBondContact O-N 3.06Å; S373-A376 WeakPolarHBondContact O-CB 3.19Å; S373-A376 PolarHBondContact O-N 3.1Å; S373-A376 VanDerWaalsContact O-N 3.15Å; S373-A376 VanDerWaalsContact OG-CB 3.22Å; S373-A376 WeakPolarHBondContact OG-CB 3.41Å; S373-A376 PolarHBondContact OG-N 3.23Å; S373-A376 VanDerWaalsContact OG-N 3.14Å; S373-L377 PolarHBondContact O-N 2.94Å; S373-V435 WeakPolarHBondContact CB-O 3.39Å; S373-V435 PolarHBondContact N-O 3.21Å; S373-V435 PolarHBondContact OG-O 3.47Å
374	P	84.4	Confident	73.4	Confident	69 Å²	69	67.7 Å²	67.7	45%	0.448	33%	0.332	S	S	.	.	H	α-helix	trans	-55	-41.9	174	-25.6	35.3	0	0	0	112.2	A376 L377 H378	P374-A376 VanDerWaalsContact C-N 3.31Å; P374-A376 PolarHBondContact O-N 2.73Å; P374-L377 PolarHBondContact O-N 3.45Å; P374-H378 PolarHBondContact O-CD2 3.3Å; P374-H378 PolarHBondContact O-N 3.4Å
375	D	84.6	Confident	75.5	Confident	104 Å²	104	66.8 Å²	66.8	56%	0.556	32%	0.316	S	S	*	.	H	α-helix	trans	-64.5	-34.6	179.5	-59.3	-31.9	0	0	0	112.4	S373 T379	S373-D375 PolarHBondContact O-N 3.06Å; D375-T379 WeakPolarHBondContact O-CB 3.36Å; D375-T379 PolarHBondContact O-N 3.22Å; D375-T379 PolarHBondContact O-OG1 2.89Å
376	A	87.9	Confident	76.4	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-63.6	-45.6	172.6	0	0	0	0	0	111.7	W372 S373 P374 H378 T379 L380 V435 D436 I440	W372-A376 HydrophobicContact CE3-CB 4.15Å; S373-A376 WeakPolarHBondContact O-CB 3.19Å; S373-A376 PolarHBondContact O-N 3.1Å; S373-A376 VanDerWaalsContact O-N 3.15Å; S373-A376 VanDerWaalsContact OG-CB 3.22Å; S373-A376 WeakPolarHBondContact OG-CB 3.41Å; S373-A376 PolarHBondContact OG-N 3.23Å; S373-A376 VanDerWaalsContact OG-N 3.14Å; P374-A376 VanDerWaalsContact C-N 3.31Å; P374-A376 PolarHBondContact O-N 2.73Å; A376-H378 PolarHBondContact O-N 3.05Å; A376-T379 PolarHBondContact O-N 3.41Å; A376-L380 WeakPolarHBondContact O-CB 3.43Å; A376-L380 PolarHBondContact O-N 3.45Å; A376-V435 HydrophobicContact CB-CG1 4.26Å; A376-V435 WeakPolarHBondContact CB-O 3.35Å; A376-D436 WeakPolarHBondContact CB-O 3.1Å; A376-I440 HydrophobicContact CB-CG1 4.03Å
377	L	87.6	Confident	76.9	Confident	23 Å²	23	56.6 Å²	56.6	12%	0.12	29%	0.286	C	S	.	.	H	α-helix	trans	-64.6	-40.2	178.1	-67.1	174.7	0	0	0	111.9	V341 W372 S373 P374 L380 Y381	V341-L377 HydrophobicContact CB-CD2 4.49Å; V341-L377 HydrophobicContact CG1-CD2 4.44Å; V341-L377 HydrophobicContact CG2-CD2 4.38Å; W372-L377 HydrophobicContact CB-CD2 4.15Å; W372-L377 HydrophobicContact CB-CG 4.15Å; W372-L377 HydrophobicContact CD2-CD2 4.31Å; W372-L377 HydrophobicContact CE3-CD2 3.86Å; W372-L377 HydrophobicContact CG-CD2 4.45Å; S373-L377 PolarHBondContact O-N 2.94Å; P374-L377 PolarHBondContact O-N 3.45Å; L377-L380 PolarHBondContact O-N 3.44Å; L377-Y381 WeakPolarHBondContact O-CB 3.34Å; L377-Y381 PolarHBondContact O-N 2.79Å
378	H	86.6	Confident	77.1	Confident	112 Å²	112	56.4 Å²	56.4	52%	0.519	29%	0.285	S	S	.	.	H	α-helix	trans	-61.8	-43.6	173.5	-83	-73.8	0	0	0	112.1	I334 P374 A376 Y381 Y382	I334-H378 HydrophobicContact CD1-CB 4.36Å; I334-H378 WeakPolarHBondContact CD1-CE1 3.43Å; I334-H378 WeakPolarHBondContact CD1-ND1 3.38Å; P374-H378 PolarHBondContact O-CD2 3.3Å; P374-H378 PolarHBondContact O-N 3.4Å; A376-H378 PolarHBondContact O-N 3.05Å; H378-Y381 PolarHBondContact O-N 2.97Å; H378-Y382 PolarHBondContact O-N 3.15Å
379	T	86.3	Confident	76.7	Confident	28 Å²	28	54.8 Å²	54.8	17%	0.172	28%	0.278	C	S	.	.	H	α-helix	trans	-67.1	-39.6	178.4	-54.7	0	0	0	0	111.3	D375 A376 Y382 F383 S437 I440 R441	D375-T379 WeakPolarHBondContact O-CB 3.36Å; D375-T379 PolarHBondContact O-N 3.22Å; D375-T379 PolarHBondContact O-OG1 2.89Å; A376-T379 PolarHBondContact O-N 3.41Å; T379-Y382 WeakPolarHBondContact O-CB 3.47Å; T379-Y382 PolarHBondContact O-N 3.45Å; T379-F383 HydrophobicContact CG2-CD2 4.36Å; T379-F383 HydrophobicContact CG2-CE2 3.86Å; T379-F383 WeakPolarHBondContact O-CD2 3.45Å; T379-F383 PolarHBondContact O-N 3.07Å; T379-S437 WeakPolarHBondContact OG1-CB 3.43Å; T379-I440 HydrophobicContact CG2-CB 4.01Å; T379-I440 HydrophobicContact CG2-CG2 3.84Å; T379-R441 HydrophobicContact CG2-CG 4.13Å
380	L	87	Confident	75.8	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-66.9	-42.2	176.7	-178.9	62.3	0	0	0	111.2	L337 V341 W372 A376 L377 Y382 F383 L384 L416 W419 I440	L337-L380 HydrophobicContact CD1-CD2 3.95Å; L337-L380 HydrophobicContact CD1-CG 4.34Å; L337-L380 HydrophobicContact CD2-CB 4.09Å; L337-L380 HydrophobicContact CD2-CD2 4.11Å; L337-L380 HydrophobicContact CD2-CG 3.96Å; L337-L380 HydrophobicContact CG-CD2 4.41Å; V341-L380 HydrophobicContact CG2-CD2 4.33Å; W372-L380 HydrophobicContact CH2-CD2 4.07Å; W372-L380 HydrophobicContact CZ3-CD2 3.7Å; A376-L380 WeakPolarHBondContact O-CB 3.43Å; A376-L380 PolarHBondContact O-N 3.45Å; L377-L380 PolarHBondContact O-N 3.44Å; L380-Y382 VanDerWaalsContact C-N 3.26Å; L380-Y382 PolarHBondContact O-N 3.28Å; L380-F383 PolarHBondContact O-N 3.26Å; L380-F383 VanDerWaalsContact O-N 3.08Å; L380-L384 HydrophobicContact CD1-CD1 3.78Å; L380-L384 HydrophobicContact CD1-CG 4.12Å; L380-L384 HydrophobicContact CD2-CD1 4.27Å; L380-L384 HydrophobicContact CG-CD1 3.75Å; L380-L384 HydrophobicContact CG-CG 4.4Å; L380-L384 PolarHBondContact O-N 2.69Å; L380-L416 HydrophobicContact CD2-CD1 4.18Å; L380-W419 HydrophobicContact CD1-CB 4.05Å; L380-W419 HydrophobicContact CD1-CD2 3.67Å; L380-W419 HydrophobicContact CD1-CE3 3.46Å; L380-W419 VanDerWaalsContact CD1-CE3 3.46Å; L380-W419 HydrophobicContact CD1-CG 3.95Å; L380-W419 HydrophobicContact CD1-CZ3 4.15Å; L380-I440 HydrophobicContact CB-CG2 4.04Å; L380-I440 HydrophobicContact CD1-CG2 4.24Å
381	Y	84.8	Confident	74.3	Confident	45 Å²	45	59.9 Å²	59.9	18%	0.176	31%	0.308	C	S	.	.	H	α-helix	trans	-58.1	-40.4	174.5	178.7	-109.6	0	0	0	111.7	G332 S333 I334 L377 H378 F383 L384 R385	G332-Y381 PolarHBondContact O-OH 3.19Å; S333-Y381 VanDerWaalsContact C-CE2 3.45Å; I334-Y381 HydrophobicContact CB-CD2 4.47Å; I334-Y381 HydrophobicContact CB-CG 4.31Å; L377-Y381 WeakPolarHBondContact O-CB 3.34Å; L377-Y381 PolarHBondContact O-N 2.79Å; H378-Y381 PolarHBondContact O-N 2.97Å; Y381-F383 VanDerWaalsContact C-N 3.25Å; Y381-F383 PolarHBondContact O-N 2.68Å; Y381-L384 PolarHBondContact O-N 3Å; Y381-R385 VanDerWaalsContact O-CB 3.27Å; Y381-R385 WeakPolarHBondContact O-CB 3.44Å; Y381-R385 PolarHBondContact O-N 2.97Å
382	Y	83.6	Confident	72.3	Confident	146 Å²	146	65.9 Å²	65.9	57%	0.573	33%	0.333	S	S	*	.	H	α-helix	trans	-56.3	-38.7	175.5	173.4	-95.6	0	0	0	112.8	H378 T379 L380	H378-Y382 PolarHBondContact O-N 3.15Å; T379-Y382 WeakPolarHBondContact O-CB 3.47Å; T379-Y382 PolarHBondContact O-N 3.45Å; L380-Y382 VanDerWaalsContact C-N 3.26Å; L380-Y382 PolarHBondContact O-N 3.28Å
383	F	81.3	Confident	70.3	Confident	24 Å²	24	71.7 Å²	71.7	11%	0.105	36%	0.362	C	S	.	.	H	α-helix	trans	-82.6	-28.4	179.9	-68.3	-64.8	0	0	0	114.4	T379 L380 Y381 W419 I440 A444 L448 L451	T379-F383 HydrophobicContact CG2-CD2 4.36Å; T379-F383 HydrophobicContact CG2-CE2 3.86Å; T379-F383 WeakPolarHBondContact O-CD2 3.45Å; T379-F383 PolarHBondContact O-N 3.07Å; L380-F383 PolarHBondContact O-N 3.26Å; L380-F383 VanDerWaalsContact O-N 3.08Å; Y381-F383 VanDerWaalsContact C-N 3.25Å; Y381-F383 PolarHBondContact O-N 2.68Å; F383-W419 HydrophobicContact CB-CH2 3.58Å; F383-W419 HydrophobicContact CB-CZ2 3.92Å; F383-W419 HydrophobicContact CB-CZ3 4.3Å; F383-W419 HydrophobicContact CD1-CH2 4.44Å; F383-W419 AromaticContact CD2-CH2 3.97Å; F383-W419 HydrophobicContact CD2-CH2 3.97Å; F383-W419 HydrophobicContact CD2-CZ3 4.12Å; F383-W419 AromaticContact CG-CH2 3.76Å; F383-W419 HydrophobicContact CG-CH2 3.76Å; F383-W419 HydrophobicContact CG-CZ3 4.36Å; F383-I440 HydrophobicContact CD2-CG2 4.09Å; F383-I440 HydrophobicContact CE2-CG2 4.34Å; F383-A444 HydrophobicContact CD1-CB 4.17Å; F383-A444 HydrophobicContact CD2-CB 3.98Å; F383-A444 HydrophobicContact CE1-CB 3.85Å; F383-A444 HydrophobicContact CE2-CB 3.64Å; F383-A444 HydrophobicContact CG-CB 4.24Å; F383-A444 HydrophobicContact CZ-CB 3.58Å; F383-L448 HydrophobicContact CD1-CD1 4Å; F383-L451 HydrophobicContact CD1-CD1 4.28Å; F383-L451 HydrophobicContact CE1-CD1 3.71Å; F383-L451 HydrophobicContact CZ-CD1 4.45Å
384	L	80	Confident	68.4	Low	4 Å²	4	74.8 Å²	74.8	2%	0.021	38%	0.376	C	S	.	.	H	α-helix	trans	-93.8	-2.9	-178.6	-66.9	177	0	0	0	114.2	T329 C330 V331 L337 L380 Y381 L416	T329-L384 WeakPolarHBondContact O-CD2 3.03Å; C330-L384 CarbonylContact C-O 3.6Å; C330-L384 VanDerWaalsContact CA-O 3.24Å; C330-L384 WeakPolarHBondContact CA-O 3.5Å; V331-L384 HydrophobicContact CG2-CB 4.32Å; V331-L384 HydrophobicContact CG2-CD1 4.27Å; V331-L384 PolarHBondContact N-O 3.19Å; L337-L384 HydrophobicContact CD1-CD1 3.78Å; L380-L384 HydrophobicContact CD1-CD1 3.78Å; L380-L384 HydrophobicContact CD1-CG 4.12Å; L380-L384 HydrophobicContact CD2-CD1 4.27Å; L380-L384 HydrophobicContact CG-CD1 3.75Å; L380-L384 HydrophobicContact CG-CG 4.4Å; L380-L384 PolarHBondContact O-N 2.69Å; Y381-L384 PolarHBondContact O-N 3Å; L384-L416 HydrophobicContact CD1-CD1 3.73Å
385	R	75.1	Confident	66.7	Low	96 Å²	96	77 Å²	77	36%	0.362	39%	0.39	S	S	.	.	B	Isolated β-bridge	trans	-69.5	134.2	-177.1	174.4	169.8	163.9	-172.9	-9.1	112	Y381 P387 E390	Y381-R385 VanDerWaalsContact O-CB 3.27Å; Y381-R385 WeakPolarHBondContact O-CB 3.44Å; Y381-R385 PolarHBondContact O-N 2.97Å; R385-P387 WeakPolarHBondContact O-CD 3.16Å; R385-E390 IonicContact CZ-OE1 3.87Å; R385-E390 IonicContact CZ-OE2 3.85Å; R385-E390 IonicContact NE-OE1 3.25Å; R385-E390 IonicContact NE-OE2 2.76Å; R385-E390 IonicContact NH1-OE1 3.72Å; R385-E390 IonicContact NH2-OE1 3.94Å; R385-E390 PolarHBondContact NH2-OE1 2.66Å; R385-E390 IonicContact NH2-OE2 2.81Å; R385-E390 PolarHBondContact NH2-OE2 3.36Å
386	C	61.3	Low	65.1	Low	27 Å²	27	79.4 Å²	79.4	18%	0.182	40%	0.403	C	S	.	.			trans	-91.2	117	170.7	-169.3	0	0	0	0	111	C330 Q388 M389	C330-C386 HydrophobicContact CB-CB 4.3Å; C386-Q388 PolarHBondContact O-N 3.09Å; C386-M389 PolarHBondContact O-N 3.23Å
387	P	52.8	Low	63.1	Low	86 Å²	86	85.4 Å²	85.4	56%	0.558	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-62.8	-21.8	179.8	-22.5	33.3	0	0	0	114.4	R385 M389	R385-P387 WeakPolarHBondContact O-CD 3.16Å; P387-M389 VanDerWaalsContact C-N 3.3Å; P387-M389 PolarHBondContact O-N 2.86Å
388	Q	47	Very low	60.6	Low	148 Å²	148	91.4 Å²	91.4	69%	0.692	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-74	-16.7	-174.9	-64.6	166	-17.8	0	0	113.6	C386 S391	C386-Q388 PolarHBondContact O-N 3.09Å; Q388-S391 PolarHBondContact O-OG 3.17Å
389	M	45.8	Very low	58.3	Low	78 Å²	78	91 Å²	91	38%	0.384	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-80.2	-28	-177.8	-82.5	177.1	58	0	0	114	C386 P387 M392 E393	C386-M389 PolarHBondContact O-N 3.23Å; P387-M389 VanDerWaalsContact C-N 3.3Å; P387-M389 PolarHBondContact O-N 2.86Å; M389-M392 WeakPolarHBondContact O-CB 3.3Å; M389-M392 PolarHBondContact O-N 3.26Å; M389-E393 PolarHBondContact O-N 3.42Å
390	E	44	Very low	55.8	Low	87 Å²	87	94.5 Å²	94.5	41%	0.407	50%	0.498	S	S	.	.	H	α-helix	trans	-74.5	-29.9	-179	-78	-177.7	149.7	0	0	113.7	R385 M392 E393 N394	R385-E390 IonicContact CZ-OE1 3.87Å; R385-E390 IonicContact CZ-OE2 3.85Å; R385-E390 IonicContact NE-OE1 3.25Å; R385-E390 IonicContact NE-OE2 2.76Å; R385-E390 IonicContact NH1-OE1 3.72Å; R385-E390 IonicContact NH2-OE1 3.94Å; R385-E390 PolarHBondContact NH2-OE1 2.66Å; R385-E390 IonicContact NH2-OE2 2.81Å; R385-E390 PolarHBondContact NH2-OE2 3.36Å; E390-M392 PolarHBondContact O-N 3.49Å; E390-M392 VanDerWaalsContact O-N 3.12Å; E390-E393 PolarHBondContact O-N 3.28Å; E390-N394 PolarHBondContact O-N 3.31Å
391	S	46.2	Very low	53.5	Low	91 Å²	91	106.2 Å²	106.2	64%	0.636	54%	0.542	S	S	*	.	H	α-helix	trans	-63.6	-15.9	172.6	49.5	0	0	0	0	113	Q388	Q388-S391 PolarHBondContact O-OG 3.17Å
392	M	40.7	Very low	51	Low	164 Å²	164	112.1 Å²	112.1	81%	0.808	57%	0.573	S	S	*	*	H	α-helix	trans	-94	-24.6	178.2	-124.1	164.5	61.2	0	0	113	M389 E390	M389-M392 WeakPolarHBondContact O-CB 3.3Å; M389-M392 PolarHBondContact O-N 3.26Å; E390-M392 PolarHBondContact O-N 3.49Å; E390-M392 VanDerWaalsContact O-N 3.12Å
393	E	43.9	Very low	48.5	Very low	145 Å²	145	110.8 Å²	110.8	68%	0.678	58%	0.58	S	S	*	*	H	α-helix	trans	-89.5	-20.7	-178.1	-73.6	-173.9	161.9	0	0	113.7	M389 E390	M389-E393 PolarHBondContact O-N 3.42Å; E390-E393 PolarHBondContact O-N 3.28Å
394	N	45.8	Very low	46.3	Very low	94 Å²	94	115.5 Å²	115.5	50%	0.503	61%	0.606	S	S	.	*			trans	-153	102.1	172.2	-86.6	-52.5	0	0	0	113.2	E390 N396 L397	E390-N394 PolarHBondContact O-N 3.31Å; N394-N396 PolarHBondContact O-N 3.42Å; N394-L397 HydrophobicContact CB-CD1 3.86Å; N394-L397 HydrophobicContact CB-CG 4.49Å
395	P	48.9	Very low	44	Very low	115 Å²	115	121.9 Å²	121.9	75%	0.747	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-0.8	179.6	26.3	-32.5	0	0	0	115.1
396	N	51	Low	42.2	Very low	154 Å²	154	124 Å²	124	82%	0.824	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.9	0.9	-173.5	-65	-34.5	0	0	0	114.5	N394	N394-N396 PolarHBondContact O-N 3.42Å
397	L	44.6	Very low	41.4	Very low	127 Å²	127	131.5 Å²	131.5	67%	0.665	69%	0.691	S	S	*	*	S	Bend	trans	-94.3	115.9	173.8	-84	158.2	0	0	0	108.3	N394	N394-L397 HydrophobicContact CB-CD1 3.86Å; N394-L397 HydrophobicContact CB-CG 4.49Å
398	D	36.4	Very low	41.3	Very low	148 Å²	148	133 Å²	133	79%	0.791	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-52.8	127.7	164.9	-84.1	-32.3	0	0	0	107.8
399	P	37.1	Very low	41.6	Very low	104 Å²	104	127.8 Å²	127.8	68%	0.675	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-56.2	136.7	179.4	22	-31.1	0	0	0	108.5	R401	P399-R401 PolarHBondContact O-N 2.9Å; P399-R401 VanDerWaalsContact O-N 3.14Å
400	P	35.5	Very low	41.8	Very low	102 Å²	102	126.9 Å²	126.9	66%	0.662	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-53.1	128.1	178.1	20	-30	0	0	0	108.6	M402	P400-M402 PolarHBondContact O-N 2.81Å
401	R	36.8	Very low	42.2	Very low	245 Å²	245	125.1 Å²	125.1	93%	0.925	65%	0.651	S	S	*	*	S	Bend	trans	-69	43.4	-178.1	-69	-174.2	177.4	174	0	113.2	P399	P399-R401 PolarHBondContact O-N 2.9Å; P399-R401 VanDerWaalsContact O-N 3.14Å
402	M	33.5	Very low	42.9	Very low	169 Å²	169	121.8 Å²	121.8	83%	0.833	63%	0.626	S	S	*	*			trans	-113.3	80.5	161.2	-147.2	118.9	114	0	0	105.5	P400 L404	P400-M402 PolarHBondContact O-N 2.81Å; M402-L404 VanDerWaalsContact C-N 3.34Å; M402-L404 PolarHBondContact O-N 2.94Å
403	T	30.6	Very low	44.5	Very low	118 Å²	118	115 Å²	115	72%	0.724	59%	0.593	S	S	*	*			trans	-53.9	102.5	168.1	43	0	0	0	0	107.5	N405	T403-N405 PolarHBondContact O-N 3.32Å
404	L	35	Very low	46.3	Very low	123 Å²	123	108.3 Å²	108.3	64%	0.644	56%	0.562	S	S	*	*			trans	-57.6	98.2	160.4	-76.5	163.2	0	0	0	105	M402 N406	M402-L404 VanDerWaalsContact C-N 3.34Å; M402-L404 PolarHBondContact O-N 2.94Å; L404-N406 PolarHBondContact O-N 2.7Å
405	N	31.1	Very low	48.1	Very low	139 Å²	139	103.9 Å²	103.9	74%	0.743	54%	0.538	S	S	*	.	S	Bend	trans	-58.8	112.6	172.5	-94.1	-7	0	0	0	107	T403	T403-N405 PolarHBondContact O-N 3.32Å
406	N	38.8	Very low	49.9	Very low	139 Å²	139	98.5 Å²	98.5	74%	0.743	50%	0.503	S	S	*	.	S	Bend	trans	86.7	112.8	171.1	-50	-19.9	0	0	0	115.3	L404 R408	L404-N406 PolarHBondContact O-N 2.7Å; N406-R408 PolarHBondContact O-N 3.34Å
407	E	43.8	Very low	51.5	Low	185 Å²	185	91.3 Å²	91.3	86%	0.864	47%	0.465	S	S	*	.			trans	-43	120.6	160	-62.6	171.4	162.8	0	0	109.3	P409	E407-P409 VanDerWaalsContact O-CD 3.28Å; E407-P409 WeakPolarHBondContact O-CD 3.48Å
408	R	51.9	Low	53.5	Low	117 Å²	117	85.4 Å²	85.4	44%	0.442	43%	0.434	S	S	.	.			trans	-75.5	119.1	174.4	-69.6	-177.9	-176.2	172.8	1.1	107.7	N406 F410	N406-R408 PolarHBondContact O-N 3.34Å; R408-F410 PolarHBondContact O-N 3.09Å
409	P	52.2	Low	56	Low	39 Å²	39	78.5 Å²	78.5	25%	0.253	40%	0.397	S	S	.	.			trans	-59.2	128	176.7	-21.4	32.1	0	0	0	110	I81 E407 M411 L412	I81-P409 HydrophobicContact CD1-CB 3.87Å; I81-P409 HydrophobicContact CD1-CG 3.64Å; I81-P409 HydrophobicContact CG1-CG 4.06Å; I81-P409 HydrophobicContact CG2-CB 4.36Å; I81-P409 HydrophobicContact CG2-CG 3.75Å; E407-P409 VanDerWaalsContact O-CD 3.28Å; E407-P409 WeakPolarHBondContact O-CD 3.48Å; P409-M411 PolarHBondContact O-N 3.32Å; P409-L412 HydrophobicContact CB-CD1 4.43Å; P409-L412 HydrophobicContact CG-CD1 4.13Å; P409-L412 PolarHBondContact O-N 2.68Å
410	F	50.7	Low	58.5	Low	60 Å²	60	73.6 Å²	73.6	26%	0.263	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-51	-28.9	177.1	180	-98.6	0	0	0	112.8	K285 T329 R408 L412 L413	K285-F410 PolarHBondContact NZ-O 3.24Å; T329-F410 WeakPolarHBondContact OG1-CE2 3.33Å; R408-F410 PolarHBondContact O-N 3.09Å; F410-L412 PolarHBondContact O-N 3.35Å; F410-L413 PolarHBondContact O-N 3.28Å
411	M	51.4	Low	61	Low	49 Å²	49	69 Å²	69	24%	0.241	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-57.6	-29.4	175.6	-64.2	-59.7	-72.5	0	0	113.9	L72 K285 P409	L72-M411 HydrophobicContact CD1-CG 4.07Å; L72-M411 HydrophobicContact CD1-SD 3.82Å; K285-M411 PolarHBondContact NZ-O 2.85Å; P409-M411 PolarHBondContact O-N 3.32Å
412	L	61.7	Low	63.5	Low	22 Å²	22	57.3 Å²	57.3	12%	0.115	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-93.8	-5.5	-176.3	-67.2	171.3	0	0	0	114.2	I81 F82 P409 F410 P414 P449	I81-L412 HydrophobicContact CG2-CD1 3.78Å; I81-L412 HydrophobicContact CG2-CG 4.5Å; F82-L412 HydrophobicContact CD1-CD2 4.21Å; F82-L412 HydrophobicContact CE1-CD2 3.48Å; F82-L412 VanDerWaalsContact CE1-CD2 3.48Å; F82-L412 HydrophobicContact CZ-CD2 3.91Å; P409-L412 HydrophobicContact CB-CD1 4.43Å; P409-L412 HydrophobicContact CG-CD1 4.13Å; P409-L412 PolarHBondContact O-N 2.68Å; F410-L412 PolarHBondContact O-N 3.35Å; L412-P414 WeakPolarHBondContact O-CD 3.23Å; L412-P449 HydrophobicContact CD1-CG 4.4Å
413	L	73.1	Confident	66.3	Low	21 Å²	21	49.2 Å²	49.2	11%	0.11	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-83.1	121.9	-179	-66.7	173.9	0	0	0	110.9	K285 T329 F410 L448	K285-L413 VanDerWaalsContact CE-O 3.3Å; K285-L413 WeakPolarHBondContact CE-O 3.4Å; K285-L413 PolarHBondContact NZ-O 3.17Å; T329-L413 HydrophobicContact CG2-CB 4.47Å; F410-L413 PolarHBondContact O-N 3.28Å; L413-L448 HydrophobicContact CD2-CD2 4.27Å
414	P	81.4	Confident	69.1	Low	5 Å²	5	44.2 Å²	44.2	3%	0.032	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-74.2	153.5	175.1	35.3	-40.3	0	0	0	110.8	L412 E418 L447	L412-P414 WeakPolarHBondContact O-CD 3.23Å; P414-E418 HydrophobicContact CB-CB 4.3Å; P414-L447 HydrophobicContact CB-CD1 4.34Å; P414-L447 HydrophobicContact CG-CB 3.98Å; P414-L447 HydrophobicContact CG-CD1 3.99Å
415	P	85.1	Confident	71.7	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.006	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-69.1	155.9	175.3	28.7	-33	0	0	0	112	L291 L326 L327 M417 E418	L291-P415 HydrophobicContact CD2-CB 3.99Å; L291-P415 HydrophobicContact CD2-CG 3.84Å; L326-P415 WeakPolarHBondContact O-CB 3.47Å; L327-P415 HydrophobicContact CD2-CB 4.38Å; P415-M417 PolarHBondContact O-N 3.32Å; P415-M417 VanDerWaalsContact O-N 3.14Å; P415-E418 HydrophobicContact CG-CB 4.47Å; P415-E418 HydrophobicContact CG-CG 3.83Å; P415-E418 WeakPolarHBondContact O-CB 3.36Å; P415-E418 PolarHBondContact O-N 3.04Å
416	L	85.6	Confident	74.4	Confident	1 Å²	1	33 Å²	33	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-53.5	-35.5	-178.9	179.3	62.7	0	0	0	112.6	L326 A328 L337 L340 V341 L380 L384 E418 W419 M420	L326-L416 PolarHBondContact O-N 3.12Å; A328-L416 WeakPolarHBondContact O-CB 3.48Å; A328-L416 PolarHBondContact O-N 3.38Å; L337-L416 HydrophobicContact CD1-CD1 4.03Å; L340-L416 HydrophobicContact CB-CD2 3.93Å; V341-L416 HydrophobicContact CG2-CD1 4.41Å; L380-L416 HydrophobicContact CD2-CD1 4.18Å; L384-L416 HydrophobicContact CD1-CD1 3.73Å; L416-E418 VanDerWaalsContact C-N 3.25Å; L416-E418 PolarHBondContact O-N 3.31Å; L416-W419 WeakPolarHBondContact O-CB 3.13Å; L416-W419 PolarHBondContact O-N 2.97Å; L416-M420 HydrophobicContact CD1-CG 4.39Å; L416-M420 HydrophobicContact CD2-SD 4.48Å; L416-M420 HydrophobicContact CG-CG 4.35Å; L416-M420 HydrophobicContact CG-SD 4.13Å; L416-M420 WeakPolarHBondContact O-CG 3.31Å; L416-M420 PolarHBondContact O-N 2.64Å
417	M	85.4	Confident	76.7	Confident	4 Å²	4	26.4 Å²	26.4	2%	0.02	12%	0.123	C	C	.	.	H	α-helix	trans	-56.2	-39.9	177.1	-167.7	-82.2	-67.6	0	0	112.6	P294 L326 P415 M420 R421	P294-M417 HydrophobicContact CG-CE 3.82Å; L326-M417 HydrophobicContact CB-CB 4.04Å; L326-M417 HydrophobicContact CB-CG 4.48Å; L326-M417 HydrophobicContact CD2-CB 3.95Å; L326-M417 HydrophobicContact CD2-CG 3.96Å; L326-M417 PolarHBondContact O-N 3.18Å; P415-M417 PolarHBondContact O-N 3.32Å; P415-M417 VanDerWaalsContact O-N 3.14Å; M417-M420 PolarHBondContact O-N 3.11Å; M417-R421 WeakPolarHBondContact O-CB 3.27Å; M417-R421 PolarHBondContact O-N 3.43Å; M417-R421 HydrophobicContact SD-CB 4.41Å
418	E	85.8	Confident	78.7	Confident	3 Å²	3	21 Å²	21	1%	0.014	10%	0.098	C	C	.	.	H	α-helix	trans	-71.7	-37.2	-179.8	-66.7	-64.7	152.4	0	0	111.6	C283 P414 P415 L416 M420 R421 V422 L447	C283-E418 HydrophobicContact CB-CB 4.2Å; C283-E418 HydrophobicContact CB-CG 3.54Å; C283-E418 VanDerWaalsContact CB-OE2 3.32Å; C283-E418 WeakPolarHBondContact CB-OE2 3.47Å; P414-E418 HydrophobicContact CB-CB 4.3Å; P415-E418 HydrophobicContact CG-CB 4.47Å; P415-E418 HydrophobicContact CG-CG 3.83Å; P415-E418 WeakPolarHBondContact O-CB 3.36Å; P415-E418 PolarHBondContact O-N 3.04Å; L416-E418 VanDerWaalsContact C-N 3.25Å; L416-E418 PolarHBondContact O-N 3.31Å; E418-M420 VanDerWaalsContact C-N 3.34Å; E418-R421 PolarHBondContact O-N 2.99Å; E418-R421 IonicContact OE1-NE 2.78Å; E418-R421 IonicContact OE2-CZ 3.55Å; E418-R421 IonicContact OE2-NE 3.74Å; E418-R421 PolarHBondContact OE2-NE 3.38Å; E418-R421 IonicContact OE2-NH2 3.51Å; E418-R421 PolarHBondContact OE2-NH2 3.33Å; E418-V422 WeakPolarHBondContact O-CB 3.32Å; E418-V422 VanDerWaalsContact O-CG2 3.27Å; E418-V422 WeakPolarHBondContact O-CG2 3.29Å; E418-V422 PolarHBondContact O-N 3.13Å; E418-V422 VanDerWaalsContact O-N 3.07Å; E418-L447 HydrophobicContact CB-CD1 4.41Å
419	W	89.6	Confident	80.3	Confident	3 Å²	3	16.1 Å²	16.1	1%	0.011	8%	0.08	C	C	.	.	H	α-helix	trans	-59.4	-46.6	170	-77.8	93.6	0	0	0	111.6	L380 F383 L416 A423 I440 T443 A444 L447 L448	L380-W419 HydrophobicContact CD1-CB 4.05Å; L380-W419 HydrophobicContact CD1-CD2 3.67Å; L380-W419 HydrophobicContact CD1-CE3 3.46Å; L380-W419 VanDerWaalsContact CD1-CE3 3.46Å; L380-W419 HydrophobicContact CD1-CG 3.95Å; L380-W419 HydrophobicContact CD1-CZ3 4.15Å; F383-W419 HydrophobicContact CB-CH2 3.58Å; F383-W419 HydrophobicContact CB-CZ2 3.92Å; F383-W419 HydrophobicContact CB-CZ3 4.3Å; F383-W419 HydrophobicContact CD1-CH2 4.44Å; F383-W419 AromaticContact CD2-CH2 3.97Å; F383-W419 HydrophobicContact CD2-CH2 3.97Å; F383-W419 HydrophobicContact CD2-CZ3 4.12Å; F383-W419 AromaticContact CG-CH2 3.76Å; F383-W419 HydrophobicContact CG-CH2 3.76Å; F383-W419 HydrophobicContact CG-CZ3 4.36Å; L416-W419 WeakPolarHBondContact O-CB 3.13Å; L416-W419 PolarHBondContact O-N 2.97Å; W419-A423 WeakPolarHBondContact O-CB 3.43Å; W419-A423 PolarHBondContact O-N 3.42Å; W419-I440 HydrophobicContact CE3-CG2 4.39Å; W419-I440 HydrophobicContact CZ3-CG2 4.06Å; W419-T443 HydrophobicContact CD2-CG2 4.08Å; W419-T443 HydrophobicContact CE3-CG2 3.4Å; W419-T443 VanDerWaalsContact CE3-CG2 3.4Å; W419-T443 HydrophobicContact CZ3-CG2 3.88Å; W419-A444 HydrophobicContact CH2-CB 3.56Å; W419-A444 HydrophobicContact CZ3-CB 3.79Å; W419-L447 HydrophobicContact CD2-CD1 4.14Å; W419-L447 HydrophobicContact CG-CD1 4.18Å; W419-L448 HydrophobicContact CH2-CD1 3.92Å; W419-L448 HydrophobicContact CH2-CG 4.37Å; W419-L448 HydrophobicContact CZ2-CD1 3.84Å; W419-L448 HydrophobicContact CZ2-CD2 4.41Å; W419-L448 HydrophobicContact CZ2-CG 4.08Å
420	M	88.7	Confident	81.7	Confident	1 Å²	1	15.3 Å²	15.3	1%	0.005	7%	0.072	C	C	.	.	H	α-helix	trans	-64	-48.8	179.1	-69.3	179.3	61.2	0	0	111.4	V341 A344 M345 M348 W372 L416 M417 E418 V422 A423 I424	V341-M420 HydrophobicContact CG1-CE 4.38Å; V341-M420 HydrophobicContact CG2-SD 4.48Å; A344-M420 HydrophobicContact CB-CE 3.57Å; A344-M420 HydrophobicContact CB-SD 3.67Å; M345-M420 HydrophobicContact CG-CE 3.7Å; M345-M420 HydrophobicContact SD-CE 3.61Å; M348-M420 HydrophobicContact SD-CE 4.12Å; W372-M420 HydrophobicContact CH2-CG 4.4Å; W372-M420 HydrophobicContact CZ2-CB 4.45Å; W372-M420 HydrophobicContact CZ2-CG 4.1Å; L416-M420 HydrophobicContact CD1-CG 4.39Å; L416-M420 HydrophobicContact CD2-SD 4.48Å; L416-M420 HydrophobicContact CG-CG 4.35Å; L416-M420 HydrophobicContact CG-SD 4.13Å; L416-M420 WeakPolarHBondContact O-CG 3.31Å; L416-M420 PolarHBondContact O-N 2.64Å; M417-M420 PolarHBondContact O-N 3.11Å; E418-M420 VanDerWaalsContact C-N 3.34Å; M420-V422 PolarHBondContact O-N 2.97Å; M420-A423 PolarHBondContact O-N 2.79Å; M420-I424 HydrophobicContact CB-CD1 4.33Å; M420-I424 WeakPolarHBondContact O-CB 3.34Å; M420-I424 VanDerWaalsContact O-CD1 3.31Å; M420-I424 WeakPolarHBondContact O-CD1 3.28Å; M420-I424 WeakPolarHBondContact O-CG1 3.35Å; M420-I424 PolarHBondContact O-N 3.24Å
421	R	88.1	Confident	83	Confident	4 Å²	4	17.1 Å²	17.1	2%	0.015	8%	0.077	C	C	.	.	H	α-helix	trans	-54.3	-52	179.1	179.7	-174.8	64.6	74.4	2.3	111.6	K160 L161 Q163 W165 M417 E418 T425	K160-R421 PolarHBondContact O-NH1 3.14Å; L161-R421 VanDerWaalsContact C-NH1 3.33Å; L161-R421 PolarHBondContact O-NH1 3.02Å; L161-R421 PolarHBondContact O-NH2 3.05Å; Q163-R421 PolarHBondContact O-NH1 2.9Å; Q163-R421 VanDerWaalsContact O-NH1 3.11Å; W165-R421 HydrophobicContact CE3-CG 4.1Å; W165-R421 HydrophobicContact CZ3-CG 4.47Å; M417-R421 WeakPolarHBondContact O-CB 3.27Å; M417-R421 PolarHBondContact O-N 3.43Å; M417-R421 HydrophobicContact SD-CB 4.41Å; E418-R421 PolarHBondContact O-N 2.99Å; E418-R421 IonicContact OE1-NE 2.78Å; E418-R421 IonicContact OE2-CZ 3.55Å; E418-R421 IonicContact OE2-NE 3.74Å; E418-R421 PolarHBondContact OE2-NE 3.38Å; E418-R421 IonicContact OE2-NH2 3.51Å; E418-R421 PolarHBondContact OE2-NH2 3.33Å; R421-T425 WeakPolarHBondContact O-CB 3.33Å; R421-T425 PolarHBondContact O-N 3.4Å; R421-T425 PolarHBondContact O-OG1 3.29Å
422	V	90.9	Very high	84.4	Confident	0 Å²	0	15.3 Å²	15.3	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-68.3	-45.9	-176.3	176.1	0	0	0	0	110.9	L161 E418 M420 I424 T425 Y426 T443 L446 L447	L161-V422 HydrophobicContact CD2-CB 4.48Å; L161-V422 HydrophobicContact CD2-CG1 3.76Å; E418-V422 WeakPolarHBondContact O-CB 3.32Å; E418-V422 VanDerWaalsContact O-CG2 3.27Å; E418-V422 WeakPolarHBondContact O-CG2 3.29Å; E418-V422 PolarHBondContact O-N 3.13Å; E418-V422 VanDerWaalsContact O-N 3.07Å; M420-V422 PolarHBondContact O-N 2.97Å; V422-I424 PolarHBondContact O-N 3.07Å; V422-T425 PolarHBondContact O-N 2.85Å; V422-Y426 HydrophobicContact CG1-CD2 3.93Å; V422-Y426 HydrophobicContact CG1-CE2 3.55Å; V422-Y426 VanDerWaalsContact O-CD2 3.28Å; V422-Y426 WeakPolarHBondContact O-CD2 3.25Å; V422-Y426 PolarHBondContact O-N 3.2Å; V422-T443 HydrophobicContact CB-CG2 3.73Å; V422-T443 HydrophobicContact CG1-CG2 3.67Å; V422-T443 WeakPolarHBondContact CG1-OG1 3.5Å; V422-L446 HydrophobicContact CG1-CD2 3.91Å; V422-L446 HydrophobicContact CG2-CD2 4.31Å; V422-L447 HydrophobicContact CG2-CD2 4.35Å
423	A	91.4	Very high	85.1	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-63.1	-42.3	179.4	0	0	0	0	0	112.6	W372 W419 M420 T425 Y426 A427 V435 I440 T443	W372-A423 HydrophobicContact CH2-CB 3.98Å; W372-A423 HydrophobicContact CZ2-CB 4.46Å; W419-A423 WeakPolarHBondContact O-CB 3.43Å; W419-A423 PolarHBondContact O-N 3.42Å; M420-A423 PolarHBondContact O-N 2.79Å; A423-T425 VanDerWaalsContact C-N 3.33Å; A423-T425 PolarHBondContact O-N 3.02Å; A423-Y426 PolarHBondContact O-N 2.72Å; A423-A427 PolarHBondContact O-N 3.35Å; A423-A427 VanDerWaalsContact O-N 3.13Å; A423-V435 HydrophobicContact CB-CG1 4.06Å; A423-I440 HydrophobicContact CB-CD1 3.6Å; A423-T443 WeakPolarHBondContact CA-OG1 3.49Å; A423-T443 PolarHBondContact N-OG1 2.84Å
424	I	88.4	Confident	85.6	Confident	12 Å²	12	17.3 Å²	17.3	6%	0.062	8%	0.08	C	C	.	.	H	α-helix	trans	-63	-41.7	175.2	-71.1	165.7	0	0	0	110.4	M345 M348 I370 M420 V422 Y426 A427 E428 V435	M345-I424 HydrophobicContact CE-CD1 4.22Å; M345-I424 HydrophobicContact SD-CD1 3.61Å; M348-I424 HydrophobicContact CE-CD1 4.49Å; I370-I424 HydrophobicContact CD1-CG2 3.62Å; M420-I424 HydrophobicContact CB-CD1 4.33Å; M420-I424 WeakPolarHBondContact O-CB 3.34Å; M420-I424 VanDerWaalsContact O-CD1 3.31Å; M420-I424 WeakPolarHBondContact O-CD1 3.28Å; M420-I424 WeakPolarHBondContact O-CG1 3.35Å; M420-I424 PolarHBondContact O-N 3.24Å; V422-I424 PolarHBondContact O-N 3.07Å; I424-Y426 VanDerWaalsContact C-N 3.34Å; I424-Y426 PolarHBondContact O-N 3.48Å; I424-A427 PolarHBondContact O-N 2.95Å; I424-E428 HydrophobicContact CG2-CG 4.27Å; I424-E428 WeakPolarHBondContact O-CG 3.24Å; I424-E428 PolarHBondContact O-N 3.05Å; I424-V435 HydrophobicContact CG1-CG2 4.49Å
425	T	89.8	Confident	85.9	Confident	9 Å²	9	17.1 Å²	17.1	6%	0.055	8%	0.079	C	C	.	.	H	α-helix	trans	-63.3	-39.2	179.3	-58.4	0	0	0	0	112	K160 L161 R421 V422 A423 E428 H429	K160-T425 HydrophobicContact CB-CG2 3.61Å; K160-T425 HydrophobicContact CD-CG2 4.22Å; L161-T425 HydrophobicContact CD2-CG2 3.73Å; L161-T425 HydrophobicContact CG-CG2 3.83Å; R421-T425 WeakPolarHBondContact O-CB 3.33Å; R421-T425 PolarHBondContact O-N 3.4Å; R421-T425 PolarHBondContact O-OG1 3.29Å; V422-T425 PolarHBondContact O-N 2.85Å; A423-T425 VanDerWaalsContact C-N 3.33Å; A423-T425 PolarHBondContact O-N 3.02Å; T425-E428 PolarHBondContact O-N 2.98Å; T425-H429 WeakPolarHBondContact O-CB 3.07Å; T425-H429 PolarHBondContact O-N 3.27Å
426	Y	89.6	Confident	86	Confident	18 Å²	18	18 Å²	18	7%	0.071	8%	0.083	C	C	.	.	H	α-helix	trans	-62.6	-44.4	172.5	-78.1	-62.9	0	0	0	112	L143 L161 V422 A423 I424 E428 H429 R430 Q442 R445	L143-Y426 HydrophobicContact CD2-CD1 4.12Å; L143-Y426 HydrophobicContact CD2-CE1 3.95Å; L161-Y426 HydrophobicContact CD1-CD1 4.25Å; L161-Y426 HydrophobicContact CD1-CE1 3.65Å; L161-Y426 HydrophobicContact CD2-CD1 4.24Å; L161-Y426 HydrophobicContact CD2-CD2 3.84Å; L161-Y426 HydrophobicContact CD2-CE1 4.09Å; L161-Y426 HydrophobicContact CD2-CE2 3.68Å; L161-Y426 HydrophobicContact CD2-CG 4.12Å; V422-Y426 HydrophobicContact CG1-CD2 3.93Å; V422-Y426 HydrophobicContact CG1-CE2 3.55Å; V422-Y426 VanDerWaalsContact O-CD2 3.28Å; V422-Y426 WeakPolarHBondContact O-CD2 3.25Å; V422-Y426 PolarHBondContact O-N 3.2Å; A423-Y426 PolarHBondContact O-N 2.72Å; I424-Y426 VanDerWaalsContact C-N 3.34Å; I424-Y426 PolarHBondContact O-N 3.48Å; Y426-E428 PolarHBondContact O-N 3.44Å; Y426-H429 PolarHBondContact O-N 3.04Å; Y426-R430 WeakPolarHBondContact O-CG 3.3Å; Y426-R430 PolarHBondContact O-N 3.33Å; Y426-Q442 HydrophobicContact CD2-CB 4.04Å; Y426-Q442 HydrophobicContact CE1-CB 4.16Å; Y426-Q442 HydrophobicContact CE2-CB 3.61Å; Y426-Q442 HydrophobicContact CG-CB 4.49Å; Y426-R445 PolarHBondContact OH-NH2 2.71Å
427	A	86.7	Confident	86.1	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-62.7	-40.4	175.8	0	0	0	0	0	112.7	A423 I424 R430 R431 S432 V435	A423-A427 PolarHBondContact O-N 3.35Å; A423-A427 VanDerWaalsContact O-N 3.13Å; I424-A427 PolarHBondContact O-N 2.95Å; A427-R430 WeakPolarHBondContact O-CG 3.42Å; A427-R431 PolarHBondContact O-N 3.33Å; A427-S432 PolarHBondContact O-N 3.26Å; A427-V435 HydrophobicContact CB-CG2 4Å
428	E	84.8	Confident	86.2	Confident	73 Å²	73	20.4 Å²	20.4	34%	0.341	10%	0.099	S	C	.	.	H	α-helix	trans	-63.6	-40.8	174.9	-76.3	-172.1	170.8	0	0	112.4	K160 I370 I424 T425 Y426 R430 R431	K160-E428 IonicContact NZ-OE2 3.21Å; K160-E428 PolarHBondContact NZ-OE2 2.72Å; I370-E428 HydrophobicContact CD1-CG 3.96Å; I424-E428 HydrophobicContact CG2-CG 4.27Å; I424-E428 WeakPolarHBondContact O-CG 3.24Å; I424-E428 PolarHBondContact O-N 3.05Å; T425-E428 PolarHBondContact O-N 2.98Å; Y426-E428 PolarHBondContact O-N 3.44Å; E428-R430 VanDerWaalsContact C-N 3.35Å; E428-R430 PolarHBondContact O-N 2.99Å; E428-R431 PolarHBondContact O-N 3.13Å
429	H	85.6	Confident	86.4	Confident	13 Å²	13	20.4 Å²	20.4	6%	0.06	10%	0.099	C	C	.	.	H	α-helix	trans	-60.3	-45.4	-179.9	-179.8	70.4	0	0	0	111.2	E154 S157 T425 Y426 R431	E154-H429 IonicContact OE1-CE1 3.35Å; S157-H429 WeakPolarHBondContact CB-ND1 3.4Å; S157-H429 PolarHBondContact OG-ND1 3.35Å; T425-H429 WeakPolarHBondContact O-CB 3.07Å; T425-H429 PolarHBondContact O-N 3.27Å; Y426-H429 PolarHBondContact O-N 3.04Å; H429-R431 PolarHBondContact O-N 2.88Å
430	R	82.3	Confident	86.4	Confident	22 Å²	22	20.3 Å²	20.3	8%	0.083	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	7	175.1	66.8	-173.7	179	90.8	-2	114.7	Y426 A427 E428 S432 T434 D436 D439 C462	Y426-R430 WeakPolarHBondContact O-CG 3.3Å; Y426-R430 PolarHBondContact O-N 3.33Å; A427-R430 WeakPolarHBondContact O-CG 3.42Å; E428-R430 VanDerWaalsContact C-N 3.35Å; E428-R430 PolarHBondContact O-N 2.99Å; R430-S432 PolarHBondContact NH1-OG 3.18Å; R430-S432 PolarHBondContact O-N 2.88Å; R430-T434 PolarHBondContact NH2-O 3.38Å; R430-D436 IonicContact CZ-OD2 2.71Å; R430-D436 IonicContact NH1-OD2 3.76Å; R430-D436 IonicContact NH2-OD2 3.8Å; R430-D436 PolarHBondContact NH2-OD2 3.48Å; R430-D439 IonicContact CZ-OD2 3.2Å; R430-D439 IonicContact NE-OD1 2.66Å; R430-D439 PolarHBondContact NE-OD1 3.07Å; R430-D439 IonicContact NE-OD2 3.14Å; R430-D439 PolarHBondContact NE-OD2 3.37Å; R430-D439 IonicContact NH2-OD1 2.73Å; R430-D439 IonicContact NH2-OD2 3.67Å; R430-D439 PolarHBondContact NH2-OD2 3.26Å; R430-C462 PolarHBondContact NH1-O 3.35Å
431	R	78.3	Confident	86.4	Confident	98 Å²	98	24.9 Å²	24.9	37%	0.37	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	36.2	-178.4	-54.7	-61.1	-177.3	-178.5	-2.4	113.3	A427 E428 H429 S554	A427-R431 PolarHBondContact O-N 3.33Å; E428-R431 PolarHBondContact O-N 3.13Å; H429-R431 PolarHBondContact O-N 2.88Å; R431-S554 WeakPolarHBondContact CB-O 3.4Å; R431-S554 WeakPolarHBondContact O-CB 3.39Å; R431-S554 PolarHBondContact O-OG 3.21Å
432	S	79.4	Confident	86.5	Confident	11 Å²	11	25.2 Å²	25.2	8%	0.077	12%	0.118	C	C	.	.			trans	-100.3	148.7	175.6	-177.1	0	0	0	0	112.1	A427 R430 T434	A427-S432 PolarHBondContact O-N 3.26Å; R430-S432 PolarHBondContact NH1-OG 3.18Å; R430-S432 PolarHBondContact O-N 2.88Å; S432-T434 PolarHBondContact OG-N 3.39Å; S432-T434 VanDerWaalsContact OG-N 3.12Å; S432-T434 PolarHBondContact OG-O 3.16Å; S432-T434 PolarHBondContact OG-OG1 2.9Å
433	L	77.3	Confident	86.5	Confident	76 Å²	76	25.2 Å²	25.2	40%	0.398	12%	0.118	S	C	.	.	S	Bend	trans	-96.5	3.7	174.8	-57.6	175.4	0	0	0	112.5	Q368 I370 S371	Q368-L433 HydrophobicContact CB-CD1 4.08Å; Q368-L433 HydrophobicContact CB-CD2 4.22Å; I370-L433 WeakPolarHBondContact CA-O 3.32Å; S371-L433 PolarHBondContact N-O 3.32Å; S371-L433 PolarHBondContact OG-O 3.44Å
434	T	82.9	Confident	86.3	Confident	10 Å²	10	25.3 Å²	25.3	6%	0.061	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	141.8	178.9	57.1	0	0	0	0	109.5	S371 R430 S432 F464	S371-T434 CarbonylContact O-C 3.55Å; S371-T434 WeakPolarHBondContact O-CA 3.06Å; S371-T434 WeakPolarHBondContact OG-CG2 3.41Å; R430-T434 PolarHBondContact NH2-O 3.38Å; S432-T434 PolarHBondContact OG-N 3.39Å; S432-T434 VanDerWaalsContact OG-N 3.12Å; S432-T434 PolarHBondContact OG-O 3.16Å; S432-T434 PolarHBondContact OG-OG1 2.9Å; T434-F464 PolarHBondContact OG1-O 3.13Å
435	V	87.8	Confident	86.3	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	126.6	166.1	-179.9	0	0	0	0	108.3	I370 S371 W372 S373 A376 A423 I424 A427 D439 I440	I370-V435 HydrophobicContact CG2-CG2 3.69Å; S371-V435 PolarHBondContact O-N 3.35Å; W372-V435 HydrophobicContact CD2-CB 4.1Å; W372-V435 HydrophobicContact CD2-CG1 4.31Å; W372-V435 HydrophobicContact CD2-CG2 4.35Å; W372-V435 HydrophobicContact CE3-CB 4.34Å; W372-V435 HydrophobicContact CE3-CG1 4.1Å; W372-V435 HydrophobicContact CG-CB 4.36Å; W372-V435 HydrophobicContact CH2-CG1 4.37Å; W372-V435 HydrophobicContact CZ2-CG2 4.46Å; W372-V435 HydrophobicContact CZ3-CG1 4.16Å; S373-V435 WeakPolarHBondContact CB-O 3.39Å; S373-V435 PolarHBondContact N-O 3.21Å; S373-V435 PolarHBondContact OG-O 3.47Å; A376-V435 HydrophobicContact CB-CG1 4.26Å; A376-V435 WeakPolarHBondContact CB-O 3.35Å; A423-V435 HydrophobicContact CB-CG1 4.06Å; I424-V435 HydrophobicContact CG1-CG2 4.49Å; A427-V435 HydrophobicContact CB-CG2 4Å; V435-D439 WeakPolarHBondContact CA-OD2 3.14Å; V435-D439 HydrophobicContact CG1-CB 3.89Å; V435-I440 HydrophobicContact CG1-CD1 3.98Å; V435-I440 HydrophobicContact CG1-CG1 4.47Å
436	D	87.6	Confident	86.2	Confident	19 Å²	19	26.3 Å²	26.3	10%	0.102	12%	0.121	C	C	.	.			trans	-104.3	175.2	-179	70.6	25.9	0	0	0	112.5	A376 R430 D438 D439 R456	A376-D436 WeakPolarHBondContact CB-O 3.1Å; R430-D436 IonicContact CZ-OD2 2.71Å; R430-D436 IonicContact NH1-OD2 3.76Å; R430-D436 IonicContact NH2-OD2 3.8Å; R430-D436 PolarHBondContact NH2-OD2 3.48Å; D436-D438 PolarHBondContact O-N 3.32Å; D436-D438 WeakPolarHBondContact OD1-CA 3.36Å; D436-D438 WeakPolarHBondContact OD1-CB 3.33Å; D436-D438 PolarHBondContact OD1-N 3.24Å; D436-D439 PolarHBondContact N-OD2 2.98Å; D436-D439 PolarHBondContact O-N 3.32Å; D436-D439 VanDerWaalsContact OD1-CG 3.25Å; D436-D439 PolarHBondContact OD1-N 3.1Å; D436-R456 VanDerWaalsContact CG-NH2 3.27Å; D436-R456 IonicContact OD1-CZ 2.85Å; D436-R456 IonicContact OD1-NH2 2.75Å; D436-R456 PolarHBondContact OD1-NH2 2.85Å; D436-R456 IonicContact OD2-CZ 2.68Å; D436-R456 VanDerWaalsContact OD2-CZ 3.31Å; D436-R456 IonicContact OD2-NH1 3Å; D436-R456 PolarHBondContact OD2-NH1 3.33Å; D436-R456 IonicContact OD2-NH2 3.19Å; D436-R456 PolarHBondContact OD2-NH2 3.32Å
437	S	87.6	Confident	86	Confident	29 Å²	29	25.6 Å²	25.6	20%	0.203	12%	0.118	C	C	.	.	H	α-helix	trans	-65.7	-25.2	-179.4	65.1	0	0	0	0	113.2	T379 R441	T379-S437 WeakPolarHBondContact OG1-CB 3.43Å; S437-R441 WeakPolarHBondContact O-CG 3.25Å; S437-R441 PolarHBondContact O-N 3.2Å; S437-R441 PolarHBondContact O-NH1 2.85Å; S437-R441 PolarHBondContact OG-NH1 3.49Å
438	D	87.3	Confident	85.8	Confident	28 Å²	28	25.8 Å²	25.8	15%	0.15	12%	0.119	C	C	.	.	H	α-helix	trans	-77.5	-39.4	-179.4	-170.8	74.8	0	0	0	111.3	D436 I440 R441 Q442 R456	D436-D438 PolarHBondContact O-N 3.32Å; D436-D438 WeakPolarHBondContact OD1-CA 3.36Å; D436-D438 WeakPolarHBondContact OD1-CB 3.33Å; D436-D438 PolarHBondContact OD1-N 3.24Å; D438-I440 PolarHBondContact O-N 3.47Å; D438-I440 VanDerWaalsContact O-N 3.16Å; D438-R441 VanDerWaalsContact CA-NH2 3.32Å; D438-R441 PolarHBondContact O-N 3Å; D438-R441 IonicContact OD1-CZ 3.82Å; D438-R441 IonicContact OD1-NE 2.87Å; D438-R441 IonicContact OD1-NH2 3.52Å; D438-R441 PolarHBondContact OD1-NH2 2.94Å; D438-Q442 WeakPolarHBondContact O-CG 3.49Å; D438-Q442 PolarHBondContact O-N 2.96Å; D438-R456 VanDerWaalsContact CB-NH2 3.34Å; D438-R456 IonicContact OD2-CZ 3.53Å; D438-R456 IonicContact OD2-NE 2.94Å; D438-R456 PolarHBondContact OD2-NE 3.26Å; D438-R456 IonicContact OD2-NH2 3.79Å; D438-R456 PolarHBondContact OD2-NH2 2.76Å
439	D	90.4	Very high	85.4	Confident	3 Å²	3	24.6 Å²	24.6	2%	0.016	12%	0.118	C	C	.	.	H	α-helix	trans	-52.4	-38.7	171.2	-61	-39.1	0	0	0	110.9	R430 V435 D436 T443 R456	R430-D439 IonicContact CZ-OD2 3.2Å; R430-D439 IonicContact NE-OD1 2.66Å; R430-D439 PolarHBondContact NE-OD1 3.07Å; R430-D439 IonicContact NE-OD2 3.14Å; R430-D439 PolarHBondContact NE-OD2 3.37Å; R430-D439 IonicContact NH2-OD1 2.73Å; R430-D439 IonicContact NH2-OD2 3.67Å; R430-D439 PolarHBondContact NH2-OD2 3.26Å; V435-D439 WeakPolarHBondContact CA-OD2 3.14Å; V435-D439 HydrophobicContact CG1-CB 3.89Å; D436-D439 PolarHBondContact N-OD2 2.98Å; D436-D439 PolarHBondContact O-N 3.32Å; D436-D439 VanDerWaalsContact OD1-CG 3.25Å; D436-D439 PolarHBondContact OD1-N 3.1Å; D439-T443 WeakPolarHBondContact O-CB 3.27Å; D439-T443 PolarHBondContact O-N 2.85Å; D439-T443 PolarHBondContact O-OG1 2.97Å; D439-R456 IonicContact OD1-NH2 2.73Å; D439-R456 PolarHBondContact OD1-NH2 3.18Å; D439-R456 VanDerWaalsContact OD1-NH2 3.12Å
440	I	89.9	Confident	84.6	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-72.3	-39.2	176.6	-53.6	-56.1	0	0	0	112.6	W372 A376 T379 L380 F383 W419 A423 V435 D438 T443 A444	W372-I440 HydrophobicContact CE3-CD1 4.35Å; W372-I440 HydrophobicContact CH2-CD1 3.81Å; W372-I440 HydrophobicContact CZ3-CD1 3.39Å; W372-I440 HydrophobicContact CZ3-CG1 4.37Å; A376-I440 HydrophobicContact CB-CG1 4.03Å; T379-I440 HydrophobicContact CG2-CB 4.01Å; T379-I440 HydrophobicContact CG2-CG2 3.84Å; L380-I440 HydrophobicContact CB-CG2 4.04Å; L380-I440 HydrophobicContact CD1-CG2 4.24Å; F383-I440 HydrophobicContact CD2-CG2 4.09Å; F383-I440 HydrophobicContact CE2-CG2 4.34Å; W419-I440 HydrophobicContact CE3-CG2 4.39Å; W419-I440 HydrophobicContact CZ3-CG2 4.06Å; A423-I440 HydrophobicContact CB-CD1 3.6Å; V435-I440 HydrophobicContact CG1-CD1 3.98Å; V435-I440 HydrophobicContact CG1-CG1 4.47Å; D438-I440 PolarHBondContact O-N 3.47Å; D438-I440 VanDerWaalsContact O-N 3.16Å; I440-T443 WeakPolarHBondContact O-CB 3.35Å; I440-T443 PolarHBondContact O-N 3.4Å; I440-A444 WeakPolarHBondContact O-CB 3.27Å; I440-A444 PolarHBondContact O-N 2.85Å
441	R	88.1	Confident	84.3	Confident	98 Å²	98	29.1 Å²	29.1	37%	0.37	16%	0.161	S	C	.	.	H	α-helix	trans	-65.9	-40.8	175.4	-70.3	-173.3	-61	-88.9	3.6	111.8	T379 S437 D438 T443 A444 R445	T379-R441 HydrophobicContact CG2-CG 4.13Å; S437-R441 WeakPolarHBondContact O-CG 3.25Å; S437-R441 PolarHBondContact O-N 3.2Å; S437-R441 PolarHBondContact O-NH1 2.85Å; S437-R441 PolarHBondContact OG-NH1 3.49Å; D438-R441 VanDerWaalsContact CA-NH2 3.32Å; D438-R441 PolarHBondContact O-N 3Å; D438-R441 IonicContact OD1-CZ 3.82Å; D438-R441 IonicContact OD1-NE 2.87Å; D438-R441 IonicContact OD1-NH2 3.52Å; D438-R441 PolarHBondContact OD1-NH2 2.94Å; R441-T443 VanDerWaalsContact C-N 3.3Å; R441-T443 PolarHBondContact O-N 3.31Å; R441-A444 WeakPolarHBondContact O-CB 3.39Å; R441-A444 PolarHBondContact O-N 2.71Å; R441-R445 PolarHBondContact O-N 3.2Å
442	Q	90	Very high	84.1	Confident	11 Å²	11	30.9 Å²	30.9	5%	0.051	18%	0.177	C	C	.	.	H	α-helix	trans	-63.7	-38.2	173.4	-61.6	-64.5	-15.1	0	0	111.5	Y426 D438 R445 L446 C453 E454	Y426-Q442 HydrophobicContact CD2-CB 4.04Å; Y426-Q442 HydrophobicContact CE1-CB 4.16Å; Y426-Q442 HydrophobicContact CE2-CB 3.61Å; Y426-Q442 HydrophobicContact CG-CB 4.49Å; D438-Q442 WeakPolarHBondContact O-CG 3.49Å; D438-Q442 PolarHBondContact O-N 2.96Å; Q442-R445 PolarHBondContact O-N 3.31Å; Q442-L446 PolarHBondContact O-N 2.83Å; Q442-C453 VanDerWaalsContact CD-SG 3.6Å; Q442-C453 PolarHBondContact NE2-SG 3.46Å; Q442-E454 PolarHBondContact NE2-O 2.87Å
443	T	90.9	Very high	84.3	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.1	-45.1	173.5	-59.2	0	0	0	0	111.3	W419 V422 A423 D439 I440 R441 R445 L446 L447	W419-T443 HydrophobicContact CD2-CG2 4.08Å; W419-T443 HydrophobicContact CE3-CG2 3.4Å; W419-T443 VanDerWaalsContact CE3-CG2 3.4Å; W419-T443 HydrophobicContact CZ3-CG2 3.88Å; V422-T443 HydrophobicContact CB-CG2 3.73Å; V422-T443 HydrophobicContact CG1-CG2 3.67Å; V422-T443 WeakPolarHBondContact CG1-OG1 3.5Å; A423-T443 WeakPolarHBondContact CA-OG1 3.49Å; A423-T443 PolarHBondContact N-OG1 2.84Å; D439-T443 WeakPolarHBondContact O-CB 3.27Å; D439-T443 PolarHBondContact O-N 2.85Å; D439-T443 PolarHBondContact O-OG1 2.97Å; I440-T443 WeakPolarHBondContact O-CB 3.35Å; I440-T443 PolarHBondContact O-N 3.4Å; R441-T443 VanDerWaalsContact C-N 3.3Å; R441-T443 PolarHBondContact O-N 3.31Å; T443-R445 VanDerWaalsContact C-N 3.33Å; T443-R445 PolarHBondContact O-N 3.33Å; T443-L446 PolarHBondContact O-N 3.35Å; T443-L446 VanDerWaalsContact O-N 3.14Å; T443-L447 HydrophobicContact CG2-CD1 3.63Å; T443-L447 HydrophobicContact CG2-CG 4.24Å; T443-L447 WeakPolarHBondContact O-CG 3.33Å; T443-L447 PolarHBondContact O-N 3.48Å
444	A	86.6	Confident	84.4	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.008	19%	0.185	C	C	.	.	H	α-helix	trans	-60.4	-41.9	178.3	0	0	0	0	0	111.9	F383 W419 I440 R441 L446 L447 L448 L451	F383-A444 HydrophobicContact CD1-CB 4.17Å; F383-A444 HydrophobicContact CD2-CB 3.98Å; F383-A444 HydrophobicContact CE1-CB 3.85Å; F383-A444 HydrophobicContact CE2-CB 3.64Å; F383-A444 HydrophobicContact CG-CB 4.24Å; F383-A444 HydrophobicContact CZ-CB 3.58Å; W419-A444 HydrophobicContact CH2-CB 3.56Å; W419-A444 HydrophobicContact CZ3-CB 3.79Å; I440-A444 WeakPolarHBondContact O-CB 3.27Å; I440-A444 PolarHBondContact O-N 2.85Å; R441-A444 WeakPolarHBondContact O-CB 3.39Å; R441-A444 PolarHBondContact O-N 2.71Å; A444-L446 VanDerWaalsContact C-N 3.33Å; A444-L446 PolarHBondContact O-N 3.39Å; A444-L447 PolarHBondContact O-N 2.91Å; A444-L448 HydrophobicContact CB-CD1 4.44Å; A444-L448 VanDerWaalsContact O-CB 3.29Å; A444-L448 WeakPolarHBondContact O-CB 3.43Å; A444-L448 PolarHBondContact O-N 3.2Å; A444-L451 HydrophobicContact CB-CD1 3.84Å
445	R	88.6	Confident	84.5	Confident	37 Å²	37	33.4 Å²	33.4	14%	0.14	19%	0.188	C	C	.	.	H	α-helix	trans	-59	-42	174.2	179.6	-149	57.8	83.1	0.5	112.3	E139 Y426 R441 Q442 T443 L451 C453	E139-R445 IonicContact OE1-CZ 3.93Å; E139-R445 VanDerWaalsContact OE1-CZ 3.23Å; E139-R445 IonicContact OE1-NH1 3.46Å; E139-R445 PolarHBondContact OE1-NH1 3.09Å; E139-R445 IonicContact OE1-NH2 3.09Å; E139-R445 PolarHBondContact OE1-NH2 3.08Å; E139-R445 IonicContact OE2-CZ 3.2Å; E139-R445 IonicContact OE2-NH2 3.01Å; E139-R445 PolarHBondContact OE2-NH2 3.27Å; Y426-R445 PolarHBondContact OH-NH2 2.71Å; R441-R445 PolarHBondContact O-N 3.2Å; Q442-R445 PolarHBondContact O-N 3.31Å; T443-R445 VanDerWaalsContact C-N 3.33Å; T443-R445 PolarHBondContact O-N 3.33Å; R445-L451 WeakPolarHBondContact CG-O 3.49Å; R445-C453 HydrophobicContact CB-CB 4.09Å; R445-C453 HydrophobicContact CG-CB 4.49Å
446	L	88.1	Confident	84.3	Confident	6 Å²	6	35.4 Å²	35.4	3%	0.031	20%	0.196	C	C	.	.	H	α-helix	trans	-71	-42	-179	-177.7	60.1	0	0	0	112.1	E139 L161 L281 V422 Q442 T443 A444	E139-L446 HydrophobicContact CG-CD1 4.36Å; L161-L446 HydrophobicContact CB-CD2 4.15Å; L281-L446 HydrophobicContact CB-CD1 4.07Å; L281-L446 HydrophobicContact CB-CG 4.14Å; L281-L446 WeakPolarHBondContact CB-O 3.47Å; L281-L446 HydrophobicContact CD2-CD1 4.42Å; L281-L446 HydrophobicContact CD2-CD2 4.18Å; L281-L446 HydrophobicContact CD2-CG 4.17Å; L281-L446 PolarHBondContact N-O 3.44Å; V422-L446 HydrophobicContact CG1-CD2 3.91Å; V422-L446 HydrophobicContact CG2-CD2 4.31Å; Q442-L446 PolarHBondContact O-N 2.83Å; T443-L446 PolarHBondContact O-N 3.35Å; T443-L446 VanDerWaalsContact O-N 3.14Å; A444-L446 VanDerWaalsContact C-N 3.33Å; A444-L446 PolarHBondContact O-N 3.39Å
447	L	86.4	Confident	84.1	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-93.2	-24.8	-169.7	-61.4	179.7	0	0	0	114.5	L281 P414 E418 W419 V422 T443 A444	L281-L447 HydrophobicContact CB-CD2 4.48Å; L281-L447 HydrophobicContact CD2-CD2 4.34Å; P414-L447 HydrophobicContact CB-CD1 4.34Å; P414-L447 HydrophobicContact CG-CB 3.98Å; P414-L447 HydrophobicContact CG-CD1 3.99Å; E418-L447 HydrophobicContact CB-CD1 4.41Å; W419-L447 HydrophobicContact CD2-CD1 4.14Å; W419-L447 HydrophobicContact CG-CD1 4.18Å; V422-L447 HydrophobicContact CG2-CD2 4.35Å; T443-L447 HydrophobicContact CG2-CD1 3.63Å; T443-L447 HydrophobicContact CG2-CG 4.24Å; T443-L447 WeakPolarHBondContact O-CG 3.33Å; T443-L447 PolarHBondContact O-N 3.48Å; A444-L447 PolarHBondContact O-N 2.91Å
448	L	81.9	Confident	83.8	Confident	5 Å²	5	38.9 Å²	38.9	3%	0.026	21%	0.209	C	C	.	.	S	Bend	trans	-111.2	142.7	-175.9	-58.8	176.3	0	0	0	111.6	F383 L413 W419 A444 L451	F383-L448 HydrophobicContact CD1-CD1 4Å; L413-L448 HydrophobicContact CD2-CD2 4.27Å; W419-L448 HydrophobicContact CH2-CD1 3.92Å; W419-L448 HydrophobicContact CH2-CG 4.37Å; W419-L448 HydrophobicContact CZ2-CD1 3.84Å; W419-L448 HydrophobicContact CZ2-CD2 4.41Å; W419-L448 HydrophobicContact CZ2-CG 4.08Å; A444-L448 HydrophobicContact CB-CD1 4.44Å; A444-L448 VanDerWaalsContact O-CB 3.29Å; A444-L448 WeakPolarHBondContact O-CB 3.43Å; A444-L448 PolarHBondContact O-N 3.2Å; L448-L451 HydrophobicContact CB-CD1 3.79Å; L448-L451 HydrophobicContact CB-CG 4.27Å; L448-L451 HydrophobicContact CD1-CD1 3.65Å; L448-L451 HydrophobicContact CG-CD1 4.32Å
449	P	77.1	Confident	83.3	Confident	48 Å²	48	42.3 Å²	42.3	31%	0.312	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	141.2	178.1	28.6	-34	0	0	0	112.3	H280 L412 L451	H280-P449 HydrophobicContact CB-CB 4.5Å; L412-P449 HydrophobicContact CD1-CG 4.4Å; P449-L451 VanDerWaalsContact C-N 3.28Å; P449-L451 PolarHBondContact O-N 3.44Å
450	G	68.4	Low	82.4	Confident	72 Å²	72	43.7 Å²	43.7	74%	0.742	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.4	10.3	168.7	0	0	0	0	0	115.7
451	L	76	Confident	81.2	Confident	58 Å²	58	49.4 Å²	49.4	30%	0.304	26%	0.259	S	S	.	.			trans	-95	130.1	170.8	-63.3	-174.8	0	0	0	109.7	F383 A444 R445 L448 P449	F383-L451 HydrophobicContact CD1-CD1 4.28Å; F383-L451 HydrophobicContact CE1-CD1 3.71Å; F383-L451 HydrophobicContact CZ-CD1 4.45Å; A444-L451 HydrophobicContact CB-CD1 3.84Å; R445-L451 WeakPolarHBondContact CG-O 3.49Å; L448-L451 HydrophobicContact CB-CD1 3.79Å; L448-L451 HydrophobicContact CB-CG 4.27Å; L448-L451 HydrophobicContact CD1-CD1 3.65Å; L448-L451 HydrophobicContact CG-CD1 4.32Å; P449-L451 VanDerWaalsContact C-N 3.28Å; P449-L451 PolarHBondContact O-N 3.44Å
452	D	74.3	Confident	79.7	Confident	134 Å²	134	45.9 Å²	45.9	72%	0.717	25%	0.249	S	C	*	.			trans	-114.1	145.2	171.6	-165.8	16.2	0	0	0	110.4
453	C	83.4	Confident	78.1	Confident	18 Å²	18	46.1 Å²	46.1	12%	0.122	25%	0.252	C	S	.	.			trans	-143.9	134	178.1	-175.7	0	0	0	0	106.3	R142 Q442 R445	R142-C453 PolarHBondContact NH2-O 2.8Å; Q442-C453 VanDerWaalsContact CD-SG 3.6Å; Q442-C453 PolarHBondContact NE2-SG 3.46Å; R445-C453 HydrophobicContact CB-CB 4.09Å; R445-C453 HydrophobicContact CG-CB 4.49Å
454	E	79.9	Confident	76.4	Confident	112 Å²	112	50.4 Å²	50.4	52%	0.523	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-70.4	146.8	179.4	-65	-174.8	154.4	0	0	111	Y21 Q442	Y21-E454 PolarHBondContact OH-OE1 3.22Å; Q442-E454 PolarHBondContact NE2-O 2.87Å
455	P	84.1	Confident	75	Confident	20 Å²	20	52.4 Å²	52.4	13%	0.13	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-57	143.3	172.1	-20.7	31.3	0	0	0	111.4	L17 R142 V145 Q457	L17-P455 HydrophobicContact CD1-CG 3.67Å; R142-P455 HydrophobicContact CG-CG 4.49Å; V145-P455 HydrophobicContact CB-CB 4.19Å; V145-P455 HydrophobicContact CG1-CB 4.28Å; V145-P455 HydrophobicContact CG2-CB 4.17Å; V145-P455 HydrophobicContact CG2-CG 4.37Å; P455-Q457 PolarHBondContact O-N 3.22Å
456	R	83.9	Confident	73.5	Confident	43 Å²	43	52.6 Å²	52.6	16%	0.162	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-65.4	128	178.7	-174.9	178	-70.1	-141.1	19.4	110.5	M146 D436 D438 D439	M146-R456 HydrophobicContact CE-CB 4.43Å; M146-R456 HydrophobicContact CE-CG 4.19Å; D436-R456 VanDerWaalsContact CG-NH2 3.27Å; D436-R456 IonicContact OD1-CZ 2.85Å; D436-R456 IonicContact OD1-NH2 2.75Å; D436-R456 PolarHBondContact OD1-NH2 2.85Å; D436-R456 IonicContact OD2-CZ 2.68Å; D436-R456 VanDerWaalsContact OD2-CZ 3.31Å; D436-R456 IonicContact OD2-NH1 3Å; D436-R456 PolarHBondContact OD2-NH1 3.33Å; D436-R456 IonicContact OD2-NH2 3.19Å; D436-R456 PolarHBondContact OD2-NH2 3.32Å; D438-R456 VanDerWaalsContact CB-NH2 3.34Å; D438-R456 IonicContact OD2-CZ 3.53Å; D438-R456 IonicContact OD2-NE 2.94Å; D438-R456 PolarHBondContact OD2-NE 3.26Å; D438-R456 IonicContact OD2-NH2 3.79Å; D438-R456 PolarHBondContact OD2-NH2 2.76Å; D439-R456 IonicContact OD1-NH2 2.73Å; D439-R456 PolarHBondContact OD1-NH2 3.18Å; D439-R456 VanDerWaalsContact OD1-NH2 3.12Å
457	Q	82.5	Confident	72	Confident	88 Å²	88	56.7 Å²	56.7	41%	0.411	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-89.7	152.7	173.6	-65.8	177.5	-9.8	0	0	111.2	P455 K459	P455-Q457 PolarHBondContact O-N 3.22Å; Q457-K459 HydrophobicContact CB-CG 4.47Å; Q457-K459 PolarHBondContact O-N 3.29Å; Q457-K459 VanDerWaalsContact O-N 3.09Å
458	L	81.9	Confident	70.6	Confident	32 Å²	32	65.8 Å²	65.8	17%	0.168	34%	0.343	C	S	.	.			trans	-68.7	104.9	174.2	-174.5	65.8	0	0	0	109.9	M146 M516 Y521 A524	M146-L458 HydrophobicContact CG-CB 4.1Å; M146-L458 HydrophobicContact CG-CD1 4.21Å; M146-L458 HydrophobicContact SD-CD1 4.44Å; L458-M516 HydrophobicContact CD2-CE 4.14Å; L458-Y521 HydrophobicContact CD1-CE1 4.13Å; L458-Y521 HydrophobicContact CG-CD1 4.18Å; L458-Y521 HydrophobicContact CG-CE1 3.97Å; L458-A524 HydrophobicContact CD2-CB 3.86Å
459	K	77.3	Confident	69.5	Low	101 Å²	101	73.5 Å²	73.5	44%	0.439	37%	0.372	S	S	.	.			trans	-134.7	151.7	179.6	-69.4	-179.3	-178.1	173	0	111.4	Q457 E461 C462	Q457-K459 HydrophobicContact CB-CG 4.47Å; Q457-K459 PolarHBondContact O-N 3.29Å; Q457-K459 VanDerWaalsContact O-N 3.09Å; K459-E461 PolarHBondContact O-N 3.35Å; K459-E461 VanDerWaalsContact O-N 3.14Å; K459-C462 VanDerWaalsContact O-CB 3.25Å; K459-C462 WeakPolarHBondContact O-CB 3.23Å; K459-C462 PolarHBondContact O-N 3.3Å; K459-C462 PolarHBondContact O-SG 3.32Å
460	P	70.2	Confident	69.2	Low	31 Å²	31	74.5 Å²	74.5	20%	0.201	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-58.2	-27.2	176.5	-30.6	41.9	0	0	0	113.9	C462 F485 N489 Y521	P460-C462 PolarHBondContact O-N 2.67Å; P460-F485 HydrophobicContact CB-CD1 4.35Å; P460-N489 WeakPolarHBondContact CB-ND2 3.43Å; P460-N489 WeakPolarHBondContact CG-ND2 3.47Å; P460-Y521 HydrophobicContact CB-CD2 4.46Å; P460-Y521 HydrophobicContact CB-CE2 4.31Å; P460-Y521 HydrophobicContact CG-CD1 3.82Å; P460-Y521 HydrophobicContact CG-CD2 3.63Å; P460-Y521 HydrophobicContact CG-CE1 4.12Å; P460-Y521 HydrophobicContact CG-CE2 3.92Å; P460-Y521 HydrophobicContact CG-CG 3.56Å
461	E	64.7	Low	69.7	Low	121 Å²	121	75.9 Å²	75.9	57%	0.565	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-72.2	-5.3	178.5	-57.8	178	176.2	0	0	113.8	K459 C463 F464	K459-E461 PolarHBondContact O-N 3.35Å; K459-E461 VanDerWaalsContact O-N 3.14Å; E461-C463 PolarHBondContact O-N 2.91Å; E461-F464 WeakPolarHBondContact O-CD2 3.44Å; E461-F464 WeakPolarHBondContact O-CE2 3.45Å
462	C	57.7	Low	70.1	Confident	24 Å²	24	77 Å²	77	16%	0.162	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-73.9	-6.8	-178.5	-64.5	0	0	0	0	113.9	R430 K459 P460	R430-C462 PolarHBondContact NH1-O 3.35Å; K459-C462 VanDerWaalsContact O-CB 3.25Å; K459-C462 WeakPolarHBondContact O-CB 3.23Å; K459-C462 PolarHBondContact O-N 3.3Å; K459-C462 PolarHBondContact O-SG 3.32Å; P460-C462 PolarHBondContact O-N 2.67Å
463	C	55.3	Low	70.6	Confident	16 Å²	16	77.3 Å²	77.3	11%	0.108	38%	0.377	C	S	.	.			trans	-117.5	72	-169	-58.9	0	0	0	0	112.4	E461 Q514	E461-C463 PolarHBondContact O-N 2.91Å; C463-Q514 WeakPolarHBondContact SG-CG 3.33Å
464	F	57.1	Low	70.5	Confident	90 Å²	90	77.8 Å²	77.8	40%	0.395	38%	0.383	S	S	.	.			trans	-91.7	105	167.8	-69.4	-76.9	0	0	0	110.4	T434 E461	T434-F464 PolarHBondContact OG1-O 3.13Å; E461-F464 WeakPolarHBondContact O-CD2 3.44Å; E461-F464 WeakPolarHBondContact O-CE2 3.45Å
465	S	56.8	Low	70.6	Confident	43 Å²	43	73.5 Å²	73.5	30%	0.301	37%	0.366	S	S	.	.			trans	-82.6	137.2	158.1	29.2	0	0	0	0	110.3	F467 K478 D513	S465-F467 PolarHBondContact O-N 2.89Å; S465-K478 WeakPolarHBondContact OG-CE 3.4Å; S465-K478 PolarHBondContact OG-NZ 3.15Å; S465-D513 PolarHBondContact OG-OD2 2.99Å
466	S	55.6	Low	70.6	Confident	40 Å²	40	76.1 Å²	76.1	28%	0.28	38%	0.382	S	S	.	.			trans	-66	121.6	-176	-175	0	0	0	0	110.9	R468	S466-R468 PolarHBondContact O-N 2.73Å; S466-R468 PolarHBondContact OG-N 2.8Å
467	F	58.6	Low	70.5	Confident	93 Å²	93	79 Å²	79	41%	0.408	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-60.3	-14.3	172.3	-65	-77.4	0	0	0	113.6	S465 R469 L470 A475 K478	S465-F467 PolarHBondContact O-N 2.89Å; F467-R469 PolarHBondContact O-N 2.84Å; F467-L470 HydrophobicContact CD1-CD1 4.44Å; F467-L470 PolarHBondContact O-N 2.71Å; F467-A475 HydrophobicContact CD1-CB 4.11Å; F467-K478 HydrophobicContact CE1-CB 4.49Å; F467-K478 HydrophobicContact CE1-CD 4.37Å
468	R	55.1	Low	70.4	Confident	193 Å²	193	75.7 Å²	75.7	73%	0.728	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-63.5	-11.3	-173.2	-66.1	-170.5	-175.1	-163.6	3.4	114.6	S466	S466-R468 PolarHBondContact O-N 2.73Å; S466-R468 PolarHBondContact OG-N 2.8Å
469	R	60.2	Low	70.5	Confident	166 Å²	166	80 Å²	80	63%	0.626	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-127.9	4.6	-176.4	-65.4	-174.4	175.8	178.6	-2.1	114.5	F467	F467-R469 PolarHBondContact O-N 2.84Å
470	L	69.1	Low	71	Confident	70 Å²	70	79.5 Å²	79.5	37%	0.366	40%	0.398	S	S	.	.	S	Bend	trans	-91.1	147.1	177.1	-65.3	173.2	0	0	0	110	F467 A474 A475 K478	F467-L470 HydrophobicContact CD1-CD1 4.44Å; F467-L470 PolarHBondContact O-N 2.71Å; L470-A474 HydrophobicContact CB-CB 4.41Å; L470-A474 HydrophobicContact CD2-CB 4.26Å; L470-A475 HydrophobicContact CB-CB 4.21Å; L470-K478 HydrophobicContact CD1-CD 3.85Å
471	D	80.2	Confident	71.8	Confident	100 Å²	100	80.1 Å²	80.1	54%	0.535	40%	0.398	S	S	.	.			trans	-69.4	160.7	167.6	69.6	-27.3	0	0	0	110	K473 A474 A475	D471-K473 PolarHBondContact O-N 2.83Å; D471-K473 VanDerWaalsContact O-N 3.11Å; D471-A474 PolarHBondContact O-N 2.9Å; D471-A474 WeakPolarHBondContact OD1-CB 3.33Å; D471-A474 PolarHBondContact OD1-N 3.21Å; D471-A475 WeakPolarHBondContact O-CB 3.22Å; D471-A475 PolarHBondContact O-N 3.17Å
472	A	83.8	Confident	72.7	Confident	83 Å²	83	76.2 Å²	76.2	69%	0.686	38%	0.381	S	S	*	.	H	α-helix	trans	-58.2	-31.1	-175.2	0	0	0	0	0	112.7	T476	A472-T476 PolarHBondContact O-N 3.43Å; A472-T476 VanDerWaalsContact O-N 3.15Å; A472-T476 PolarHBondContact O-OG1 2.92Å
473	K	86.1	Confident	74.1	Confident	140 Å²	140	78.2 Å²	78.2	61%	0.609	39%	0.39	S	S	*	.	H	α-helix	trans	-70.6	-54.2	177.1	-172.8	179.2	170.6	-174.6	0	111.4	D471 A475 T476 E477	D471-K473 PolarHBondContact O-N 2.83Å; D471-K473 VanDerWaalsContact O-N 3.11Å; K473-A475 VanDerWaalsContact C-N 3.26Å; K473-A475 PolarHBondContact O-N 3.22Å; K473-T476 PolarHBondContact O-N 3.14Å; K473-T476 VanDerWaalsContact O-N 3.1Å; K473-E477 WeakPolarHBondContact CE-OE1 3.31Å; K473-E477 IonicContact NZ-OE1 3.04Å; K473-E477 PolarHBondContact O-N 3.34Å
474	A	80.7	Confident	75.7	Confident	28 Å²	28	77.5 Å²	77.5	23%	0.231	39%	0.385	C	S	.	.	H	α-helix	trans	-65	-31.8	178.2	0	0	0	0	0	112.3	L470 D471 T476 K478	L470-A474 HydrophobicContact CB-CB 4.41Å; L470-A474 HydrophobicContact CD2-CB 4.26Å; D471-A474 PolarHBondContact O-N 2.9Å; D471-A474 WeakPolarHBondContact OD1-CB 3.33Å; D471-A474 PolarHBondContact OD1-N 3.21Å; A474-T476 VanDerWaalsContact C-N 3.33Å; A474-T476 PolarHBondContact O-N 3.19Å; A474-K478 WeakPolarHBondContact O-CB 3.26Å; A474-K478 PolarHBondContact O-N 3.47Å
475	A	81.3	Confident	77.1	Confident	22 Å²	22	73.7 Å²	73.7	18%	0.182	37%	0.369	C	S	.	.	H	α-helix	trans	-63.1	-39	173.3	0	0	0	0	0	112.2	F467 L470 D471 K473 F479	F467-A475 HydrophobicContact CD1-CB 4.11Å; L470-A475 HydrophobicContact CB-CB 4.21Å; D471-A475 WeakPolarHBondContact O-CB 3.22Å; D471-A475 PolarHBondContact O-N 3.17Å; K473-A475 VanDerWaalsContact C-N 3.26Å; K473-A475 PolarHBondContact O-N 3.22Å; A475-F479 VanDerWaalsContact O-CB 3.31Å; A475-F479 WeakPolarHBondContact O-CB 3.46Å; A475-F479 PolarHBondContact O-N 3.25Å
476	T	84.1	Confident	78.6	Confident	75 Å²	75	77.6 Å²	77.6	46%	0.46	38%	0.377	S	S	.	.	H	α-helix	trans	-71	-45.8	177.4	-55.3	0	0	0	0	111.4	A472 K473 A474 K478 F479 Q480	A472-T476 PolarHBondContact O-N 3.43Å; A472-T476 VanDerWaalsContact O-N 3.15Å; A472-T476 PolarHBondContact O-OG1 2.92Å; K473-T476 PolarHBondContact O-N 3.14Å; K473-T476 VanDerWaalsContact O-N 3.1Å; A474-T476 VanDerWaalsContact C-N 3.33Å; A474-T476 PolarHBondContact O-N 3.19Å; T476-K478 VanDerWaalsContact C-N 3.32Å; T476-K478 PolarHBondContact O-N 3.47Å; T476-F479 PolarHBondContact O-N 3.1Å; T476-Q480 WeakPolarHBondContact O-CG 3.43Å; T476-Q480 PolarHBondContact O-N 3.27Å
477	E	82.5	Confident	80.1	Confident	102 Å²	102	77.6 Å²	77.6	48%	0.477	37%	0.373	S	S	.	.	H	α-helix	trans	-59.4	-44.1	176.3	-71.2	172.9	177.7	0	0	110.9	K473 Q480 Q481	K473-E477 WeakPolarHBondContact CE-OE1 3.31Å; K473-E477 IonicContact NZ-OE1 3.04Å; K473-E477 PolarHBondContact O-N 3.34Å; E477-Q480 PolarHBondContact O-N 3.08Å; E477-Q481 WeakPolarHBondContact O-CB 3.49Å; E477-Q481 PolarHBondContact O-N 3.45Å
478	K	80.4	Confident	81.5	Confident	19 Å²	19	73.3 Å²	73.3	8%	0.083	35%	0.354	C	S	.	.	H	α-helix	trans	-64.3	-42.8	176	-168.6	178.6	-166.7	87.6	0	112.6	S465 F467 L470 A474 T476 Q480 Q481 D482 D513	S465-K478 WeakPolarHBondContact OG-CE 3.4Å; S465-K478 PolarHBondContact OG-NZ 3.15Å; F467-K478 HydrophobicContact CE1-CB 4.49Å; F467-K478 HydrophobicContact CE1-CD 4.37Å; L470-K478 HydrophobicContact CD1-CD 3.85Å; A474-K478 WeakPolarHBondContact O-CB 3.26Å; A474-K478 PolarHBondContact O-N 3.47Å; T476-K478 VanDerWaalsContact C-N 3.32Å; T476-K478 PolarHBondContact O-N 3.47Å; K478-Q480 VanDerWaalsContact C-N 3.31Å; K478-Q480 PolarHBondContact O-N 3.48Å; K478-Q481 WeakPolarHBondContact O-CB 3.43Å; K478-Q481 PolarHBondContact O-N 3.44Å; K478-D482 PolarHBondContact O-N 3.35Å; K478-D513 IonicContact NZ-OD1 2.61Å; K478-D513 PolarHBondContact NZ-OD1 3.34Å; K478-D513 IonicContact NZ-OD2 3.56Å; K478-D513 PolarHBondContact NZ-OD2 2.91Å
479	F	84.7	Confident	82.8	Confident	123 Å²	123	66.7 Å²	66.7	54%	0.539	33%	0.333	S	S	.	.	H	α-helix	trans	-61.4	-41.1	176	176.9	-94.2	0	0	0	111.9	A475 T476 D482 L483	A475-F479 VanDerWaalsContact O-CB 3.31Å; A475-F479 WeakPolarHBondContact O-CB 3.46Å; A475-F479 PolarHBondContact O-N 3.25Å; T476-F479 PolarHBondContact O-N 3.1Å; F479-D482 PolarHBondContact O-N 3.41Å; F479-L483 HydrophobicContact CE1-CD2 4.47Å; F479-L483 VanDerWaalsContact O-CB 3.29Å; F479-L483 WeakPolarHBondContact O-CB 3.4Å; F479-L483 PolarHBondContact O-N 3.14Å
480	Q	87.5	Confident	83.9	Confident	91 Å²	91	62.1 Å²	62.1	43%	0.425	33%	0.326	S	S	.	.	H	α-helix	trans	-64.9	-41	175.7	-73.7	175.6	-24.6	0	0	111.9	T476 E477 K478 L483 G484	T476-Q480 WeakPolarHBondContact O-CG 3.43Å; T476-Q480 PolarHBondContact O-N 3.27Å; E477-Q480 PolarHBondContact O-N 3.08Å; K478-Q480 VanDerWaalsContact C-N 3.31Å; K478-Q480 PolarHBondContact O-N 3.48Å; Q480-L483 PolarHBondContact O-N 3.37Å; Q480-G484 PolarHBondContact O-N 3.2Å
481	Q	85.9	Confident	84.5	Confident	43 Å²	43	60.7 Å²	60.7	20%	0.201	33%	0.328	C	S	.	.	H	α-helix	trans	-60.1	-52.7	173.4	-173	-178.2	21.7	0	0	111.4	E477 K478 L483 G484 F485 L503 T510 M511	E477-Q481 WeakPolarHBondContact O-CB 3.49Å; E477-Q481 PolarHBondContact O-N 3.45Å; K478-Q481 WeakPolarHBondContact O-CB 3.43Å; K478-Q481 PolarHBondContact O-N 3.44Å; Q481-L483 VanDerWaalsContact C-N 3.27Å; Q481-L483 PolarHBondContact O-N 2.92Å; Q481-G484 PolarHBondContact O-N 3.36Å; Q481-G484 VanDerWaalsContact O-N 3.14Å; Q481-F485 HydrophobicContact CG-CD2 4.03Å; Q481-F485 HydrophobicContact CG-CE2 4Å; Q481-F485 WeakPolarHBondContact O-CD2 3.36Å; Q481-F485 PolarHBondContact O-N 2.91Å; Q481-L503 HydrophobicContact CG-CD2 4.35Å; Q481-T510 HydrophobicContact CG-CG2 4.41Å; Q481-M511 PolarHBondContact NE2-O 2.8Å
482	D	85	Confident	84.7	Confident	39 Å²	39	63 Å²	63	21%	0.209	33%	0.329	C	S	.	.	H	α-helix	trans	-57.7	-40.7	178	-73.6	-8.5	0	0	0	111.6	K478 F479 R486	K478-D482 PolarHBondContact O-N 3.35Å; F479-D482 PolarHBondContact O-N 3.41Å; D482-R486 WeakPolarHBondContact O-CG 3.4Å; D482-R486 PolarHBondContact O-N 3.01Å
483	L	87.3	Confident	84.9	Confident	67 Å²	67	63.2 Å²	63.2	35%	0.351	32%	0.322	S	S	.	.	H	α-helix	trans	-64.6	-47.3	176.2	-180	63.5	0	0	0	111.5	F479 Q480 Q481 R486 M487	F479-L483 HydrophobicContact CE1-CD2 4.47Å; F479-L483 VanDerWaalsContact O-CB 3.29Å; F479-L483 WeakPolarHBondContact O-CB 3.4Å; F479-L483 PolarHBondContact O-N 3.14Å; Q480-L483 PolarHBondContact O-N 3.37Å; Q481-L483 VanDerWaalsContact C-N 3.27Å; Q481-L483 PolarHBondContact O-N 2.92Å; L483-R486 PolarHBondContact O-N 3.49Å; L483-M487 HydrophobicContact CD1-CE 4.04Å; L483-M487 HydrophobicContact CD2-CE 4.05Å; L483-M487 HydrophobicContact CG-CE 3.89Å; L483-M487 HydrophobicContact CG-SD 4.35Å; L483-M487 WeakPolarHBondContact O-CG 3.48Å; L483-M487 PolarHBondContact O-N 3.08Å
484	G	88.2	Confident	85	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-59.8	-44.6	177.9	0	0	0	0	0	112.4	Q480 Q481 R486 M487 L488	Q480-G484 PolarHBondContact O-N 3.2Å; Q481-G484 PolarHBondContact O-N 3.36Å; Q481-G484 VanDerWaalsContact O-N 3.14Å; G484-R486 PolarHBondContact O-N 3.37Å; G484-M487 PolarHBondContact O-N 2.88Å; G484-L488 PolarHBondContact O-N 3.22Å
485	F	87.3	Confident	85.4	Confident	10 Å²	10	62.7 Å²	62.7	4%	0.044	32%	0.322	C	S	.	.	H	α-helix	trans	-59.5	-47.2	173	-90.7	-100.4	0	0	0	111.5	P460 Q481 M487 L488 N489 L503 T510 D512 P518 Y521	P460-F485 HydrophobicContact CB-CD1 4.35Å; Q481-F485 HydrophobicContact CG-CD2 4.03Å; Q481-F485 HydrophobicContact CG-CE2 4Å; Q481-F485 WeakPolarHBondContact O-CD2 3.36Å; Q481-F485 PolarHBondContact O-N 2.91Å; F485-M487 VanDerWaalsContact C-N 3.31Å; F485-M487 PolarHBondContact O-N 3.05Å; F485-L488 PolarHBondContact O-N 3.08Å; F485-N489 WeakPolarHBondContact O-CB 3.41Å; F485-N489 PolarHBondContact O-N 2.9Å; F485-N489 PolarHBondContact O-ND2 3.38Å; F485-L503 HydrophobicContact CD2-CD2 3.7Å; F485-L503 HydrophobicContact CE2-CD2 3.93Å; F485-T510 HydrophobicContact CE2-CG2 4.2Å; F485-T510 VanDerWaalsContact CZ-O 3.3Å; F485-T510 WeakPolarHBondContact CZ-O 3.42Å; F485-D512 HydrophobicContact CE1-CB 4.08Å; F485-D512 HydrophobicContact CE2-CB 4.43Å; F485-D512 HydrophobicContact CZ-CB 3.87Å; F485-P518 HydrophobicContact CD1-CG 4.1Å; F485-P518 HydrophobicContact CE1-CG 3.79Å; F485-P518 HydrophobicContact CZ-CG 4.14Å; F485-Y521 HydrophobicContact CE1-CE2 4.37Å
486	R	86.5	Confident	85.7	Confident	126 Å²	126	62.8 Å²	62.8	48%	0.475	32%	0.319	S	S	.	.	H	α-helix	trans	-61.1	-37.9	176.5	-73.8	-180	-167.4	-160.1	3.5	112.7	D482 L483 G484 N489 C490	D482-R486 WeakPolarHBondContact O-CG 3.4Å; D482-R486 PolarHBondContact O-N 3.01Å; L483-R486 PolarHBondContact O-N 3.49Å; G484-R486 PolarHBondContact O-N 3.37Å; R486-N489 PolarHBondContact O-N 2.96Å; R486-C490 PolarHBondContact O-N 3.06Å; R486-C490 PolarHBondContact O-SG 3.36Å
487	M	88.6	Confident	85.8	Confident	40 Å²	40	64.7 Å²	64.7	20%	0.197	33%	0.327	C	S	.	.	H	α-helix	trans	-62.9	-44.8	176.3	-74.4	177.1	170.5	0	0	111.7	L483 G484 F485 C490 L495 Q498 A499	L483-M487 HydrophobicContact CD1-CE 4.04Å; L483-M487 HydrophobicContact CD2-CE 4.05Å; L483-M487 HydrophobicContact CG-CE 3.89Å; L483-M487 HydrophobicContact CG-SD 4.35Å; L483-M487 WeakPolarHBondContact O-CG 3.48Å; L483-M487 PolarHBondContact O-N 3.08Å; G484-M487 PolarHBondContact O-N 2.88Å; F485-M487 VanDerWaalsContact C-N 3.31Å; F485-M487 PolarHBondContact O-N 3.05Å; M487-C490 WeakPolarHBondContact O-CB 3.29Å; M487-C490 PolarHBondContact O-N 3.35Å; M487-L495 HydrophobicContact CB-CB 4.42Å; M487-Q498 HydrophobicContact SD-CB 4.36Å; M487-A499 HydrophobicContact CB-CB 3.8Å; M487-A499 HydrophobicContact SD-CB 4.39Å
488	L	86.5	Confident	86.2	Confident	2 Å²	2	65 Å²	65	1%	0.01	33%	0.328	C	S	.	.	H	α-helix	trans	-64.8	-44.8	175.8	-66.8	177.3	0	0	0	111.5	G484 F485 C490 G491 A499 L503 V508 P518 L534	G484-L488 PolarHBondContact O-N 3.22Å; F485-L488 PolarHBondContact O-N 3.08Å; L488-C490 PolarHBondContact O-N 2.66Å; L488-C490 VanDerWaalsContact O-N 3.09Å; L488-G491 PolarHBondContact O-N 3.49Å; L488-G491 VanDerWaalsContact O-N 3.1Å; L488-A499 HydrophobicContact CD2-CB 3.69Å; L488-A499 HydrophobicContact CG-CB 3.76Å; L488-L503 HydrophobicContact CD1-CD1 3.53Å; L488-L503 HydrophobicContact CG-CD1 4.34Å; L488-V508 HydrophobicContact CD1-CG1 4.4Å; L488-V508 HydrophobicContact CD2-CG1 4.39Å; L488-P518 HydrophobicContact CB-CB 4.46Å; L488-P518 HydrophobicContact CD1-CB 3.91Å; L488-P518 HydrophobicContact CD1-CG 3.55Å; L488-L534 HydrophobicContact CD1-CD2 4.47Å; L488-L534 HydrophobicContact CD2-CD2 4.33Å
489	N	83.4	Confident	86.5	Confident	55 Å²	55	64 Å²	64	29%	0.294	32%	0.324	S	S	.	.	H	α-helix	trans	-66.2	-12.4	179.4	-66	-39.2	0	0	0	114.4	P460 F485 R486 G491 M530	P460-N489 WeakPolarHBondContact CB-ND2 3.43Å; P460-N489 WeakPolarHBondContact CG-ND2 3.47Å; F485-N489 WeakPolarHBondContact O-CB 3.41Å; F485-N489 PolarHBondContact O-N 2.9Å; F485-N489 PolarHBondContact O-ND2 3.38Å; R486-N489 PolarHBondContact O-N 2.96Å; N489-G491 PolarHBondContact O-N 3.22Å; N489-M530 WeakPolarHBondContact O-CE 3.39Å
490	C	83.6	Confident	86.7	Confident	70 Å²	70	60.6 Å²	60.6	47%	0.473	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-12.5	173.4	-72.8	0	0	0	0	113.2	R486 M487 L488 R492	R486-C490 PolarHBondContact O-N 3.06Å; R486-C490 PolarHBondContact O-SG 3.36Å; M487-C490 WeakPolarHBondContact O-CB 3.29Å; M487-C490 PolarHBondContact O-N 3.35Å; L488-C490 PolarHBondContact O-N 2.66Å; L488-C490 VanDerWaalsContact O-N 3.09Å; C490-R492 PolarHBondContact O-N 2.85Å
491	G	80.6	Confident	86.7	Confident	39 Å²	39	62.7 Å²	62.7	40%	0.402	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	13.9	179.4	0	0	0	0	0	114.2	L488 N489	L488-G491 PolarHBondContact O-N 3.49Å; L488-G491 VanDerWaalsContact O-N 3.1Å; N489-G491 PolarHBondContact O-N 3.22Å
492	R	85.8	Confident	86.8	Confident	148 Å²	148	61.8 Å²	61.8	56%	0.558	33%	0.325	S	S	*	.			trans	-95.1	115.8	-179.5	-74.2	-170.3	-81.7	170.1	-5.2	110.4	C490 D494 L495	C490-R492 PolarHBondContact O-N 2.85Å; R492-D494 PolarHBondContact O-N 2.85Å; R492-L495 HydrophobicContact CB-CD1 4.2Å; R492-L495 HydrophobicContact CB-CG 4.24Å; R492-L495 PolarHBondContact O-N 3.1Å
493	T	86.6	Confident	86.8	Confident	88 Å²	88	60.8 Å²	60.8	54%	0.54	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-60	-31.6	-180	51.5	0	0	0	0	113.4	L495 I496 M533	T493-L495 PolarHBondContact O-N 3.09Å; T493-I496 HydrophobicContact CG2-CD1 4.42Å; T493-I496 WeakPolarHBondContact O-CB 3.37Å; T493-I496 WeakPolarHBondContact O-CD1 3.4Å; T493-I496 VanDerWaalsContact O-CG1 3.27Å; T493-I496 WeakPolarHBondContact O-CG1 3.35Å; T493-I496 PolarHBondContact O-N 3.15Å; T493-M533 HydrophobicContact CG2-CG 3.94Å
494	D	88.1	Confident	86.7	Confident	132 Å²	132	59.1 Å²	59.1	71%	0.706	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-66.2	-23.8	-178.5	-54.3	-29.1	0	0	0	113.1	R492	R492-D494 PolarHBondContact O-N 2.85Å
495	L	89	Confident	86.3	Confident	26 Å²	26	65.4 Å²	65.4	14%	0.136	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-90.5	-6.9	-177.7	-62.5	-178.8	0	0	0	113	M487 R492 T493 N497 Q498 A499	M487-L495 HydrophobicContact CB-CB 4.42Å; R492-L495 HydrophobicContact CB-CD1 4.2Å; R492-L495 HydrophobicContact CB-CG 4.24Å; R492-L495 PolarHBondContact O-N 3.1Å; T493-L495 PolarHBondContact O-N 3.09Å; L495-N497 PolarHBondContact O-N 3.04Å; L495-Q498 PolarHBondContact O-N 3.24Å; L495-A499 WeakPolarHBondContact O-CB 3.44Å; L495-A499 PolarHBondContact O-N 2.86Å
496	I	87.6	Confident	86	Confident	23 Å²	23	69.9 Å²	69.9	12%	0.118	38%	0.384	C	S	.	.	H	α-helix	trans	-58.5	-49.3	-175.4	-63.6	168.2	0	0	0	111	T493 Q498 A499 I500 M533 A537	T493-I496 HydrophobicContact CG2-CD1 4.42Å; T493-I496 WeakPolarHBondContact O-CB 3.37Å; T493-I496 WeakPolarHBondContact O-CD1 3.4Å; T493-I496 VanDerWaalsContact O-CG1 3.27Å; T493-I496 WeakPolarHBondContact O-CG1 3.35Å; T493-I496 PolarHBondContact O-N 3.15Å; I496-Q498 VanDerWaalsContact C-N 3.33Å; I496-Q498 PolarHBondContact O-N 2.75Å; I496-A499 WeakPolarHBondContact O-CB 3.4Å; I496-A499 PolarHBondContact O-N 3.33Å; I496-A499 VanDerWaalsContact O-N 3.15Å; I496-I500 HydrophobicContact CG2-CD1 3.74Å; I496-I500 HydrophobicContact CG2-CG1 4.35Å; I496-I500 WeakPolarHBondContact O-CG1 3.32Å; I496-I500 PolarHBondContact O-N 2.76Å; I496-M533 HydrophobicContact CD1-CG 3.57Å; I496-M533 HydrophobicContact CD1-SD 3.31Å; I496-M533 WeakPolarHBondContact CD1-SD 3.28Å; I496-M533 HydrophobicContact CG1-CG 4.38Å; I496-M533 HydrophobicContact CG1-SD 3.59Å; I496-M533 VanDerWaalsContact CG1-SD 3.59Å; I496-A537 HydrophobicContact CG2-CB 3.9Å
497	N	87.3	Confident	86	Confident	116 Å²	116	64.2 Å²	64.2	62%	0.62	36%	0.364	S	S	*	.	H	α-helix	trans	-63.1	-40.5	-178.9	-66.7	-34.1	0	0	0	111.7	L495 A499 I500 D501	L495-N497 PolarHBondContact O-N 3.04Å; N497-A499 VanDerWaalsContact C-N 3.31Å; N497-A499 PolarHBondContact O-N 3.46Å; N497-I500 PolarHBondContact O-N 3.03Å; N497-D501 VanDerWaalsContact O-CG 3.29Å; N497-D501 PolarHBondContact O-N 2.89Å
498	Q	89.6	Confident	86	Confident	107 Å²	107	62.6 Å²	62.6	50%	0.5	36%	0.356	S	S	.	.	H	α-helix	trans	-66.9	-35.1	176.4	-63.1	177	19	0	0	111.8	M487 L495 I496 A502	M487-Q498 HydrophobicContact SD-CB 4.36Å; L495-Q498 PolarHBondContact O-N 3.24Å; I496-Q498 VanDerWaalsContact C-N 3.33Å; I496-Q498 PolarHBondContact O-N 2.75Å; Q498-A502 WeakPolarHBondContact O-CB 3.23Å; Q498-A502 PolarHBondContact O-N 2.73Å; Q498-A502 VanDerWaalsContact O-N 3.09Å
499	A	88.2	Confident	86.2	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-69.2	-42	175.5	0	0	0	0	0	111.5	M487 L488 L495 I496 N497 D501 A502 L503	M487-A499 HydrophobicContact CB-CB 3.8Å; M487-A499 HydrophobicContact SD-CB 4.39Å; L488-A499 HydrophobicContact CD2-CB 3.69Å; L488-A499 HydrophobicContact CG-CB 3.76Å; L495-A499 WeakPolarHBondContact O-CB 3.44Å; L495-A499 PolarHBondContact O-N 2.86Å; I496-A499 WeakPolarHBondContact O-CB 3.4Å; I496-A499 PolarHBondContact O-N 3.33Å; I496-A499 VanDerWaalsContact O-N 3.15Å; N497-A499 VanDerWaalsContact C-N 3.31Å; N497-A499 PolarHBondContact O-N 3.46Å; A499-D501 VanDerWaalsContact C-N 3.34Å; A499-D501 PolarHBondContact O-N 2.95Å; A499-A502 PolarHBondContact O-N 3.25Å; A499-L503 VanDerWaalsContact O-CB 3.31Å; A499-L503 WeakPolarHBondContact O-CB 3.14Å; A499-L503 WeakPolarHBondContact O-CD1 3.43Å; A499-L503 WeakPolarHBondContact O-CG 3.49Å; A499-L503 PolarHBondContact O-N 3.25Å
500	I	88.4	Confident	86.4	Confident	50 Å²	50	62.7 Å²	62.7	26%	0.256	36%	0.357	S	S	.	.	H	α-helix	trans	-60.7	-45	175	-68.6	167.5	0	0	0	110.2	I496 N497 A502 L503 G504 V508	I496-I500 HydrophobicContact CG2-CD1 3.74Å; I496-I500 HydrophobicContact CG2-CG1 4.35Å; I496-I500 WeakPolarHBondContact O-CG1 3.32Å; I496-I500 PolarHBondContact O-N 2.76Å; N497-I500 PolarHBondContact O-N 3.03Å; I500-A502 VanDerWaalsContact C-N 3.27Å; I500-A502 PolarHBondContact O-N 3.43Å; I500-L503 PolarHBondContact O-N 2.92Å; I500-G504 PolarHBondContact O-N 3.48Å; I500-V508 HydrophobicContact CD1-CG1 4.21Å; I500-V508 HydrophobicContact CG1-CG1 4.02Å
501	D	87.7	Confident	86.6	Confident	135 Å²	135	61.3 Å²	61.3	72%	0.722	35%	0.345	S	S	*	.	H	α-helix	trans	-59.9	-37.3	176.1	-70.5	-22.9	0	0	0	112.2	N497 A499	N497-D501 VanDerWaalsContact O-CG 3.29Å; N497-D501 PolarHBondContact O-N 2.89Å; A499-D501 VanDerWaalsContact C-N 3.34Å; A499-D501 PolarHBondContact O-N 2.95Å
502	A	87.8	Confident	86.8	Confident	25 Å²	25	60.1 Å²	60.1	21%	0.207	33%	0.329	C	S	.	.	H	α-helix	trans	-76.1	-31.4	177.2	0	0	0	0	0	113.7	Q498 A499 I500	Q498-A502 WeakPolarHBondContact O-CB 3.23Å; Q498-A502 PolarHBondContact O-N 2.73Å; Q498-A502 VanDerWaalsContact O-N 3.09Å; A499-A502 PolarHBondContact O-N 3.25Å; I500-A502 VanDerWaalsContact C-N 3.27Å; I500-A502 PolarHBondContact O-N 3.43Å
503	L	85.6	Confident	86.5	Confident	17 Å²	17	54.1 Å²	54.1	9%	0.089	31%	0.308	C	S	.	.	H	α-helix	trans	-84.6	-13.2	-178.3	-70.9	166.5	0	0	0	113.4	Q481 F485 L488 A499 I500 G507 T510	Q481-L503 HydrophobicContact CG-CD2 4.35Å; F485-L503 HydrophobicContact CD2-CD2 3.7Å; F485-L503 HydrophobicContact CE2-CD2 3.93Å; L488-L503 HydrophobicContact CD1-CD1 3.53Å; L488-L503 HydrophobicContact CG-CD1 4.34Å; A499-L503 VanDerWaalsContact O-CB 3.31Å; A499-L503 WeakPolarHBondContact O-CB 3.14Å; A499-L503 WeakPolarHBondContact O-CD1 3.43Å; A499-L503 WeakPolarHBondContact O-CG 3.49Å; A499-L503 PolarHBondContact O-N 3.25Å; I500-L503 PolarHBondContact O-N 2.92Å; L503-G507 WeakPolarHBondContact CB-O 3.2Å; L503-G507 WeakPolarHBondContact CD1-O 3.45Å; L503-T510 HydrophobicContact CD2-CG2 4.11Å; L503-T510 PolarHBondContact O-OG1 3.28Å
504	G	84.3	Confident	86.2	Confident	32 Å²	32	51.4 Å²	51.4	33%	0.33	29%	0.289	S	S	.	.			trans	84.6	-154.2	174.9	0	0	0	0	0	113.7	I500 D506 G507	I500-G504 PolarHBondContact O-N 3.48Å; G504-D506 VanDerWaalsContact C-N 3.28Å; G504-D506 PolarHBondContact O-N 3.38Å; G504-G507 PolarHBondContact O-N 3.11Å; G504-G507 VanDerWaalsContact O-N 3.09Å
505	P	79.7	Confident	86.1	Confident	133 Å²	133	45.1 Å²	45.1	86%	0.864	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-26.7	-167.6	27.7	-35.5	0	0	0	114	G507	P505-G507 VanDerWaalsContact C-N 3.32Å
506	D	80.9	Confident	86.1	Confident	104 Å²	104	44.1 Å²	44.1	56%	0.556	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-13.3	179.1	-62.4	-31.4	0	0	0	112.1	G504 V508 N509 T510	G504-D506 VanDerWaalsContact C-N 3.28Å; G504-D506 PolarHBondContact O-N 3.38Å; D506-V508 PolarHBondContact O-N 3.09Å; D506-N509 WeakPolarHBondContact O-CA 3.42Å; D506-N509 WeakPolarHBondContact O-CB 3.47Å; D506-N509 PolarHBondContact O-N 3.46Å; D506-T510 WeakPolarHBondContact CB-OG1 3.32Å
507	G	87.1	Confident	86.2	Confident	6 Å²	6	43.2 Å²	43.2	6%	0.062	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	51.8	-122.3	173.7	0	0	0	0	0	113.6	L503 G504 P505 N509 T510	L503-G507 WeakPolarHBondContact CB-O 3.2Å; L503-G507 WeakPolarHBondContact CD1-O 3.45Å; G504-G507 PolarHBondContact O-N 3.11Å; G504-G507 VanDerWaalsContact O-N 3.09Å; P505-G507 VanDerWaalsContact C-N 3.32Å; G507-N509 PolarHBondContact O-N 2.92Å; G507-T510 PolarHBondContact O-N 2.95Å; G507-T510 PolarHBondContact O-OG1 3.3Å; G507-T510 VanDerWaalsContact O-OG1 3.04Å
508	V	87.7	Confident	86.3	Confident	7 Å²	7	37.7 Å²	37.7	4%	0.042	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-69.4	-12	178.8	-66.1	0	0	0	0	114.1	L488 I500 D506 P518 L534 A537 A539	L488-V508 HydrophobicContact CD1-CG1 4.4Å; L488-V508 HydrophobicContact CD2-CG1 4.39Å; I500-V508 HydrophobicContact CD1-CG1 4.21Å; I500-V508 HydrophobicContact CG1-CG1 4.02Å; D506-V508 PolarHBondContact O-N 3.09Å; V508-P518 WeakPolarHBondContact O-CD 3.49Å; V508-L534 HydrophobicContact CG1-CD2 4.38Å; V508-A537 HydrophobicContact CG1-CB 4.07Å; V508-A539 HydrophobicContact CG2-CB 4.11Å
509	N	90.4	Very high	86.5	Confident	44 Å²	44	32.7 Å²	32.7	24%	0.235	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-95.2	1.7	179.3	-61.5	-51.5	0	0	0	113	D506 G507 M511 N540 I543	D506-N509 WeakPolarHBondContact O-CA 3.42Å; D506-N509 WeakPolarHBondContact O-CB 3.47Å; D506-N509 PolarHBondContact O-N 3.46Å; G507-N509 PolarHBondContact O-N 2.92Å; N509-M511 PolarHBondContact O-N 3.15Å; N509-N540 PolarHBondContact OD1-N 3.48Å; N509-I543 HydrophobicContact CB-CD1 3.7Å
510	T	89.3	Confident	86.6	Confident	14 Å²	14	32.8 Å²	32.8	9%	0.086	19%	0.193	C	C	.	.			trans	-58.6	134.5	174.9	-59.9	0	0	0	0	110.3	Q481 F485 L503 D506 G507 P518	Q481-T510 HydrophobicContact CG-CG2 4.41Å; F485-T510 HydrophobicContact CE2-CG2 4.2Å; F485-T510 VanDerWaalsContact CZ-O 3.3Å; F485-T510 WeakPolarHBondContact CZ-O 3.42Å; L503-T510 HydrophobicContact CD2-CG2 4.11Å; L503-T510 PolarHBondContact O-OG1 3.28Å; D506-T510 WeakPolarHBondContact CB-OG1 3.32Å; G507-T510 PolarHBondContact O-N 2.95Å; G507-T510 PolarHBondContact O-OG1 3.3Å; G507-T510 VanDerWaalsContact O-OG1 3.04Å; T510-P518 WeakPolarHBondContact O-CD 3.44Å
511	M	87.6	Confident	86.7	Confident	42 Å²	42	30.7 Å²	30.7	21%	0.207	18%	0.182	C	C	.	.			trans	-100.4	143.9	177.8	-70.1	178	-84.3	0	0	111.2	Q481 N509 M516 T517 I543 P546 Y552	Q481-M511 PolarHBondContact NE2-O 2.8Å; N509-M511 PolarHBondContact O-N 3.15Å; M511-M516 WeakPolarHBondContact CA-O 2.87Å; M511-T517 HydrophobicContact CG-CG2 3.83Å; M511-I543 HydrophobicContact SD-CG2 4.41Å; M511-P546 HydrophobicContact SD-CG 4Å; M511-Y552 HydrophobicContact CB-CE1 3.79Å; M511-Y552 HydrophobicContact CE-CE2 4.34Å; M511-Y552 VanDerWaalsContact CE-OH 3.29Å; M511-Y552 WeakPolarHBondContact CE-OH 3.37Å
512	D	84.4	Confident	86.9	Confident	13 Å²	13	24.6 Å²	24.6	7%	0.07	15%	0.15	C	C	.	.			trans	-82.2	-173.1	175	83.5	-33.9	0	0	0	112.9	F485 Q514 G515 M516 Y521 Y552	F485-D512 HydrophobicContact CE1-CB 4.08Å; F485-D512 HydrophobicContact CE2-CB 4.43Å; F485-D512 HydrophobicContact CZ-CB 3.87Å; D512-Q514 PolarHBondContact O-N 2.93Å; D512-Q514 VanDerWaalsContact O-N 3.14Å; D512-Q514 WeakPolarHBondContact OD1-CA 3.48Å; D512-Q514 WeakPolarHBondContact OD1-CB 3.44Å; D512-Q514 PolarHBondContact OD1-N 3.27Å; D512-Q514 PolarHBondContact OD2-N 3.29Å; D512-G515 PolarHBondContact O-N 3.33Å; D512-G515 PolarHBondContact OD1-N 2.78Å; D512-G515 VanDerWaalsContact OD1-N 3.15Å; D512-M516 PolarHBondContact N-O 3.45Å; D512-M516 WeakPolarHBondContact OD1-CB 3.5Å; D512-M516 PolarHBondContact OD1-N 2.83Å; D512-Y521 PolarHBondContact OD2-OH 3.49Å; D512-Y552 WeakPolarHBondContact O-CD1 3.4Å
513	D	79.9	Confident	87.1	Confident	22 Å²	22	23.4 Å²	23.4	12%	0.118	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-19.2	177.4	-70.4	-9	0	0	0	113.6	S465 K478 Y552 S554	S465-D513 PolarHBondContact OG-OD2 2.99Å; K478-D513 IonicContact NZ-OD1 2.61Å; K478-D513 PolarHBondContact NZ-OD1 3.34Å; K478-D513 IonicContact NZ-OD2 3.56Å; K478-D513 PolarHBondContact NZ-OD2 2.91Å; D513-Y552 CarbonylContact O-C 3.39Å; D513-S554 PolarHBondContact O-N 2.82Å
514	Q	80.1	Confident	87.4	Confident	31 Å²	31	22.8 Å²	22.8	15%	0.145	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-3.1	174.5	-61.9	-74.6	-25.4	0	0	113	C463 D512 M516 S554 V555	C463-Q514 WeakPolarHBondContact SG-CG 3.33Å; D512-Q514 PolarHBondContact O-N 2.93Å; D512-Q514 VanDerWaalsContact O-N 3.14Å; D512-Q514 WeakPolarHBondContact OD1-CA 3.48Å; D512-Q514 WeakPolarHBondContact OD1-CB 3.44Å; D512-Q514 PolarHBondContact OD1-N 3.27Å; D512-Q514 PolarHBondContact OD2-N 3.29Å; Q514-M516 VanDerWaalsContact C-N 3.29Å; Q514-M516 HydrophobicContact CB-CB 4.44Å; Q514-M516 HydrophobicContact CB-CG 3.81Å; Q514-S554 VanDerWaalsContact CD-O 3.29Å; Q514-S554 PolarHBondContact NE2-O 3.01Å; Q514-S554 PolarHBondContact OE1-O 3.23Å; Q514-V555 WeakPolarHBondContact O-CG2 3.42Å
515	G	85.6	Confident	87.6	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	15%	0.15	C	C	.	.	S	Bend	trans	74.6	19.6	-174.8	0	0	0	0	0	113.3	D512 P546	D512-G515 PolarHBondContact O-N 3.33Å; D512-G515 PolarHBondContact OD1-N 2.78Å; D512-G515 VanDerWaalsContact OD1-N 3.15Å; G515-P546 WeakPolarHBondContact O-CD 3.25Å
516	M	88.2	Confident	88.1	Confident	6 Å²	6	19.3 Å²	19.3	3%	0.03	12%	0.119	C	C	.	.			trans	-102.5	139.6	-174.5	-63.2	-74.4	-75.6	0	0	111	L458 M511 D512 Q514 M520 Y521 V545 L567	L458-M516 HydrophobicContact CD2-CE 4.14Å; M511-M516 WeakPolarHBondContact CA-O 2.87Å; D512-M516 PolarHBondContact N-O 3.45Å; D512-M516 WeakPolarHBondContact OD1-CB 3.5Å; D512-M516 PolarHBondContact OD1-N 2.83Å; Q514-M516 VanDerWaalsContact C-N 3.29Å; Q514-M516 HydrophobicContact CB-CB 4.44Å; Q514-M516 HydrophobicContact CB-CG 3.81Å; M516-M520 HydrophobicContact CB-SD 4.37Å; M516-M520 HydrophobicContact CE-CB 3.74Å; M516-M520 HydrophobicContact CE-SD 4.42Å; M516-M520 HydrophobicContact SD-CB 4.35Å; M516-M520 HydrophobicContact SD-SD 3.82Å; M516-Y521 HydrophobicContact CB-CD2 4.14Å; M516-Y521 HydrophobicContact CB-CE2 3.46Å; M516-Y521 VanDerWaalsContact CB-CE2 3.46Å; M516-Y521 HydrophobicContact CG-CE2 4.43Å; M516-V545 HydrophobicContact SD-CG2 3.54Å; M516-V545 VanDerWaalsContact SD-CG2 3.54Å; M516-L567 HydrophobicContact CE-CD1 3.51Å; M516-L567 HydrophobicContact CE-CD2 4.22Å; M516-L567 HydrophobicContact SD-CD1 4.21Å
517	T	90.7	Very high	88.6	Confident	3 Å²	3	17.6 Å²	17.6	2%	0.018	11%	0.11	C	C	.	.			trans	-90.5	159.6	174.1	68	0	0	0	0	111.4	M511 L519 M520 Y521 I543	M511-T517 HydrophobicContact CG-CG2 3.83Å; T517-L519 PolarHBondContact O-N 3.07Å; T517-M520 HydrophobicContact CG2-CE 4.5Å; T517-M520 HydrophobicContact CG2-SD 4.35Å; T517-M520 PolarHBondContact N-SD 2.81Å; T517-M520 VanDerWaalsContact N-SD 3.4Å; T517-M520 WeakPolarHBondContact O-CB 3.25Å; T517-M520 PolarHBondContact O-N 3.14Å; T517-M520 WeakPolarHBondContact OG1-CG 3.39Å; T517-M520 PolarHBondContact OG1-N 3.47Å; T517-Y521 WeakPolarHBondContact O-CD2 3.31Å; T517-Y521 PolarHBondContact O-N 2.74Å; T517-I543 HydrophobicContact CG2-CD1 4.27Å; T517-I543 HydrophobicContact CG2-CG2 4.29Å
518	P	90.1	Very high	88.9	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.006	13%	0.128	C	C	.	.	H	α-helix	trans	-52.4	-37.2	171.7	-26.7	34	0	0	0	113.2	F485 L488 V508 T510 Y521 A522 L534	F485-P518 HydrophobicContact CD1-CG 4.1Å; F485-P518 HydrophobicContact CE1-CG 3.79Å; F485-P518 HydrophobicContact CZ-CG 4.14Å; L488-P518 HydrophobicContact CB-CB 4.46Å; L488-P518 HydrophobicContact CD1-CB 3.91Å; L488-P518 HydrophobicContact CD1-CG 3.55Å; V508-P518 WeakPolarHBondContact O-CD 3.49Å; T510-P518 WeakPolarHBondContact O-CD 3.44Å; P518-Y521 PolarHBondContact O-N 3.27Å; P518-A522 PolarHBondContact O-N 3.37Å; P518-L534 HydrophobicContact CB-CD1 4.11Å; P518-L534 HydrophobicContact CB-CD2 4.27Å
519	L	92.3	Very high	89.1	Confident	2 Å²	2	25.1 Å²	25.1	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-63.8	-42.5	177	179.9	66.9	0	0	0	111.6	T517 Y521 A522 C523 V531 L534 I535 A539 L541 A564	T517-L519 PolarHBondContact O-N 3.07Å; L519-Y521 VanDerWaalsContact C-N 3.32Å; L519-Y521 PolarHBondContact O-N 3.39Å; L519-A522 PolarHBondContact O-N 3.2Å; L519-C523 WeakPolarHBondContact O-CB 3.49Å; L519-C523 PolarHBondContact O-N 2.74Å; L519-C523 PolarHBondContact O-SG 3.27Å; L519-V531 HydrophobicContact CD1-CG1 4.14Å; L519-V531 HydrophobicContact CD1-CG2 4.43Å; L519-L534 HydrophobicContact CB-CD1 4.2Å; L519-L534 HydrophobicContact CD1-CB 4.08Å; L519-L534 HydrophobicContact CD1-CD1 4.38Å; L519-I535 HydrophobicContact CD1-CG1 4.48Å; L519-A539 HydrophobicContact CB-CB 4.4Å; L519-A539 HydrophobicContact CD2-CB 4.08Å; L519-L541 HydrophobicContact CD2-CD2 3.66Å; L519-A564 HydrophobicContact CD2-CB 3.96Å; L519-A564 HydrophobicContact CG-CB 4.05Å
520	M	91.8	Very high	89.1	Confident	1 Å²	1	23.7 Å²	23.7	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-60.9	-40.5	177.1	-71.7	172.2	175.9	0	0	112.1	M516 T517 C523 A524 I543 V545 A564 L567	M516-M520 HydrophobicContact CB-SD 4.37Å; M516-M520 HydrophobicContact CE-CB 3.74Å; M516-M520 HydrophobicContact CE-SD 4.42Å; M516-M520 HydrophobicContact SD-CB 4.35Å; M516-M520 HydrophobicContact SD-SD 3.82Å; T517-M520 HydrophobicContact CG2-CE 4.5Å; T517-M520 HydrophobicContact CG2-SD 4.35Å; T517-M520 PolarHBondContact N-SD 2.81Å; T517-M520 VanDerWaalsContact N-SD 3.4Å; T517-M520 WeakPolarHBondContact O-CB 3.25Å; T517-M520 PolarHBondContact O-N 3.14Å; T517-M520 WeakPolarHBondContact OG1-CG 3.39Å; T517-M520 PolarHBondContact OG1-N 3.47Å; M520-C523 PolarHBondContact O-N 2.89Å; M520-A524 WeakPolarHBondContact O-CB 3.43Å; M520-A524 PolarHBondContact O-N 2.89Å; M520-I543 HydrophobicContact CE-CG2 4.38Å; M520-I543 WeakPolarHBondContact CE-O 3.41Å; M520-V545 HydrophobicContact CE-CG2 3.8Å; M520-V545 HydrophobicContact SD-CG2 3.72Å; M520-A564 HydrophobicContact CG-CB 4.45Å; M520-L567 HydrophobicContact CB-CD1 3.52Å; M520-L567 HydrophobicContact CG-CD1 3.7Å; M520-L567 HydrophobicContact SD-CD1 4.3Å
521	Y	90.4	Very high	89.4	Confident	7 Å²	7	23 Å²	23	3%	0.027	14%	0.144	C	C	.	.	H	α-helix	trans	-66.5	-43.7	175	-75.6	-71.2	0	0	0	112.7	L458 P460 F485 D512 M516 T517 P518 L519 C523 A524 A525	L458-Y521 HydrophobicContact CD1-CE1 4.13Å; L458-Y521 HydrophobicContact CG-CD1 4.18Å; L458-Y521 HydrophobicContact CG-CE1 3.97Å; P460-Y521 HydrophobicContact CB-CD2 4.46Å; P460-Y521 HydrophobicContact CB-CE2 4.31Å; P460-Y521 HydrophobicContact CG-CD1 3.82Å; P460-Y521 HydrophobicContact CG-CD2 3.63Å; P460-Y521 HydrophobicContact CG-CE1 4.12Å; P460-Y521 HydrophobicContact CG-CE2 3.92Å; P460-Y521 HydrophobicContact CG-CG 3.56Å; F485-Y521 HydrophobicContact CE1-CE2 4.37Å; D512-Y521 PolarHBondContact OD2-OH 3.49Å; M516-Y521 HydrophobicContact CB-CD2 4.14Å; M516-Y521 HydrophobicContact CB-CE2 3.46Å; M516-Y521 VanDerWaalsContact CB-CE2 3.46Å; M516-Y521 HydrophobicContact CG-CE2 4.43Å; T517-Y521 WeakPolarHBondContact O-CD2 3.31Å; T517-Y521 PolarHBondContact O-N 2.74Å; P518-Y521 PolarHBondContact O-N 3.27Å; L519-Y521 VanDerWaalsContact C-N 3.32Å; L519-Y521 PolarHBondContact O-N 3.39Å; Y521-C523 VanDerWaalsContact C-N 3.28Å; Y521-C523 PolarHBondContact O-N 2.74Å; Y521-A524 PolarHBondContact O-N 2.8Å; Y521-A525 WeakPolarHBondContact O-CB 3.48Å; Y521-A525 PolarHBondContact O-N 3.07Å
522	A	91.5	Very high	89.7	Confident	6 Å²	6	24.6 Å²	24.6	5%	0.05	15%	0.151	C	C	.	.	H	α-helix	trans	-60.1	-40.7	174.8	0	0	0	0	0	111.6	P518 L519 A525 G526 D527 M530 V531 L534	P518-A522 PolarHBondContact O-N 3.37Å; L519-A522 PolarHBondContact O-N 3.2Å; A522-A525 PolarHBondContact O-N 3.29Å; A522-G526 PolarHBondContact O-N 3.26Å; A522-D527 PolarHBondContact O-N 3.18Å; A522-D527 VanDerWaalsContact O-N 3.12Å; A522-M530 HydrophobicContact CB-CB 3.93Å; A522-M530 HydrophobicContact CB-CG 3.58Å; A522-V531 HydrophobicContact CB-CG2 3.75Å; A522-L534 HydrophobicContact CB-CD1 4.11Å
523	C	92.5	Very high	90	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-66.8	-39.8	177.1	-69	0	0	0	0	113	L519 M520 Y521 G526 A568 H573 V576	L519-C523 WeakPolarHBondContact O-CB 3.49Å; L519-C523 PolarHBondContact O-N 2.74Å; L519-C523 PolarHBondContact O-SG 3.27Å; M520-C523 PolarHBondContact O-N 2.89Å; Y521-C523 VanDerWaalsContact C-N 3.28Å; Y521-C523 PolarHBondContact O-N 2.74Å; C523-G526 PolarHBondContact O-N 2.85Å; C523-A568 HydrophobicContact CB-CB 4.19Å; C523-H573 PolarHBondContact O-CD2 3.41Å; C523-H573 VanDerWaalsContact O-CD2 3.29Å; C523-V576 HydrophobicContact CB-CG1 4.27Å
524	A	90.2	Very high	90.6	Very high	5 Å²	5	23.7 Å²	23.7	4%	0.041	15%	0.146	C	C	.	.	H	α-helix	trans	-69	-36.2	174.9	0	0	0	0	0	112.3	L458 M520 Y521 G526 H571 H573	L458-A524 HydrophobicContact CD2-CB 3.86Å; M520-A524 WeakPolarHBondContact O-CB 3.43Å; M520-A524 PolarHBondContact O-N 2.89Å; Y521-A524 PolarHBondContact O-N 2.8Å; A524-G526 VanDerWaalsContact C-N 3.32Å; A524-H571 PolarHBondContact O-CD2 3.42Å; A524-H573 PolarHBondContact O-CD2 2.97Å; A524-H573 PolarHBondContact O-NE2 3.32Å
525	A	88.9	Confident	91.2	Very high	70 Å²	70	23.9 Å²	23.9	58%	0.579	15%	0.147	S	C	*	.	H	α-helix	trans	-72.6	-23.3	176.4	0	0	0	0	0	113.4	Y521 A522	Y521-A525 WeakPolarHBondContact O-CB 3.48Å; Y521-A525 PolarHBondContact O-N 3.07Å; A522-A525 PolarHBondContact O-N 3.29Å
526	G	90.8	Very high	91.5	Very high	21 Å²	21	29.5 Å²	29.5	22%	0.216	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.8	21.9	-175.3	0	0	0	0	0	113.4	A522 C523 A524 E528 H573	A522-G526 PolarHBondContact O-N 3.26Å; C523-G526 PolarHBondContact O-N 2.85Å; A524-G526 VanDerWaalsContact C-N 3.32Å; G526-E528 PolarHBondContact O-N 3.07Å; G526-E528 VanDerWaalsContact O-N 3.15Å; G526-H573 VanDerWaalsContact CA-CD2 3.41Å; G526-H573 WeakPolarHBondContact CA-CD2 3.4Å; G526-H573 PolarHBondContact N-CD2 3.43Å; G526-H573 PolarHBondContact N-NE2 3.28Å
527	D	91.3	Very high	91.5	Very high	68 Å²	68	30.8 Å²	30.8	36%	0.364	19%	0.189	S	C	.	.			trans	-82.7	91	-178.9	-171.7	-18.5	0	0	0	110.5	A522 A529 M530 V531	A522-D527 PolarHBondContact O-N 3.18Å; A522-D527 VanDerWaalsContact O-N 3.12Å; D527-A529 VanDerWaalsContact C-N 3.27Å; D527-A529 PolarHBondContact O-N 3.12Å; D527-A529 PolarHBondContact OD1-N 3.37Å; D527-M530 HydrophobicContact CB-CB 3.82Å; D527-M530 PolarHBondContact O-N 3.1Å; D527-M530 PolarHBondContact OD1-N 3.2Å; D527-M530 WeakPolarHBondContact OD2-CB 3.27Å; D527-V531 VanDerWaalsContact O-CG2 3.29Å; D527-V531 WeakPolarHBondContact O-CG2 3.31Å; D527-V531 PolarHBondContact O-N 3.3Å
528	E	93.3	Very high	91.4	Very high	96 Å²	96	33.1 Å²	33.1	45%	0.449	21%	0.214	S	C	.	.	H	α-helix	trans	-55.4	-39.4	-179.5	-63.1	176.3	-162	0	0	112.8	G526 V531 Q532 S575 V576 L579	G526-E528 PolarHBondContact O-N 3.07Å; G526-E528 VanDerWaalsContact O-N 3.15Å; E528-V531 PolarHBondContact O-N 3.32Å; E528-Q532 PolarHBondContact O-N 3.49Å; E528-S575 VanDerWaalsContact CD-CB 3.41Å; E528-S575 WeakPolarHBondContact OE1-CB 3.33Å; E528-S575 PolarHBondContact OE1-OG 3.12Å; E528-V576 HydrophobicContact CG-CG2 3.94Å; E528-L579 HydrophobicContact CB-CD1 4.18Å; E528-L579 HydrophobicContact CG-CD1 4.43Å
529	A	92.3	Very high	91.4	Very high	75 Å²	75	33.6 Å²	33.6	62%	0.62	22%	0.218	S	C	*	.	H	α-helix	trans	-70.6	-41.6	-177.9	0	0	0	0	0	111.4	D527 Q532 M533	D527-A529 VanDerWaalsContact C-N 3.27Å; D527-A529 PolarHBondContact O-N 3.12Å; D527-A529 PolarHBondContact OD1-N 3.37Å; A529-Q532 PolarHBondContact O-N 3.22Å; A529-M533 WeakPolarHBondContact O-CB 3.43Å; A529-M533 PolarHBondContact O-N 2.78Å
530	M	91	Very high	91.3	Very high	14 Å²	14	37.5 Å²	37.5	7%	0.069	24%	0.239	C	C	.	.	H	α-helix	trans	-65.1	-42.2	174.7	-170.5	77.2	67.3	0	0	111.8	N489 A522 D527 M533 L534	N489-M530 WeakPolarHBondContact O-CE 3.39Å; A522-M530 HydrophobicContact CB-CB 3.93Å; A522-M530 HydrophobicContact CB-CG 3.58Å; D527-M530 HydrophobicContact CB-CB 3.82Å; D527-M530 PolarHBondContact O-N 3.1Å; D527-M530 PolarHBondContact OD1-N 3.2Å; D527-M530 WeakPolarHBondContact OD2-CB 3.27Å; M530-M533 HydrophobicContact CG-CE 4.23Å; M530-M533 PolarHBondContact O-N 3.04Å; M530-M533 HydrophobicContact SD-CE 3.24Å; M530-M533 WeakPolarHBondContact SD-CE 3.26Å; M530-L534 HydrophobicContact CG-CD1 4.06Å; M530-L534 WeakPolarHBondContact O-CG 3.29Å; M530-L534 PolarHBondContact O-N 2.96Å
531	V	94.1	Very high	91.2	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60	-48.9	176.6	169.4	0	0	0	0	110.1	L519 A522 D527 E528 M533 L534 I535 V576 L580	L519-V531 HydrophobicContact CD1-CG1 4.14Å; L519-V531 HydrophobicContact CD1-CG2 4.43Å; A522-V531 HydrophobicContact CB-CG2 3.75Å; D527-V531 VanDerWaalsContact O-CG2 3.29Å; D527-V531 WeakPolarHBondContact O-CG2 3.31Å; D527-V531 PolarHBondContact O-N 3.3Å; E528-V531 PolarHBondContact O-N 3.32Å; V531-M533 VanDerWaalsContact C-N 3.34Å; V531-M533 PolarHBondContact O-N 2.67Å; V531-L534 PolarHBondContact O-N 3.28Å; V531-I535 HydrophobicContact CG1-CD1 3.71Å; V531-I535 HydrophobicContact CG1-CG1 4.4Å; V531-I535 VanDerWaalsContact O-CG1 3.23Å; V531-I535 WeakPolarHBondContact O-CG1 2.89Å; V531-I535 PolarHBondContact O-N 2.93Å; V531-V576 HydrophobicContact CG1-CG1 4.35Å; V531-V576 HydrophobicContact CG2-CG1 3.99Å; V531-V576 HydrophobicContact CG2-CG2 4.5Å; V531-L580 HydrophobicContact CG1-CD2 4.34Å
532	Q	93.7	Very high	91.1	Very high	75 Å²	75	41 Å²	41	35%	0.35	26%	0.258	S	S	.	.	H	α-helix	trans	-60	-45	177.6	-171.9	62.2	48.7	0	0	111.8	E528 A529 L534 I535 D536	E528-Q532 PolarHBondContact O-N 3.49Å; A529-Q532 PolarHBondContact O-N 3.22Å; Q532-L534 VanDerWaalsContact C-N 3.33Å; Q532-L534 PolarHBondContact O-N 3.37Å; Q532-I535 PolarHBondContact O-N 3.31Å; Q532-D536 PolarHBondContact NE2-OD1 3.13Å; Q532-D536 WeakPolarHBondContact O-CB 3.26Å; Q532-D536 PolarHBondContact O-N 3.36Å
533	M	92.1	Very high	90.9	Very high	15 Å²	15	41.9 Å²	41.9	7%	0.074	26%	0.262	C	S	.	.	H	α-helix	trans	-58.9	-42.6	178.1	177	-83.2	-68.1	0	0	112.6	T493 I496 A529 M530 V531 D536 A537	T493-M533 HydrophobicContact CG2-CG 3.94Å; I496-M533 HydrophobicContact CD1-CG 3.57Å; I496-M533 HydrophobicContact CD1-SD 3.31Å; I496-M533 WeakPolarHBondContact CD1-SD 3.28Å; I496-M533 HydrophobicContact CG1-CG 4.38Å; I496-M533 HydrophobicContact CG1-SD 3.59Å; I496-M533 VanDerWaalsContact CG1-SD 3.59Å; A529-M533 WeakPolarHBondContact O-CB 3.43Å; A529-M533 PolarHBondContact O-N 2.78Å; M530-M533 HydrophobicContact CG-CE 4.23Å; M530-M533 PolarHBondContact O-N 3.04Å; M530-M533 HydrophobicContact SD-CE 3.24Å; M530-M533 WeakPolarHBondContact SD-CE 3.26Å; V531-M533 VanDerWaalsContact C-N 3.34Å; V531-M533 PolarHBondContact O-N 2.67Å; M533-D536 PolarHBondContact O-N 3.05Å; M533-A537 WeakPolarHBondContact O-CB 3.37Å; M533-A537 PolarHBondContact O-N 2.81Å
534	L	91.9	Very high	90.7	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-71.5	-36.2	179.1	-70.1	170.3	0	0	0	112	L488 V508 P518 L519 A522 M530 V531 Q532 A537 G538 A539	L488-L534 HydrophobicContact CD1-CD2 4.47Å; L488-L534 HydrophobicContact CD2-CD2 4.33Å; V508-L534 HydrophobicContact CG1-CD2 4.38Å; P518-L534 HydrophobicContact CB-CD1 4.11Å; P518-L534 HydrophobicContact CB-CD2 4.27Å; L519-L534 HydrophobicContact CB-CD1 4.2Å; L519-L534 HydrophobicContact CD1-CB 4.08Å; L519-L534 HydrophobicContact CD1-CD1 4.38Å; A522-L534 HydrophobicContact CB-CD1 4.11Å; M530-L534 HydrophobicContact CG-CD1 4.06Å; M530-L534 WeakPolarHBondContact O-CG 3.29Å; M530-L534 PolarHBondContact O-N 2.96Å; V531-L534 PolarHBondContact O-N 3.28Å; Q532-L534 VanDerWaalsContact C-N 3.33Å; Q532-L534 PolarHBondContact O-N 3.37Å; L534-A537 PolarHBondContact O-N 2.76Å; L534-G538 PolarHBondContact O-N 3.22Å; L534-A539 HydrophobicContact CB-CB 4.21Å; L534-A539 WeakPolarHBondContact O-CB 3.49Å; L534-A539 PolarHBondContact O-N 3.32Å
535	I	92.8	Very high	90.5	Very high	35 Å²	35	44 Å²	44	18%	0.179	28%	0.275	C	S	.	.	H	α-helix	trans	-62.5	-46.5	172.6	-66.8	171.7	0	0	0	110.2	L519 V531 Q532 A537 G538 L541 L580 A583	L519-I535 HydrophobicContact CD1-CG1 4.48Å; V531-I535 HydrophobicContact CG1-CD1 3.71Å; V531-I535 HydrophobicContact CG1-CG1 4.4Å; V531-I535 VanDerWaalsContact O-CG1 3.23Å; V531-I535 WeakPolarHBondContact O-CG1 2.89Å; V531-I535 PolarHBondContact O-N 2.93Å; Q532-I535 PolarHBondContact O-N 3.31Å; I535-A537 PolarHBondContact O-N 2.77Å; I535-G538 PolarHBondContact O-N 2.85Å; I535-L541 HydrophobicContact CD1-CD2 4.35Å; I535-L541 HydrophobicContact CG1-CD2 3.95Å; I535-L580 HydrophobicContact CD1-CD2 4.3Å; I535-A583 HydrophobicContact CD1-CB 4.24Å; I535-A583 HydrophobicContact CG2-CB 4.37Å
536	D	90.9	Very high	90.2	Very high	119 Å²	119	42.1 Å²	42.1	64%	0.636	26%	0.257	S	S	*	.	H	α-helix	trans	-63.3	-30	177.6	-65.9	-16.3	0	0	0	112	Q532 M533 G538	Q532-D536 PolarHBondContact NE2-OD1 3.13Å; Q532-D536 WeakPolarHBondContact O-CB 3.26Å; Q532-D536 PolarHBondContact O-N 3.36Å; M533-D536 PolarHBondContact O-N 3.05Å; D536-G538 PolarHBondContact O-N 3.16Å
537	A	88.5	Confident	89.7	Confident	32 Å²	32	43.3 Å²	43.3	26%	0.264	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	0.4	174.4	0	0	0	0	0	114.3	I496 V508 M533 L534 I535	I496-A537 HydrophobicContact CG2-CB 3.9Å; V508-A537 HydrophobicContact CG1-CB 4.07Å; M533-A537 WeakPolarHBondContact O-CB 3.37Å; M533-A537 PolarHBondContact O-N 2.81Å; L534-A537 PolarHBondContact O-N 2.76Å; I535-A537 PolarHBondContact O-N 2.77Å
538	G	88.3	Confident	88.9	Confident	53 Å²	53	41.9 Å²	41.9	55%	0.546	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	27.9	177.4	0	0	0	0	0	114.8	L534 I535 D536	L534-G538 PolarHBondContact O-N 3.22Å; I535-G538 PolarHBondContact O-N 2.85Å; D536-G538 PolarHBondContact O-N 3.16Å
539	A	91.2	Very high	88	Confident	11 Å²	11	39.3 Å²	39.3	9%	0.091	25%	0.248	C	C	.	.			trans	-64.1	135.5	172.7	0	0	0	0	0	111.4	V508 L519 L534	V508-A539 HydrophobicContact CG2-CB 4.11Å; L519-A539 HydrophobicContact CB-CB 4.4Å; L519-A539 HydrophobicContact CD2-CB 4.08Å; L534-A539 HydrophobicContact CB-CB 4.21Å; L534-A539 WeakPolarHBondContact O-CB 3.49Å; L534-A539 PolarHBondContact O-N 3.32Å
540	N	90.1	Very high	87	Confident	84 Å²	84	42.3 Å²	42.3	45%	0.449	26%	0.261	S	S	.	.			trans	-83.4	124.2	175.7	-179.4	1.3	0	0	0	110.1	N509 D542 I543	N509-N540 PolarHBondContact OD1-N 3.48Å; N540-D542 PolarHBondContact OD1-N 2.69Å; N540-I543 HydrophobicContact CB-CD1 3.8Å; N540-I543 HydrophobicContact CB-CG1 3.83Å
541	L	90.1	Very high	86.1	Confident	18 Å²	18	50.4 Å²	50.4	9%	0.094	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-30.4	-172.5	-50.2	-178.3	0	0	0	113.1	L519 I535 L580 A583 A585	L519-L541 HydrophobicContact CD2-CD2 3.66Å; I535-L541 HydrophobicContact CD1-CD2 4.35Å; I535-L541 HydrophobicContact CG1-CD2 3.95Å; L541-L580 HydrophobicContact CD2-CD2 3.91Å; L541-A583 HydrophobicContact CD1-CB 3.75Å; L541-A585 HydrophobicContact CB-CB 4.05Å; L541-A585 HydrophobicContact CD1-CB 3.92Å
542	D	87.2	Confident	85.3	Confident	62 Å²	62	51.9 Å²	51.9	33%	0.332	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	18.8	-169.1	-60.6	-43.7	0	0	0	112.5	N540 P544 H586	N540-D542 PolarHBondContact OD1-N 2.69Å; D542-P544 WeakPolarHBondContact O-CD 3.35Å; D542-H586 PolarHBondContact OD1-N 3.25Å
543	I	88.2	Confident	84.3	Confident	26 Å²	26	51.6 Å²	51.6	13%	0.133	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-68.6	120.2	172.3	-62.3	176.1	0	0	0	108.4	N509 M511 T517 M520 N540	N509-I543 HydrophobicContact CB-CD1 3.7Å; M511-I543 HydrophobicContact SD-CG2 4.41Å; T517-I543 HydrophobicContact CG2-CD1 4.27Å; T517-I543 HydrophobicContact CG2-CG2 4.29Å; M520-I543 HydrophobicContact CE-CG2 4.38Å; M520-I543 WeakPolarHBondContact CE-O 3.41Å; N540-I543 HydrophobicContact CB-CD1 3.8Å; N540-I543 HydrophobicContact CB-CG1 3.83Å
544	P	88.1	Confident	83.6	Confident	50 Å²	50	51.7 Å²	51.7	33%	0.325	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-85.7	145.5	172.5	33.5	-31.3	0	0	0	111.2	D542 W562	D542-P544 WeakPolarHBondContact O-CD 3.35Å; P544-W562 CarbonylContact C-O 3.25Å; P544-W562 WeakPolarHBondContact CA-O 3.39Å
545	V	85.6	Confident	83	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-61.7	125.5	170.2	174.6	0	0	0	0	109.1	M516 M520 V555 S559 H561 W562	M516-V545 HydrophobicContact SD-CG2 3.54Å; M516-V545 VanDerWaalsContact SD-CG2 3.54Å; M520-V545 HydrophobicContact CE-CG2 3.8Å; M520-V545 HydrophobicContact SD-CG2 3.72Å; V545-V555 HydrophobicContact CG1-CG1 3.84Å; V545-S559 WeakPolarHBondContact CB-O 3.27Å; V545-S559 WeakPolarHBondContact CG1-O 3.31Å; V545-H561 WeakPolarHBondContact O-CA 3.43Å; V545-H561 PolarHBondContact O-N 3.29Å; V545-W562 WeakPolarHBondContact CG2-O 3.45Å; V545-W562 PolarHBondContact N-O 3.34Å
546	P	83.8	Confident	82.2	Confident	30 Å²	30	50.5 Å²	50.5	20%	0.195	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-70.2	158.8	-175.7	28	-34.8	0	0	0	112.4	M511 G515 Y552 V555	M511-P546 HydrophobicContact SD-CG 4Å; G515-P546 WeakPolarHBondContact O-CD 3.25Å; P546-Y552 HydrophobicContact CB-CD2 3.97Å; P546-Y552 HydrophobicContact CB-CE2 4.2Å; P546-Y552 HydrophobicContact CG-CD2 3.36Å; P546-Y552 HydrophobicContact CG-CE2 3.63Å; P546-Y552 HydrophobicContact CG-CG 3.95Å; P546-V555 WeakPolarHBondContact O-CG1 3.21Å
547	S	79.7	Confident	81.4	Confident	46 Å²	46	45.7 Å²	45.7	32%	0.322	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-63.5	150.9	166.7	-75.5	0	0	0	0	111.4	S549	S547-S549 PolarHBondContact O-N 2.93Å; S547-S549 VanDerWaalsContact O-N 3.17Å
548	T	73.4	Confident	80.7	Confident	38 Å²	38	46 Å²	46	23%	0.233	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-54.4	124.4	-180	-42.6	0	0	0	0	110.8	R365	R365-T548 VanDerWaalsContact NH2-CB 3.29Å
549	S	76.2	Confident	80.1	Confident	42 Å²	42	43.7 Å²	43.7	29%	0.294	25%	0.245	S	C	.	.			trans	-139.6	168.4	-178.1	70.5	0	0	0	0	110	S547 R551 Y552	S547-S549 PolarHBondContact O-N 2.93Å; S547-S549 VanDerWaalsContact O-N 3.17Å; S549-R551 PolarHBondContact O-N 3.39Å; S549-R551 VanDerWaalsContact O-N 3.12Å; S549-R551 PolarHBondContact OG-N 3.48Å; S549-Y552 PolarHBondContact N-O 3.23Å; S549-Y552 CarbonylContact O-C 3.51Å; S549-Y552 PolarHBondContact O-N 2.94Å; S549-Y552 PolarHBondContact OG-N 3Å
550	P	71.1	Confident	79.4	Confident	137 Å²	137	47 Å²	47	89%	0.89	26%	0.255	S	S	*	.	S	Bend	trans	-58.2	-23.8	173.8	-23.6	34	0	0	0	113.5
551	R	71.9	Confident	79	Confident	184 Å²	184	44.1 Å²	44.1	69%	0.694	24%	0.239	S	C	*	.	S	Bend	trans	-77	-34.2	175.3	-173.5	-175.5	-69.1	-145.9	0.5	112.3	S549 P553	S549-R551 PolarHBondContact O-N 3.39Å; S549-R551 VanDerWaalsContact O-N 3.12Å; S549-R551 PolarHBondContact OG-N 3.48Å; R551-P553 WeakPolarHBondContact O-CD 3.37Å
552	Y	76.3	Confident	78.8	Confident	32 Å²	32	43.5 Å²	43.5	13%	0.125	24%	0.236	C	C	.	.	S	Bend	trans	-125.3	76.6	-179.2	-51.1	-64.4	0	0	0	109.1	M511 D512 D513 P546 S549 S554 V555	M511-Y552 HydrophobicContact CB-CE1 3.79Å; M511-Y552 HydrophobicContact CE-CE2 4.34Å; M511-Y552 VanDerWaalsContact CE-OH 3.29Å; M511-Y552 WeakPolarHBondContact CE-OH 3.37Å; D512-Y552 WeakPolarHBondContact O-CD1 3.4Å; D513-Y552 CarbonylContact O-C 3.39Å; P546-Y552 HydrophobicContact CB-CD2 3.97Å; P546-Y552 HydrophobicContact CB-CE2 4.2Å; P546-Y552 HydrophobicContact CG-CD2 3.36Å; P546-Y552 HydrophobicContact CG-CE2 3.63Å; P546-Y552 HydrophobicContact CG-CG 3.95Å; S549-Y552 PolarHBondContact N-O 3.23Å; S549-Y552 CarbonylContact O-C 3.51Å; S549-Y552 PolarHBondContact O-N 2.94Å; S549-Y552 PolarHBondContact OG-N 3Å; Y552-S554 VanDerWaalsContact C-N 3.3Å; Y552-S554 PolarHBondContact O-N 3.19Å; Y552-V555 VanDerWaalsContact CB-CG2 3.45Å; Y552-V555 WeakPolarHBondContact O-CG2 3.28Å
553	P	73	Confident	78.9	Confident	69 Å²	69	40.6 Å²	40.6	45%	0.448	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-21.9	-169.9	29.2	-35.5	0	0	0	113.2	R551	R551-P553 WeakPolarHBondContact O-CD 3.37Å
554	S	77.1	Confident	79.1	Confident	17 Å²	17	39.5 Å²	39.5	12%	0.119	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	0.1	-169.4	-63	0	0	0	0	114.6	R431 D513 Q514 Y552 H556	R431-S554 WeakPolarHBondContact CB-O 3.4Å; R431-S554 WeakPolarHBondContact O-CB 3.39Å; R431-S554 PolarHBondContact O-OG 3.21Å; D513-S554 PolarHBondContact O-N 2.82Å; Q514-S554 VanDerWaalsContact CD-O 3.29Å; Q514-S554 PolarHBondContact NE2-O 3.01Å; Q514-S554 PolarHBondContact OE1-O 3.23Å; Y552-S554 VanDerWaalsContact C-N 3.3Å; Y552-S554 PolarHBondContact O-N 3.19Å; S554-H556 PolarHBondContact O-N 3.41Å
555	V	79.6	Confident	79.2	Confident	3 Å²	3	37.1 Å²	37.1	2%	0.018	20%	0.2	C	C	.	.			trans	-45.9	125.4	178.9	-177.9	0	0	0	0	112.1	Q514 V545 P546 Y552 R560	Q514-V555 WeakPolarHBondContact O-CG2 3.42Å; V545-V555 HydrophobicContact CG1-CG1 3.84Å; P546-V555 WeakPolarHBondContact O-CG1 3.21Å; Y552-V555 VanDerWaalsContact CB-CG2 3.45Å; Y552-V555 WeakPolarHBondContact O-CG2 3.28Å; V555-R560 HydrophobicContact CG1-CG 3.88Å
556	H	75.8	Confident	79.4	Confident	8 Å²	8	37.3 Å²	37.3	4%	0.037	20%	0.201	C	C	.	.			trans	-69	131.7	175.2	-167.3	-97.1	0	0	0	111.1	H147 E154 S554 D558 S559	H147-H556 AromaticContact CE1-CD2 3.82Å; H147-H556 AromaticContact CE1-CG 3.72Å; H147-H556 AromaticContact CE1-ND1 3.94Å; H147-H556 AromaticContact NE2-CG 3.83Å; E154-H556 IonicContact OE1-CE1 3.26Å; E154-H556 IonicContact OE1-NE2 3.92Å; S554-H556 PolarHBondContact O-N 3.41Å; H556-D558 IonicContact CE1-OD2 2.71Å; H556-D558 PolarHBondContact CE1-OD2 3.1Å; H556-D558 VanDerWaalsContact CE1-OD2 3.28Å; H556-D558 PolarHBondContact ND1-N 3.4Å; H556-D558 IonicContact ND1-OD2 3.94Å; H556-D558 PolarHBondContact O-N 2.81Å; H556-D558 VanDerWaalsContact O-N 3.09Å; H556-S559 WeakPolarHBondContact CB-OG 3.32Å; H556-S559 PolarHBondContact N-OG 3.35Å; H556-S559 PolarHBondContact O-N 3.49Å; H556-S559 PolarHBondContact O-OG 2.98Å
557	P	73.9	Confident	79.7	Confident	18 Å²	18	36 Å²	36	12%	0.117	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-30.5	-176.6	-28.1	35.4	0	0	0	115.2	F153 R560	F153-P557 HydrophobicContact CE2-CB 3.78Å; F153-P557 HydrophobicContact CE2-CG 4.1Å; F153-P557 HydrophobicContact CZ-CB 4.01Å; F153-P557 HydrophobicContact CZ-CG 4.06Å; P557-R560 PolarHBondContact O-NE 3.27Å; P557-R560 PolarHBondContact O-NH2 3.09Å; P557-R560 VanDerWaalsContact O-NH2 3.14Å
558	D	73.3	Confident	80.4	Confident	38 Å²	38	33.8 Å²	33.8	20%	0.203	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-20.9	-179.7	-58.5	-34.4	0	0	0	112.8	T151 H556 R560 W562	T151-D558 WeakPolarHBondContact CG2-OD2 3.32Å; T151-D558 PolarHBondContact OG1-OD2 3.49Å; H556-D558 IonicContact CE1-OD2 2.71Å; H556-D558 PolarHBondContact CE1-OD2 3.1Å; H556-D558 VanDerWaalsContact CE1-OD2 3.28Å; H556-D558 PolarHBondContact ND1-N 3.4Å; H556-D558 IonicContact ND1-OD2 3.94Å; H556-D558 PolarHBondContact O-N 2.81Å; H556-D558 VanDerWaalsContact O-N 3.09Å; D558-R560 PolarHBondContact O-N 3.01Å; D558-W562 HydrophobicContact CB-CH2 4.45Å; D558-W562 WeakPolarHBondContact O-CZ2 3.5Å; D558-W562 PolarHBondContact O-NE1 3.42Å
559	S	76.4	Confident	81.2	Confident	5 Å²	5	32 Å²	32	4%	0.035	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-9.4	177.7	67.2	0	0	0	0	113.6	V545 H556 H561 W562	V545-S559 WeakPolarHBondContact CB-O 3.27Å; V545-S559 WeakPolarHBondContact CG1-O 3.31Å; H556-S559 WeakPolarHBondContact CB-OG 3.32Å; H556-S559 PolarHBondContact N-OG 3.35Å; H556-S559 PolarHBondContact O-N 3.49Å; H556-S559 PolarHBondContact O-OG 2.98Å; S559-H561 PolarHBondContact O-N 3.22Å; S559-W562 VanDerWaalsContact O-CB 3.3Å; S559-W562 WeakPolarHBondContact O-CB 2.98Å; S559-W562 PolarHBondContact O-N 2.94Å
560	R	77.8	Confident	81.9	Confident	80 Å²	80	30 Å²	30	30%	0.302	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	138.3	-177.9	-68.3	-178.7	-70.6	153.7	2.2	110.4	V555 P557 D558 W562	V555-R560 HydrophobicContact CG1-CG 3.88Å; P557-R560 PolarHBondContact O-NE 3.27Å; P557-R560 PolarHBondContact O-NH2 3.09Å; P557-R560 VanDerWaalsContact O-NH2 3.14Å; D558-R560 PolarHBondContact O-N 3.01Å; R560-W562 PolarHBondContact O-N 3.14Å; R560-W562 VanDerWaalsContact O-N 3.15Å
561	H	80.4	Confident	82.7	Confident	24 Å²	24	25.4 Å²	25.4	11%	0.111	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.4	6.9	-179.5	-48.5	-65.7	0	0	0	115	V545 S559 S590 N598 A600	V545-H561 WeakPolarHBondContact O-CA 3.43Å; V545-H561 PolarHBondContact O-N 3.29Å; S559-H561 PolarHBondContact O-N 3.22Å; H561-S590 WeakPolarHBondContact O-CB 3.47Å; H561-N598 WeakPolarHBondContact NE2-CB 3.43Å; H561-A600 HydrophobicContact CB-CB 3.87Å
562	W	85.6	Confident	83.5	Confident	5 Å²	5	17.5 Å²	17.5	2%	0.019	9%	0.094	C	C	.	.			trans	-74.3	143.6	172.4	-71.6	-2.2	0	0	0	111	P544 V545 D558 S559 R560 T566 L567 L570	P544-W562 CarbonylContact C-O 3.25Å; P544-W562 WeakPolarHBondContact CA-O 3.39Å; V545-W562 WeakPolarHBondContact CG2-O 3.45Å; V545-W562 PolarHBondContact N-O 3.34Å; D558-W562 HydrophobicContact CB-CH2 4.45Å; D558-W562 WeakPolarHBondContact O-CZ2 3.5Å; D558-W562 PolarHBondContact O-NE1 3.42Å; S559-W562 VanDerWaalsContact O-CB 3.3Å; S559-W562 WeakPolarHBondContact O-CB 2.98Å; S559-W562 PolarHBondContact O-N 2.94Å; R560-W562 PolarHBondContact O-N 3.14Å; R560-W562 VanDerWaalsContact O-N 3.15Å; W562-T566 VanDerWaalsContact CA-OG1 3.31Å; W562-T566 WeakPolarHBondContact CA-OG1 3.34Å; W562-T566 VanDerWaalsContact CB-OG1 3.24Å; W562-T566 WeakPolarHBondContact CB-OG1 3.3Å; W562-L567 HydrophobicContact CE3-CD2 3.68Å; W562-L567 HydrophobicContact CE3-CG 4.43Å; W562-L567 HydrophobicContact CZ3-CD2 4.22Å; W562-L570 HydrophobicContact CE3-CD2 4.04Å; W562-L570 HydrophobicContact CH2-CD1 4.13Å; W562-L570 HydrophobicContact CH2-CD2 3.61Å; W562-L570 HydrophobicContact CZ3-CD2 3.27Å
563	T	89.6	Confident	84.4	Confident	1 Å²	1	18.3 Å²	18.3	1%	0.006	10%	0.099	C	C	.	.			trans	-103.4	174.8	173.1	58	0	0	0	0	110.3	L565 T566 L567	T563-L565 PolarHBondContact O-N 2.88Å; T563-T566 PolarHBondContact N-OG1 3.4Å; T563-T566 PolarHBondContact O-N 3.39Å; T563-T566 PolarHBondContact O-OG1 3.35Å; T563-T566 PolarHBondContact OG1-N 3.44Å; T563-T566 PolarHBondContact OG1-OG1 3.4Å; T563-L567 PolarHBondContact O-N 2.76Å
564	A	91.6	Very high	85.4	Confident	2 Å²	2	17.4 Å²	17.4	2%	0.017	9%	0.09	C	C	.	.	H	α-helix	trans	-55.6	-39.6	173	0	0	0	0	0	112	L519 M520 L567 A568 L580	L519-A564 HydrophobicContact CD2-CB 3.96Å; L519-A564 HydrophobicContact CG-CB 4.05Å; M520-A564 HydrophobicContact CG-CB 4.45Å; A564-L567 PolarHBondContact O-N 3.13Å; A564-A568 PolarHBondContact O-N 3.23Å; A564-A568 VanDerWaalsContact O-N 3.08Å; A564-L580 HydrophobicContact CB-CD1 4.38Å
565	L	91.9	Very high	86.2	Confident	1 Å²	1	19.2 Å²	19.2	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-63.9	-46.8	178.1	-176.8	70.1	0	0	0	112.3	T563 L567 A568 V569 V577 L580 L581 H586 P603	T563-L565 PolarHBondContact O-N 2.88Å; L565-L567 VanDerWaalsContact C-N 3.26Å; L565-L567 PolarHBondContact O-N 3.49Å; L565-A568 PolarHBondContact O-N 2.76Å; L565-V569 WeakPolarHBondContact O-CG2 3.48Å; L565-V569 PolarHBondContact O-N 3.02Å; L565-V577 HydrophobicContact CD1-CG1 3.97Å; L565-L580 HydrophobicContact CB-CD1 4.34Å; L565-L580 HydrophobicContact CD1-CB 4.11Å; L565-L580 HydrophobicContact CD1-CD1 4.23Å; L565-L581 HydrophobicContact CD1-CD2 3.97Å; L565-L581 HydrophobicContact CD1-CG 3.94Å; L565-L581 HydrophobicContact CD2-CD2 3.83Å; L565-H586 WeakPolarHBondContact CD2-O 3.32Å; L565-P603 HydrophobicContact CD2-CG 4.06Å; L565-P603 HydrophobicContact CG-CG 4.38Å
566	T	89.8	Confident	86.9	Confident	4 Å²	4	19.1 Å²	19.1	3%	0.025	10%	0.102	C	C	.	.	H	α-helix	trans	-61.9	-35.9	179.5	48.3	0	0	0	0	111.5	W562 T563 V569 L570 P603	W562-T566 VanDerWaalsContact CA-OG1 3.31Å; W562-T566 WeakPolarHBondContact CA-OG1 3.34Å; W562-T566 VanDerWaalsContact CB-OG1 3.24Å; W562-T566 WeakPolarHBondContact CB-OG1 3.3Å; T563-T566 PolarHBondContact N-OG1 3.4Å; T563-T566 PolarHBondContact O-N 3.39Å; T563-T566 PolarHBondContact O-OG1 3.35Å; T563-T566 PolarHBondContact OG1-N 3.44Å; T563-T566 PolarHBondContact OG1-OG1 3.4Å; T566-V569 PolarHBondContact O-N 3.13Å; T566-L570 VanDerWaalsContact O-CB 3.23Å; T566-L570 WeakPolarHBondContact O-CB 3.48Å; T566-L570 PolarHBondContact O-N 3.23Å; T566-P603 HydrophobicContact CG2-CG 3.7Å
567	L	90.1	Very high	87.9	Confident	2 Å²	2	18.8 Å²	18.8	1%	0.01	10%	0.1	C	C	.	.	H	α-helix	trans	-70.6	-39.5	177.8	-73	163.4	0	0	0	113	M516 M520 W562 T563 A564 L565 L570 H571	M516-L567 HydrophobicContact CE-CD1 3.51Å; M516-L567 HydrophobicContact CE-CD2 4.22Å; M516-L567 HydrophobicContact SD-CD1 4.21Å; M520-L567 HydrophobicContact CB-CD1 3.52Å; M520-L567 HydrophobicContact CG-CD1 3.7Å; M520-L567 HydrophobicContact SD-CD1 4.3Å; W562-L567 HydrophobicContact CE3-CD2 3.68Å; W562-L567 HydrophobicContact CE3-CG 4.43Å; W562-L567 HydrophobicContact CZ3-CD2 4.22Å; T563-L567 PolarHBondContact O-N 2.76Å; A564-L567 PolarHBondContact O-N 3.13Å; L565-L567 VanDerWaalsContact C-N 3.26Å; L565-L567 PolarHBondContact O-N 3.49Å; L567-L570 HydrophobicContact CD2-CD2 4.28Å; L567-L570 WeakPolarHBondContact O-CB 3.44Å; L567-L570 PolarHBondContact O-N 3.05Å; L567-H571 PolarHBondContact O-N 2.69Å; L567-H571 VanDerWaalsContact O-N 3.14Å; L567-H571 PolarHBondContact O-ND1 3.28Å
568	A	92.6	Very high	88.9	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-62.9	-43	173.9	0	0	0	0	0	111.3	C523 A564 L565 H571 G572 H573 V576 V577 L580	C523-A568 HydrophobicContact CB-CB 4.19Å; A564-A568 PolarHBondContact O-N 3.23Å; A564-A568 VanDerWaalsContact O-N 3.08Å; L565-A568 PolarHBondContact O-N 2.76Å; A568-H571 PolarHBondContact O-N 3.3Å; A568-G572 PolarHBondContact O-N 2.91Å; A568-H573 PolarHBondContact O-N 2.74Å; A568-V576 HydrophobicContact CB-CB 4.4Å; A568-V576 HydrophobicContact CB-CG1 3.85Å; A568-V577 HydrophobicContact CB-CG2 3.66Å; A568-L580 HydrophobicContact CB-CD1 4.12Å
569	V	91.9	Very high	89.9	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-67.3	-37.9	175.6	172.5	0	0	0	0	112	R219 L565 T566 H571 G572 V577 P603 L606 A607 L615 L619	R219-V569 PolarHBondContact NH2-O 3.28Å; R219-V569 VanDerWaalsContact NH2-O 3.14Å; L565-V569 WeakPolarHBondContact O-CG2 3.48Å; L565-V569 PolarHBondContact O-N 3.02Å; T566-V569 PolarHBondContact O-N 3.13Å; V569-H571 VanDerWaalsContact C-N 3.29Å; V569-H571 PolarHBondContact O-N 2.95Å; V569-G572 PolarHBondContact O-N 3.02Å; V569-V577 HydrophobicContact CB-CG2 4.46Å; V569-V577 HydrophobicContact CG2-CB 4.5Å; V569-V577 HydrophobicContact CG2-CG1 4.07Å; V569-V577 HydrophobicContact CG2-CG2 3.52Å; V569-P603 HydrophobicContact CB-CB 4.45Å; V569-P603 HydrophobicContact CG1-CB 4.41Å; V569-P603 WeakPolarHBondContact CG1-O 3.4Å; V569-P603 HydrophobicContact CG2-CB 4.12Å; V569-L606 HydrophobicContact CG1-CB 4.15Å; V569-A607 HydrophobicContact CG1-CB 4.03Å; V569-L615 HydrophobicContact CG1-CD1 4.35Å; V569-L619 HydrophobicContact CG2-CD1 4.44Å
570	L	89.3	Confident	90.7	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-58.7	-40.3	175.9	-176.2	72.1	0	0	0	111.7	H147 S148 R219 W562 T566 L567 L606	H147-L570 WeakPolarHBondContact O-CD1 3.43Å; H147-L570 VanDerWaalsContact O-CD2 3.25Å; H147-L570 WeakPolarHBondContact O-CD2 3.32Å; H147-L570 VanDerWaalsContact O-CG 3.32Å; H147-L570 WeakPolarHBondContact O-CG 3.37Å; S148-L570 WeakPolarHBondContact CB-O 3.43Å; R219-L570 PolarHBondContact NH1-O 3.02Å; R219-L570 PolarHBondContact NH2-O 3.46Å; W562-L570 HydrophobicContact CE3-CD2 4.04Å; W562-L570 HydrophobicContact CH2-CD1 4.13Å; W562-L570 HydrophobicContact CH2-CD2 3.61Å; W562-L570 HydrophobicContact CZ3-CD2 3.27Å; T566-L570 VanDerWaalsContact O-CB 3.23Å; T566-L570 WeakPolarHBondContact O-CB 3.48Å; T566-L570 PolarHBondContact O-N 3.23Å; L567-L570 HydrophobicContact CD2-CD2 4.28Å; L567-L570 WeakPolarHBondContact O-CB 3.44Å; L567-L570 PolarHBondContact O-N 3.05Å; L570-L606 HydrophobicContact CD1-CD1 4.43Å; L570-L606 HydrophobicContact CD1-CD2 4Å
571	H	88.4	Confident	91.4	Very high	39 Å²	39	19.3 Å²	19.3	18%	0.181	11%	0.105	C	C	.	.	H	α-helix	trans	-89	-8.1	179.6	-68.2	69.9	0	0	0	113.4	A524 L567 A568 V569 H573	A524-H571 PolarHBondContact O-CD2 3.42Å; L567-H571 PolarHBondContact O-N 2.69Å; L567-H571 VanDerWaalsContact O-N 3.14Å; L567-H571 PolarHBondContact O-ND1 3.28Å; A568-H571 PolarHBondContact O-N 3.3Å; V569-H571 VanDerWaalsContact C-N 3.29Å; V569-H571 PolarHBondContact O-N 2.95Å; H571-H573 VanDerWaalsContact CB-CD2 3.45Å; H571-H573 WeakPolarHBondContact CB-CD2 3.5Å; H571-H573 WeakPolarHBondContact CB-NE2 3.33Å
572	G	90.1	Very high	92	Very high	19 Å²	19	22.7 Å²	22.7	20%	0.196	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.6	17	175.4	0	0	0	0	0	114.7	A568 V569 I574	A568-G572 PolarHBondContact O-N 2.91Å; V569-G572 PolarHBondContact O-N 3.02Å; G572-I574 PolarHBondContact O-N 3.25Å; G572-I574 VanDerWaalsContact O-N 3.07Å
573	H	93.6	Very high	92.3	Very high	49 Å²	49	24.9 Å²	24.9	23%	0.227	14%	0.142	C	C	.	.			trans	-82.1	85.3	-173.3	-63	-51	0	0	0	112.2	C523 A524 G526 A568 H571 S575 V576 V577	C523-H573 PolarHBondContact O-CD2 3.41Å; C523-H573 VanDerWaalsContact O-CD2 3.29Å; A524-H573 PolarHBondContact O-CD2 2.97Å; A524-H573 PolarHBondContact O-NE2 3.32Å; G526-H573 VanDerWaalsContact CA-CD2 3.41Å; G526-H573 WeakPolarHBondContact CA-CD2 3.4Å; G526-H573 PolarHBondContact N-CD2 3.43Å; G526-H573 PolarHBondContact N-NE2 3.28Å; A568-H573 PolarHBondContact O-N 2.74Å; H571-H573 VanDerWaalsContact CB-CD2 3.45Å; H571-H573 WeakPolarHBondContact CB-CD2 3.5Å; H571-H573 WeakPolarHBondContact CB-NE2 3.33Å; H573-S575 PolarHBondContact O-N 3.32Å; H573-V576 HydrophobicContact CB-CB 4.1Å; H573-V576 HydrophobicContact CB-CG2 4.25Å; H573-V576 PolarHBondContact O-N 2.92Å; H573-V577 VanDerWaalsContact O-CG2 3.31Å; H573-V577 WeakPolarHBondContact O-CG2 3.35Å; H573-V577 PolarHBondContact O-N 3.04Å
574	I	93.9	Very high	92.2	Very high	50 Å²	50	27.5 Å²	27.5	26%	0.256	17%	0.17	S	C	.	.	H	α-helix	trans	-58.3	-45.1	-172.5	-54.2	179.7	0	0	0	112.5	G572 V576 V577 Q578 E614 L615 L618	G572-I574 PolarHBondContact O-N 3.25Å; G572-I574 VanDerWaalsContact O-N 3.07Å; I574-V576 PolarHBondContact O-N 3.37Å; I574-V577 PolarHBondContact O-N 3.31Å; I574-Q578 PolarHBondContact O-N 3.21Å; I574-E614 HydrophobicContact CD1-CB 3.82Å; I574-E614 WeakPolarHBondContact CD1-OE2 3.25Å; I574-L615 HydrophobicContact CB-CD2 4.4Å; I574-L615 HydrophobicContact CG1-CD2 3.97Å; I574-L615 HydrophobicContact CG1-CG 4Å; I574-L618 HydrophobicContact CG2-CD2 4.39Å
575	S	94.6	Very high	92.1	Very high	55 Å²	55	27.7 Å²	27.7	39%	0.385	17%	0.172	S	C	.	.	H	α-helix	trans	-60.8	-44.3	179.7	-44.1	0	0	0	0	112.3	E528 H573 Q578 L579	E528-S575 VanDerWaalsContact CD-CB 3.41Å; E528-S575 WeakPolarHBondContact OE1-CB 3.33Å; E528-S575 PolarHBondContact OE1-OG 3.12Å; H573-S575 PolarHBondContact O-N 3.32Å; S575-Q578 WeakPolarHBondContact O-CB 3.31Å; S575-Q578 PolarHBondContact O-N 3.15Å; S575-L579 WeakPolarHBondContact O-CG 3.13Å; S575-L579 PolarHBondContact O-N 3.02Å
576	V	94.9	Very high	91.8	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-65.9	-41.2	178.3	174.3	0	0	0	0	110.7	C523 E528 V531 A568 H573 I574 Q578 L579 L580	C523-V576 HydrophobicContact CB-CG1 4.27Å; E528-V576 HydrophobicContact CG-CG2 3.94Å; V531-V576 HydrophobicContact CG1-CG1 4.35Å; V531-V576 HydrophobicContact CG2-CG1 3.99Å; V531-V576 HydrophobicContact CG2-CG2 4.5Å; A568-V576 HydrophobicContact CB-CB 4.4Å; A568-V576 HydrophobicContact CB-CG1 3.85Å; H573-V576 HydrophobicContact CB-CB 4.1Å; H573-V576 HydrophobicContact CB-CG2 4.25Å; H573-V576 PolarHBondContact O-N 2.92Å; I574-V576 PolarHBondContact O-N 3.37Å; V576-Q578 VanDerWaalsContact C-N 3.29Å; V576-Q578 PolarHBondContact O-N 2.81Å; V576-L579 PolarHBondContact O-N 3.46Å; V576-L580 HydrophobicContact CG1-CD1 4.1Å; V576-L580 HydrophobicContact CG1-CG 4.37Å; V576-L580 WeakPolarHBondContact O-CG 3.12Å; V576-L580 PolarHBondContact O-N 3.28Å
577	V	95.1	Very high	91.6	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-59.6	-42.8	174.5	172.8	0	0	0	0	110.7	L565 A568 V569 H573 I574 L580 L581 L615 L618	L565-V577 HydrophobicContact CD1-CG1 3.97Å; A568-V577 HydrophobicContact CB-CG2 3.66Å; V569-V577 HydrophobicContact CB-CG2 4.46Å; V569-V577 HydrophobicContact CG2-CB 4.5Å; V569-V577 HydrophobicContact CG2-CG1 4.07Å; V569-V577 HydrophobicContact CG2-CG2 3.52Å; H573-V577 VanDerWaalsContact O-CG2 3.31Å; H573-V577 WeakPolarHBondContact O-CG2 3.35Å; H573-V577 PolarHBondContact O-N 3.04Å; I574-V577 PolarHBondContact O-N 3.31Å; V577-L580 PolarHBondContact O-N 2.93Å; V577-L581 HydrophobicContact CG1-CD1 3.73Å; V577-L581 HydrophobicContact CG1-CG 4.38Å; V577-L581 WeakPolarHBondContact O-CB 3.45Å; V577-L581 WeakPolarHBondContact O-CG 3.23Å; V577-L581 PolarHBondContact O-N 3.33Å; V577-L615 HydrophobicContact CB-CD2 4.1Å; V577-L615 HydrophobicContact CG1-CD2 4.05Å; V577-L615 HydrophobicContact CG2-CD2 3.96Å; V577-L618 HydrophobicContact CB-CD2 4.41Å; V577-L618 HydrophobicContact CG1-CD2 3.81Å
578	Q	94.9	Very high	91.2	Very high	90 Å²	90	33.1 Å²	33.1	42%	0.421	20%	0.198	S	C	.	.	H	α-helix	trans	-62.4	-46.5	175.8	-176.2	174.3	-11.9	0	0	111.8	I574 S575 V576 L580 L581 D582 L618	I574-Q578 PolarHBondContact O-N 3.21Å; S575-Q578 WeakPolarHBondContact O-CB 3.31Å; S575-Q578 PolarHBondContact O-N 3.15Å; V576-Q578 VanDerWaalsContact C-N 3.29Å; V576-Q578 PolarHBondContact O-N 2.81Å; Q578-L580 PolarHBondContact O-N 3.39Å; Q578-L581 PolarHBondContact O-N 2.95Å; Q578-D582 WeakPolarHBondContact CG-OD2 3.49Å; Q578-D582 VanDerWaalsContact O-CB 3.32Å; Q578-D582 WeakPolarHBondContact O-CB 3.43Å; Q578-D582 PolarHBondContact O-N 3.28Å; Q578-L618 HydrophobicContact CB-CD2 4.38Å
579	L	94.3	Very high	90.5	Very high	49 Å²	49	33.2 Å²	33.2	26%	0.257	20%	0.199	S	C	.	.	H	α-helix	trans	-58.1	-46.5	177.1	-72	172.1	0	0	0	112.3	E528 S575 V576 D582 A583	E528-L579 HydrophobicContact CB-CD1 4.18Å; E528-L579 HydrophobicContact CG-CD1 4.43Å; S575-L579 WeakPolarHBondContact O-CG 3.13Å; S575-L579 PolarHBondContact O-N 3.02Å; V576-L579 PolarHBondContact O-N 3.46Å; L579-D582 PolarHBondContact O-N 3.01Å; L579-A583 VanDerWaalsContact O-CB 3.31Å; L579-A583 WeakPolarHBondContact O-CB 3.41Å; L579-A583 PolarHBondContact O-N 3.48Å
580	L	93.6	Very high	89.5	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63.6	-43.6	179	-69.7	172.6	0	0	0	112	V531 I535 L541 A564 L565 A568 V576 V577 Q578 A583 G584 A585	V531-L580 HydrophobicContact CG1-CD2 4.34Å; I535-L580 HydrophobicContact CD1-CD2 4.3Å; L541-L580 HydrophobicContact CD2-CD2 3.91Å; A564-L580 HydrophobicContact CB-CD1 4.38Å; L565-L580 HydrophobicContact CB-CD1 4.34Å; L565-L580 HydrophobicContact CD1-CB 4.11Å; L565-L580 HydrophobicContact CD1-CD1 4.23Å; A568-L580 HydrophobicContact CB-CD1 4.12Å; V576-L580 HydrophobicContact CG1-CD1 4.1Å; V576-L580 HydrophobicContact CG1-CG 4.37Å; V576-L580 WeakPolarHBondContact O-CG 3.12Å; V576-L580 PolarHBondContact O-N 3.28Å; V577-L580 PolarHBondContact O-N 2.93Å; Q578-L580 PolarHBondContact O-N 3.39Å; L580-A583 PolarHBondContact O-N 3.29Å; L580-G584 PolarHBondContact O-N 2.66Å; L580-A585 HydrophobicContact CB-CB 4.12Å; L580-A585 WeakPolarHBondContact O-CB 3.19Å; L580-A585 PolarHBondContact O-N 3.3Å
581	L	93	Very high	88.1	Confident	14 Å²	14	34.9 Å²	34.9	7%	0.073	21%	0.213	C	C	.	.	H	α-helix	trans	-69.3	-33.9	178.6	-67.1	172.3	0	0	0	112.2	L565 V577 Q578 A583 G584 V587 L618 L619 R622	L565-L581 HydrophobicContact CD1-CD2 3.97Å; L565-L581 HydrophobicContact CD1-CG 3.94Å; L565-L581 HydrophobicContact CD2-CD2 3.83Å; V577-L581 HydrophobicContact CG1-CD1 3.73Å; V577-L581 HydrophobicContact CG1-CG 4.38Å; V577-L581 WeakPolarHBondContact O-CB 3.45Å; V577-L581 WeakPolarHBondContact O-CG 3.23Å; V577-L581 PolarHBondContact O-N 3.33Å; Q578-L581 PolarHBondContact O-N 2.95Å; L581-A583 VanDerWaalsContact C-N 3.34Å; L581-G584 PolarHBondContact O-N 2.66Å; L581-V587 HydrophobicContact CD2-CB 4.48Å; L581-V587 HydrophobicContact CD2-CG2 3.96Å; L581-L618 HydrophobicContact CD1-CD2 4.39Å; L581-L618 HydrophobicContact CD1-CG 4.33Å; L581-L619 HydrophobicContact CD1-CD2 4.16Å; L581-R622 HydrophobicContact CD1-CG 4.06Å
582	D	93	Very high	86.4	Confident	95 Å²	95	35.9 Å²	35.9	51%	0.508	22%	0.221	S	C	.	.	H	α-helix	trans	-71.4	-31.3	174.6	-68	-9.7	0	0	0	111.4	Q578 L579 G584 R622	Q578-D582 WeakPolarHBondContact CG-OD2 3.49Å; Q578-D582 VanDerWaalsContact O-CB 3.32Å; Q578-D582 WeakPolarHBondContact O-CB 3.43Å; Q578-D582 PolarHBondContact O-N 3.28Å; L579-D582 PolarHBondContact O-N 3.01Å; D582-G584 PolarHBondContact O-N 3.28Å; D582-R622 IonicContact OD1-CZ 3.41Å; D582-R622 IonicContact OD1-NH1 3.7Å; D582-R622 PolarHBondContact OD1-NH1 2.67Å; D582-R622 IonicContact OD1-NH2 2.69Å; D582-R622 PolarHBondContact OD1-NH2 2.7Å
583	A	91	Very high	84.4	Confident	50 Å²	50	40.6 Å²	40.6	41%	0.413	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-3.4	172.8	0	0	0	0	0	114	I535 L541 L579 L580 L581	I535-A583 HydrophobicContact CD1-CB 4.24Å; I535-A583 HydrophobicContact CG2-CB 4.37Å; L541-A583 HydrophobicContact CD1-CB 3.75Å; L579-A583 VanDerWaalsContact O-CB 3.31Å; L579-A583 WeakPolarHBondContact O-CB 3.41Å; L579-A583 PolarHBondContact O-N 3.48Å; L580-A583 PolarHBondContact O-N 3.29Å; L581-A583 VanDerWaalsContact C-N 3.34Å
584	G	88.1	Confident	82.2	Confident	56 Å²	56	40.2 Å²	40.2	58%	0.577	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	94.3	18.2	174.2	0	0	0	0	0	115.7	L580 L581 D582	L580-G584 PolarHBondContact O-N 2.66Å; L581-G584 PolarHBondContact O-N 2.66Å; D582-G584 PolarHBondContact O-N 3.28Å
585	A	89.2	Confident	79.7	Confident	7 Å²	7	41.3 Å²	41.3	6%	0.058	27%	0.268	C	S	.	.			trans	-59.2	146.2	172.9	0	0	0	0	0	111.9	L541 L580 V587	L541-A585 HydrophobicContact CB-CB 4.05Å; L541-A585 HydrophobicContact CD1-CB 3.92Å; L580-A585 HydrophobicContact CB-CB 4.12Å; L580-A585 WeakPolarHBondContact O-CB 3.19Å; L580-A585 PolarHBondContact O-N 3.3Å; A585-V587 PolarHBondContact O-N 3.1Å
586	H	86.4	Confident	77.2	Confident	78 Å²	78	46.8 Å²	46.8	36%	0.361	29%	0.288	S	S	.	.			trans	-68.1	123.6	179.9	-161.5	67.9	0	0	0	111.7	D542 L565 E588 G589	D542-H586 PolarHBondContact OD1-N 3.25Å; L565-H586 WeakPolarHBondContact CD2-O 3.32Å; H586-E588 PolarHBondContact O-N 3.39Å; H586-G589 PolarHBondContact CD2-O 3.38Å; H586-G589 VanDerWaalsContact CD2-O 3.28Å; H586-G589 PolarHBondContact O-N 3.3Å
587	V	86	Confident	74.9	Confident	27 Å²	27	52.5 Å²	52.5	16%	0.164	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-33.3	-173.9	-178.6	0	0	0	0	112.6	L581 A585 G589 P603 L619 R622 A624	L581-V587 HydrophobicContact CD2-CB 4.48Å; L581-V587 HydrophobicContact CD2-CG2 3.96Å; A585-V587 PolarHBondContact O-N 3.1Å; V587-G589 VanDerWaalsContact C-N 3.34Å; V587-P603 WeakPolarHBondContact O-CG 3.36Å; V587-L619 HydrophobicContact CG1-CD2 4.35Å; V587-R622 HydrophobicContact CG1-CB 4.41Å; V587-R622 HydrophobicContact CG2-CB 3.92Å; V587-A624 HydrophobicContact CG1-CB 3.68Å
588	E	80.7	Confident	72.9	Confident	16 Å²	16	55.5 Å²	55.5	8%	0.075	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-0.7	178.3	-57.3	-59.7	161.2	0	0	113.4	H586 A591 V592 P603 A624 D625 L628	H586-E588 PolarHBondContact O-N 3.39Å; E588-A591 WeakPolarHBondContact O-CB 3.26Å; E588-V592 HydrophobicContact CB-CG2 3.87Å; E588-V592 HydrophobicContact CG-CG2 4.31Å; E588-P603 WeakPolarHBondContact O-CD 3.18Å; E588-A624 WeakPolarHBondContact OE1-CA 3.48Å; E588-D625 PolarHBondContact OE1-N 3.32Å; E588-L628 HydrophobicContact CB-CD2 3.91Å; E588-L628 HydrophobicContact CG-CD2 3.73Å
589	G	78.4	Confident	71.1	Confident	2 Å²	2	55.3 Å²	55.3	2%	0.021	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.1	-137.5	-174.2	0	0	0	0	0	112.5	H586 V587 A591	H586-G589 PolarHBondContact CD2-O 3.38Å; H586-G589 VanDerWaalsContact CD2-O 3.28Å; H586-G589 PolarHBondContact O-N 3.3Å; V587-G589 VanDerWaalsContact C-N 3.34Å; G589-A591 VanDerWaalsContact C-N 3.34Å
590	S	71.4	Confident	69.8	Low	7 Å²	7	54 Å²	54	5%	0.049	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-1.5	-179.9	-166.6	0	0	0	0	114	H561 V592 N593 S594	H561-S590 WeakPolarHBondContact O-CB 3.47Å; S590-V592 PolarHBondContact O-N 2.98Å; S590-N593 PolarHBondContact O-N 3.47Å; S590-N593 VanDerWaalsContact O-N 3.11Å; S590-S594 PolarHBondContact O-OG 3.21Å
591	A	59.7	Low	69	Low	29 Å²	29	54.5 Å²	54.5	24%	0.24	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-21.1	-171.3	0	0	0	0	0	113.8	E588 G589 T602 L628	E588-A591 WeakPolarHBondContact O-CB 3.26Å; G589-A591 VanDerWaalsContact C-N 3.34Å; A591-T602 HydrophobicContact CB-CG2 3.76Å; A591-L628 HydrophobicContact CB-CD2 4.43Å
592	V	51.9	Low	68.6	Low	60 Å²	60	54.2 Å²	54.2	36%	0.364	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-15.3	-177.5	-176.4	0	0	0	0	113	E588 S590 L628	E588-V592 HydrophobicContact CB-CG2 3.87Å; E588-V592 HydrophobicContact CG-CG2 4.31Å; S590-V592 PolarHBondContact O-N 2.98Å; V592-L628 HydrophobicContact CG2-CD2 4.04Å
593	N	48	Very low	68.5	Low	117 Å²	117	49.7 Å²	49.7	63%	0.626	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	0.6	-167.6	-67.8	-34	0	0	0	114.3	S590 G595	S590-N593 PolarHBondContact O-N 3.47Å; S590-N593 VanDerWaalsContact O-N 3.11Å; N593-G595 PolarHBondContact O-N 3.04Å
594	S	47.1	Very low	68.4	Low	41 Å²	41	47.4 Å²	47.4	29%	0.287	28%	0.284	S	S	.	.			trans	-99.9	89.3	-171.3	-63.4	0	0	0	0	111.6	S590	S590-S594 PolarHBondContact O-OG 3.21Å
595	G	42	Very low	68.4	Low	73 Å²	73	45 Å²	45	75%	0.753	26%	0.258	S	S	*	.			trans	-64.1	134.5	164.4	0	0	0	0	0	111.5	N593	N593-G595 PolarHBondContact O-N 3.04Å
596	E	42.8	Very low	68.4	Low	171 Å²	171	44.8 Å²	44.8	80%	0.799	26%	0.256	S	S	*	.	S	Bend	trans	60.6	115.6	173.6	-64.1	-176.4	165.3	0	0	117.5	N598	E596-N598 PolarHBondContact O-N 3.4Å
597	D	47.2	Very low	68.6	Low	120 Å²	120	41 Å²	41	64%	0.642	24%	0.239	S	C	*	.	S	Bend	trans	65.5	27.5	153.2	-67.5	-13.7	0	0	0	120.3	S637	D597-S637 PolarHBondContact OD1-OG 2.85Å
598	N	52.5	Low	68.9	Low	64 Å²	64	39.8 Å²	39.8	34%	0.342	23%	0.231	S	C	.	.			trans	-141.8	116.1	171.1	-66.5	-77.3	0	0	0	115.3	H561 E596	H561-N598 WeakPolarHBondContact NE2-CB 3.43Å; E596-N598 PolarHBondContact O-N 3.4Å
599	Y	57.8	Low	69.3	Low	86 Å²	86	39.2 Å²	39.2	34%	0.337	23%	0.229	S	C	.	.			trans	-62.7	124	173.3	178.5	-99.2	0	0	0	111.8	E601 D643	Y599-E601 HydrophobicContact CD1-CG 4.49Å; Y599-E601 HydrophobicContact CE1-CG 3.51Å; Y599-D643 WeakPolarHBondContact CD2-OD1 3.5Å; Y599-D643 HydrophobicContact CE2-CB 4.36Å; Y599-D643 VanDerWaalsContact CE2-OD1 3.26Å; Y599-D643 WeakPolarHBondContact CE2-OD1 3.3Å
600	A	66.4	Low	69.8	Low	20 Å²	20	40.1 Å²	40.1	17%	0.165	24%	0.237	C	C	.	.			trans	-127.6	120.1	172.3	0	0	0	0	0	109.7	H561 T602	H561-A600 HydrophobicContact CB-CB 3.87Å; A600-T602 PolarHBondContact O-N 3.36Å
601	E	76.1	Confident	70.7	Confident	11 Å²	11	40.9 Å²	40.9	5%	0.051	25%	0.245	C	C	.	.			trans	-68.8	129.7	175.4	-69.6	173.4	167.4	0	0	110.2	K149 Y599 L606	K149-E601 IonicContact NZ-OE1 3.47Å; K149-E601 PolarHBondContact NZ-OE1 3.05Å; K149-E601 IonicContact NZ-OE2 3.58Å; K149-E601 PolarHBondContact NZ-OE2 3.08Å; Y599-E601 HydrophobicContact CD1-CG 4.49Å; Y599-E601 HydrophobicContact CE1-CG 3.51Å; E601-L606 HydrophobicContact CB-CD2 4.28Å; E601-L606 HydrophobicContact CB-CG 4.18Å; E601-L606 WeakPolarHBondContact OE2-CD2 3.41Å
602	T	85.8	Confident	72.2	Confident	9 Å²	9	41.5 Å²	41.5	6%	0.055	25%	0.245	C	C	.	.			trans	-66.4	151.5	173.7	59.5	0	0	0	0	111	A591 A600 L604 Q605 L606 L628	A591-T602 HydrophobicContact CB-CG2 3.76Å; A600-T602 PolarHBondContact O-N 3.36Å; T602-L604 PolarHBondContact O-N 3.14Å; T602-L604 VanDerWaalsContact O-N 3.15Å; T602-Q605 PolarHBondContact O-N 3.38Å; T602-Q605 VanDerWaalsContact O-N 3.09Å; T602-Q605 WeakPolarHBondContact OG1-CB 3.23Å; T602-Q605 VanDerWaalsContact OG1-CD 3.3Å; T602-Q605 VanDerWaalsContact OG1-CG 3.23Å; T602-Q605 WeakPolarHBondContact OG1-CG 3.14Å; T602-Q605 PolarHBondContact OG1-N 2.85Å; T602-Q605 VanDerWaalsContact OG1-N 3.15Å; T602-Q605 PolarHBondContact OG1-OE1 3.5Å; T602-L606 PolarHBondContact O-N 3.15Å; T602-L606 VanDerWaalsContact O-N 3.11Å; T602-L628 HydrophobicContact CG2-CD2 4Å
603	P	89.2	Confident	74.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-51	-37.8	170.9	-26.6	34.2	0	0	0	112.9	L565 T566 V569 V587 E588 L606 A607 L619	L565-P603 HydrophobicContact CD2-CG 4.06Å; L565-P603 HydrophobicContact CG-CG 4.38Å; T566-P603 HydrophobicContact CG2-CG 3.7Å; V569-P603 HydrophobicContact CB-CB 4.45Å; V569-P603 HydrophobicContact CG1-CB 4.41Å; V569-P603 WeakPolarHBondContact CG1-O 3.4Å; V569-P603 HydrophobicContact CG2-CB 4.12Å; V587-P603 WeakPolarHBondContact O-CG 3.36Å; E588-P603 WeakPolarHBondContact O-CD 3.18Å; P603-L606 PolarHBondContact O-N 2.8Å; P603-A607 WeakPolarHBondContact O-CB 3.43Å; P603-A607 PolarHBondContact O-N 3Å; P603-L619 HydrophobicContact CB-CD1 3.98Å; P603-L619 HydrophobicContact CB-CD2 4.2Å
604	L	90.1	Very high	76.3	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-68.2	-39.2	179.3	-174.7	63.5	0	0	0	112.7	T602 A607 S608 V616 L619 L620 A624 P626 L662	T602-L604 PolarHBondContact O-N 3.14Å; T602-L604 VanDerWaalsContact O-N 3.15Å; L604-A607 PolarHBondContact O-N 2.66Å; L604-S608 VanDerWaalsContact O-CB 3.28Å; L604-S608 WeakPolarHBondContact O-CB 3.45Å; L604-S608 PolarHBondContact O-N 2.71Å; L604-S608 PolarHBondContact O-OG 2.98Å; L604-V616 HydrophobicContact CD1-CG1 4.13Å; L604-V616 HydrophobicContact CD1-CG2 4.44Å; L604-L619 HydrophobicContact CB-CD1 4.43Å; L604-L619 HydrophobicContact CD1-CB 4.22Å; L604-L619 HydrophobicContact CD1-CD1 4.44Å; L604-L620 HydrophobicContact CD1-CD2 4.18Å; L604-L620 HydrophobicContact CD1-CG 4.16Å; L604-L620 HydrophobicContact CD2-CD2 3.86Å; L604-A624 HydrophobicContact CB-CB 4.4Å; L604-A624 HydrophobicContact CD2-CB 4.02Å; L604-P626 HydrophobicContact CD2-CB 4.21Å; L604-L662 HydrophobicContact CD1-CD2 4.33Å; L604-L662 HydrophobicContact CD2-CD2 4.42Å
605	Q	88.4	Confident	78.5	Confident	6 Å²	6	42.4 Å²	42.4	3%	0.028	23%	0.233	C	C	.	.	H	α-helix	trans	-61.5	-45.5	173	-77.7	163	-46.7	0	0	111.1	T602 A607 S608 A609 S629 M644 C646	T602-Q605 PolarHBondContact O-N 3.38Å; T602-Q605 VanDerWaalsContact O-N 3.09Å; T602-Q605 WeakPolarHBondContact OG1-CB 3.23Å; T602-Q605 VanDerWaalsContact OG1-CD 3.3Å; T602-Q605 VanDerWaalsContact OG1-CG 3.23Å; T602-Q605 WeakPolarHBondContact OG1-CG 3.14Å; T602-Q605 PolarHBondContact OG1-N 2.85Å; T602-Q605 VanDerWaalsContact OG1-N 3.15Å; T602-Q605 PolarHBondContact OG1-OE1 3.5Å; Q605-A607 PolarHBondContact O-N 3.28Å; Q605-S608 PolarHBondContact O-N 3.15Å; Q605-A609 WeakPolarHBondContact O-CB 3.45Å; Q605-A609 PolarHBondContact O-N 3.36Å; Q605-S629 PolarHBondContact NE2-OG 3.45Å; Q605-M644 PolarHBondContact NE2-O 3.3Å; Q605-C646 HydrophobicContact CG-CB 4.37Å
606	L	88.6	Confident	81	Confident	2 Å²	2	39 Å²	39	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-61.8	-42.5	177.7	-71.2	175.4	0	0	0	112.8	R219 V569 L570 E601 T602 P603 S608 A610	R219-L606 PolarHBondContact NE-O 3.12Å; V569-L606 HydrophobicContact CG1-CB 4.15Å; L570-L606 HydrophobicContact CD1-CD1 4.43Å; L570-L606 HydrophobicContact CD1-CD2 4Å; E601-L606 HydrophobicContact CB-CD2 4.28Å; E601-L606 HydrophobicContact CB-CG 4.18Å; E601-L606 WeakPolarHBondContact OE2-CD2 3.41Å; T602-L606 PolarHBondContact O-N 3.15Å; T602-L606 VanDerWaalsContact O-N 3.11Å; P603-L606 PolarHBondContact O-N 2.8Å; L606-S608 VanDerWaalsContact C-N 3.35Å; L606-A610 WeakPolarHBondContact O-CB 3.38Å; L606-A610 PolarHBondContact O-N 3.47Å; L606-A610 VanDerWaalsContact O-N 3.16Å
607	A	91.6	Very high	83.4	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-67.1	-37.3	175.8	0	0	0	0	0	111.8	V569 P603 L604 Q605 A610 G611 N612 L615 V616 L619	V569-A607 HydrophobicContact CG1-CB 4.03Å; P603-A607 WeakPolarHBondContact O-CB 3.43Å; P603-A607 PolarHBondContact O-N 3Å; L604-A607 PolarHBondContact O-N 2.66Å; Q605-A607 PolarHBondContact O-N 3.28Å; A607-A610 PolarHBondContact O-N 3.46Å; A607-G611 PolarHBondContact O-N 2.95Å; A607-G611 VanDerWaalsContact O-N 3.13Å; A607-N612 PolarHBondContact O-N 3.17Å; A607-L615 HydrophobicContact CB-CB 3.95Å; A607-V616 HydrophobicContact CB-CG2 3.75Å; A607-L619 HydrophobicContact CB-CD1 4.09Å
608	S	91.4	Very high	85.5	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-68.9	-40.8	179.2	-59.9	0	0	0	0	112.5	L604 Q605 L606 A610 G611 H655	L604-S608 VanDerWaalsContact O-CB 3.28Å; L604-S608 WeakPolarHBondContact O-CB 3.45Å; L604-S608 PolarHBondContact O-N 2.71Å; L604-S608 PolarHBondContact O-OG 2.98Å; Q605-S608 PolarHBondContact O-N 3.15Å; L606-S608 VanDerWaalsContact C-N 3.35Å; S608-A610 VanDerWaalsContact C-N 3.34Å; S608-G611 PolarHBondContact O-N 3.48Å; S608-H655 PolarHBondContact O-CD2 3.12Å
609	A	89.8	Confident	87.4	Confident	5 Å²	5	24.6 Å²	24.6	4%	0.041	13%	0.127	C	C	.	.	H	α-helix	trans	-65.3	-37.2	174	0	0	0	0	0	112.1	R219 Q605 G611 H649 H655	R219-A609 HydrophobicContact CG-CB 4.02Å; Q605-A609 WeakPolarHBondContact O-CB 3.45Å; Q605-A609 PolarHBondContact O-N 3.36Å; A609-G611 VanDerWaalsContact C-N 3.28Å; A609-G611 PolarHBondContact O-N 3.29Å; A609-H649 HydrophobicContact CB-CB 4.1Å; A609-H655 PolarHBondContact O-CD2 2.78Å; A609-H655 VanDerWaalsContact O-CD2 3.31Å; A609-H655 PolarHBondContact O-NE2 3.4Å
610	A	88.6	Confident	89	Confident	21 Å²	21	21 Å²	21	17%	0.174	11%	0.114	C	C	.	.	H	α-helix	trans	-71.8	-20.2	177	0	0	0	0	0	114.1	V218 R219 L606 A607 S608 N612	V218-A610 HydrophobicContact CG1-CB 3.56Å; R219-A610 HydrophobicContact CG-CB 4.34Å; L606-A610 WeakPolarHBondContact O-CB 3.38Å; L606-A610 PolarHBondContact O-N 3.47Å; L606-A610 VanDerWaalsContact O-N 3.16Å; A607-A610 PolarHBondContact O-N 3.46Å; S608-A610 VanDerWaalsContact C-N 3.34Å; A610-N612 VanDerWaalsContact C-N 3.27Å; A610-N612 PolarHBondContact O-N 2.94Å
611	G	89.9	Confident	90.1	Very high	22 Å²	22	24 Å²	24	23%	0.227	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	14.3	-174.5	0	0	0	0	0	114	A607 S608 A609 Y613 H655	A607-G611 PolarHBondContact O-N 2.95Å; A607-G611 VanDerWaalsContact O-N 3.13Å; S608-G611 PolarHBondContact O-N 3.48Å; A609-G611 VanDerWaalsContact C-N 3.28Å; A609-G611 PolarHBondContact O-N 3.29Å; G611-Y613 PolarHBondContact O-N 3.26Å; G611-H655 WeakPolarHBondContact CA-CD2 3.32Å; G611-H655 VanDerWaalsContact CA-CG 3.41Å; G611-H655 WeakPolarHBondContact CA-NE2 3.49Å; G611-H655 PolarHBondContact N-CD2 3.37Å; G611-H655 VanDerWaalsContact N-CD2 3.32Å; G611-H655 PolarHBondContact N-NE2 2.97Å
612	N	91.8	Very high	90.7	Very high	43 Å²	43	27.6 Å²	27.6	23%	0.23	15%	0.147	C	C	.	.			trans	-78.4	93.9	-178.8	-170.5	-25.3	0	0	0	110.3	A607 A610 E614 L615 V616	A607-N612 PolarHBondContact O-N 3.17Å; A610-N612 VanDerWaalsContact C-N 3.27Å; A610-N612 PolarHBondContact O-N 2.94Å; N612-E614 VanDerWaalsContact C-N 3.27Å; N612-E614 PolarHBondContact O-N 2.93Å; N612-E614 PolarHBondContact OD1-N 3.07Å; N612-L615 HydrophobicContact CB-CB 4.16Å; N612-L615 HydrophobicContact CB-CD1 4.16Å; N612-L615 HydrophobicContact CB-CG 4.41Å; N612-L615 VanDerWaalsContact ND2-CD1 3.3Å; N612-L615 WeakPolarHBondContact ND2-CD1 3.36Å; N612-L615 PolarHBondContact O-N 3.24Å; N612-L615 PolarHBondContact OD1-N 3.4Å; N612-V616 WeakPolarHBondContact O-CG2 3.47Å; N612-V616 PolarHBondContact O-N 3.31Å
613	Y	92.9	Very high	90.6	Very high	109 Å²	109	29.3 Å²	29.3	43%	0.427	17%	0.167	S	C	.	.	H	α-helix	trans	-57.9	-36.4	-178.5	179.6	-88.7	0	0	0	113.4	G611 S617 K661	G611-Y613 PolarHBondContact O-N 3.26Å; Y613-S617 WeakPolarHBondContact CE1-OG 3.46Å; Y613-S617 WeakPolarHBondContact O-CB 3.48Å; Y613-S617 PolarHBondContact O-N 2.88Å; Y613-S617 PolarHBondContact O-OG 2.84Å; Y613-K661 HydrophobicContact CD2-CB 4.32Å; Y613-K661 HydrophobicContact CE2-CB 3.81Å; Y613-K661 HydrophobicContact CE2-CD 4.17Å; Y613-K661 HydrophobicContact CE2-CG 3.99Å
614	E	93.4	Very high	90.4	Very high	127 Å²	127	29.7 Å²	29.7	59%	0.593	17%	0.17	S	C	*	.	H	α-helix	trans	-70.3	-46.6	-178.2	-65.2	-176.1	179.3	0	0	111	I574 N612 V616 S617 L618	I574-E614 HydrophobicContact CD1-CB 3.82Å; I574-E614 WeakPolarHBondContact CD1-OE2 3.25Å; N612-E614 VanDerWaalsContact C-N 3.27Å; N612-E614 PolarHBondContact O-N 2.93Å; N612-E614 PolarHBondContact OD1-N 3.07Å; E614-V616 PolarHBondContact O-N 3.23Å; E614-S617 PolarHBondContact O-N 3.48Å; E614-L618 WeakPolarHBondContact O-CB 3.49Å; E614-L618 PolarHBondContact O-N 2.73Å
615	L	93	Very high	90	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-61.4	-43.3	174.1	-78	176.6	0	0	0	112.3	V569 I574 V577 A607 N612 S617 L618 L619	V569-L615 HydrophobicContact CG1-CD1 4.35Å; I574-L615 HydrophobicContact CB-CD2 4.4Å; I574-L615 HydrophobicContact CG1-CD2 3.97Å; I574-L615 HydrophobicContact CG1-CG 4Å; V577-L615 HydrophobicContact CB-CD2 4.1Å; V577-L615 HydrophobicContact CG1-CD2 4.05Å; V577-L615 HydrophobicContact CG2-CD2 3.96Å; A607-L615 HydrophobicContact CB-CB 3.95Å; N612-L615 HydrophobicContact CB-CB 4.16Å; N612-L615 HydrophobicContact CB-CD1 4.16Å; N612-L615 HydrophobicContact CB-CG 4.41Å; N612-L615 VanDerWaalsContact ND2-CD1 3.3Å; N612-L615 WeakPolarHBondContact ND2-CD1 3.36Å; N612-L615 PolarHBondContact O-N 3.24Å; N612-L615 PolarHBondContact OD1-N 3.4Å; L615-S617 VanDerWaalsContact C-N 3.3Å; L615-S617 PolarHBondContact O-N 3.36Å; L615-L618 PolarHBondContact O-N 3.24Å; L615-L619 WeakPolarHBondContact O-CB 3.3Å; L615-L619 WeakPolarHBondContact O-CG 3.17Å; L615-L619 PolarHBondContact O-N 2.74Å
616	V	93.7	Very high	89.6	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-60.5	-43.5	175.7	170.4	0	0	0	0	110.4	L604 A607 N612 E614 L620 V658 K661 L662	L604-V616 HydrophobicContact CD1-CG1 4.13Å; L604-V616 HydrophobicContact CD1-CG2 4.44Å; A607-V616 HydrophobicContact CB-CG2 3.75Å; N612-V616 WeakPolarHBondContact O-CG2 3.47Å; N612-V616 PolarHBondContact O-N 3.31Å; E614-V616 PolarHBondContact O-N 3.23Å; V616-L620 HydrophobicContact CG1-CD1 3.69Å; V616-L620 HydrophobicContact CG1-CG 4.31Å; V616-L620 VanDerWaalsContact O-CB 3.31Å; V616-L620 WeakPolarHBondContact O-CB 3.41Å; V616-L620 WeakPolarHBondContact O-CD1 3.28Å; V616-L620 WeakPolarHBondContact O-CG 3.31Å; V616-L620 PolarHBondContact O-N 3.47Å; V616-V658 HydrophobicContact CG1-CG1 4.3Å; V616-V658 HydrophobicContact CG2-CG1 3.92Å; V616-K661 HydrophobicContact CG1-CG 4.38Å; V616-L662 HydrophobicContact CG1-CD2 4.06Å; V616-L662 HydrophobicContact CG1-CG 4.44Å
617	S	92.8	Very high	89	Confident	27 Å²	27	34.1 Å²	34.1	19%	0.189	20%	0.195	C	C	.	.	H	α-helix	trans	-65.3	-40.5	178	-62.4	0	0	0	0	112.4	Y613 E614 L615 S621 K661	Y613-S617 WeakPolarHBondContact CE1-OG 3.46Å; Y613-S617 WeakPolarHBondContact O-CB 3.48Å; Y613-S617 PolarHBondContact O-N 2.88Å; Y613-S617 PolarHBondContact O-OG 2.84Å; E614-S617 PolarHBondContact O-N 3.48Å; L615-S617 VanDerWaalsContact C-N 3.3Å; L615-S617 PolarHBondContact O-N 3.36Å; S617-S621 WeakPolarHBondContact O-CB 3.35Å; S617-S621 PolarHBondContact O-N 3.4Å; S617-K661 WeakPolarHBondContact OG-CE 3.36Å
618	L	92.8	Very high	87.8	Confident	26 Å²	26	36.3 Å²	36.3	14%	0.136	21%	0.206	C	C	.	.	H	α-helix	trans	-63.5	-52.8	177.3	-177.7	65.1	0	0	0	110.9	I574 V577 Q578 L581 E614 L615 L620 S621 R622	I574-L618 HydrophobicContact CG2-CD2 4.39Å; V577-L618 HydrophobicContact CB-CD2 4.41Å; V577-L618 HydrophobicContact CG1-CD2 3.81Å; Q578-L618 HydrophobicContact CB-CD2 4.38Å; L581-L618 HydrophobicContact CD1-CD2 4.39Å; L581-L618 HydrophobicContact CD1-CG 4.33Å; E614-L618 WeakPolarHBondContact O-CB 3.49Å; E614-L618 PolarHBondContact O-N 2.73Å; L615-L618 PolarHBondContact O-N 3.24Å; L618-L620 PolarHBondContact O-N 3.34Å; L618-S621 WeakPolarHBondContact O-CB 3.5Å; L618-S621 PolarHBondContact O-N 3.35Å; L618-S621 VanDerWaalsContact O-N 3.11Å; L618-S621 PolarHBondContact O-OG 2.96Å; L618-R622 WeakPolarHBondContact O-CG 3.32Å; L618-R622 PolarHBondContact O-N 2.89Å; L618-R622 VanDerWaalsContact O-N 3.17Å
619	L	91.9	Very high	86.2	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.2	-45.1	179.9	-69.6	170.5	0	0	0	111.8	V569 L581 V587 P603 L604 A607 L615 S621 R622 G623 A624	V569-L619 HydrophobicContact CG2-CD1 4.44Å; L581-L619 HydrophobicContact CD1-CD2 4.16Å; V587-L619 HydrophobicContact CG1-CD2 4.35Å; P603-L619 HydrophobicContact CB-CD1 3.98Å; P603-L619 HydrophobicContact CB-CD2 4.2Å; L604-L619 HydrophobicContact CB-CD1 4.43Å; L604-L619 HydrophobicContact CD1-CB 4.22Å; L604-L619 HydrophobicContact CD1-CD1 4.44Å; A607-L619 HydrophobicContact CB-CD1 4.09Å; L615-L619 WeakPolarHBondContact O-CB 3.3Å; L615-L619 WeakPolarHBondContact O-CG 3.17Å; L615-L619 PolarHBondContact O-N 2.74Å; L619-S621 VanDerWaalsContact C-N 3.3Å; L619-S621 PolarHBondContact O-N 3.23Å; L619-R622 PolarHBondContact O-N 3.39Å; L619-R622 VanDerWaalsContact O-N 3.12Å; L619-G623 PolarHBondContact O-N 2.91Å; L619-A624 HydrophobicContact CB-CB 4.03Å; L619-A624 VanDerWaalsContact O-CB 3.27Å; L619-A624 WeakPolarHBondContact O-CB 3.42Å; L619-A624 PolarHBondContact O-N 3.5Å; L619-A624 VanDerWaalsContact O-N 3.1Å
620	L	90.1	Very high	84.3	Confident	11 Å²	11	40.5 Å²	40.5	6%	0.058	23%	0.229	C	C	.	.	H	α-helix	trans	-63.3	-35.2	176.1	-68.6	172.8	0	0	0	112.4	L604 V616 L618 R622 G623 K661 L662 Q665	L604-L620 HydrophobicContact CD1-CD2 4.18Å; L604-L620 HydrophobicContact CD1-CG 4.16Å; L604-L620 HydrophobicContact CD2-CD2 3.86Å; V616-L620 HydrophobicContact CG1-CD1 3.69Å; V616-L620 HydrophobicContact CG1-CG 4.31Å; V616-L620 VanDerWaalsContact O-CB 3.31Å; V616-L620 WeakPolarHBondContact O-CB 3.41Å; V616-L620 WeakPolarHBondContact O-CD1 3.28Å; V616-L620 WeakPolarHBondContact O-CG 3.31Å; V616-L620 PolarHBondContact O-N 3.47Å; L618-L620 PolarHBondContact O-N 3.34Å; L620-R622 PolarHBondContact O-N 2.92Å; L620-G623 PolarHBondContact O-N 3.44Å; L620-K661 HydrophobicContact CD1-CG 4.2Å; L620-L662 HydrophobicContact CD1-CD2 4.19Å; L620-L662 HydrophobicContact CD2-CD2 4.47Å; L620-Q665 HydrophobicContact CD1-CG 3.9Å; L620-Q665 HydrophobicContact CD2-CG 4.04Å; L620-Q665 HydrophobicContact CG-CG 4.39Å
621	S	90.1	Very high	82.1	Confident	83 Å²	83	44.8 Å²	44.8	58%	0.58	25%	0.249	S	C	*	.	H	α-helix	trans	-67	-25.8	176.3	77.7	0	0	0	0	113.2	S617 L618 L619 G623	S617-S621 WeakPolarHBondContact O-CB 3.35Å; S617-S621 PolarHBondContact O-N 3.4Å; L618-S621 WeakPolarHBondContact O-CB 3.5Å; L618-S621 PolarHBondContact O-N 3.35Å; L618-S621 VanDerWaalsContact O-N 3.11Å; L618-S621 PolarHBondContact O-OG 2.96Å; L619-S621 VanDerWaalsContact C-N 3.3Å; L619-S621 PolarHBondContact O-N 3.23Å; S621-G623 VanDerWaalsContact C-N 3.33Å
622	R	88.4	Confident	79.8	Confident	87 Å²	87	50.4 Å²	50.4	33%	0.328	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	5.8	175.9	-56.4	-55	179	87.9	-4	113.1	L581 D582 V587 L618 L619 L620	L581-R622 HydrophobicContact CD1-CG 4.06Å; D582-R622 IonicContact OD1-CZ 3.41Å; D582-R622 IonicContact OD1-NH1 3.7Å; D582-R622 PolarHBondContact OD1-NH1 2.67Å; D582-R622 IonicContact OD1-NH2 2.69Å; D582-R622 PolarHBondContact OD1-NH2 2.7Å; V587-R622 HydrophobicContact CG1-CB 4.41Å; V587-R622 HydrophobicContact CG2-CB 3.92Å; L618-R622 WeakPolarHBondContact O-CG 3.32Å; L618-R622 PolarHBondContact O-N 2.89Å; L618-R622 VanDerWaalsContact O-N 3.17Å; L619-R622 PolarHBondContact O-N 3.39Å; L619-R622 VanDerWaalsContact O-N 3.12Å; L620-R622 PolarHBondContact O-N 2.92Å
623	G	84.1	Confident	77.2	Confident	45 Å²	45	52.6 Å²	52.6	46%	0.464	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.7	21.7	172.6	0	0	0	0	0	115.5	L619 L620 S621	L619-G623 PolarHBondContact O-N 2.91Å; L620-G623 PolarHBondContact O-N 3.44Å; S621-G623 VanDerWaalsContact C-N 3.33Å
624	A	85	Confident	74.3	Confident	8 Å²	8	55 Å²	55	7%	0.066	30%	0.304	C	S	.	.			trans	-62.4	135.6	175.4	0	0	0	0	0	112.3	V587 E588 L604 L619	V587-A624 HydrophobicContact CG1-CB 3.68Å; E588-A624 WeakPolarHBondContact OE1-CA 3.48Å; L604-A624 HydrophobicContact CB-CB 4.4Å; L604-A624 HydrophobicContact CD2-CB 4.02Å; L619-A624 HydrophobicContact CB-CB 4.03Å; L619-A624 VanDerWaalsContact O-CB 3.27Å; L619-A624 WeakPolarHBondContact O-CB 3.42Å; L619-A624 PolarHBondContact O-N 3.5Å; L619-A624 VanDerWaalsContact O-N 3.1Å
625	D	81.4	Confident	71.7	Confident	47 Å²	47	51.8 Å²	51.8	25%	0.251	31%	0.305	S	S	.	.			trans	-94.1	115.9	-179.6	-170.8	-11	0	0	0	111.8	E588 L627 L628	E588-D625 PolarHBondContact OE1-N 3.32Å; D625-L627 PolarHBondContact O-N 3.37Å; D625-L627 PolarHBondContact OD1-N 3.26Å; D625-L628 HydrophobicContact CB-CB 4.29Å
626	P	81.3	Confident	69	Low	24 Å²	24	60.8 Å²	60.8	16%	0.156	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-15.5	177.6	27.6	-34.8	0	0	0	114.7	L604 C646 F647 L662	L604-P626 HydrophobicContact CD2-CB 4.21Å; P626-C646 VanDerWaalsContact CA-SG 3.54Å; P626-C646 WeakPolarHBondContact CB-SG 3.37Å; P626-C646 PolarHBondContact O-SG 3.28Å; P626-F647 HydrophobicContact CB-CE2 4.03Å; P626-F647 HydrophobicContact CB-CZ 4.09Å; P626-F647 HydrophobicContact CG-CZ 4.47Å; P626-L662 HydrophobicContact CB-CD2 4.4Å
627	L	74.4	Confident	65.9	Low	31 Å²	31	63.8 Å²	63.8	16%	0.162	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	1.5	-175.8	-65.3	175.5	0	0	0	114.1	D625 S629 M630 F647 R705 A708	D625-L627 PolarHBondContact O-N 3.37Å; D625-L627 PolarHBondContact OD1-N 3.26Å; L627-S629 PolarHBondContact O-N 3.41Å; L627-M630 PolarHBondContact O-N 3.28Å; L627-F647 HydrophobicContact CD2-CD2 4.48Å; L627-F647 HydrophobicContact CD2-CE2 3.84Å; L627-R705 HydrophobicContact CD1-CB 4.49Å; L627-A708 HydrophobicContact CD2-CB 4.1Å
628	L	66.8	Low	63.1	Low	45 Å²	45	66 Å²	66	24%	0.236	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-53.8	-32.8	-172.7	-164.4	74.7	0	0	0	113.8	E588 A591 V592 T602 D625 M630 L631	E588-L628 HydrophobicContact CB-CD2 3.91Å; E588-L628 HydrophobicContact CG-CD2 3.73Å; A591-L628 HydrophobicContact CB-CD2 4.43Å; V592-L628 HydrophobicContact CG2-CD2 4.04Å; T602-L628 HydrophobicContact CG2-CD2 4Å; D625-L628 HydrophobicContact CB-CB 4.29Å; L628-M630 PolarHBondContact O-N 3.05Å; L628-L631 PolarHBondContact O-N 3.15Å
629	S	58.7	Low	60.5	Low	32 Å²	32	69.1 Å²	69.1	22%	0.224	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-61.8	-13.6	179	-168.5	0	0	0	0	115.1	Q605 L627	Q605-S629 PolarHBondContact NE2-OG 3.45Å; L627-S629 PolarHBondContact O-N 3.41Å
630	M	48.6	Very low	58.1	Low	62 Å²	62	73.5 Å²	73.5	31%	0.305	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-99.1	-14.6	178.8	-78.7	-146.7	-139.7	0	0	114.8	L627 L628 T704 K707 A708	L627-M630 PolarHBondContact O-N 3.28Å; L628-M630 PolarHBondContact O-N 3.05Å; M630-T704 HydrophobicContact CB-CG2 4.11Å; M630-T704 HydrophobicContact CE-CG2 4.19Å; M630-T704 VanDerWaalsContact CE-O 3.23Å; M630-T704 WeakPolarHBondContact CE-O 3.32Å; M630-T704 HydrophobicContact CG-CG2 4.37Å; M630-T704 HydrophobicContact SD-CG2 3.57Å; M630-T704 VanDerWaalsContact SD-CG2 3.57Å; M630-K707 HydrophobicContact CE-CB 4.07Å; M630-A708 HydrophobicContact CE-CB 3.53Å
631	L	43.7	Very low	56.1	Low	111 Å²	111	78 Å²	78	58%	0.581	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-6.5	-163.5	-75.6	166.8	0	0	0	114.8	L628	L628-L631 PolarHBondContact O-N 3.15Å
632	E	41.2	Very low	54.3	Low	140 Å²	140	75.8 Å²	75.8	65%	0.654	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.9	45.6	-177.2	-66.7	-158.7	154.8	0	0	115.4
633	V	38.2	Very low	53.1	Low	89 Å²	89	74.7 Å²	74.7	54%	0.539	44%	0.435	S	S	.	.			trans	-133	85	160.4	-169.3	0	0	0	0	110.7	G635	V633-G635 PolarHBondContact O-N 3.41Å; V633-G635 VanDerWaalsContact O-N 3.14Å
634	N	31.7	Very low	52.6	Low	158 Å²	158	73.2 Å²	73.2	85%	0.845	42%	0.416	S	S	*	.			trans	-56.2	112.2	157.2	-89.3	-19	0	0	0	109.2	M636	N634-M636 PolarHBondContact O-N 3.4Å
635	G	37.3	Very low	52.5	Low	61 Å²	61	73 Å²	73	63%	0.629	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	-48.3	136.2	0	0	0	0	0	119.9	V633	V633-G635 PolarHBondContact O-N 3.41Å; V633-G635 VanDerWaalsContact O-N 3.14Å
636	M	36.4	Very low	52.7	Low	189 Å²	189	70.8 Å²	70.8	93%	0.931	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-152.2	11.2	-163.2	-78	-51.8	155.7	0	0	119.1	N634	N634-M636 PolarHBondContact O-N 3.4Å
637	S	30.1	Very low	53.1	Low	63 Å²	63	69.8 Å²	69.8	44%	0.441	40%	0.395	S	S	.	.	S	Bend	trans	-105	118.6	173.8	-166.1	0	0	0	0	113.6	D597	D597-S637 PolarHBondContact OD1-OG 2.85Å
638	S	33.2	Very low	53.7	Low	73 Å²	73	68.3 Å²	68.3	51%	0.51	39%	0.387	S	S	.	.			trans	54.6	83.1	157.7	-153.5	0	0	0	0	119.4	L640	S638-L640 PolarHBondContact O-N 2.95Å
639	S	38.3	Very low	54.7	Low	92 Å²	92	66.9 Å²	66.9	64%	0.643	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	33.8	164.6	62.6	0	0	0	0	115.3
640	L	40.3	Very low	56.2	Low	92 Å²	92	65.4 Å²	65.4	48%	0.482	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-16.8	-172.5	-66.1	179.1	0	0	0	114.1	Y223 S638	Y223-L640 PolarHBondContact OH-O 3.04Å; S638-L640 PolarHBondContact O-N 2.95Å
641	H	48.3	Very low	58.3	Low	105 Å²	105	62.4 Å²	62.4	49%	0.486	35%	0.354	S	S	.	.	S	Bend	trans	-129	126.4	177.3	-66.8	-45.9	0	0	0	109.4	Y223 D643	Y223-H641 AromaticContact CE2-CE1 3.9Å; Y223-H641 AromaticContact CE2-ND1 3.59Å; Y223-H641 AromaticContact CZ-ND1 3.79Å; Y223-H641 PolarHBondContact OH-ND1 3.36Å; H641-D643 PolarHBondContact O-N 2.92Å
642	E	53.4	Low	60.4	Low	37 Å²	37	57.2 Å²	57.2	17%	0.173	33%	0.327	C	S	.	.			trans	-77.8	106.6	171	-81.1	-175.9	179	0	0	107.9	Y182 R197 M644 Y715	Y182-E642 PolarHBondContact OH-OE2 3.47Å; R197-E642 IonicContact CZ-OE1 3.42Å; R197-E642 IonicContact NH1-OE1 2.81Å; R197-E642 PolarHBondContact NH1-OE1 3.08Å; R197-E642 IonicContact NH1-OE2 3.42Å; R197-E642 IonicContact NH2-OE1 3.93Å; R197-E642 PolarHBondContact NH2-OE1 3.14Å; E642-M644 PolarHBondContact O-N 2.99Å; E642-Y715 PolarHBondContact OE2-OH 3.33Å
643	D	62.6	Low	62.6	Low	65 Å²	65	51 Å²	51	35%	0.348	30%	0.298	S	S	.	.			trans	-70.3	98.1	-177.9	-64.7	-27	0	0	0	110	Y599 H641 N645	Y599-D643 WeakPolarHBondContact CD2-OD1 3.5Å; Y599-D643 HydrophobicContact CE2-CB 4.36Å; Y599-D643 VanDerWaalsContact CE2-OD1 3.26Å; Y599-D643 WeakPolarHBondContact CE2-OD1 3.3Å; H641-D643 PolarHBondContact O-N 2.92Å; D643-N645 PolarHBondContact O-N 2.6Å
644	M	73.4	Confident	65.1	Low	13 Å²	13	47.8 Å²	47.8	6%	0.064	28%	0.283	C	S	.	.			trans	-72.4	117.5	176.9	-74.1	-156.2	-165.9	0	0	110.7	E222 Q605 E642 S648 H649 Y715	E222-M644 HydrophobicContact CB-CE 4.12Å; E222-M644 HydrophobicContact CG-CE 3.95Å; E222-M644 VanDerWaalsContact OE2-CE 3.25Å; E222-M644 WeakPolarHBondContact OE2-CE 3.27Å; Q605-M644 PolarHBondContact NE2-O 3.3Å; E642-M644 PolarHBondContact O-N 2.99Å; M644-S648 WeakPolarHBondContact CA-OG 3.17Å; M644-S648 WeakPolarHBondContact CB-OG 3.35Å; M644-H649 WeakPolarHBondContact CB-NE2 3.28Å; M644-H649 PolarHBondContact O-CD2 2.77Å; M644-H649 VanDerWaalsContact O-CD2 3.3Å; M644-H649 PolarHBondContact O-NE2 2.79Å; M644-Y715 HydrophobicContact CE-CD1 3.91Å; M644-Y715 HydrophobicContact CE-CE1 3.47Å; M644-Y715 VanDerWaalsContact CE-CE1 3.47Å; M644-Y715 HydrophobicContact CE-CE2 4.24Å; M644-Y715 HydrophobicContact CE-CG 4.46Å; M644-Y715 HydrophobicContact CG-CE2 4.12Å; M644-Y715 HydrophobicContact SD-CE1 4.49Å; M644-Y715 HydrophobicContact SD-CE2 4.3Å
645	N	83.4	Confident	68	Low	3 Å²	3	42.6 Å²	42.6	2%	0.016	25%	0.253	C	S	.	.			trans	-66.2	167.9	169.3	71.4	62.8	0	0	0	113.2	D643 F647 S648 H649 A708 E711	D643-N645 PolarHBondContact O-N 2.6Å; N645-F647 VanDerWaalsContact C-N 3.31Å; N645-F647 PolarHBondContact O-N 3.31Å; N645-F647 WeakPolarHBondContact OD1-CA 3.43Å; N645-F647 VanDerWaalsContact OD1-CB 3.24Å; N645-F647 WeakPolarHBondContact OD1-CB 3.32Å; N645-F647 PolarHBondContact OD1-N 3.04Å; N645-S648 PolarHBondContact N-OG 3.38Å; N645-S648 PolarHBondContact O-N 3.4Å; N645-S648 PolarHBondContact O-OG 3.07Å; N645-S648 PolarHBondContact OD1-N 3.27Å; N645-S648 PolarHBondContact OD1-OG 2.91Å; N645-H649 PolarHBondContact O-CD2 2.73Å; N645-H649 VanDerWaalsContact O-CD2 3.28Å; N645-H649 PolarHBondContact O-N 3.21Å; N645-A708 VanDerWaalsContact ND2-CA 3.29Å; N645-A708 WeakPolarHBondContact ND2-CA 3.23Å; N645-A708 PolarHBondContact ND2-O 3.1Å; N645-A708 VanDerWaalsContact ND2-O 3.13Å; N645-E711 PolarHBondContact ND2-OE2 3.41Å
646	C	85.9	Confident	70.6	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.014	24%	0.242	C	C	.	.	H	α-helix	trans	-64.9	-33	-178.9	68.4	0	0	0	0	113.2	Q605 P626 S650 L662	Q605-C646 HydrophobicContact CG-CB 4.37Å; P626-C646 VanDerWaalsContact CA-SG 3.54Å; P626-C646 WeakPolarHBondContact CB-SG 3.37Å; P626-C646 PolarHBondContact O-SG 3.28Å; C646-S650 PolarHBondContact O-N 3.12Å; C646-S650 PolarHBondContact O-OG 2.96Å; C646-L662 HydrophobicContact CB-CD1 4.28Å
647	F	88.6	Confident	73.2	Confident	3 Å²	3	40.7 Å²	40.7	1%	0.013	23%	0.225	C	C	.	.	H	α-helix	trans	-65.9	-43.1	175.9	-56.8	-85	0	0	0	110.4	P626 L627 N645 S650 A651 L659 L662 L663 A708 L709 A712	P626-F647 HydrophobicContact CB-CE2 4.03Å; P626-F647 HydrophobicContact CB-CZ 4.09Å; P626-F647 HydrophobicContact CG-CZ 4.47Å; L627-F647 HydrophobicContact CD2-CD2 4.48Å; L627-F647 HydrophobicContact CD2-CE2 3.84Å; N645-F647 VanDerWaalsContact C-N 3.31Å; N645-F647 PolarHBondContact O-N 3.31Å; N645-F647 WeakPolarHBondContact OD1-CA 3.43Å; N645-F647 VanDerWaalsContact OD1-CB 3.24Å; N645-F647 WeakPolarHBondContact OD1-CB 3.32Å; N645-F647 PolarHBondContact OD1-N 3.04Å; F647-S650 PolarHBondContact O-N 3.47Å; F647-S650 PolarHBondContact O-OG 3.43Å; F647-A651 VanDerWaalsContact O-CB 3.25Å; F647-A651 WeakPolarHBondContact O-CB 3.26Å; F647-A651 PolarHBondContact O-N 2.92Å; F647-L659 HydrophobicContact CB-CD1 4.06Å; F647-L659 HydrophobicContact CD1-CD1 3.9Å; F647-L662 HydrophobicContact CD1-CB 3.95Å; F647-L662 HydrophobicContact CD1-CD1 4.44Å; F647-L662 HydrophobicContact CE1-CB 3.58Å; F647-L662 HydrophobicContact CZ-CB 4.31Å; F647-L663 HydrophobicContact CD1-CD2 4.29Å; F647-L663 HydrophobicContact CE1-CD2 3.94Å; F647-L663 HydrophobicContact CE1-CG 4.26Å; F647-A708 HydrophobicContact CD2-CB 4.15Å; F647-L709 HydrophobicContact CB-CD2 4.32Å; F647-L709 HydrophobicContact CD1-CD2 3.93Å; F647-L709 HydrophobicContact CE1-CD2 4.45Å; F647-L709 HydrophobicContact CG-CD2 4.09Å; F647-A712 HydrophobicContact CB-CB 3.99Å
648	S	88.3	Confident	76.1	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-68.2	-40.2	178.2	58.8	0	0	0	0	111.8	M644 N645 S650 A651 A652	M644-S648 WeakPolarHBondContact CA-OG 3.17Å; M644-S648 WeakPolarHBondContact CB-OG 3.35Å; N645-S648 PolarHBondContact N-OG 3.38Å; N645-S648 PolarHBondContact O-N 3.4Å; N645-S648 PolarHBondContact O-OG 3.07Å; N645-S648 PolarHBondContact OD1-N 3.27Å; N645-S648 PolarHBondContact OD1-OG 2.91Å; S648-S650 PolarHBondContact O-N 3.42Å; S648-A651 PolarHBondContact O-N 3.37Å; S648-A652 WeakPolarHBondContact O-CB 3.34Å; S648-A652 PolarHBondContact O-N 3.11Å
649	H	87.8	Confident	78.8	Confident	15 Å²	15	34.5 Å²	34.5	7%	0.069	18%	0.181	C	C	.	.	H	α-helix	trans	-57.9	-47.7	170.9	-82.1	-64.5	0	0	0	112.2	A609 M644 N645 A651 H653	A609-H649 HydrophobicContact CB-CB 4.1Å; M644-H649 WeakPolarHBondContact CB-NE2 3.28Å; M644-H649 PolarHBondContact O-CD2 2.77Å; M644-H649 VanDerWaalsContact O-CD2 3.3Å; M644-H649 PolarHBondContact O-NE2 2.79Å; N645-H649 PolarHBondContact O-CD2 2.73Å; N645-H649 VanDerWaalsContact O-CD2 3.28Å; N645-H649 PolarHBondContact O-N 3.21Å; H649-A651 PolarHBondContact O-N 3.16Å; H649-H653 PolarHBondContact O-CD2 2.78Å; H649-H653 VanDerWaalsContact O-CD2 3.32Å; H649-H653 PolarHBondContact O-N 3.44Å
650	S	90.4	Very high	81.3	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64.8	-39.5	178.8	71.9	0	0	0	0	112.5	C646 F647 S648 G654 H655 L659	C646-S650 PolarHBondContact O-N 3.12Å; C646-S650 PolarHBondContact O-OG 2.96Å; F647-S650 PolarHBondContact O-N 3.47Å; F647-S650 PolarHBondContact O-OG 3.43Å; S648-S650 PolarHBondContact O-N 3.42Å; S650-G654 PolarHBondContact O-N 3.38Å; S650-H655 PolarHBondContact O-N 3.09Å; S650-L659 WeakPolarHBondContact OG-CD1 3.44Å
651	A	91	Very high	83.7	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-73.1	-38.7	-179.8	0	0	0	0	0	112.6	F647 S648 H649 H653 G654 A712 I724	F647-A651 VanDerWaalsContact O-CB 3.25Å; F647-A651 WeakPolarHBondContact O-CB 3.26Å; F647-A651 PolarHBondContact O-N 2.92Å; S648-A651 PolarHBondContact O-N 3.37Å; H649-A651 PolarHBondContact O-N 3.16Å; A651-H653 VanDerWaalsContact C-N 3.28Å; A651-H653 PolarHBondContact O-N 3.05Å; A651-G654 PolarHBondContact O-N 3.13Å; A651-A712 HydrophobicContact CB-CB 3.85Å; A651-A712 WeakPolarHBondContact CB-O 3.16Å; A651-I724 HydrophobicContact CB-CG2 4Å
652	A	88.6	Confident	85.5	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.008	13%	0.134	C	C	.	.	H	α-helix	trans	-62.8	-34.3	177	0	0	0	0	0	112.1	F208 S648 H719 Y721	F208-A652 VanDerWaalsContact CE1-O 3.27Å; F208-A652 WeakPolarHBondContact CE1-O 3.49Å; S648-A652 WeakPolarHBondContact O-CB 3.34Å; S648-A652 PolarHBondContact O-N 3.11Å; A652-H719 PolarHBondContact O-ND1 3.11Å; A652-Y721 WeakPolarHBondContact O-CE2 3.28Å
653	H	88.3	Confident	87	Confident	9 Å²	9	28 Å²	28	4%	0.042	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-2.3	179.5	-77.8	-75.4	0	0	0	114.5	F208 I220 H649 A651 H655 Y721	F208-H653 AromaticContact CZ-CE1 3.73Å; F208-H653 AromaticContact CZ-NE2 3.9Å; I220-H653 PolarHBondContact N-CE1 2.89Å; I220-H653 VanDerWaalsContact N-CE1 3.26Å; I220-H653 PolarHBondContact O-NE2 2.64Å; H649-H653 PolarHBondContact O-CD2 2.78Å; H649-H653 VanDerWaalsContact O-CD2 3.32Å; H649-H653 PolarHBondContact O-N 3.44Å; A651-H653 VanDerWaalsContact C-N 3.28Å; A651-H653 PolarHBondContact O-N 3.05Å; H653-H655 WeakPolarHBondContact CB-CD2 3.45Å; H653-H655 WeakPolarHBondContact CB-NE2 3.39Å; H653-Y721 PolarHBondContact O-OH 3.17Å
654	G	90.2	Very high	88	Confident	22 Å²	22	29.5 Å²	29.5	23%	0.227	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.6	12.1	179.8	0	0	0	0	0	115	S650 A651 R656	S650-G654 PolarHBondContact O-N 3.38Å; A651-G654 PolarHBondContact O-N 3.13Å; G654-R656 VanDerWaalsContact C-N 3.3Å; G654-R656 PolarHBondContact O-N 3.33Å
655	H	92.4	Very high	88	Confident	49 Å²	49	31.6 Å²	31.6	23%	0.227	16%	0.156	C	C	.	.			trans	-80	70.6	-174.7	-63	-46.9	0	0	0	112.7	S608 A609 G611 S650 H653 N657 V658 L659	S608-H655 PolarHBondContact O-CD2 3.12Å; A609-H655 PolarHBondContact O-CD2 2.78Å; A609-H655 VanDerWaalsContact O-CD2 3.31Å; A609-H655 PolarHBondContact O-NE2 3.4Å; G611-H655 WeakPolarHBondContact CA-CD2 3.32Å; G611-H655 VanDerWaalsContact CA-CG 3.41Å; G611-H655 WeakPolarHBondContact CA-NE2 3.49Å; G611-H655 PolarHBondContact N-CD2 3.37Å; G611-H655 VanDerWaalsContact N-CD2 3.32Å; G611-H655 PolarHBondContact N-NE2 2.97Å; S650-H655 PolarHBondContact O-N 3.09Å; H653-H655 WeakPolarHBondContact CB-CD2 3.45Å; H653-H655 WeakPolarHBondContact CB-NE2 3.39Å; H655-N657 VanDerWaalsContact C-N 3.33Å; H655-N657 PolarHBondContact O-N 3.34Å; H655-V658 HydrophobicContact CB-CB 4.06Å; H655-V658 HydrophobicContact CB-CG2 4.27Å; H655-V658 PolarHBondContact O-N 3.04Å; H655-L659 PolarHBondContact O-N 3.29Å
656	R	91.6	Very high	86.8	Confident	103 Å²	103	36.4 Å²	36.4	39%	0.389	19%	0.187	S	C	.	.	H	α-helix	trans	-55.4	-41.5	-176.5	-171.8	-174.9	-176.8	-155.4	15.5	114.2	G654 L659 R660 I724 E727	G654-R656 VanDerWaalsContact C-N 3.3Å; G654-R656 PolarHBondContact O-N 3.33Å; R656-L659 PolarHBondContact O-N 2.8Å; R656-R660 VanDerWaalsContact CZ-CZ 3.43Å; R656-R660 WeakPolarHBondContact O-CG 3.43Å; R656-R660 PolarHBondContact O-N 3.34Å; R656-I724 HydrophobicContact CB-CD1 4.35Å; R656-I724 HydrophobicContact CB-CG1 4.22Å; R656-I724 HydrophobicContact CG-CG1 4.38Å; R656-E727 IonicContact CZ-OE2 3.28Å; R656-E727 VanDerWaalsContact CZ-OE2 3.23Å; R656-E727 IonicContact NE-OE2 3.98Å; R656-E727 PolarHBondContact NE-OE2 3.31Å; R656-E727 IonicContact NH2-OE2 3.87Å; R656-E727 PolarHBondContact NH2-OE2 3.47Å
657	N	91	Very high	85.5	Confident	107 Å²	107	40.7 Å²	40.7	57%	0.572	21%	0.207	S	C	*	.	H	α-helix	trans	-68.2	-37.7	-177.7	-66.7	-21.3	0	0	0	112	H655 K661	H655-N657 VanDerWaalsContact C-N 3.33Å; H655-N657 PolarHBondContact O-N 3.34Å; N657-K661 PolarHBondContact O-N 3.4Å; N657-K661 VanDerWaalsContact O-N 3.08Å
658	V	91.2	Very high	83.6	Confident	3 Å²	3	47.5 Å²	47.5	2%	0.018	24%	0.239	C	C	.	.	H	α-helix	trans	-66.8	-46	174.5	171.4	0	0	0	0	110.2	V616 H655 R660 K661 L662	V616-V658 HydrophobicContact CG1-CG1 4.3Å; V616-V658 HydrophobicContact CG2-CG1 3.92Å; H655-V658 HydrophobicContact CB-CB 4.06Å; H655-V658 HydrophobicContact CB-CG2 4.27Å; H655-V658 PolarHBondContact O-N 3.04Å; V658-R660 VanDerWaalsContact C-N 3.3Å; V658-R660 PolarHBondContact O-N 3.33Å; V658-K661 WeakPolarHBondContact O-CA 3.2Å; V658-K661 WeakPolarHBondContact O-CB 3.47Å; V658-K661 PolarHBondContact O-N 2.95Å; V658-L662 HydrophobicContact CG1-CD1 3.98Å; V658-L662 HydrophobicContact CG1-CG 4.31Å; V658-L662 WeakPolarHBondContact O-CG 3.43Å; V658-L662 PolarHBondContact O-N 2.84Å
659	L	90.1	Very high	81.5	Confident	3 Å²	3	54.9 Å²	54.9	2%	0.016	28%	0.277	C	S	.	.	H	α-helix	trans	-55.6	-45.9	176.7	-177.6	67.8	0	0	0	111.6	F647 S650 H655 R656 K661 L662 L663 I724 L728	F647-L659 HydrophobicContact CB-CD1 4.06Å; F647-L659 HydrophobicContact CD1-CD1 3.9Å; S650-L659 WeakPolarHBondContact OG-CD1 3.44Å; H655-L659 PolarHBondContact O-N 3.29Å; R656-L659 PolarHBondContact O-N 2.8Å; L659-K661 VanDerWaalsContact C-N 3.34Å; L659-K661 PolarHBondContact O-N 3.4Å; L659-L662 PolarHBondContact O-N 3.28Å; L659-L663 HydrophobicContact CG-CD1 4.18Å; L659-L663 VanDerWaalsContact O-CG 3.24Å; L659-L663 WeakPolarHBondContact O-CG 3.41Å; L659-L663 PolarHBondContact O-N 3.11Å; L659-I724 HydrophobicContact CD2-CG2 3.57Å; L659-L728 HydrophobicContact CD2-CD2 4.14Å; L659-L728 HydrophobicContact CD2-CG 4.32Å
660	R	90.5	Very high	79.4	Confident	99 Å²	99	61.7 Å²	61.7	37%	0.374	31%	0.307	S	S	.	.	H	α-helix	trans	-59.4	-43.3	174.6	-74.3	170.6	171.1	-160.5	-20.7	112.4	R656 V658 L663 T664 E727	R656-R660 VanDerWaalsContact CZ-CZ 3.43Å; R656-R660 WeakPolarHBondContact O-CG 3.43Å; R656-R660 PolarHBondContact O-N 3.34Å; V658-R660 VanDerWaalsContact C-N 3.3Å; V658-R660 PolarHBondContact O-N 3.33Å; R660-L663 PolarHBondContact O-N 2.97Å; R660-T664 VanDerWaalsContact O-CG2 3.28Å; R660-T664 WeakPolarHBondContact O-CG2 3.34Å; R660-T664 PolarHBondContact O-N 3.09Å; R660-E727 IonicContact CZ-OE1 3.74Å; R660-E727 IonicContact CZ-OE2 2.66Å; R660-E727 IonicContact NE-OE1 2.71Å; R660-E727 PolarHBondContact NE-OE1 3.49Å; R660-E727 IonicContact NE-OE2 2.79Å; R660-E727 PolarHBondContact NE-OE2 2.96Å; R660-E727 IonicContact NH2-OE1 3.71Å; R660-E727 PolarHBondContact NH2-OE1 3.36Å; R660-E727 IonicContact NH2-OE2 2.71Å; R660-E727 PolarHBondContact NH2-OE2 3.34Å
661	K	89.6	Confident	76.9	Confident	56 Å²	56	65 Å²	65	24%	0.243	34%	0.341	C	S	.	.	H	α-helix	trans	-62.9	-44.2	177.8	-174.6	59.7	173.7	-177.1	0	111.7	Y613 V616 S617 L620 N657 V658 L659 L663 T664	Y613-K661 HydrophobicContact CD2-CB 4.32Å; Y613-K661 HydrophobicContact CE2-CB 3.81Å; Y613-K661 HydrophobicContact CE2-CD 4.17Å; Y613-K661 HydrophobicContact CE2-CG 3.99Å; V616-K661 HydrophobicContact CG1-CG 4.38Å; S617-K661 WeakPolarHBondContact OG-CE 3.36Å; L620-K661 HydrophobicContact CD1-CG 4.2Å; N657-K661 PolarHBondContact O-N 3.4Å; N657-K661 VanDerWaalsContact O-N 3.08Å; V658-K661 WeakPolarHBondContact O-CA 3.2Å; V658-K661 WeakPolarHBondContact O-CB 3.47Å; V658-K661 PolarHBondContact O-N 2.95Å; L659-K661 VanDerWaalsContact C-N 3.34Å; L659-K661 PolarHBondContact O-N 3.4Å; K661-L663 VanDerWaalsContact C-N 3.27Å; K661-L663 PolarHBondContact O-N 3.44Å; K661-T664 PolarHBondContact O-N 3.24Å; K661-T664 PolarHBondContact O-OG1 3.47Å
662	L	87.3	Confident	74.5	Confident	1 Å²	1	70.7 Å²	70.7	1%	0.005	37%	0.371	C	S	.	.	H	α-helix	trans	-60.3	-38.9	174.8	-66.9	169.1	0	0	0	111.3	L604 V616 L620 P626 C646 F647 V658 L659 T664	L604-L662 HydrophobicContact CD1-CD2 4.33Å; L604-L662 HydrophobicContact CD2-CD2 4.42Å; V616-L662 HydrophobicContact CG1-CD2 4.06Å; V616-L662 HydrophobicContact CG1-CG 4.44Å; L620-L662 HydrophobicContact CD1-CD2 4.19Å; L620-L662 HydrophobicContact CD2-CD2 4.47Å; P626-L662 HydrophobicContact CB-CD2 4.4Å; C646-L662 HydrophobicContact CB-CD1 4.28Å; F647-L662 HydrophobicContact CD1-CB 3.95Å; F647-L662 HydrophobicContact CD1-CD1 4.44Å; F647-L662 HydrophobicContact CE1-CB 3.58Å; F647-L662 HydrophobicContact CZ-CB 4.31Å; V658-L662 HydrophobicContact CG1-CD1 3.98Å; V658-L662 HydrophobicContact CG1-CG 4.31Å; V658-L662 WeakPolarHBondContact O-CG 3.43Å; V658-L662 PolarHBondContact O-N 2.84Å; L659-L662 PolarHBondContact O-N 3.28Å; L662-T664 VanDerWaalsContact C-N 3.34Å; L662-T664 PolarHBondContact O-N 3.36Å
663	L	85.1	Confident	72.4	Confident	34 Å²	34	77.4 Å²	77.4	18%	0.178	41%	0.412	C	S	.	.	H	α-helix	trans	-68.6	-28.4	178.2	-71.5	169.1	0	0	0	113.9	F647 L659 R660 K661 Q665 R705 L709 L731	F647-L663 HydrophobicContact CD1-CD2 4.29Å; F647-L663 HydrophobicContact CE1-CD2 3.94Å; F647-L663 HydrophobicContact CE1-CG 4.26Å; L659-L663 HydrophobicContact CG-CD1 4.18Å; L659-L663 VanDerWaalsContact O-CG 3.24Å; L659-L663 WeakPolarHBondContact O-CG 3.41Å; L659-L663 PolarHBondContact O-N 3.11Å; R660-L663 PolarHBondContact O-N 2.97Å; K661-L663 VanDerWaalsContact C-N 3.27Å; K661-L663 PolarHBondContact O-N 3.44Å; L663-Q665 VanDerWaalsContact C-N 3.27Å; L663-Q665 PolarHBondContact O-N 3.42Å; L663-R705 PolarHBondContact O-NH2 3.4Å; L663-L709 HydrophobicContact CD2-CD1 4.34Å; L663-L709 HydrophobicContact CD2-CD2 3.8Å; L663-L731 HydrophobicContact CD1-CD1 3.54Å; L663-L731 HydrophobicContact CD2-CD1 4.24Å
664	T	83.8	Confident	70.3	Confident	96 Å²	96	80.4 Å²	80.4	59%	0.589	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-14.8	-179.4	58.9	0	0	0	0	114.6	R660 K661 L662	R660-T664 VanDerWaalsContact O-CG2 3.28Å; R660-T664 WeakPolarHBondContact O-CG2 3.34Å; R660-T664 PolarHBondContact O-N 3.09Å; K661-T664 PolarHBondContact O-N 3.24Å; K661-T664 PolarHBondContact O-OG1 3.47Å; L662-T664 VanDerWaalsContact C-N 3.34Å; L662-T664 PolarHBondContact O-N 3.36Å
665	Q	72.9	Confident	68.4	Low	57 Å²	57	81.8 Å²	81.8	27%	0.266	43%	0.434	S	S	.	.	S	Bend	trans	-69.3	129.6	-177.6	-71.5	-66.5	-18.4	0	0	111.6	L620 L663	L620-Q665 HydrophobicContact CD1-CG 3.9Å; L620-Q665 HydrophobicContact CD2-CG 4.04Å; L620-Q665 HydrophobicContact CG-CG 4.39Å; L663-Q665 VanDerWaalsContact C-N 3.27Å; L663-Q665 PolarHBondContact O-N 3.42Å
666	P	59.2	Low	65.9	Low	105 Å²	105	85.9 Å²	85.9	68%	0.682	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-67.1	138.1	174.7	27.7	-31.9	0	0	0	109.9	Q668	P666-Q668 PolarHBondContact O-N 3.41Å
667	Q	58.4	Low	63.9	Low	92 Å²	92	88.3 Å²	88.3	43%	0.43	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-64.9	118.2	-178.4	-165.7	176.1	-5.7	0	0	109.8	L669 C702	Q667-L669 PolarHBondContact O-N 3.45Å; Q667-C702 PolarHBondContact NE2-SG 2.69Å; Q667-C702 VanDerWaalsContact NE2-SG 3.45Å
668	Q	48.9	Very low	61.8	Low	146 Å²	146	87.6 Å²	87.6	68%	0.682	47%	0.466	S	S	*	.			trans	-75.3	106.6	164.8	-69.2	-168.3	8.1	0	0	107.5	P666 K670	P666-Q668 PolarHBondContact O-N 3.41Å; Q668-K670 PolarHBondContact O-N 3.5Å
669	L	44.1	Very low	60.1	Low	154 Å²	154	91.8 Å²	91.8	81%	0.806	49%	0.487	S	S	*	.			trans	-68.4	73.7	167.2	-76.6	155.7	0	0	0	108.7	Q667 G671	Q667-L669 PolarHBondContact O-N 3.45Å; L669-G671 PolarHBondContact O-N 3.38Å
670	K	41.9	Very low	57.9	Low	158 Å²	158	97.9 Å²	97.9	69%	0.687	52%	0.519	S	S	*	.			trans	-70.6	114.8	155.7	-81.5	-178.7	-179.8	172	0	104.9	Q668 D672	Q668-K670 PolarHBondContact O-N 3.5Å; K670-D672 PolarHBondContact O-N 3.4Å; K670-D672 VanDerWaalsContact O-N 3.09Å
671	G	39	Very low	55.8	Low	69 Å²	69	97.3 Å²	97.3	71%	0.711	54%	0.536	S	S	*	.			trans	-51.5	117.1	-169.5	0	0	0	0	0	111.5	L669 V673	L669-G671 PolarHBondContact O-N 3.38Å; G671-V673 VanDerWaalsContact C-N 3.3Å; G671-V673 PolarHBondContact O-N 3.18Å
672	D	39.8	Very low	53.9	Low	120 Å²	120	99.3 Å²	99.3	64%	0.642	55%	0.546	S	S	*	.			trans	-56.6	95.2	168.5	-74.6	-31.5	0	0	0	107.6	K670 L674	K670-D672 PolarHBondContact O-N 3.4Å; K670-D672 VanDerWaalsContact O-N 3.09Å; D672-L674 PolarHBondContact O-N 3.22Å
673	V	44.4	Very low	51.4	Low	142 Å²	142	102 Å²	102	86%	0.861	57%	0.573	S	S	*	*			trans	-71.8	86.5	155.5	-177.7	0	0	0	0	104.3	G671 S675	G671-V673 VanDerWaalsContact C-N 3.3Å; G671-V673 PolarHBondContact O-N 3.18Å; V673-S675 PolarHBondContact O-N 3.49Å
674	L	44	Very low	49	Very low	73 Å²	73	107.3 Å²	107.3	38%	0.382	61%	0.607	S	S	.	*			trans	-46.6	128.8	170.9	-69.2	161.7	0	0	0	108	D672 E678 I679	D672-L674 PolarHBondContact O-N 3.22Å; L674-E678 HydrophobicContact CD2-CB 4.22Å; L674-E678 WeakPolarHBondContact CD2-OE2 3.2Å; L674-I679 HydrophobicContact CB-CD1 4.15Å; L674-I679 HydrophobicContact CB-CG1 3.84Å; L674-I679 HydrophobicContact CD1-CG1 4.41Å
675	S	50.6	Low	46.7	Very low	51 Å²	51	111.4 Å²	111.4	36%	0.357	62%	0.619	S	S	.	*			trans	-64	150.7	172.7	68.3	0	0	0	0	108.9	V673 E677 E678 I679	V673-S675 PolarHBondContact O-N 3.49Å; S675-E677 PolarHBondContact O-N 3.48Å; S675-E678 PolarHBondContact O-N 3.41Å; S675-I679 PolarHBondContact O-N 3.03Å
676	L	40.8	Very low	44.8	Very low	134 Å²	134	113.5 Å²	113.5	70%	0.702	64%	0.64	S	S	*	*	H	α-helix	trans	-56.3	-25.9	-179.3	-149.6	84.4	0	0	0	111.9	L680	L676-L680 HydrophobicContact CD2-CD1 4.34Å; L676-L680 HydrophobicContact CG-CD1 4.35Å; L676-L680 WeakPolarHBondContact O-CB 3.21Å; L676-L680 WeakPolarHBondContact O-CD1 3.3Å; L676-L680 WeakPolarHBondContact O-CG 3.45Å; L676-L680 PolarHBondContact O-N 3.28Å
677	E	48.8	Very low	43.5	Very low	154 Å²	154	116.5 Å²	116.5	72%	0.72	65%	0.65	S	S	*	*	H	α-helix	trans	-72.2	-36.4	175.4	-72.7	173.5	155.4	0	0	113.2	S675 L680 A681	S675-E677 PolarHBondContact O-N 3.48Å; E677-L680 PolarHBondContact O-N 3.11Å; E677-A681 VanDerWaalsContact O-CB 3.23Å; E677-A681 WeakPolarHBondContact O-CB 3.26Å; E677-A681 PolarHBondContact O-N 3.14Å
678	E	47.9	Very low	42.2	Very low	93 Å²	93	118 Å²	118	44%	0.435	67%	0.666	S	S	.	*	H	α-helix	trans	-69.7	-36.6	173.8	-76.2	-175.3	141.9	0	0	111.6	L674 S675 L680 E682	L674-E678 HydrophobicContact CD2-CB 4.22Å; L674-E678 WeakPolarHBondContact CD2-OE2 3.2Å; S675-E678 PolarHBondContact O-N 3.41Å; E678-L680 VanDerWaalsContact C-N 3.31Å; E678-L680 PolarHBondContact O-N 3.04Å; E678-E682 WeakPolarHBondContact O-CG 3.47Å; E678-E682 PolarHBondContact O-N 3.29Å; E678-E682 VanDerWaalsContact O-N 3.15Å
679	I	55	Low	41.2	Very low	91 Å²	91	116.7 Å²	116.7	47%	0.467	67%	0.673	S	S	.	*	H	α-helix	trans	-66.3	-34.8	174	-60.3	173.7	0	0	0	111.1	L674 S675	L674-I679 HydrophobicContact CB-CD1 4.15Å; L674-I679 HydrophobicContact CB-CG1 3.84Å; L674-I679 HydrophobicContact CD1-CG1 4.41Å; S675-I679 PolarHBondContact O-N 3.03Å
680	L	43.5	Very low	40.9	Very low	131 Å²	131	115 Å²	115	69%	0.686	68%	0.675	S	S	*	*	H	α-helix	trans	-84.7	-25.8	-179.7	-71.5	168	0	0	0	113.3	L676 E677 E678	L676-L680 HydrophobicContact CD2-CD1 4.34Å; L676-L680 HydrophobicContact CG-CD1 4.35Å; L676-L680 WeakPolarHBondContact O-CB 3.21Å; L676-L680 WeakPolarHBondContact O-CD1 3.3Å; L676-L680 WeakPolarHBondContact O-CG 3.45Å; L676-L680 PolarHBondContact O-N 3.28Å; E677-L680 PolarHBondContact O-N 3.11Å; E678-L680 VanDerWaalsContact C-N 3.31Å; E678-L680 PolarHBondContact O-N 3.04Å
681	A	47.8	Very low	40.3	Very low	87 Å²	87	117 Å²	117	72%	0.719	69%	0.686	S	S	*	*	H	α-helix	trans	-76.3	-25	173	0	0	0	0	0	112.4	E677 G683	E677-A681 VanDerWaalsContact O-CB 3.23Å; E677-A681 WeakPolarHBondContact O-CB 3.26Å; E677-A681 PolarHBondContact O-N 3.14Å; A681-G683 VanDerWaalsContact C-N 3.29Å; A681-G683 PolarHBondContact O-N 2.8Å; A681-G683 VanDerWaalsContact O-N 3.09Å
682	E	48.1	Very low	39.8	Very low	98 Å²	98	117.7 Å²	117.7	46%	0.458	69%	0.693	S	S	.	*	S	Bend	trans	-78.8	77.3	165.8	-70.6	-175.5	172	0	0	109.7	E678 V684 K703	E678-E682 WeakPolarHBondContact O-CG 3.47Å; E678-E682 PolarHBondContact O-N 3.29Å; E678-E682 VanDerWaalsContact O-N 3.15Å; E682-V684 PolarHBondContact O-N 2.99Å; E682-K703 IonicContact OE1-NZ 3.63Å; E682-K703 PolarHBondContact OE1-NZ 3.31Å
683	G	35.6	Very low	39.1	Very low	56 Å²	56	117.5 Å²	117.5	58%	0.577	70%	0.701	S	S	*	*			trans	-48.8	134.8	161.5	0	0	0	0	0	109.5	A681 E685	A681-G683 VanDerWaalsContact C-N 3.29Å; A681-G683 PolarHBondContact O-N 2.8Å; A681-G683 VanDerWaalsContact O-N 3.09Å; G683-E685 VanDerWaalsContact C-N 3.33Å; G683-E685 PolarHBondContact O-N 3.46Å
684	V	35.3	Very low	38.6	Very low	146 Å²	146	116.5 Å²	116.5	89%	0.885	70%	0.7	S	S	*	*			trans	-57.7	88.7	-175.2	-176.5	0	0	0	0	110.6	E682	E682-V684 PolarHBondContact O-N 2.99Å
685	E	34.5	Very low	37.8	Very low	183 Å²	183	117.7 Å²	117.7	86%	0.855	72%	0.715	S	S	*	*			trans	-87.4	115	162.9	-71.1	-128.2	161.6	0	0	108	G683 D687	G683-E685 VanDerWaalsContact C-N 3.33Å; G683-E685 PolarHBondContact O-N 3.46Å; E685-D687 PolarHBondContact O-N 2.85Å
686	S	32.4	Very low	36.9	Very low	100 Å²	100	124.8 Å²	124.8	70%	0.699	74%	0.742	S	S	*	*			trans	-67.4	99.3	-177.6	48.8	0	0	0	0	111.5	T688	S686-T688 VanDerWaalsContact C-N 3.34Å; S686-T688 PolarHBondContact O-N 2.87Å
687	D	32.9	Very low	36.5	Very low	168 Å²	168	122 Å²	122	90%	0.898	75%	0.746	S	S	*	*			trans	-62.8	91.7	164.6	-89	-23.4	0	0	0	110.5	E685	E685-D687 PolarHBondContact O-N 2.85Å
688	T	30.4	Very low	35.9	Very low	124 Å²	124	123 Å²	123	76%	0.761	75%	0.75	S	S	*	*			trans	-126	73.1	162.9	39.4	0	0	0	0	110	S686	S686-T688 VanDerWaalsContact C-N 3.34Å; S686-T688 PolarHBondContact O-N 2.87Å
689	S	28.4	Very low	35.8	Very low	119 Å²	119	123.4 Å²	123.4	83%	0.832	76%	0.76	S	S	*	*			trans	-163.8	83.9	148.4	48.2	0	0	0	0	111.2
690	S	36.7	Very low	35.6	Very low	119 Å²	119	130.4 Å²	130.4	83%	0.832	78%	0.78	S	S	*	*			trans	-82.6	118.5	153.3	46.3	0	0	0	0	108.5
691	Q	29.6	Very low	36.7	Very low	200 Å²	200	125.6 Å²	125.6	94%	0.935	76%	0.755	S	S	*	*			trans	-166.7	139.2	138.7	-105.3	177.9	23.5	0	0	109.7
692	G	28.9	Very low	37.8	Very low	82 Å²	82	122.9 Å²	122.9	85%	0.845	73%	0.73	S	S	*	*			trans	-87.7	165.9	-152.1	0	0	0	0	0	116.1
693	S	24.9	Very low	39.1	Very low	116 Å²	116	124.8 Å²	124.8	81%	0.811	74%	0.737	S	S	*	*			trans	-158	118.2	149.5	130	0	0	0	0	107.8	S695	S693-S695 PolarHBondContact O-N 2.88Å
694	S	34.7	Very low	40.9	Very low	121 Å²	121	124.4 Å²	124.4	85%	0.846	72%	0.723	S	S	*	*			trans	-54.9	115.3	173.8	44.9	0	0	0	0	111.9
695	S	26.6	Very low	43.1	Very low	99 Å²	99	118.6 Å²	118.6	69%	0.692	69%	0.686	S	S	*	*			trans	-121.5	102.9	155.7	-177.7	0	0	0	0	107.3	S693 G697	S693-S695 PolarHBondContact O-N 2.88Å; S695-G697 PolarHBondContact O-N 3.26Å
696	E	32	Very low	45.4	Very low	200 Å²	200	112.9 Å²	112.9	94%	0.935	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	119.6	168.8	-71	178.6	145.2	0	0	108.7
697	G	32.2	Very low	47.8	Very low	76 Å²	76	113.8 Å²	113.8	78%	0.784	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	134.6	-5.6	162.1	0	0	0	0	0	118.4	S695	S695-G697 PolarHBondContact O-N 3.26Å
698	Q	36.2	Very low	50.2	Low	173 Å²	173	105.8 Å²	105.8	81%	0.808	61%	0.608	S	S	*	*			trans	-98.2	106.2	174.1	-82.7	-178.2	-18.2	0	0	111.3	R700	Q698-R700 PolarHBondContact O-N 3.39Å; Q698-R700 VanDerWaalsContact O-N 3.09Å
699	V	45.8	Very low	52.9	Low	103 Å²	103	99.9 Å²	99.9	62%	0.624	57%	0.572	S	S	*	*			trans	-61.3	110.2	167.3	179.6	0	0	0	0	107.4	L701	V699-L701 HydrophobicContact CG1-CD2 4.14Å; V699-L701 PolarHBondContact O-N 2.97Å
700	R	51.6	Low	55.8	Low	238 Å²	238	96 Å²	96	90%	0.898	54%	0.54	S	S	*	.			trans	-68.8	99.6	174.9	-166.5	175.9	-175.4	177.6	0.5	108.3	Q698	Q698-R700 PolarHBondContact O-N 3.39Å; Q698-R700 VanDerWaalsContact O-N 3.09Å
701	L	65.6	Low	58.2	Low	30 Å²	30	92.6 Å²	92.6	16%	0.157	51%	0.511	C	S	.	.			trans	-72.4	137	-179.2	-60.2	168.7	0	0	0	110.4	V699 R705 M706 L709	V699-L701 HydrophobicContact CG1-CD2 4.14Å; V699-L701 PolarHBondContact O-N 2.97Å; L701-R705 HydrophobicContact CD2-CG 4.2Å; L701-M706 HydrophobicContact CB-CE 4.34Å; L701-L709 HydrophobicContact CD1-CD1 3.85Å; L701-L709 HydrophobicContact CD2-CD1 4.13Å
702	C	71.9	Confident	61.1	Low	30 Å²	30	83 Å²	83	20%	0.203	47%	0.467	C	S	.	.			trans	-68.7	158.6	170	65.9	0	0	0	0	111.4	Q667 T704 R705 M706	Q667-C702 PolarHBondContact NE2-SG 2.69Å; Q667-C702 VanDerWaalsContact NE2-SG 3.45Å; C702-T704 VanDerWaalsContact C-N 3.28Å; C702-T704 PolarHBondContact O-N 3.49Å; C702-R705 PolarHBondContact O-N 3.27Å; C702-R705 WeakPolarHBondContact SG-CB 3.27Å; C702-R705 PolarHBondContact SG-N 3.42Å; C702-R705 VanDerWaalsContact SG-N 3.35Å; C702-M706 WeakPolarHBondContact O-CB 3.35Å; C702-M706 PolarHBondContact O-N 3.34Å
703	K	75.1	Confident	64	Low	138 Å²	138	79.3 Å²	79.3	60%	0.6	43%	0.427	S	S	*	.	H	α-helix	trans	-54.5	-43.1	-179.4	-67.7	-178.7	-173.5	170.5	0	111.6	E682 M706 K707	E682-K703 IonicContact OE1-NZ 3.63Å; E682-K703 PolarHBondContact OE1-NZ 3.31Å; K703-M706 PolarHBondContact O-N 3.49Å; K703-K707 WeakPolarHBondContact O-CG 3.08Å; K703-K707 PolarHBondContact O-N 3.28Å
704	T	73.6	Confident	67.1	Low	47 Å²	47	73.8 Å²	73.8	29%	0.288	39%	0.389	S	S	.	.	H	α-helix	trans	-62.8	-47.9	178.8	-44.5	0	0	0	0	112.3	M630 C702 M706 K707 A708	M630-T704 HydrophobicContact CB-CG2 4.11Å; M630-T704 HydrophobicContact CE-CG2 4.19Å; M630-T704 VanDerWaalsContact CE-O 3.23Å; M630-T704 WeakPolarHBondContact CE-O 3.32Å; M630-T704 HydrophobicContact CG-CG2 4.37Å; M630-T704 HydrophobicContact SD-CG2 3.57Å; M630-T704 VanDerWaalsContact SD-CG2 3.57Å; C702-T704 VanDerWaalsContact C-N 3.28Å; C702-T704 PolarHBondContact O-N 3.49Å; T704-M706 VanDerWaalsContact C-N 3.32Å; T704-M706 PolarHBondContact O-N 2.94Å; T704-K707 PolarHBondContact O-N 2.79Å; T704-A708 PolarHBondContact O-N 2.75Å
705	R	80.5	Confident	69.8	Low	25 Å²	25	68.5 Å²	68.5	9%	0.094	35%	0.351	C	S	.	.	H	α-helix	trans	-65.9	-36.1	176.5	-172.4	173.1	-178.5	168.8	2	111.7	L627 L663 L701 C702 A708 L709	L627-R705 HydrophobicContact CD1-CB 4.49Å; L663-R705 PolarHBondContact O-NH2 3.4Å; L701-R705 HydrophobicContact CD2-CG 4.2Å; C702-R705 PolarHBondContact O-N 3.27Å; C702-R705 WeakPolarHBondContact SG-CB 3.27Å; C702-R705 PolarHBondContact SG-N 3.42Å; C702-R705 VanDerWaalsContact SG-N 3.35Å; R705-A708 PolarHBondContact O-N 3.21Å; R705-L709 HydrophobicContact CG-CD1 4.09Å; R705-L709 HydrophobicContact CG-CG 4.43Å; R705-L709 WeakPolarHBondContact O-CB 3.34Å; R705-L709 VanDerWaalsContact O-CG 3.24Å; R705-L709 WeakPolarHBondContact O-CG 3.39Å; R705-L709 PolarHBondContact O-N 3Å
706	M	83.6	Confident	72.9	Confident	62 Å²	62	63.8 Å²	63.8	31%	0.305	32%	0.318	S	S	.	.	H	α-helix	trans	-64.1	-43.1	175.5	-175	169.8	-70.6	0	0	111.7	L701 C702 K703 T704 L709 Q710	L701-M706 HydrophobicContact CB-CE 4.34Å; C702-M706 WeakPolarHBondContact O-CB 3.35Å; C702-M706 PolarHBondContact O-N 3.34Å; K703-M706 PolarHBondContact O-N 3.49Å; T704-M706 VanDerWaalsContact C-N 3.32Å; T704-M706 PolarHBondContact O-N 2.94Å; M706-L709 PolarHBondContact O-N 2.96Å; M706-Q710 VanDerWaalsContact O-CG 3.31Å; M706-Q710 WeakPolarHBondContact O-CG 3.48Å; M706-Q710 PolarHBondContact O-N 3.43Å
707	K	82.7	Confident	75.7	Confident	119 Å²	119	54.3 Å²	54.3	52%	0.517	27%	0.273	S	S	.	.	H	α-helix	trans	-59.2	-46.7	173.2	-72.8	178.2	-179.8	177.9	0	111.4	M630 K703 T704 L709 Q710 E711	M630-K707 HydrophobicContact CE-CB 4.07Å; K703-K707 WeakPolarHBondContact O-CG 3.08Å; K703-K707 PolarHBondContact O-N 3.28Å; T704-K707 PolarHBondContact O-N 2.79Å; K707-L709 VanDerWaalsContact C-N 3.31Å; K707-L709 PolarHBondContact O-N 3.42Å; K707-Q710 WeakPolarHBondContact O-CB 3.31Å; K707-Q710 PolarHBondContact O-N 3.39Å; K707-Q710 VanDerWaalsContact O-N 3.14Å; K707-E711 PolarHBondContact O-N 3.05Å
708	A	83.2	Confident	78.4	Confident	0 Å²	0	51 Å²	51	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-58.5	-43.4	178.7	0	0	0	0	0	112.5	L627 M630 N645 F647 T704 R705 E711 A712	L627-A708 HydrophobicContact CD2-CB 4.1Å; M630-A708 HydrophobicContact CE-CB 3.53Å; N645-A708 VanDerWaalsContact ND2-CA 3.29Å; N645-A708 WeakPolarHBondContact ND2-CA 3.23Å; N645-A708 PolarHBondContact ND2-O 3.1Å; N645-A708 VanDerWaalsContact ND2-O 3.13Å; F647-A708 HydrophobicContact CD2-CB 4.15Å; T704-A708 PolarHBondContact O-N 2.75Å; R705-A708 PolarHBondContact O-N 3.21Å; A708-E711 PolarHBondContact O-N 2.88Å; A708-A712 WeakPolarHBondContact O-CB 3.46Å; A708-A712 PolarHBondContact O-N 3.42Å
709	L	88	Confident	81	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-73.4	-29.9	179.6	-65.6	173.7	0	0	0	112.5	F647 L663 L701 R705 M706 K707 A712 M713 L728 V733	F647-L709 HydrophobicContact CB-CD2 4.32Å; F647-L709 HydrophobicContact CD1-CD2 3.93Å; F647-L709 HydrophobicContact CE1-CD2 4.45Å; F647-L709 HydrophobicContact CG-CD2 4.09Å; L663-L709 HydrophobicContact CD2-CD1 4.34Å; L663-L709 HydrophobicContact CD2-CD2 3.8Å; L701-L709 HydrophobicContact CD1-CD1 3.85Å; L701-L709 HydrophobicContact CD2-CD1 4.13Å; R705-L709 HydrophobicContact CG-CD1 4.09Å; R705-L709 HydrophobicContact CG-CG 4.43Å; R705-L709 WeakPolarHBondContact O-CB 3.34Å; R705-L709 VanDerWaalsContact O-CG 3.24Å; R705-L709 WeakPolarHBondContact O-CG 3.39Å; R705-L709 PolarHBondContact O-N 3Å; M706-L709 PolarHBondContact O-N 2.96Å; K707-L709 VanDerWaalsContact C-N 3.31Å; K707-L709 PolarHBondContact O-N 3.42Å; L709-A712 PolarHBondContact O-N 3.29Å; L709-M713 WeakPolarHBondContact O-CB 3.29Å; L709-M713 PolarHBondContact O-N 3.4Å; L709-L728 HydrophobicContact CD2-CD2 3.84Å; L709-V733 HydrophobicContact CB-CG2 3.78Å; L709-V733 HydrophobicContact CD1-CG2 4.44Å
710	Q	88.6	Confident	83	Confident	37 Å²	37	38.4 Å²	38.4	17%	0.173	17%	0.174	C	C	.	.	H	α-helix	trans	-65.9	-41.2	170.9	-76.5	179.1	5.8	0	0	111.7	M706 K707 M713 Y714 V733 K736	M706-Q710 VanDerWaalsContact O-CG 3.31Å; M706-Q710 WeakPolarHBondContact O-CG 3.48Å; M706-Q710 PolarHBondContact O-N 3.43Å; K707-Q710 WeakPolarHBondContact O-CB 3.31Å; K707-Q710 PolarHBondContact O-N 3.39Å; K707-Q710 VanDerWaalsContact O-N 3.14Å; Q710-M713 PolarHBondContact O-N 3.43Å; Q710-Y714 PolarHBondContact O-N 3.03Å; Q710-V733 HydrophobicContact CB-CG1 4.49Å; Q710-V733 HydrophobicContact CG-CG1 3.72Å; Q710-K736 VanDerWaalsContact OE1-CE 3.32Å
711	E	87	Confident	84.9	Confident	48 Å²	48	28.3 Å²	28.3	22%	0.224	14%	0.136	C	C	.	.	H	α-helix	trans	-63.6	-45.6	173.1	-71.2	162.7	-168.3	0	0	110.9	L190 N645 K707 A708 M713 Y714 Y715	L190-E711 HydrophobicContact CD1-CG 4.29Å; L190-E711 HydrophobicContact CD2-CG 4.35Å; N645-E711 PolarHBondContact ND2-OE2 3.41Å; K707-E711 PolarHBondContact O-N 3.05Å; A708-E711 PolarHBondContact O-N 2.88Å; E711-M713 VanDerWaalsContact C-N 3.27Å; E711-M713 PolarHBondContact O-N 3.06Å; E711-Y714 WeakPolarHBondContact O-CB 3.24Å; E711-Y714 PolarHBondContact O-N 2.78Å; E711-Y714 VanDerWaalsContact O-N 3.08Å; E711-Y715 HydrophobicContact CB-CE2 4.32Å; E711-Y715 WeakPolarHBondContact O-CD2 3.35Å; E711-Y715 PolarHBondContact O-N 2.95Å
712	A	89.5	Confident	86.1	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-59.5	-38.4	175.4	0	0	0	0	0	112.4	F647 A651 A708 L709 S716 L728	F647-A712 HydrophobicContact CB-CB 3.99Å; A651-A712 HydrophobicContact CB-CB 3.85Å; A651-A712 WeakPolarHBondContact CB-O 3.16Å; A708-A712 WeakPolarHBondContact O-CB 3.46Å; A708-A712 PolarHBondContact O-N 3.42Å; L709-A712 PolarHBondContact O-N 3.29Å; A712-S716 WeakPolarHBondContact O-CB 3.08Å; A712-S716 PolarHBondContact O-N 3.44Å; A712-S716 PolarHBondContact O-OG 3.49Å; A712-L728 HydrophobicContact CB-CD1 4.07Å
713	M	90.9	Very high	86.9	Confident	3 Å²	3	29.6 Å²	29.6	2%	0.015	14%	0.141	C	C	.	.	H	α-helix	trans	-66.2	-39	174.7	-171.5	-174.2	-84	0	0	111.8	L709 Q710 E711 S716 A717 L728 R729 V733 W735 V739	L709-M713 WeakPolarHBondContact O-CB 3.29Å; L709-M713 PolarHBondContact O-N 3.4Å; Q710-M713 PolarHBondContact O-N 3.43Å; E711-M713 VanDerWaalsContact C-N 3.27Å; E711-M713 PolarHBondContact O-N 3.06Å; M713-S716 WeakPolarHBondContact CA-OG 3.33Å; M713-S716 PolarHBondContact O-OG 3.38Å; M713-S716 VanDerWaalsContact O-OG 3.1Å; M713-A717 WeakPolarHBondContact O-CB 3.37Å; M713-A717 PolarHBondContact O-N 2.93Å; M713-L728 HydrophobicContact CB-CB 4.48Å; M713-L728 HydrophobicContact CB-CD1 3.95Å; M713-L728 HydrophobicContact CE-CB 3.7Å; M713-R729 HydrophobicContact CE-CB 3.96Å; M713-R729 VanDerWaalsContact CE-N 3.35Å; M713-V733 HydrophobicContact CB-CG1 4.5Å; M713-V733 HydrophobicContact CE-CB 3.47Å; M713-V733 VanDerWaalsContact CE-CB 3.47Å; M713-V733 HydrophobicContact CE-CG1 3.46Å; M713-V733 VanDerWaalsContact CE-CG1 3.46Å; M713-V733 HydrophobicContact CE-CG2 4.41Å; M713-V733 HydrophobicContact SD-CB 4.48Å; M713-V733 HydrophobicContact SD-CG1 3.84Å; M713-W735 HydrophobicContact SD-CE3 4.3Å; M713-W735 HydrophobicContact SD-CZ3 4.33Å; M713-V739 HydrophobicContact CG-CG1 3.7Å; M713-V739 HydrophobicContact SD-CG1 4.02Å
714	Y	90.6	Very high	87.7	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-61.7	-52.8	175.6	171.8	-94.5	0	0	0	112	G189 L190 K192 K194 Q710 E711 S716 A717 E718 H738 V739	G189-Y714 WeakPolarHBondContact O-CE2 3.2Å; G189-Y714 PolarHBondContact O-OH 3Å; L190-Y714 HydrophobicContact CD2-CD1 4.04Å; L190-Y714 HydrophobicContact CD2-CD2 3.97Å; L190-Y714 HydrophobicContact CD2-CG 3.59Å; K192-Y714 PolarHBondContact O-OH 3.02Å; K194-Y714 HydrophobicContact CG-CE1 4.35Å; Q710-Y714 PolarHBondContact O-N 3.03Å; E711-Y714 WeakPolarHBondContact O-CB 3.24Å; E711-Y714 PolarHBondContact O-N 2.78Å; E711-Y714 VanDerWaalsContact O-N 3.08Å; Y714-S716 VanDerWaalsContact C-N 3.34Å; Y714-S716 PolarHBondContact O-N 2.97Å; Y714-A717 PolarHBondContact O-N 3.31Å; Y714-E718 HydrophobicContact CE1-CG 4.14Å; Y714-E718 HydrophobicContact CE2-CG 4.14Å; Y714-E718 PolarHBondContact O-N 3Å; Y714-H738 AromaticContact CD2-CD2 3.74Å; Y714-H738 AromaticContact CE2-CD2 3.35Å; Y714-H738 WeakPolarHBondContact CE2-CD2 3.48Å; Y714-H738 AromaticContact CE2-NE2 3.59Å; Y714-V739 HydrophobicContact CD2-CG2 4Å
715	Y	89.9	Confident	88.5	Confident	11 Å²	11	21 Å²	21	4%	0.043	10%	0.1	C	C	.	.	H	α-helix	trans	-65.9	-36	-178.6	-66.6	-64.4	0	0	0	112.9	K194 E642 M644 E711 H719	K194-Y715 VanDerWaalsContact CE-CD1 3.41Å; E642-Y715 PolarHBondContact OE2-OH 3.33Å; M644-Y715 HydrophobicContact CE-CD1 3.91Å; M644-Y715 HydrophobicContact CE-CE1 3.47Å; M644-Y715 VanDerWaalsContact CE-CE1 3.47Å; M644-Y715 HydrophobicContact CE-CE2 4.24Å; M644-Y715 HydrophobicContact CE-CG 4.46Å; M644-Y715 HydrophobicContact CG-CE2 4.12Å; M644-Y715 HydrophobicContact SD-CE1 4.49Å; M644-Y715 HydrophobicContact SD-CE2 4.3Å; E711-Y715 HydrophobicContact CB-CE2 4.32Å; E711-Y715 WeakPolarHBondContact O-CD2 3.35Å; E711-Y715 PolarHBondContact O-N 2.95Å; Y715-H719 WeakPolarHBondContact O-CB 3.3Å; Y715-H719 PolarHBondContact O-N 3.5Å; Y715-H719 VanDerWaalsContact O-N 3.1Å
716	S	91.9	Very high	89	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-67.4	-36.1	175.1	46.4	0	0	0	0	112.7	A712 M713 Y714 G720 Y721 T725	A712-S716 WeakPolarHBondContact O-CB 3.08Å; A712-S716 PolarHBondContact O-N 3.44Å; A712-S716 PolarHBondContact O-OG 3.49Å; M713-S716 WeakPolarHBondContact CA-OG 3.33Å; M713-S716 PolarHBondContact O-OG 3.38Å; M713-S716 VanDerWaalsContact O-OG 3.1Å; Y714-S716 VanDerWaalsContact C-N 3.34Å; Y714-S716 PolarHBondContact O-N 2.97Å; S716-G720 PolarHBondContact O-N 2.9Å; S716-Y721 PolarHBondContact O-N 3.48Å; S716-T725 VanDerWaalsContact OG-CG2 3.25Å; S716-T725 WeakPolarHBondContact OG-CG2 3.27Å
717	A	90.9	Very high	89.3	Confident	1 Å²	1	20.3 Å²	20.3	1%	0.008	10%	0.098	C	C	.	.	H	α-helix	trans	-68.1	-49.8	175.3	0	0	0	0	0	111.8	M713 Y714 H719 G720 T725 V739 E742	M713-A717 WeakPolarHBondContact O-CB 3.37Å; M713-A717 PolarHBondContact O-N 2.93Å; Y714-A717 PolarHBondContact O-N 3.31Å; A717-H719 VanDerWaalsContact C-N 3.26Å; A717-H719 PolarHBondContact O-N 3.28Å; A717-G720 PolarHBondContact O-N 3.35Å; A717-T725 HydrophobicContact CB-CG2 3.78Å; A717-T725 VanDerWaalsContact N-CG2 3.29Å; A717-V739 HydrophobicContact CB-CB 4.31Å; A717-V739 HydrophobicContact CB-CG1 3.61Å; A717-E742 WeakPolarHBondContact O-CG 3.31Å
718	E	89.2	Confident	89.6	Confident	7 Å²	7	14.7 Å²	14.7	3%	0.033	7%	0.073	C	C	.	.	H	α-helix	trans	-56.7	-38.2	178.3	-82.9	-77.3	103.2	0	0	112.5	K194 G205 Y714 G720 H738	K194-E718 WeakPolarHBondContact CB-OE2 3.36Å; K194-E718 HydrophobicContact CG-CG 4.48Å; K194-E718 WeakPolarHBondContact CG-OE2 3.18Å; K194-E718 PolarHBondContact N-OE2 3.36Å; G205-E718 VanDerWaalsContact CA-O 3.27Å; G205-E718 WeakPolarHBondContact CA-O 3.49Å; Y714-E718 HydrophobicContact CE1-CG 4.14Å; Y714-E718 HydrophobicContact CE2-CG 4.14Å; Y714-E718 PolarHBondContact O-N 3Å; E718-G720 VanDerWaalsContact C-N 3.33Å; E718-H738 IonicContact OE1-CE1 3.55Å; E718-H738 PolarHBondContact OE1-CE1 3.44Å; E718-H738 IonicContact OE1-NE2 2.79Å; E718-H738 PolarHBondContact OE1-NE2 3.1Å
719	H	89.9	Confident	89.9	Confident	2 Å²	2	17.1 Å²	17.1	1%	0.009	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	1.7	179.5	-55.6	173.2	0	0	0	113	K194 F208 R209 A652 Y715 A717 Y721	K194-H719 PolarHBondContact NZ-NE2 3.45Å; F208-H719 HydrophobicContact CD1-CB 4.46Å; F208-H719 AromaticContact CD1-CE1 3.25Å; F208-H719 WeakPolarHBondContact CD1-CE1 3.12Å; F208-H719 AromaticContact CD1-CG 3.68Å; F208-H719 AromaticContact CD1-ND1 3.14Å; F208-H719 WeakPolarHBondContact CD1-ND1 3.43Å; F208-H719 AromaticContact CD1-NE2 3.84Å; F208-H719 AromaticContact CD2-CE1 3.83Å; F208-H719 AromaticContact CE1-CE1 3.39Å; F208-H719 WeakPolarHBondContact CE1-CE1 3.35Å; F208-H719 AromaticContact CE1-ND1 3.33Å; F208-H719 VanDerWaalsContact CE1-ND1 3.33Å; F208-H719 WeakPolarHBondContact CE1-ND1 3.45Å; F208-H719 AromaticContact CE2-CE1 3.94Å; F208-H719 AromaticContact CG-CE1 3.49Å; F208-H719 VanDerWaalsContact CG-CE1 3.49Å; F208-H719 WeakPolarHBondContact CG-CE1 3.37Å; F208-H719 AromaticContact CG-ND1 3.82Å; F208-H719 AromaticContact CG-NE2 3.68Å; F208-H719 AromaticContact CZ-CE1 3.73Å; R209-H719 WeakPolarHBondContact CB-O 3.47Å; R209-H719 WeakPolarHBondContact CD-O 3.29Å; R209-H719 WeakPolarHBondContact CG-O 3.28Å; R209-H719 PolarHBondContact NH1-O 2.57Å; A652-H719 PolarHBondContact O-ND1 3.11Å; Y715-H719 WeakPolarHBondContact O-CB 3.3Å; Y715-H719 PolarHBondContact O-N 3.5Å; Y715-H719 VanDerWaalsContact O-N 3.1Å; A717-H719 VanDerWaalsContact C-N 3.26Å; A717-H719 PolarHBondContact O-N 3.28Å; H719-Y721 HydrophobicContact CB-CD2 3.8Å; H719-Y721 HydrophobicContact CB-CE2 3.79Å
720	G	89.1	Confident	89.9	Confident	8 Å²	8	21.6 Å²	21.6	8%	0.082	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.4	20.2	175.9	0	0	0	0	0	116	R209 S716 A717 E718 V722	R209-G720 VanDerWaalsContact NH1-C 3.27Å; R209-G720 PolarHBondContact NH1-O 3.42Å; S716-G720 PolarHBondContact O-N 2.9Å; A717-G720 PolarHBondContact O-N 3.35Å; E718-G720 VanDerWaalsContact C-N 3.33Å; G720-V722 VanDerWaalsContact C-N 3.28Å; G720-V722 PolarHBondContact O-N 3.3Å; G720-V722 VanDerWaalsContact O-N 3.11Å
721	Y	91.1	Very high	89.8	Confident	27 Å²	27	23.5 Å²	23.5	11%	0.106	12%	0.124	C	C	.	.			trans	-83.7	66.8	173.1	-63.6	-68.5	0	0	0	112	A652 H653 S716 H719 D723 I724 T725	A652-Y721 WeakPolarHBondContact O-CE2 3.28Å; H653-Y721 PolarHBondContact O-OH 3.17Å; S716-Y721 PolarHBondContact O-N 3.48Å; H719-Y721 HydrophobicContact CB-CD2 3.8Å; H719-Y721 HydrophobicContact CB-CE2 3.79Å; Y721-D723 VanDerWaalsContact C-N 3.25Å; Y721-D723 PolarHBondContact O-N 2.95Å; Y721-I724 PolarHBondContact O-N 3.05Å; Y721-I724 VanDerWaalsContact O-N 3.07Å; Y721-T725 PolarHBondContact O-N 2.97Å
722	V	89.7	Confident	89.6	Confident	2 Å²	2	22.9 Å²	22.9	1%	0.012	13%	0.131	C	C	.	.	H	α-helix	trans	-56.1	-36.7	-176.6	-178.7	0	0	0	0	113.1	G720 I724 T725 M726 T746 T747 V755	G720-V722 VanDerWaalsContact C-N 3.28Å; G720-V722 PolarHBondContact O-N 3.3Å; G720-V722 VanDerWaalsContact O-N 3.11Å; V722-I724 PolarHBondContact O-N 2.77Å; V722-T725 WeakPolarHBondContact CA-OG1 3.2Å; V722-T725 PolarHBondContact O-N 3.42Å; V722-T725 PolarHBondContact O-OG1 3.5Å; V722-M726 HydrophobicContact CG1-CG 4.05Å; V722-M726 WeakPolarHBondContact O-CG 3.4Å; V722-M726 PolarHBondContact O-N 3.26Å; V722-T746 VanDerWaalsContact CG2-OG1 3.28Å; V722-T746 WeakPolarHBondContact CG2-OG1 3.37Å; V722-T747 HydrophobicContact CB-CG2 4.24Å; V722-T747 HydrophobicContact CG1-CG2 3.41Å; V722-T747 VanDerWaalsContact CG1-CG2 3.41Å; V722-T747 HydrophobicContact CG2-CG2 3.89Å; V722-V755 HydrophobicContact CG1-CG1 4.06Å
723	D	90.3	Very high	89.5	Confident	84 Å²	84	22.9 Å²	22.9	45%	0.449	13%	0.131	S	C	.	.	H	α-helix	trans	-64.3	-32.5	-178.2	-63.1	-44.5	0	0	0	111.9	Y721 E727 R752	Y721-D723 VanDerWaalsContact C-N 3.25Å; Y721-D723 PolarHBondContact O-N 2.95Å; D723-E727 WeakPolarHBondContact O-CB 3.32Å; D723-E727 PolarHBondContact O-N 2.89Å; D723-R752 VanDerWaalsContact CG-NH1 3.32Å; D723-R752 IonicContact OD1-NH1 3.27Å; D723-R752 PolarHBondContact OD1-NH1 2.93Å; D723-R752 IonicContact OD2-CZ 2.8Å; D723-R752 IonicContact OD2-NH1 3.76Å; D723-R752 PolarHBondContact OD2-NH1 3.38Å; D723-R752 IonicContact OD2-NH2 3.66Å
724	I	91.2	Very high	89.2	Confident	4 Å²	4	25.3 Å²	25.3	2%	0.021	15%	0.147	C	C	.	.	H	α-helix	trans	-75.5	-41.7	174.5	-70.1	168.6	0	0	0	110.6	A651 R656 L659 Y721 V722 M726 E727 L728	A651-I724 HydrophobicContact CB-CG2 4Å; R656-I724 HydrophobicContact CB-CD1 4.35Å; R656-I724 HydrophobicContact CB-CG1 4.22Å; R656-I724 HydrophobicContact CG-CG1 4.38Å; L659-I724 HydrophobicContact CD2-CG2 3.57Å; Y721-I724 PolarHBondContact O-N 3.05Å; Y721-I724 VanDerWaalsContact O-N 3.07Å; V722-I724 PolarHBondContact O-N 2.77Å; I724-M726 VanDerWaalsContact C-N 3.33Å; I724-M726 PolarHBondContact O-N 2.91Å; I724-E727 PolarHBondContact O-N 3.42Å; I724-L728 HydrophobicContact CG2-CD1 3.93Å; I724-L728 HydrophobicContact CG2-CG 4.3Å; I724-L728 WeakPolarHBondContact O-CG 3.29Å; I724-L728 PolarHBondContact O-N 2.93Å
725	T	91.5	Very high	89	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.4	-43.1	178.9	63.9	0	0	0	0	111.3	S716 A717 Y721 V722 L728 R729	S716-T725 VanDerWaalsContact OG-CG2 3.25Å; S716-T725 WeakPolarHBondContact OG-CG2 3.27Å; A717-T725 HydrophobicContact CB-CG2 3.78Å; A717-T725 VanDerWaalsContact N-CG2 3.29Å; Y721-T725 PolarHBondContact O-N 2.97Å; V722-T725 WeakPolarHBondContact CA-OG1 3.2Å; V722-T725 PolarHBondContact O-N 3.42Å; V722-T725 PolarHBondContact O-OG1 3.5Å; T725-L728 PolarHBondContact O-N 3.49Å; T725-R729 WeakPolarHBondContact O-CB 3.49Å; T725-R729 PolarHBondContact O-N 2.87Å
726	M	90.5	Very high	88.8	Confident	42 Å²	42	28 Å²	28	21%	0.207	16%	0.159	C	C	.	.	H	α-helix	trans	-67	-35.9	177.2	-66.5	-56.4	-62.7	0	0	112.5	V722 I724 R729 S730 W735 V755 T758 L759	V722-M726 HydrophobicContact CG1-CG 4.05Å; V722-M726 WeakPolarHBondContact O-CG 3.4Å; V722-M726 PolarHBondContact O-N 3.26Å; I724-M726 VanDerWaalsContact C-N 3.33Å; I724-M726 PolarHBondContact O-N 2.91Å; M726-R729 WeakPolarHBondContact O-CB 3.23Å; M726-R729 PolarHBondContact O-N 3.29Å; M726-S730 PolarHBondContact O-N 2.9Å; M726-W735 HydrophobicContact SD-CH2 4.11Å; M726-W735 HydrophobicContact SD-CZ2 4.2Å; M726-V755 HydrophobicContact CE-CG1 4.41Å; M726-V755 HydrophobicContact CG-CG1 4.05Å; M726-V755 HydrophobicContact SD-CG1 4.07Å; M726-T758 HydrophobicContact CE-CG2 3.97Å; M726-L759 HydrophobicContact SD-CD2 3.71Å; M726-L759 HydrophobicContact SD-CG 4.29Å
727	E	89.6	Confident	88.5	Confident	32 Å²	32	28.3 Å²	28.3	15%	0.15	16%	0.16	C	C	.	.	H	α-helix	trans	-67.9	-44.4	175	-173	161.4	178.3	0	0	111.3	R656 R660 D723 I724 R729 S730 L731	R656-E727 IonicContact CZ-OE2 3.28Å; R656-E727 VanDerWaalsContact CZ-OE2 3.23Å; R656-E727 IonicContact NE-OE2 3.98Å; R656-E727 PolarHBondContact NE-OE2 3.31Å; R656-E727 IonicContact NH2-OE2 3.87Å; R656-E727 PolarHBondContact NH2-OE2 3.47Å; R660-E727 IonicContact CZ-OE1 3.74Å; R660-E727 IonicContact CZ-OE2 2.66Å; R660-E727 IonicContact NE-OE1 2.71Å; R660-E727 PolarHBondContact NE-OE1 3.49Å; R660-E727 IonicContact NE-OE2 2.79Å; R660-E727 PolarHBondContact NE-OE2 2.96Å; R660-E727 IonicContact NH2-OE1 3.71Å; R660-E727 PolarHBondContact NH2-OE1 3.36Å; R660-E727 IonicContact NH2-OE2 2.71Å; R660-E727 PolarHBondContact NH2-OE2 3.34Å; D723-E727 WeakPolarHBondContact O-CB 3.32Å; D723-E727 PolarHBondContact O-N 2.89Å; I724-E727 PolarHBondContact O-N 3.42Å; E727-R729 VanDerWaalsContact C-N 3.25Å; E727-R729 PolarHBondContact O-N 3.11Å; E727-S730 WeakPolarHBondContact O-CB 3.08Å; E727-S730 PolarHBondContact O-N 2.66Å; E727-S730 VanDerWaalsContact O-N 3.13Å; E727-S730 PolarHBondContact O-OG 2.92Å; E727-L731 WeakPolarHBondContact O-CG 3.36Å; E727-L731 PolarHBondContact O-N 3.22Å
728	L	88.9	Confident	88.3	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.8	-35.9	173.1	-70	173.7	0	0	0	111.9	L659 L709 A712 M713 I724 T725 L731 V733	L659-L728 HydrophobicContact CD2-CD2 4.14Å; L659-L728 HydrophobicContact CD2-CG 4.32Å; L709-L728 HydrophobicContact CD2-CD2 3.84Å; A712-L728 HydrophobicContact CB-CD1 4.07Å; M713-L728 HydrophobicContact CB-CB 4.48Å; M713-L728 HydrophobicContact CB-CD1 3.95Å; M713-L728 HydrophobicContact CE-CB 3.7Å; I724-L728 HydrophobicContact CG2-CD1 3.93Å; I724-L728 HydrophobicContact CG2-CG 4.3Å; I724-L728 WeakPolarHBondContact O-CG 3.29Å; I724-L728 PolarHBondContact O-N 2.93Å; T725-L728 PolarHBondContact O-N 3.49Å; L728-L731 HydrophobicContact CD2-CD1 4.41Å; L728-L731 WeakPolarHBondContact O-CB 3.5Å; L728-L731 PolarHBondContact O-N 3.29Å; L728-V733 WeakPolarHBondContact O-CB 3.46Å; L728-V733 WeakPolarHBondContact O-CG2 3.38Å
729	R	89.9	Confident	88.3	Confident	51 Å²	51	28.1 Å²	28.1	19%	0.192	16%	0.159	C	C	.	.	H	α-helix	trans	-64.8	-42.7	173.8	176.1	57.7	-176.8	149.4	-0.9	112	M713 T725 M726 E727 L731 G732 V733 W735 E762	M713-R729 HydrophobicContact CE-CB 3.96Å; M713-R729 VanDerWaalsContact CE-N 3.35Å; T725-R729 WeakPolarHBondContact O-CB 3.49Å; T725-R729 PolarHBondContact O-N 2.87Å; M726-R729 WeakPolarHBondContact O-CB 3.23Å; M726-R729 PolarHBondContact O-N 3.29Å; E727-R729 VanDerWaalsContact C-N 3.25Å; E727-R729 PolarHBondContact O-N 3.11Å; R729-L731 PolarHBondContact O-N 3.48Å; R729-G732 PolarHBondContact O-N 2.74Å; R729-V733 VanDerWaalsContact CD-O 3.22Å; R729-V733 WeakPolarHBondContact CD-O 3.4Å; R729-V733 PolarHBondContact NH1-O 3.49Å; R729-W735 HydrophobicContact CB-CH2 4.42Å; R729-W735 HydrophobicContact CB-CZ2 4.05Å; R729-W735 HydrophobicContact CG-CZ2 3.7Å; R729-E762 IonicContact CZ-OE2 3.62Å; R729-E762 IonicContact NE-OE2 2.79Å; R729-E762 PolarHBondContact NE-OE2 3.25Å; R729-E762 IonicContact NH2-OE2 3.55Å
730	S	87.9	Confident	88.3	Confident	95 Å²	95	28 Å²	28	66%	0.664	16%	0.159	S	C	*	.	H	α-helix	trans	-61.4	-23.5	177.3	77.2	0	0	0	0	113.4	M726 E727 G732	M726-S730 PolarHBondContact O-N 2.9Å; E727-S730 WeakPolarHBondContact O-CB 3.08Å; E727-S730 PolarHBondContact O-N 2.66Å; E727-S730 VanDerWaalsContact O-N 3.13Å; E727-S730 PolarHBondContact O-OG 2.92Å; S730-G732 VanDerWaalsContact C-N 3.25Å; S730-G732 PolarHBondContact O-N 3.32Å
731	L	85.1	Confident	88.3	Confident	76 Å²	76	27.6 Å²	27.6	40%	0.398	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-0.5	174.7	-62.9	170.9	0	0	0	113.6	L663 E727 L728 R729	L663-L731 HydrophobicContact CD1-CD1 3.54Å; L663-L731 HydrophobicContact CD2-CD1 4.24Å; E727-L731 WeakPolarHBondContact O-CG 3.36Å; E727-L731 PolarHBondContact O-N 3.22Å; L728-L731 HydrophobicContact CD2-CD1 4.41Å; L728-L731 WeakPolarHBondContact O-CB 3.5Å; L728-L731 PolarHBondContact O-N 3.29Å; R729-L731 PolarHBondContact O-N 3.48Å
732	G	83.7	Confident	88.2	Confident	36 Å²	36	26.9 Å²	26.9	37%	0.371	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.5	11.8	175.9	0	0	0	0	0	115.1	R729 S730	R729-G732 PolarHBondContact O-N 2.74Å; S730-G732 VanDerWaalsContact C-N 3.25Å; S730-G732 PolarHBondContact O-N 3.32Å
733	V	86.5	Confident	88.2	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.152	C	C	.	.	P	Polyproline II helix	trans	-69.2	129.7	172.7	179.8	0	0	0	0	109.2	L709 Q710 M713 L728 R729	L709-V733 HydrophobicContact CB-CG2 3.78Å; L709-V733 HydrophobicContact CD1-CG2 4.44Å; Q710-V733 HydrophobicContact CB-CG1 4.49Å; Q710-V733 HydrophobicContact CG-CG1 3.72Å; M713-V733 HydrophobicContact CB-CG1 4.5Å; M713-V733 HydrophobicContact CE-CB 3.47Å; M713-V733 VanDerWaalsContact CE-CB 3.47Å; M713-V733 HydrophobicContact CE-CG1 3.46Å; M713-V733 VanDerWaalsContact CE-CG1 3.46Å; M713-V733 HydrophobicContact CE-CG2 4.41Å; M713-V733 HydrophobicContact SD-CB 4.48Å; M713-V733 HydrophobicContact SD-CG1 3.84Å; L728-V733 WeakPolarHBondContact O-CB 3.46Å; L728-V733 WeakPolarHBondContact O-CG2 3.38Å; R729-V733 VanDerWaalsContact CD-O 3.22Å; R729-V733 WeakPolarHBondContact CD-O 3.4Å; R729-V733 PolarHBondContact NH1-O 3.49Å
734	P	85.6	Confident	88.2	Confident	54 Å²	54	22.8 Å²	22.8	35%	0.351	13%	0.13	S	C	.	.	P	Polyproline II helix	trans	-74.2	152	179.8	30.3	-35.2	0	0	0	111.8
735	W	86.3	Confident	88.1	Confident	15 Å²	15	24.9 Å²	24.9	6%	0.057	14%	0.138	C	C	.	.	P	Polyproline II helix	trans	-69	134.4	173.8	-72	113.2	0	0	0	111	M713 M726 R729 V739 W740 L759 E762 I766	M713-W735 HydrophobicContact SD-CE3 4.3Å; M713-W735 HydrophobicContact SD-CZ3 4.33Å; M726-W735 HydrophobicContact SD-CH2 4.11Å; M726-W735 HydrophobicContact SD-CZ2 4.2Å; R729-W735 HydrophobicContact CB-CH2 4.42Å; R729-W735 HydrophobicContact CB-CZ2 4.05Å; R729-W735 HydrophobicContact CG-CZ2 3.7Å; W735-V739 HydrophobicContact CE3-CG1 4.13Å; W735-V739 HydrophobicContact CZ3-CG1 4Å; W735-W740 HydrophobicContact CD2-CB 4.34Å; W735-W740 HydrophobicContact CE3-CB 4.03Å; W735-L759 HydrophobicContact CH2-CD2 3.52Å; W735-L759 HydrophobicContact CZ2-CD2 3.47Å; W735-L759 VanDerWaalsContact CZ2-CD2 3.47Å; W735-L759 HydrophobicContact CZ3-CD2 4.41Å; W735-E762 PolarHBondContact NE1-OE2 2.85Å; W735-I766 HydrophobicContact CB-CD1 4.25Å; W735-I766 HydrophobicContact CB-CG1 3.92Å
736	K	86.1	Confident	87.9	Confident	53 Å²	53	25.7 Å²	25.7	23%	0.23	14%	0.143	C	C	.	.	P	Polyproline II helix	trans	-95.6	142.4	156.2	-67.8	-174.5	-179.7	174.6	0	108.1	L190 Q710 H738 V739 W740	L190-K736 HydrophobicContact CB-CD 3.76Å; Q710-K736 VanDerWaalsContact OE1-CE 3.32Å; K736-H738 VanDerWaalsContact C-N 3.34Å; K736-H738 PolarHBondContact O-N 2.61Å; K736-V739 HydrophobicContact CB-CB 4.37Å; K736-V739 HydrophobicContact CB-CG2 4Å; K736-V739 WeakPolarHBondContact O-CB 3.34Å; K736-V739 PolarHBondContact O-N 3.21Å; K736-V739 VanDerWaalsContact O-N 3.11Å; K736-W740 PolarHBondContact O-N 2.71Å
737	L	85.1	Confident	87.7	Confident	5 Å²	5	23.7 Å²	23.7	3%	0.026	13%	0.133	C	C	.	.	H	α-helix	trans	-51.8	-50.8	-174.5	177.9	65.6	0	0	0	112.6	V739 W740 I741 I766 D770 N772 L775	L737-V739 PolarHBondContact O-N 3.49Å; L737-W740 WeakPolarHBondContact O-CB 3.47Å; L737-W740 PolarHBondContact O-N 3.11Å; L737-I741 HydrophobicContact CD1-CD1 4.14Å; L737-I741 HydrophobicContact CD1-CG1 4.41Å; L737-I741 HydrophobicContact CG-CD1 4.01Å; L737-I741 WeakPolarHBondContact O-CG1 3.5Å; L737-I741 PolarHBondContact O-N 2.86Å; L737-I766 HydrophobicContact CD1-CD1 4.46Å; L737-I766 HydrophobicContact CD1-CG2 4.46Å; L737-D770 VanDerWaalsContact CD2-O 3.27Å; L737-D770 WeakPolarHBondContact CD2-O 3.47Å; L737-N772 HydrophobicContact CD2-CB 3.82Å; L737-N772 VanDerWaalsContact CD2-N 3.3Å; L737-L775 HydrophobicContact CD1-CB 4.22Å; L737-L775 HydrophobicContact CD1-CD1 4.22Å; L737-L775 HydrophobicContact CD1-CD2 4.26Å; L737-L775 HydrophobicContact CD1-CG 4.47Å; L737-L775 HydrophobicContact CD2-CB 3.88Å; L737-L775 HydrophobicContact CG-CB 4.46Å
738	H	87.1	Confident	87.5	Confident	2 Å²	2	23.7 Å²	23.7	1%	0.009	13%	0.133	C	C	.	.	H	α-helix	trans	-58.1	-47.5	178.8	169.7	66.6	0	0	0	112.4	G193 Y714 E718 K736 W740 I741 E742 E774	G193-H738 WeakPolarHBondContact CA-CE1 3.43Å; G193-H738 WeakPolarHBondContact CA-NE2 3.4Å; G193-H738 PolarHBondContact N-CE1 3.16Å; G193-H738 PolarHBondContact N-ND1 2.95Å; Y714-H738 AromaticContact CD2-CD2 3.74Å; Y714-H738 AromaticContact CE2-CD2 3.35Å; Y714-H738 WeakPolarHBondContact CE2-CD2 3.48Å; Y714-H738 AromaticContact CE2-NE2 3.59Å; E718-H738 IonicContact OE1-CE1 3.55Å; E718-H738 PolarHBondContact OE1-CE1 3.44Å; E718-H738 IonicContact OE1-NE2 2.79Å; E718-H738 PolarHBondContact OE1-NE2 3.1Å; K736-H738 VanDerWaalsContact C-N 3.34Å; K736-H738 PolarHBondContact O-N 2.61Å; H738-W740 VanDerWaalsContact C-N 3.27Å; H738-W740 PolarHBondContact O-N 3.43Å; H738-I741 PolarHBondContact O-N 2.75Å; H738-E742 PolarHBondContact O-N 3.4Å; H738-E774 IonicContact CE1-OE1 3.78Å; H738-E774 IonicContact CG-OE1 2.93Å; H738-E774 IonicContact CG-OE2 2.69Å; H738-E774 VanDerWaalsContact ND1-CD 3.33Å; H738-E774 IonicContact ND1-OE1 2.85Å; H738-E774 PolarHBondContact ND1-OE1 3.39Å; H738-E774 IonicContact ND1-OE2 3.04Å; H738-E774 PolarHBondContact ND1-OE2 3.44Å
739	V	88.4	Confident	87.3	Confident	2 Å²	2	31.3 Å²	31.3	1%	0.012	16%	0.163	C	C	.	.	H	α-helix	trans	-59.4	-39.4	177.9	178.2	0	0	0	0	111.5	M713 Y714 A717 W735 K736 L737 S743	M713-V739 HydrophobicContact CG-CG1 3.7Å; M713-V739 HydrophobicContact SD-CG1 4.02Å; Y714-V739 HydrophobicContact CD2-CG2 4Å; A717-V739 HydrophobicContact CB-CB 4.31Å; A717-V739 HydrophobicContact CB-CG1 3.61Å; W735-V739 HydrophobicContact CE3-CG1 4.13Å; W735-V739 HydrophobicContact CZ3-CG1 4Å; K736-V739 HydrophobicContact CB-CB 4.37Å; K736-V739 HydrophobicContact CB-CG2 4Å; K736-V739 WeakPolarHBondContact O-CB 3.34Å; K736-V739 PolarHBondContact O-N 3.21Å; K736-V739 VanDerWaalsContact O-N 3.11Å; L737-V739 PolarHBondContact O-N 3.49Å; V739-S743 VanDerWaalsContact O-CB 3.23Å; V739-S743 WeakPolarHBondContact O-CB 3.19Å; V739-S743 PolarHBondContact O-N 3.19Å; V739-S743 PolarHBondContact O-OG 3.48Å
740	W	90.9	Very high	87.1	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-67	-46.1	175.9	178.5	90.5	0	0	0	111.9	W735 K736 L737 H738 E742 S743 L744 L759 L760 F763 I766 M783	W735-W740 HydrophobicContact CD2-CB 4.34Å; W735-W740 HydrophobicContact CE3-CB 4.03Å; K736-W740 PolarHBondContact O-N 2.71Å; L737-W740 WeakPolarHBondContact O-CB 3.47Å; L737-W740 PolarHBondContact O-N 3.11Å; H738-W740 VanDerWaalsContact C-N 3.27Å; H738-W740 PolarHBondContact O-N 3.43Å; W740-E742 PolarHBondContact O-N 3.43Å; W740-S743 PolarHBondContact O-N 3Å; W740-L744 HydrophobicContact CH2-CD2 3.6Å; W740-L744 HydrophobicContact CZ2-CD2 3.96Å; W740-L744 HydrophobicContact CZ3-CD2 4.05Å; W740-L744 WeakPolarHBondContact O-CB 3.48Å; W740-L744 PolarHBondContact O-N 3.3Å; W740-L759 PolarHBondContact NE1-O 2.99Å; W740-L760 HydrophobicContact CZ2-CD2 4.19Å; W740-F763 HydrophobicContact CD2-CD2 4.08Å; W740-F763 AromaticContact CE2-CD2 3.74Å; W740-F763 HydrophobicContact CE3-CD2 4.05Å; W740-F763 HydrophobicContact CE3-CE2 4.29Å; W740-F763 AromaticContact CH2-CD2 3.4Å; W740-F763 HydrophobicContact CH2-CD2 3.4Å; W740-F763 VanDerWaalsContact CH2-CD2 3.4Å; W740-F763 AromaticContact CH2-CE2 3.9Å; W740-F763 HydrophobicContact CH2-CE2 3.9Å; W740-F763 HydrophobicContact CH2-CG 4.27Å; W740-F763 HydrophobicContact CZ2-CB 3.88Å; W740-F763 AromaticContact CZ2-CD2 3.41Å; W740-F763 HydrophobicContact CZ2-CD2 3.41Å; W740-F763 VanDerWaalsContact CZ2-CD2 3.41Å; W740-F763 HydrophobicContact CZ2-CE2 4.34Å; W740-F763 HydrophobicContact CZ2-CG 4.02Å; W740-F763 AromaticContact CZ3-CD2 3.74Å; W740-F763 HydrophobicContact CZ3-CD2 3.74Å; W740-F763 AromaticContact CZ3-CE2 3.87Å; W740-F763 HydrophobicContact CZ3-CE2 3.87Å; W740-I766 HydrophobicContact CB-CD1 3.85Å; W740-I766 HydrophobicContact CD2-CD1 4.01Å; W740-I766 HydrophobicContact CE3-CD1 4.46Å; W740-I766 HydrophobicContact CG-CD1 3.71Å; W740-M783 HydrophobicContact CH2-SD 4.06Å
741	I	89	Confident	87	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.5	-47.8	178.1	-66.9	171.5	0	0	0	110.3	L737 H738 L744 R745 E774 L775 L782	L737-I741 HydrophobicContact CD1-CD1 4.14Å; L737-I741 HydrophobicContact CD1-CG1 4.41Å; L737-I741 HydrophobicContact CG-CD1 4.01Å; L737-I741 WeakPolarHBondContact O-CG1 3.5Å; L737-I741 PolarHBondContact O-N 2.86Å; H738-I741 PolarHBondContact O-N 2.75Å; I741-L744 PolarHBondContact O-N 3.33Å; I741-R745 WeakPolarHBondContact O-CB 3.31Å; I741-R745 PolarHBondContact O-N 3.14Å; I741-E774 HydrophobicContact CD1-CG 4.18Å; I741-L775 HydrophobicContact CD1-CB 4.33Å; I741-L775 HydrophobicContact CD1-CD1 4.41Å; I741-L782 HydrophobicContact CG2-CD2 4.47Å
742	E	88.4	Confident	87.1	Confident	11 Å²	11	32.2 Å²	32.2	5%	0.051	16%	0.16	C	C	.	.	H	α-helix	trans	-69.2	-37	-178.7	-167.9	59.2	-152	0	0	111.9	A717 H738 W740 L744 R745 T746	A717-E742 WeakPolarHBondContact O-CG 3.31Å; H738-E742 PolarHBondContact O-N 3.4Å; W740-E742 PolarHBondContact O-N 3.43Å; E742-L744 VanDerWaalsContact C-N 3.34Å; E742-L744 PolarHBondContact O-N 2.89Å; E742-R745 WeakPolarHBondContact O-CB 3.4Å; E742-R745 PolarHBondContact O-N 2.84Å; E742-R745 WeakPolarHBondContact OE2-CD 3.5Å; E742-R745 IonicContact OE2-CZ 3.59Å; E742-R745 IonicContact OE2-NE 2.65Å; E742-R745 IonicContact OE2-NH1 3.11Å; E742-R745 PolarHBondContact OE2-NH1 3.2Å; E742-T746 HydrophobicContact CG-CG2 4.47Å; E742-T746 WeakPolarHBondContact O-CB 2.92Å; E742-T746 VanDerWaalsContact O-CG2 3.3Å; E742-T746 WeakPolarHBondContact O-CG2 3.37Å; E742-T746 PolarHBondContact O-N 3.01Å; E742-T746 PolarHBondContact O-OG1 3.46Å
743	S	90.3	Very high	87.1	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.6	-39.3	172.7	-62.1	0	0	0	0	111.9	V739 W740 T746 T747	V739-S743 VanDerWaalsContact O-CB 3.23Å; V739-S743 WeakPolarHBondContact O-CB 3.19Å; V739-S743 PolarHBondContact O-N 3.19Å; V739-S743 PolarHBondContact O-OG 3.48Å; W740-S743 PolarHBondContact O-N 3Å; S743-T746 WeakPolarHBondContact CA-OG1 3.49Å; S743-T746 PolarHBondContact O-OG1 3Å; S743-T746 VanDerWaalsContact O-OG1 3.08Å; S743-T747 WeakPolarHBondContact O-CB 3.22Å; S743-T747 VanDerWaalsContact O-CG2 3.24Å; S743-T747 WeakPolarHBondContact O-CG2 3.39Å; S743-T747 PolarHBondContact O-N 2.88Å; S743-T747 VanDerWaalsContact O-N 3.08Å; S743-T747 PolarHBondContact O-OG1 2.85Å
744	L	90.3	Very high	87.1	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-66.9	-41.8	175.4	-177.3	64.7	0	0	0	111.3	W740 I741 E742 T747 F748 V756 L759 L760 L782 M783 I786	W740-L744 HydrophobicContact CH2-CD2 3.6Å; W740-L744 HydrophobicContact CZ2-CD2 3.96Å; W740-L744 HydrophobicContact CZ3-CD2 4.05Å; W740-L744 WeakPolarHBondContact O-CB 3.48Å; W740-L744 PolarHBondContact O-N 3.3Å; I741-L744 PolarHBondContact O-N 3.33Å; E742-L744 VanDerWaalsContact C-N 3.34Å; E742-L744 PolarHBondContact O-N 2.89Å; L744-T747 WeakPolarHBondContact CA-OG1 3.43Å; L744-T747 PolarHBondContact O-OG1 3.37Å; L744-F748 VanDerWaalsContact O-CB 3.28Å; L744-F748 WeakPolarHBondContact O-CB 3.4Å; L744-F748 PolarHBondContact O-N 3.46Å; L744-V756 HydrophobicContact CD1-CG1 3.97Å; L744-L759 HydrophobicContact CD1-CB 4.49Å; L744-L760 HydrophobicContact CD1-CD2 4.02Å; L744-L760 HydrophobicContact CD1-CG 4.3Å; L744-L760 HydrophobicContact CD2-CD2 4.08Å; L744-L782 HydrophobicContact CB-CD2 4.15Å; L744-L782 HydrophobicContact CD2-CD2 4.03Å; L744-L782 HydrophobicContact CG-CD2 3.98Å; L744-M783 HydrophobicContact CD2-CG 4.23Å; L744-I786 HydrophobicContact CD1-CD1 3.96Å; L744-I786 HydrophobicContact CD2-CD1 3.91Å; L744-I786 HydrophobicContact CG-CD1 3.8Å
745	R	89.3	Confident	87.1	Confident	49 Å²	49	38.1 Å²	38.1	19%	0.185	18%	0.181	C	C	.	.	H	α-helix	trans	-60.2	-53.1	178.2	-179.6	-179.9	-66	160	-3.6	111.3	I741 E742 F748 Y749 E778 L782	I741-R745 WeakPolarHBondContact O-CB 3.31Å; I741-R745 PolarHBondContact O-N 3.14Å; E742-R745 WeakPolarHBondContact O-CB 3.4Å; E742-R745 PolarHBondContact O-N 2.84Å; E742-R745 WeakPolarHBondContact OE2-CD 3.5Å; E742-R745 IonicContact OE2-CZ 3.59Å; E742-R745 IonicContact OE2-NE 2.65Å; E742-R745 IonicContact OE2-NH1 3.11Å; E742-R745 PolarHBondContact OE2-NH1 3.2Å; R745-F748 PolarHBondContact O-N 3.27Å; R745-Y749 HydrophobicContact CG-CD2 3.78Å; R745-Y749 HydrophobicContact CG-CE2 3.37Å; R745-Y749 WeakPolarHBondContact O-CD2 3.26Å; R745-Y749 PolarHBondContact O-N 3.37Å; R745-E778 IonicContact CZ-OE2 2.83Å; R745-E778 IonicContact NH1-OE2 2.99Å; R745-E778 PolarHBondContact NH1-OE2 2.77Å; R745-E778 IonicContact NH2-OE2 3Å; R745-E778 PolarHBondContact NH2-OE2 3.41Å; R745-L782 HydrophobicContact CB-CD1 4.29Å; R745-L782 HydrophobicContact CB-CD2 3.77Å; R745-L782 HydrophobicContact CG-CD1 4.35Å
746	T	86.1	Confident	87.1	Confident	17 Å²	17	37.5 Å²	37.5	10%	0.104	18%	0.178	C	C	.	.	H	α-helix	trans	-64.2	-42.7	-177.8	51.3	0	0	0	0	111.8	V722 E742 S743 F748 Y749 Q750	V722-T746 VanDerWaalsContact CG2-OG1 3.28Å; V722-T746 WeakPolarHBondContact CG2-OG1 3.37Å; E742-T746 HydrophobicContact CG-CG2 4.47Å; E742-T746 WeakPolarHBondContact O-CB 2.92Å; E742-T746 VanDerWaalsContact O-CG2 3.3Å; E742-T746 WeakPolarHBondContact O-CG2 3.37Å; E742-T746 PolarHBondContact O-N 3.01Å; E742-T746 PolarHBondContact O-OG1 3.46Å; S743-T746 WeakPolarHBondContact CA-OG1 3.49Å; S743-T746 PolarHBondContact O-OG1 3Å; S743-T746 VanDerWaalsContact O-OG1 3.08Å; T746-F748 VanDerWaalsContact C-N 3.35Å; T746-F748 PolarHBondContact O-N 3.49Å; T746-Y749 PolarHBondContact O-N 2.8Å; T746-Q750 WeakPolarHBondContact O-CB 3.28Å; T746-Q750 VanDerWaalsContact O-CG 3.3Å; T746-Q750 WeakPolarHBondContact O-CG 3.22Å; T746-Q750 PolarHBondContact O-N 3.37Å
747	T	87.3	Confident	87.1	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-64.5	-37.1	176.2	49.1	0	0	0	0	113.5	V722 S743 L744 Q750 S751 R752 V755 L759	V722-T747 HydrophobicContact CB-CG2 4.24Å; V722-T747 HydrophobicContact CG1-CG2 3.41Å; V722-T747 VanDerWaalsContact CG1-CG2 3.41Å; V722-T747 HydrophobicContact CG2-CG2 3.89Å; S743-T747 WeakPolarHBondContact O-CB 3.22Å; S743-T747 VanDerWaalsContact O-CG2 3.24Å; S743-T747 WeakPolarHBondContact O-CG2 3.39Å; S743-T747 PolarHBondContact O-N 2.88Å; S743-T747 VanDerWaalsContact O-N 3.08Å; S743-T747 PolarHBondContact O-OG1 2.85Å; L744-T747 WeakPolarHBondContact CA-OG1 3.43Å; L744-T747 PolarHBondContact O-OG1 3.37Å; T747-Q750 PolarHBondContact O-N 2.97Å; T747-S751 PolarHBondContact O-N 3.43Å; T747-S751 VanDerWaalsContact O-N 3.16Å; T747-R752 PolarHBondContact O-N 3.34Å; T747-V755 HydrophobicContact CG2-CB 4.01Å; T747-V755 HydrophobicContact CG2-CG1 3.68Å; T747-L759 HydrophobicContact CG2-CD1 3.97Å
748	F	86.3	Confident	87.2	Confident	32 Å²	32	39.9 Å²	39.9	14%	0.14	19%	0.194	C	C	.	.	H	α-helix	trans	-66.2	-46.9	176.3	175	-111.1	0	0	0	111.6	L744 R745 T746 Q750 S751 L782 I786 T789	L744-F748 VanDerWaalsContact O-CB 3.28Å; L744-F748 WeakPolarHBondContact O-CB 3.4Å; L744-F748 PolarHBondContact O-N 3.46Å; R745-F748 PolarHBondContact O-N 3.27Å; T746-F748 VanDerWaalsContact C-N 3.35Å; T746-F748 PolarHBondContact O-N 3.49Å; F748-Q750 VanDerWaalsContact C-N 3.3Å; F748-Q750 PolarHBondContact O-N 2.73Å; F748-S751 PolarHBondContact O-N 3.39Å; F748-L782 HydrophobicContact CD1-CD1 4.33Å; F748-I786 HydrophobicContact CB-CD1 4.31Å; F748-I786 HydrophobicContact CB-CG1 4.27Å; F748-I786 HydrophobicContact CD1-CG1 4.11Å; F748-I786 HydrophobicContact CD2-CB 4.37Å; F748-I786 HydrophobicContact CD2-CD1 4.42Å; F748-I786 HydrophobicContact CD2-CG1 3.59Å; F748-I786 HydrophobicContact CD2-CG2 4.3Å; F748-I786 HydrophobicContact CE1-CG1 4.37Å; F748-I786 HydrophobicContact CE2-CB 4.31Å; F748-I786 HydrophobicContact CE2-CG1 3.88Å; F748-I786 HydrophobicContact CE2-CG2 4.36Å; F748-I786 HydrophobicContact CG-CD1 4.28Å; F748-I786 HydrophobicContact CG-CG1 3.71Å; F748-I786 HydrophobicContact CZ-CG1 4.28Å; F748-T789 VanDerWaalsContact CE2-OG1 3.27Å; F748-T789 WeakPolarHBondContact CE2-OG1 3.31Å; F748-T789 HydrophobicContact CZ-CG2 4.24Å; F748-T789 WeakPolarHBondContact CZ-OG1 3.27Å
749	Y	84.3	Confident	87.2	Confident	159 Å²	159	39.8 Å²	39.8	62%	0.624	19%	0.194	S	C	*	.	H	α-helix	trans	-62.7	-36.1	175.3	-71	-53.1	0	0	0	112.8	R745 T746 S751	R745-Y749 HydrophobicContact CG-CD2 3.78Å; R745-Y749 HydrophobicContact CG-CE2 3.37Å; R745-Y749 WeakPolarHBondContact O-CD2 3.26Å; R745-Y749 PolarHBondContact O-N 3.37Å; T746-Y749 PolarHBondContact O-N 2.8Å; Y749-S751 PolarHBondContact O-N 3.03Å
750	Q	84.6	Confident	87.1	Confident	76 Å²	76	39.8 Å²	39.8	36%	0.355	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-0.2	173.8	-68.1	177.2	9.5	0	0	113.8	T746 T747 F748 R752	T746-Q750 WeakPolarHBondContact O-CB 3.28Å; T746-Q750 VanDerWaalsContact O-CG 3.3Å; T746-Q750 WeakPolarHBondContact O-CG 3.22Å; T746-Q750 PolarHBondContact O-N 3.37Å; T747-Q750 PolarHBondContact O-N 2.97Å; F748-Q750 VanDerWaalsContact C-N 3.3Å; F748-Q750 PolarHBondContact O-N 2.73Å; Q750-R752 HydrophobicContact CB-CG 4.15Å; Q750-R752 PolarHBondContact O-N 3.46Å
751	S	86.2	Confident	86.9	Confident	70 Å²	70	47 Å²	47	49%	0.49	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	28.4	-178.3	-57.1	0	0	0	0	114.6	T747 F748 Y749 Y753	T747-S751 PolarHBondContact O-N 3.43Å; T747-S751 VanDerWaalsContact O-N 3.16Å; F748-S751 PolarHBondContact O-N 3.39Å; Y749-S751 PolarHBondContact O-N 3.03Å; S751-Y753 VanDerWaalsContact O-CD2 3.31Å; S751-Y753 WeakPolarHBondContact O-CD2 3.38Å; S751-Y753 PolarHBondContact O-N 3.49Å; S751-Y753 VanDerWaalsContact O-N 3.12Å
752	R	86.4	Confident	86.8	Confident	96 Å²	96	49.1 Å²	49.1	36%	0.362	23%	0.231	S	C	.	.			trans	-86.3	72.6	179.1	-68	-173.2	-178.9	-170.6	4.9	111.4	D723 T747 Q750 S754 V755 V756	D723-R752 VanDerWaalsContact CG-NH1 3.32Å; D723-R752 IonicContact OD1-NH1 3.27Å; D723-R752 PolarHBondContact OD1-NH1 2.93Å; D723-R752 IonicContact OD2-CZ 2.8Å; D723-R752 IonicContact OD2-NH1 3.76Å; D723-R752 PolarHBondContact OD2-NH1 3.38Å; D723-R752 IonicContact OD2-NH2 3.66Å; T747-R752 PolarHBondContact O-N 3.34Å; Q750-R752 HydrophobicContact CB-CG 4.15Å; Q750-R752 PolarHBondContact O-N 3.46Å; R752-S754 VanDerWaalsContact C-N 3.28Å; R752-S754 PolarHBondContact O-N 2.95Å; R752-S754 VanDerWaalsContact O-N 3.16Å; R752-V755 HydrophobicContact CB-CG2 4.35Å; R752-V755 PolarHBondContact O-N 3.1Å; R752-V755 VanDerWaalsContact O-N 3.15Å; R752-V756 PolarHBondContact O-N 3.28Å
753	Y	84.6	Confident	86.5	Confident	105 Å²	105	48.6 Å²	48.6	41%	0.412	23%	0.228	S	C	.	.	H	α-helix	trans	-59.7	-28	-172.3	-62	-69.1	0	0	0	115.7	S751 Q757 I795	S751-Y753 VanDerWaalsContact O-CD2 3.31Å; S751-Y753 WeakPolarHBondContact O-CD2 3.38Å; S751-Y753 PolarHBondContact O-N 3.49Å; S751-Y753 VanDerWaalsContact O-N 3.12Å; Y753-Q757 PolarHBondContact O-N 3.21Å; Y753-I795 HydrophobicContact CD1-CD1 3.83Å; Y753-I795 HydrophobicContact CG-CD1 4.41Å
754	S	86.1	Confident	86	Confident	85 Å²	85	53.4 Å²	53.4	59%	0.594	26%	0.257	S	S	*	.	H	α-helix	trans	-66.9	-40.4	176.9	54	0	0	0	0	112.6	R752 T758	R752-S754 VanDerWaalsContact C-N 3.28Å; R752-S754 PolarHBondContact O-N 2.95Å; R752-S754 VanDerWaalsContact O-N 3.16Å; S754-T758 PolarHBondContact O-N 3.17Å; S754-T758 PolarHBondContact O-OG1 3.18Å
755	V	86.8	Confident	85.5	Confident	24 Å²	24	57 Å²	57	15%	0.145	28%	0.279	C	S	.	.	H	α-helix	trans	-72.5	-41.3	177.6	-172.4	0	0	0	0	109.7	V722 M726 T747 R752 Q757 T758 L759	V722-V755 HydrophobicContact CG1-CG1 4.06Å; M726-V755 HydrophobicContact CE-CG1 4.41Å; M726-V755 HydrophobicContact CG-CG1 4.05Å; M726-V755 HydrophobicContact SD-CG1 4.07Å; T747-V755 HydrophobicContact CG2-CB 4.01Å; T747-V755 HydrophobicContact CG2-CG1 3.68Å; R752-V755 HydrophobicContact CB-CG2 4.35Å; R752-V755 PolarHBondContact O-N 3.1Å; R752-V755 VanDerWaalsContact O-N 3.15Å; V755-Q757 VanDerWaalsContact C-N 3.3Å; V755-Q757 PolarHBondContact O-N 3.31Å; V755-T758 WeakPolarHBondContact O-CA 3.37Å; V755-T758 WeakPolarHBondContact O-CB 3.41Å; V755-T758 PolarHBondContact O-N 3.1Å; V755-L759 HydrophobicContact CG1-CD1 4.15Å; V755-L759 HydrophobicContact CG1-CG 4.29Å; V755-L759 WeakPolarHBondContact O-CG 3.11Å; V755-L759 PolarHBondContact O-N 3.04Å
756	V	86.3	Confident	85.1	Confident	1 Å²	1	55 Å²	55	1%	0.006	27%	0.272	C	S	.	.	H	α-helix	trans	-53.4	-48.2	172.7	173.5	0	0	0	0	110.7	L744 R752 T758 L759 L760 I795	L744-V756 HydrophobicContact CD1-CG1 3.97Å; R752-V756 PolarHBondContact O-N 3.28Å; V756-T758 VanDerWaalsContact C-N 3.27Å; V756-T758 PolarHBondContact O-N 3.11Å; V756-L759 PolarHBondContact O-N 2.86Å; V756-L760 HydrophobicContact CG1-CD1 3.87Å; V756-L760 HydrophobicContact CG1-CG 4.25Å; V756-L760 WeakPolarHBondContact O-CB 2.93Å; V756-L760 VanDerWaalsContact O-CG 3.25Å; V756-L760 WeakPolarHBondContact O-CG 3.1Å; V756-L760 PolarHBondContact O-N 3.25Å; V756-I795 HydrophobicContact CG1-CD1 4.2Å; V756-I795 HydrophobicContact CG1-CG2 4.47Å
757	Q	85.4	Confident	84.5	Confident	58 Å²	58	60.8 Å²	60.8	27%	0.271	30%	0.296	S	S	.	.	H	α-helix	trans	-61	-36	178.4	-172.3	179.3	4.7	0	0	112.9	Y753 V755 R761	Y753-Q757 PolarHBondContact O-N 3.21Å; V755-Q757 VanDerWaalsContact C-N 3.3Å; V755-Q757 PolarHBondContact O-N 3.31Å; Q757-R761 PolarHBondContact O-N 2.81Å
758	T	87.3	Confident	83.7	Confident	51 Å²	51	65.9 Å²	65.9	31%	0.313	32%	0.319	S	S	.	.	H	α-helix	trans	-69.6	-47	177.3	-53.6	0	0	0	0	110.9	M726 S754 V755 V756 L760 R761 E762	M726-T758 HydrophobicContact CE-CG2 3.97Å; S754-T758 PolarHBondContact O-N 3.17Å; S754-T758 PolarHBondContact O-OG1 3.18Å; V755-T758 WeakPolarHBondContact O-CA 3.37Å; V755-T758 WeakPolarHBondContact O-CB 3.41Å; V755-T758 PolarHBondContact O-N 3.1Å; V756-T758 VanDerWaalsContact C-N 3.27Å; V756-T758 PolarHBondContact O-N 3.11Å; T758-L760 PolarHBondContact O-N 2.93Å; T758-R761 WeakPolarHBondContact O-CB 3.31Å; T758-R761 PolarHBondContact O-N 2.91Å; T758-E762 WeakPolarHBondContact O-CG 3.39Å; T758-E762 PolarHBondContact O-N 3.41Å
759	L	87.3	Confident	82.7	Confident	0 Å²	0	72 Å²	72	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-60.5	-42.4	177.7	-71.6	173.1	0	0	0	112.3	M726 W735 W740 L744 T747 V755 V756 E762 F763	M726-L759 HydrophobicContact SD-CD2 3.71Å; M726-L759 HydrophobicContact SD-CG 4.29Å; W735-L759 HydrophobicContact CH2-CD2 3.52Å; W735-L759 HydrophobicContact CZ2-CD2 3.47Å; W735-L759 VanDerWaalsContact CZ2-CD2 3.47Å; W735-L759 HydrophobicContact CZ3-CD2 4.41Å; W740-L759 PolarHBondContact NE1-O 2.99Å; L744-L759 HydrophobicContact CD1-CB 4.49Å; T747-L759 HydrophobicContact CG2-CD1 3.97Å; V755-L759 HydrophobicContact CG1-CD1 4.15Å; V755-L759 HydrophobicContact CG1-CG 4.29Å; V755-L759 WeakPolarHBondContact O-CG 3.11Å; V755-L759 PolarHBondContact O-N 3.04Å; V756-L759 PolarHBondContact O-N 2.86Å; L759-E762 PolarHBondContact O-N 2.99Å; L759-F763 PolarHBondContact O-N 3.21Å
760	L	86.5	Confident	82	Confident	1 Å²	1	68.1 Å²	68.1	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-64.6	-40.4	177	-67.8	176.5	0	0	0	111.8	W740 L744 V756 T758 E762 F763 I795 Q798 L799 I802	W740-L760 HydrophobicContact CZ2-CD2 4.19Å; L744-L760 HydrophobicContact CD1-CD2 4.02Å; L744-L760 HydrophobicContact CD1-CG 4.3Å; L744-L760 HydrophobicContact CD2-CD2 4.08Å; V756-L760 HydrophobicContact CG1-CD1 3.87Å; V756-L760 HydrophobicContact CG1-CG 4.25Å; V756-L760 WeakPolarHBondContact O-CB 2.93Å; V756-L760 VanDerWaalsContact O-CG 3.25Å; V756-L760 WeakPolarHBondContact O-CG 3.1Å; V756-L760 PolarHBondContact O-N 3.25Å; T758-L760 PolarHBondContact O-N 2.93Å; L760-E762 VanDerWaalsContact C-N 3.28Å; L760-E762 PolarHBondContact O-N 3.36Å; L760-F763 WeakPolarHBondContact O-CB 3.24Å; L760-F763 PolarHBondContact O-N 3.41Å; L760-I795 HydrophobicContact CD1-CG2 3.76Å; L760-Q798 HydrophobicContact CB-CB 4.18Å; L760-L799 HydrophobicContact CD1-CD2 4.04Å; L760-L799 HydrophobicContact CD1-CG 3.96Å; L760-L799 HydrophobicContact CD2-CD2 3.6Å; L760-L799 HydrophobicContact CD2-CG 4.41Å; L760-L799 HydrophobicContact CG-CD2 4.47Å; L760-I802 HydrophobicContact CB-CD1 4.01Å; L760-I802 HydrophobicContact CD2-CD1 3.7Å; L760-I802 HydrophobicContact CG-CD1 4.43Å; L760-I802 WeakPolarHBondContact O-CD1 3.48Å
761	R	86.6	Confident	81.7	Confident	153 Å²	153	65.3 Å²	65.3	58%	0.577	33%	0.325	S	S	*	.	H	α-helix	trans	-62.6	-37.5	175.4	-172.6	-174.7	-60.7	166.9	2.9	111.9	Q757 T758 F763	Q757-R761 PolarHBondContact O-N 2.81Å; T758-R761 WeakPolarHBondContact O-CB 3.31Å; T758-R761 PolarHBondContact O-N 2.91Å; R761-F763 VanDerWaalsContact C-N 3.28Å; R761-F763 PolarHBondContact O-N 3.47Å
762	E	85.8	Confident	81.3	Confident	44 Å²	44	63.4 Å²	63.4	21%	0.206	31%	0.309	C	S	.	.	H	α-helix	trans	-78.5	-6.6	-178.7	-70.3	-170.5	-157.8	0	0	114.2	R729 W735 T758 L759 L760 V764 T765	R729-E762 IonicContact CZ-OE2 3.62Å; R729-E762 IonicContact NE-OE2 2.79Å; R729-E762 PolarHBondContact NE-OE2 3.25Å; R729-E762 IonicContact NH2-OE2 3.55Å; W735-E762 PolarHBondContact NE1-OE2 2.85Å; T758-E762 WeakPolarHBondContact O-CG 3.39Å; T758-E762 PolarHBondContact O-N 3.41Å; L759-E762 PolarHBondContact O-N 2.99Å; L760-E762 VanDerWaalsContact C-N 3.28Å; L760-E762 PolarHBondContact O-N 3.36Å; E762-V764 PolarHBondContact O-N 3.3Å; E762-V764 VanDerWaalsContact O-N 3.15Å; E762-T765 WeakPolarHBondContact O-CB 3.38Å; E762-T765 PolarHBondContact O-N 2.81Å; E762-T765 PolarHBondContact O-OG1 3.3Å
763	F	83.9	Confident	80.8	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-54.6	-34.7	177.3	-178	-98.5	0	0	0	112.7	W740 L759 L760 R761 T765 I766 Y771 L775 I802	W740-F763 HydrophobicContact CD2-CD2 4.08Å; W740-F763 AromaticContact CE2-CD2 3.74Å; W740-F763 HydrophobicContact CE3-CD2 4.05Å; W740-F763 HydrophobicContact CE3-CE2 4.29Å; W740-F763 AromaticContact CH2-CD2 3.4Å; W740-F763 HydrophobicContact CH2-CD2 3.4Å; W740-F763 VanDerWaalsContact CH2-CD2 3.4Å; W740-F763 AromaticContact CH2-CE2 3.9Å; W740-F763 HydrophobicContact CH2-CE2 3.9Å; W740-F763 HydrophobicContact CH2-CG 4.27Å; W740-F763 HydrophobicContact CZ2-CB 3.88Å; W740-F763 AromaticContact CZ2-CD2 3.41Å; W740-F763 HydrophobicContact CZ2-CD2 3.41Å; W740-F763 VanDerWaalsContact CZ2-CD2 3.41Å; W740-F763 HydrophobicContact CZ2-CE2 4.34Å; W740-F763 HydrophobicContact CZ2-CG 4.02Å; W740-F763 AromaticContact CZ3-CD2 3.74Å; W740-F763 HydrophobicContact CZ3-CD2 3.74Å; W740-F763 AromaticContact CZ3-CE2 3.87Å; W740-F763 HydrophobicContact CZ3-CE2 3.87Å; L759-F763 PolarHBondContact O-N 3.21Å; L760-F763 WeakPolarHBondContact O-CB 3.24Å; L760-F763 PolarHBondContact O-N 3.41Å; R761-F763 VanDerWaalsContact C-N 3.28Å; R761-F763 PolarHBondContact O-N 3.47Å; F763-T765 PolarHBondContact O-N 3Å; F763-I766 HydrophobicContact CD2-CD1 4.03Å; F763-I766 HydrophobicContact CE2-CD1 4.34Å; F763-I766 WeakPolarHBondContact O-CB 3.32Å; F763-I766 PolarHBondContact O-N 3.46Å; F763-Y771 HydrophobicContact CZ-CE1 4.2Å; F763-L775 HydrophobicContact CE2-CD1 4.5Å; F763-I802 HydrophobicContact CB-CD1 3.95Å; F763-I802 HydrophobicContact CB-CG1 4.13Å; F763-I802 HydrophobicContact CD1-CB 4.28Å; F763-I802 HydrophobicContact CD1-CD1 4.42Å; F763-I802 HydrophobicContact CD1-CG1 3.89Å; F763-I802 HydrophobicContact CD1-CG2 3.62Å; F763-I802 HydrophobicContact CE1-CG2 3.6Å; F763-I802 HydrophobicContact CG-CD1 4.21Å; F763-I802 HydrophobicContact CG-CG1 4.17Å; F763-I802 HydrophobicContact CG-CG2 4.17Å; F763-I802 HydrophobicContact CZ-CG2 4.14Å
764	V	78.8	Confident	80.5	Confident	100 Å²	100	60 Å²	60	61%	0.606	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-60.5	-16.6	177.9	-173.2	0	0	0	0	112.9	E762 I766	E762-V764 PolarHBondContact O-N 3.3Å; E762-V764 VanDerWaalsContact O-N 3.15Å; V764-I766 VanDerWaalsContact C-N 3.32Å
765	T	80.7	Confident	80.3	Confident	77 Å²	77	56 Å²	56	47%	0.472	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-80.2	-12.8	176.4	67.2	0	0	0	0	113.6	E762 F763	E762-T765 WeakPolarHBondContact O-CB 3.38Å; E762-T765 PolarHBondContact O-N 2.81Å; E762-T765 PolarHBondContact O-OG1 3.3Å; F763-T765 PolarHBondContact O-N 3Å
766	I	80.4	Confident	79.9	Confident	5 Å²	5	55.8 Å²	55.8	3%	0.026	27%	0.272	C	S	.	.	S	Bend	trans	-84.8	127.2	175.2	-57	172.5	0	0	0	108	W735 L737 W740 F763 V764 D770 Y771	W735-I766 HydrophobicContact CB-CD1 4.25Å; W735-I766 HydrophobicContact CB-CG1 3.92Å; L737-I766 HydrophobicContact CD1-CD1 4.46Å; L737-I766 HydrophobicContact CD1-CG2 4.46Å; W740-I766 HydrophobicContact CB-CD1 3.85Å; W740-I766 HydrophobicContact CD2-CD1 4.01Å; W740-I766 HydrophobicContact CE3-CD1 4.46Å; W740-I766 HydrophobicContact CG-CD1 3.71Å; F763-I766 HydrophobicContact CD2-CD1 4.03Å; F763-I766 HydrophobicContact CE2-CD1 4.34Å; F763-I766 WeakPolarHBondContact O-CB 3.32Å; F763-I766 PolarHBondContact O-N 3.46Å; V764-I766 VanDerWaalsContact C-N 3.32Å; I766-D770 HydrophobicContact CG2-CB 4.31Å; I766-Y771 HydrophobicContact CG2-CE1 4.4Å
767	K	73.9	Confident	79.6	Confident	139 Å²	139	60.9 Å²	60.9	60%	0.604	30%	0.299	S	S	*	.			trans	-77.2	150.2	-179.3	-64.3	-178	177.9	-176.5	0	111	E769 D770	K767-E769 PolarHBondContact O-N 2.99Å; K767-D770 WeakPolarHBondContact O-CB 3.32Å; K767-D770 PolarHBondContact O-N 2.83Å
768	E	69.1	Low	79.4	Confident	107 Å²	107	62.2 Å²	62.2	50%	0.5	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-61.1	-28	177	-63.3	-179.8	-176.5	0	0	112.8	D770 Y771 H805	E768-D770 PolarHBondContact O-N 3.21Å; E768-Y771 HydrophobicContact CB-CD2 4.38Å; E768-Y771 HydrophobicContact CB-CE2 4.03Å; E768-Y771 HydrophobicContact CG-CE2 3.93Å; E768-Y771 WeakPolarHBondContact O-CB 3.16Å; E768-Y771 PolarHBondContact O-N 3.15Å; E768-H805 IonicContact OE1-CE1 3.85Å
769	E	65.7	Low	79.2	Confident	160 Å²	160	59.8 Å²	59.8	75%	0.748	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-65.1	-22	175.5	-63.1	171.5	-170.3	0	0	113.2	K767	K767-E769 PolarHBondContact O-N 2.99Å
770	D	70.6	Confident	79.1	Confident	78 Å²	78	59.8 Å²	59.8	42%	0.417	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-91.8	3.5	-178.8	-65.7	-47.8	0	0	0	112.7	L737 I766 K767 E768 N772	L737-D770 VanDerWaalsContact CD2-O 3.27Å; L737-D770 WeakPolarHBondContact CD2-O 3.47Å; I766-D770 HydrophobicContact CG2-CB 4.31Å; K767-D770 WeakPolarHBondContact O-CB 3.32Å; K767-D770 PolarHBondContact O-N 2.83Å; E768-D770 PolarHBondContact O-N 3.21Å; D770-N772 PolarHBondContact O-N 2.81Å
771	Y	78.1	Confident	79.1	Confident	17 Å²	17	63.3 Å²	63.3	7%	0.067	31%	0.307	C	S	.	.			trans	-67.7	123.6	179.2	-68.2	-7.4	0	0	0	111.4	F763 I766 E768 L775 L1008 Y1012	F763-Y771 HydrophobicContact CZ-CE1 4.2Å; I766-Y771 HydrophobicContact CG2-CE1 4.4Å; E768-Y771 HydrophobicContact CB-CD2 4.38Å; E768-Y771 HydrophobicContact CB-CE2 4.03Å; E768-Y771 HydrophobicContact CG-CE2 3.93Å; E768-Y771 WeakPolarHBondContact O-CB 3.16Å; E768-Y771 PolarHBondContact O-N 3.15Å; Y771-L775 HydrophobicContact CD1-CD2 3.77Å; Y771-L775 HydrophobicContact CD2-CD2 4.41Å; Y771-L775 HydrophobicContact CE1-CD2 4.15Å; Y771-L775 HydrophobicContact CG-CD2 3.92Å; Y771-L1008 HydrophobicContact CD2-CD2 4.04Å; Y771-L1008 HydrophobicContact CE2-CD2 4.2Å; Y771-Y1012 WeakPolarHBondContact O-CD2 3.44Å; Y771-Y1012 WeakPolarHBondContact O-CE2 3.44Å
772	N	76.5	Confident	79	Confident	31 Å²	31	56.5 Å²	56.5	17%	0.166	28%	0.282	C	S	.	.			trans	-116.7	165.1	-179.4	-66.5	-30.4	0	0	0	111.7	L737 D770 E774 L775	L737-N772 HydrophobicContact CD2-CB 3.82Å; L737-N772 VanDerWaalsContact CD2-N 3.3Å; D770-N772 PolarHBondContact O-N 2.81Å; N772-E774 PolarHBondContact O-N 3.5Å; N772-E774 VanDerWaalsContact O-N 3.07Å; N772-L775 WeakPolarHBondContact O-CB 3.44Å; N772-L775 PolarHBondContact O-N 3.22Å
773	E	76.2	Confident	79.1	Confident	100 Å²	100	54.4 Å²	54.4	47%	0.467	27%	0.272	S	S	.	.	H	α-helix	trans	-53.7	-28.4	173.5	-68.9	-173.5	171.3	0	0	113.4	L775 V776 N777 Y1012	E773-L775 VanDerWaalsContact C-N 3.33Å; E773-L775 PolarHBondContact O-N 3.4Å; E773-V776 PolarHBondContact O-N 3.28Å; E773-V776 VanDerWaalsContact O-N 3.15Å; E773-N777 PolarHBondContact O-N 3.2Å; E773-N777 PolarHBondContact O-ND2 3.03Å; E773-Y1012 HydrophobicContact CG-CE1 3.91Å
774	E	77.7	Confident	79.1	Confident	30 Å²	30	54.7 Å²	54.7	14%	0.14	27%	0.273	C	S	.	.	H	α-helix	trans	-63.3	-36.1	176.2	-170.2	177.5	177.1	0	0	112.7	H738 I741 N772 V776 E778 G779	H738-E774 IonicContact CE1-OE1 3.78Å; H738-E774 IonicContact CG-OE1 2.93Å; H738-E774 IonicContact CG-OE2 2.69Å; H738-E774 VanDerWaalsContact ND1-CD 3.33Å; H738-E774 IonicContact ND1-OE1 2.85Å; H738-E774 PolarHBondContact ND1-OE1 3.39Å; H738-E774 IonicContact ND1-OE2 3.04Å; H738-E774 PolarHBondContact ND1-OE2 3.44Å; I741-E774 HydrophobicContact CD1-CG 4.18Å; N772-E774 PolarHBondContact O-N 3.5Å; N772-E774 VanDerWaalsContact O-N 3.07Å; E774-V776 VanDerWaalsContact C-N 3.29Å; E774-V776 PolarHBondContact O-N 3.05Å; E774-E778 HydrophobicContact CG-CB 4.36Å; E774-E778 HydrophobicContact CG-CG 4.5Å; E774-E778 WeakPolarHBondContact O-CA 3.43Å; E774-E778 WeakPolarHBondContact O-CB 3.25Å; E774-E778 PolarHBondContact O-N 3.34Å; E774-G779 PolarHBondContact O-N 3.01Å
775	L	82.1	Confident	79.4	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	26%	0.259	C	S	.	.	I	π-helix	trans	-62.5	-41.9	173.3	176.7	62	0	0	0	110.4	L737 I741 F763 Y771 N772 E773 G779 L780 M783 L1008	L737-L775 HydrophobicContact CD1-CB 4.22Å; L737-L775 HydrophobicContact CD1-CD1 4.22Å; L737-L775 HydrophobicContact CD1-CD2 4.26Å; L737-L775 HydrophobicContact CD1-CG 4.47Å; L737-L775 HydrophobicContact CD2-CB 3.88Å; L737-L775 HydrophobicContact CG-CB 4.46Å; I741-L775 HydrophobicContact CD1-CB 4.33Å; I741-L775 HydrophobicContact CD1-CD1 4.41Å; F763-L775 HydrophobicContact CE2-CD1 4.5Å; Y771-L775 HydrophobicContact CD1-CD2 3.77Å; Y771-L775 HydrophobicContact CD2-CD2 4.41Å; Y771-L775 HydrophobicContact CE1-CD2 4.15Å; Y771-L775 HydrophobicContact CG-CD2 3.92Å; N772-L775 WeakPolarHBondContact O-CB 3.44Å; N772-L775 PolarHBondContact O-N 3.22Å; E773-L775 VanDerWaalsContact C-N 3.33Å; E773-L775 PolarHBondContact O-N 3.4Å; L775-G779 CarbonylContact O-C 3.53Å; L775-G779 VanDerWaalsContact O-CA 3.31Å; L775-G779 WeakPolarHBondContact O-CA 3.42Å; L775-G779 PolarHBondContact O-N 3.14Å; L775-L780 WeakPolarHBondContact O-CG 3.46Å; L775-L780 PolarHBondContact O-N 3.21Å; L775-M783 HydrophobicContact CD1-CE 4.11Å; L775-L1008 HydrophobicContact CD2-CD1 4.32Å; L775-L1008 HydrophobicContact CG-CD1 4.44Å
776	V	79.9	Confident	79.6	Confident	18 Å²	18	49 Å²	49	11%	0.109	24%	0.237	C	C	.	.	I	π-helix	trans	-68.4	-47.2	-177.8	-177.9	0	0	0	0	111.5	E773 E774 A1005 L1008	E773-V776 PolarHBondContact O-N 3.28Å; E773-V776 VanDerWaalsContact O-N 3.15Å; E774-V776 VanDerWaalsContact C-N 3.29Å; E774-V776 PolarHBondContact O-N 3.05Å; V776-A1005 HydrophobicContact CG1-CB 3.69Å; V776-L1008 HydrophobicContact CG2-CB 3.87Å; V776-L1008 HydrophobicContact CG2-CD1 4.4Å
777	N	80.1	Confident	79.7	Confident	109 Å²	109	48.8 Å²	48.8	58%	0.583	24%	0.236	S	C	*	.	I	π-helix	trans	-81.9	-45.5	-173.9	-68	-28.5	0	0	0	112.6	E773	E773-N777 PolarHBondContact O-N 3.2Å; E773-N777 PolarHBondContact O-ND2 3.03Å
778	E	79.8	Confident	80.1	Confident	85 Å²	85	47.4 Å²	47.4	40%	0.397	23%	0.23	S	C	.	.	I	π-helix	trans	-107.1	-43	-172.1	-59.2	-158.6	168.2	0	0	112.9	R745 E774 L782	R745-E778 IonicContact CZ-OE2 2.83Å; R745-E778 IonicContact NH1-OE2 2.99Å; R745-E778 PolarHBondContact NH1-OE2 2.77Å; R745-E778 IonicContact NH2-OE2 3Å; R745-E778 PolarHBondContact NH2-OE2 3.41Å; E774-E778 HydrophobicContact CG-CB 4.36Å; E774-E778 HydrophobicContact CG-CG 4.5Å; E774-E778 WeakPolarHBondContact O-CA 3.43Å; E774-E778 WeakPolarHBondContact O-CB 3.25Å; E774-E778 PolarHBondContact O-N 3.34Å; E778-L782 VanDerWaalsContact O-CB 3.31Å; E778-L782 WeakPolarHBondContact O-CB 3.39Å; E778-L782 PolarHBondContact O-N 3.48Å
779	G	83.6	Confident	80.7	Confident	1 Å²	1	46 Å²	46	1%	0.01	23%	0.228	C	C	.	.	I	π-helix	trans	-65.1	-46.9	-177.9	0	0	0	0	0	113.1	E774 L775 L782 M783	E774-G779 PolarHBondContact O-N 3.01Å; L775-G779 CarbonylContact O-C 3.53Å; L775-G779 VanDerWaalsContact O-CA 3.31Å; L775-G779 WeakPolarHBondContact O-CA 3.42Å; L775-G779 PolarHBondContact O-N 3.14Å; G779-L782 PolarHBondContact O-N 2.76Å; G779-M783 WeakPolarHBondContact O-CG 3.48Å; G779-M783 PolarHBondContact O-N 3.33Å
780	L	84.8	Confident	81.4	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63.1	-48.9	177	-66	-171.9	0	0	0	111.2	L775 L782 M783 F784 L1004 A1005 L1008	L775-L780 WeakPolarHBondContact O-CG 3.46Å; L775-L780 PolarHBondContact O-N 3.21Å; L780-L782 VanDerWaalsContact C-N 3.25Å; L780-L782 PolarHBondContact O-N 3.37Å; L780-M783 HydrophobicContact CD2-CE 3.51Å; L780-M783 PolarHBondContact O-N 3.09Å; L780-M783 VanDerWaalsContact O-N 3.11Å; L780-F784 VanDerWaalsContact O-CD2 3.26Å; L780-F784 WeakPolarHBondContact O-CD2 3.35Å; L780-F784 PolarHBondContact O-N 3.1Å; L780-L1004 HydrophobicContact CD1-CD2 3.4Å; L780-L1004 HydrophobicContact CD2-CD2 3.28Å; L780-L1004 HydrophobicContact CG-CD2 3.93Å; L780-A1005 HydrophobicContact CD1-CB 3.9Å; L780-L1008 HydrophobicContact CD1-CD1 4.1Å; L780-L1008 HydrophobicContact CD2-CD1 3.97Å; L780-L1008 HydrophobicContact CG-CD1 4.29Å
781	Q	86.3	Confident	81.7	Confident	74 Å²	74	44.6 Å²	44.6	35%	0.346	22%	0.217	S	C	.	.	H	α-helix	trans	-53.2	-48.5	177.9	-178.6	63.2	45.8	0	0	110.2	M783 F784 D785	Q781-M783 PolarHBondContact O-N 3.23Å; Q781-F784 PolarHBondContact O-N 3.17Å; Q781-D785 PolarHBondContact NE2-OD1 3.2Å; Q781-D785 PolarHBondContact NE2-OD2 3.09Å; Q781-D785 WeakPolarHBondContact O-CB 3.44Å; Q781-D785 VanDerWaalsContact O-CG 3.26Å; Q781-D785 PolarHBondContact O-N 3.04Å
782	L	84.4	Confident	81.9	Confident	11 Å²	11	46.8 Å²	46.8	6%	0.058	23%	0.23	C	C	.	.	H	α-helix	trans	-60.2	-47	176.9	-179.8	69.7	0	0	0	112.3	I741 L744 R745 F748 E778 G779 L780 F784 D785 I786	I741-L782 HydrophobicContact CG2-CD2 4.47Å; L744-L782 HydrophobicContact CB-CD2 4.15Å; L744-L782 HydrophobicContact CD2-CD2 4.03Å; L744-L782 HydrophobicContact CG-CD2 3.98Å; R745-L782 HydrophobicContact CB-CD1 4.29Å; R745-L782 HydrophobicContact CB-CD2 3.77Å; R745-L782 HydrophobicContact CG-CD1 4.35Å; F748-L782 HydrophobicContact CD1-CD1 4.33Å; E778-L782 VanDerWaalsContact O-CB 3.31Å; E778-L782 WeakPolarHBondContact O-CB 3.39Å; E778-L782 PolarHBondContact O-N 3.48Å; G779-L782 PolarHBondContact O-N 2.76Å; L780-L782 VanDerWaalsContact C-N 3.25Å; L780-L782 PolarHBondContact O-N 3.37Å; L782-F784 VanDerWaalsContact C-N 3.35Å; L782-F784 PolarHBondContact O-N 3.09Å; L782-D785 PolarHBondContact O-N 3.14Å; L782-I786 HydrophobicContact CD1-CD1 4.42Å; L782-I786 HydrophobicContact CG-CD1 4.02Å; L782-I786 WeakPolarHBondContact O-CG1 3.27Å; L782-I786 PolarHBondContact O-N 3.21Å
783	M	87.5	Confident	82.1	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.8	-39.7	179.4	-74.6	-171.9	-70.6	0	0	112.6	W740 L744 L775 G779 L780 Q781 I786 L787 L799 I802 F803	W740-M783 HydrophobicContact CH2-SD 4.06Å; L744-M783 HydrophobicContact CD2-CG 4.23Å; L775-M783 HydrophobicContact CD1-CE 4.11Å; G779-M783 WeakPolarHBondContact O-CG 3.48Å; G779-M783 PolarHBondContact O-N 3.33Å; L780-M783 HydrophobicContact CD2-CE 3.51Å; L780-M783 PolarHBondContact O-N 3.09Å; L780-M783 VanDerWaalsContact O-N 3.11Å; Q781-M783 PolarHBondContact O-N 3.23Å; M783-I786 PolarHBondContact O-N 2.98Å; M783-L787 PolarHBondContact O-N 3.05Å; M783-L799 HydrophobicContact CB-CD2 3.97Å; M783-L799 HydrophobicContact CG-CD2 3.93Å; M783-L799 HydrophobicContact SD-CD2 4.26Å; M783-I802 HydrophobicContact SD-CG2 3.89Å; M783-F803 HydrophobicContact CB-CE1 3.79Å; M783-F803 HydrophobicContact CB-CZ 3.77Å; M783-F803 HydrophobicContact CE-CE1 4.13Å; M783-F803 HydrophobicContact SD-CE1 4.17Å
784	F	85.4	Confident	82.5	Confident	5 Å²	5	47.3 Å²	47.3	2%	0.022	24%	0.239	C	C	.	.	H	α-helix	trans	-69.6	-35.5	175	-83.7	-78.8	0	0	0	112.1	L780 Q781 L782 L787 K788 F803 L997 L1000 Q1001	L780-F784 VanDerWaalsContact O-CD2 3.26Å; L780-F784 WeakPolarHBondContact O-CD2 3.35Å; L780-F784 PolarHBondContact O-N 3.1Å; Q781-F784 PolarHBondContact O-N 3.17Å; L782-F784 VanDerWaalsContact C-N 3.35Å; L782-F784 PolarHBondContact O-N 3.09Å; F784-L787 HydrophobicContact CD1-CD2 4.37Å; F784-L787 PolarHBondContact O-N 2.99Å; F784-K788 WeakPolarHBondContact O-CB 3.2Å; F784-K788 PolarHBondContact O-N 3.06Å; F784-F803 HydrophobicContact CD1-CZ 4.44Å; F784-F803 HydrophobicContact CD2-CE1 4.25Å; F784-F803 HydrophobicContact CD2-CZ 4.13Å; F784-F803 HydrophobicContact CE1-CE2 4.41Å; F784-F803 HydrophobicContact CE1-CZ 4.37Å; F784-F803 HydrophobicContact CE2-CD1 4.48Å; F784-F803 AromaticContact CE2-CE1 3.91Å; F784-F803 HydrophobicContact CE2-CE1 3.91Å; F784-F803 HydrophobicContact CE2-CZ 4.03Å; F784-F803 HydrophobicContact CG-CZ 4.33Å; F784-F803 HydrophobicContact CZ-CE1 4.28Å; F784-F803 HydrophobicContact CZ-CE2 4.41Å; F784-F803 HydrophobicContact CZ-CZ 4.16Å; F784-L997 HydrophobicContact CD1-CD2 3.94Å; F784-L997 HydrophobicContact CE1-CD2 4.3Å; F784-L1000 HydrophobicContact CE1-CB 3.99Å; F784-L1000 HydrophobicContact CZ-CB 4.06Å; F784-Q1001 HydrophobicContact CD2-CB 3.8Å; F784-Q1001 HydrophobicContact CD2-CG 3.85Å; F784-Q1001 HydrophobicContact CE2-CB 3.77Å; F784-Q1001 HydrophobicContact CE2-CG 4.08Å; F784-Q1001 HydrophobicContact CG-CB 4.25Å; F784-Q1001 HydrophobicContact CZ-CB 4.16Å
785	D	84.1	Confident	82.7	Confident	55 Å²	55	46 Å²	46	29%	0.294	23%	0.232	S	C	.	.	H	α-helix	trans	-67.1	-38.1	173.3	-73.3	-33.6	0	0	0	111.7	Q781 L782 K788 T789	Q781-D785 PolarHBondContact NE2-OD1 3.2Å; Q781-D785 PolarHBondContact NE2-OD2 3.09Å; Q781-D785 WeakPolarHBondContact O-CB 3.44Å; Q781-D785 VanDerWaalsContact O-CG 3.26Å; Q781-D785 PolarHBondContact O-N 3.04Å; L782-D785 PolarHBondContact O-N 3.14Å; D785-K788 PolarHBondContact O-N 3.45Å; D785-T789 WeakPolarHBondContact O-CB 3.35Å; D785-T789 VanDerWaalsContact O-CG2 3.29Å; D785-T789 WeakPolarHBondContact O-CG2 3.28Å; D785-T789 PolarHBondContact O-N 3.28Å; D785-T789 VanDerWaalsContact O-N 3.09Å; D785-T789 PolarHBondContact O-OG1 2.91Å
786	I	84.8	Confident	82.8	Confident	2 Å²	2	46.3 Å²	46.3	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-62.8	-47.7	171.1	-64	165.1	0	0	0	110	L744 F748 L782 M783 K788 T789 S790 I795 L799	L744-I786 HydrophobicContact CD1-CD1 3.96Å; L744-I786 HydrophobicContact CD2-CD1 3.91Å; L744-I786 HydrophobicContact CG-CD1 3.8Å; F748-I786 HydrophobicContact CB-CD1 4.31Å; F748-I786 HydrophobicContact CB-CG1 4.27Å; F748-I786 HydrophobicContact CD1-CG1 4.11Å; F748-I786 HydrophobicContact CD2-CB 4.37Å; F748-I786 HydrophobicContact CD2-CD1 4.42Å; F748-I786 HydrophobicContact CD2-CG1 3.59Å; F748-I786 HydrophobicContact CD2-CG2 4.3Å; F748-I786 HydrophobicContact CE1-CG1 4.37Å; F748-I786 HydrophobicContact CE2-CB 4.31Å; F748-I786 HydrophobicContact CE2-CG1 3.88Å; F748-I786 HydrophobicContact CE2-CG2 4.36Å; F748-I786 HydrophobicContact CG-CD1 4.28Å; F748-I786 HydrophobicContact CG-CG1 3.71Å; F748-I786 HydrophobicContact CZ-CG1 4.28Å; L782-I786 HydrophobicContact CD1-CD1 4.42Å; L782-I786 HydrophobicContact CG-CD1 4.02Å; L782-I786 WeakPolarHBondContact O-CG1 3.27Å; L782-I786 PolarHBondContact O-N 3.21Å; M783-I786 PolarHBondContact O-N 2.98Å; I786-K788 VanDerWaalsContact C-N 3.27Å; I786-K788 PolarHBondContact O-N 2.96Å; I786-T789 PolarHBondContact O-N 3.23Å; I786-T789 PolarHBondContact O-OG1 3Å; I786-S790 WeakPolarHBondContact O-CB 3.47Å; I786-S790 PolarHBondContact O-N 3.44Å; I786-S790 PolarHBondContact O-OG 3.47Å; I786-I795 HydrophobicContact CG2-CG2 3.94Å; I786-L799 HydrophobicContact CB-CD1 4.19Å; I786-L799 HydrophobicContact CG2-CD1 3.83Å
787	L	83.8	Confident	83.1	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-56.7	-42.4	177.7	-178.7	68.4	0	0	0	111.5	M783 F784 N796 L799 F803 M971 L997	M783-L787 PolarHBondContact O-N 3.05Å; F784-L787 HydrophobicContact CD1-CD2 4.37Å; F784-L787 PolarHBondContact O-N 2.99Å; L787-N796 HydrophobicContact CD1-CB 4.07Å; L787-N796 WeakPolarHBondContact CD1-OD1 3.29Å; L787-L799 HydrophobicContact CB-CD1 4.08Å; L787-F803 HydrophobicContact CD2-CE2 4.2Å; L787-M971 HydrophobicContact CD2-CE 4.07Å; L787-L997 HydrophobicContact CD2-CD2 3.82Å
788	K	82.1	Confident	83.2	Confident	110 Å²	110	45.9 Å²	45.9	48%	0.478	23%	0.228	S	C	.	.	H	α-helix	trans	-69.5	-32.3	-178.2	-179	178.5	171.2	-170.3	0	113.6	F784 D785 I786 L997	F784-K788 WeakPolarHBondContact O-CB 3.2Å; F784-K788 PolarHBondContact O-N 3.06Å; D785-K788 PolarHBondContact O-N 3.45Å; I786-K788 VanDerWaalsContact C-N 3.27Å; I786-K788 PolarHBondContact O-N 2.96Å; K788-L997 HydrophobicContact CB-CD1 4.33Å; K788-L997 HydrophobicContact CG-CD1 4.39Å
789	T	81.4	Confident	83.5	Confident	77 Å²	77	41.9 Å²	41.9	47%	0.472	21%	0.209	S	C	.	.	H	α-helix	trans	-98.3	-28.9	-173.5	53.4	0	0	0	0	112.9	F748 D785 I786	F748-T789 VanDerWaalsContact CE2-OG1 3.27Å; F748-T789 WeakPolarHBondContact CE2-OG1 3.31Å; F748-T789 HydrophobicContact CZ-CG2 4.24Å; F748-T789 WeakPolarHBondContact CZ-OG1 3.27Å; D785-T789 WeakPolarHBondContact O-CB 3.35Å; D785-T789 VanDerWaalsContact O-CG2 3.29Å; D785-T789 WeakPolarHBondContact O-CG2 3.28Å; D785-T789 PolarHBondContact O-N 3.28Å; D785-T789 VanDerWaalsContact O-N 3.09Å; D785-T789 PolarHBondContact O-OG1 2.91Å; I786-T789 PolarHBondContact O-N 3.23Å; I786-T789 PolarHBondContact O-OG1 3Å
790	S	80.3	Confident	83.5	Confident	5 Å²	5	41.8 Å²	41.8	4%	0.035	21%	0.208	C	C	.	.			trans	-78.9	130	-173.6	98.4	0	0	0	0	111.6	I786 N792 N796	I786-S790 WeakPolarHBondContact O-CB 3.47Å; I786-S790 PolarHBondContact O-N 3.44Å; I786-S790 PolarHBondContact O-OG 3.47Å; S790-N792 VanDerWaalsContact C-N 3.35Å; S790-N796 PolarHBondContact O-ND2 3.48Å; S790-N796 PolarHBondContact OG-OD1 3.46Å
791	K	77.6	Confident	83.5	Confident	205 Å²	205	44.7 Å²	44.7	89%	0.891	23%	0.229	S	C	*	.			trans	-92.9	3.1	174.2	-62.6	-177.9	-179.6	177.4	0	112.7
792	N	81	Confident	83.4	Confident	63 Å²	63	41.4 Å²	41.4	34%	0.337	21%	0.213	S	C	.	.			trans	-94.8	112.1	-172.9	-171.1	-7.3	0	0	0	110.2	S790 S794 I795 N796	S790-N792 VanDerWaalsContact C-N 3.35Å; N792-S794 PolarHBondContact ND2-OG 2.85Å; N792-S794 PolarHBondContact O-N 3.36Å; N792-S794 PolarHBondContact OD1-N 2.88Å; N792-S794 PolarHBondContact OD1-OG 3.2Å; N792-S794 VanDerWaalsContact OD1-OG 3.05Å; N792-I795 HydrophobicContact CB-CB 4.37Å; N792-I795 HydrophobicContact CB-CD1 4.09Å; N792-I795 HydrophobicContact CB-CG1 4.21Å; N792-I795 PolarHBondContact O-N 2.88Å; N792-I795 VanDerWaalsContact O-N 3.1Å; N792-N796 PolarHBondContact O-N 3.18Å; N792-N796 PolarHBondContact O-ND2 3.37Å
793	D	80.8	Confident	83.4	Confident	103 Å²	103	40.9 Å²	40.9	55%	0.551	21%	0.211	S	C	*	.	H	α-helix	trans	-57.9	-32.3	-178.2	-70.5	-32.5	0	0	0	112.7	I795 N796 Q797	D793-I795 PolarHBondContact O-N 2.62Å; D793-N796 PolarHBondContact O-N 2.78Å; D793-Q797 WeakPolarHBondContact O-CB 3.49Å; D793-Q797 WeakPolarHBondContact O-CG 3.48Å; D793-Q797 PolarHBondContact O-N 2.89Å
794	S	84.3	Confident	83.3	Confident	39 Å²	39	42.7 Å²	42.7	27%	0.273	22%	0.222	S	C	.	.	H	α-helix	trans	-68	-36.5	179	70.4	0	0	0	0	112.7	N792 Q798	N792-S794 PolarHBondContact ND2-OG 2.85Å; N792-S794 PolarHBondContact O-N 3.36Å; N792-S794 PolarHBondContact OD1-N 2.88Å; N792-S794 PolarHBondContact OD1-OG 3.2Å; N792-S794 VanDerWaalsContact OD1-OG 3.05Å; S794-Q798 VanDerWaalsContact O-CG 3.28Å; S794-Q798 WeakPolarHBondContact O-CG 3.37Å; S794-Q798 PolarHBondContact O-N 3.02Å
795	I	83.3	Confident	83.1	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-70	-44.6	178.2	-68.7	178.6	0	0	0	109.2	Y753 V756 L760 I786 N792 D793 Q797 Q798 L799	Y753-I795 HydrophobicContact CD1-CD1 3.83Å; Y753-I795 HydrophobicContact CG-CD1 4.41Å; V756-I795 HydrophobicContact CG1-CD1 4.2Å; V756-I795 HydrophobicContact CG1-CG2 4.47Å; L760-I795 HydrophobicContact CD1-CG2 3.76Å; I786-I795 HydrophobicContact CG2-CG2 3.94Å; N792-I795 HydrophobicContact CB-CB 4.37Å; N792-I795 HydrophobicContact CB-CD1 4.09Å; N792-I795 HydrophobicContact CB-CG1 4.21Å; N792-I795 PolarHBondContact O-N 2.88Å; N792-I795 VanDerWaalsContact O-N 3.1Å; D793-I795 PolarHBondContact O-N 2.62Å; I795-Q797 VanDerWaalsContact C-N 3.32Å; I795-Q797 PolarHBondContact O-N 3.39Å; I795-Q798 PolarHBondContact O-N 2.87Å; I795-L799 HydrophobicContact CG2-CD1 4Å; I795-L799 HydrophobicContact CG2-CG 4.43Å; I795-L799 WeakPolarHBondContact O-CG 3.46Å; I795-L799 PolarHBondContact O-N 2.99Å
796	N	84.4	Confident	82.8	Confident	8 Å²	8	43.3 Å²	43.3	4%	0.043	22%	0.224	C	C	.	.	H	α-helix	trans	-61.4	-40.1	178.5	-66.4	-24.3	0	0	0	112.1	L787 S790 N792 D793 L799 A800 L975 Y985	L787-N796 HydrophobicContact CD1-CB 4.07Å; L787-N796 WeakPolarHBondContact CD1-OD1 3.29Å; S790-N796 PolarHBondContact O-ND2 3.48Å; S790-N796 PolarHBondContact OG-OD1 3.46Å; N792-N796 PolarHBondContact O-N 3.18Å; N792-N796 PolarHBondContact O-ND2 3.37Å; D793-N796 PolarHBondContact O-N 2.78Å; N796-L799 PolarHBondContact O-N 3.2Å; N796-A800 WeakPolarHBondContact O-CB 3.47Å; N796-A800 PolarHBondContact O-N 3.29Å; N796-L975 HydrophobicContact CB-CD1 4.33Å; N796-L975 WeakPolarHBondContact O-CD1 3.3Å; N796-Y985 PolarHBondContact ND2-OH 2.88Å; N796-Y985 VanDerWaalsContact ND2-OH 3.08Å
797	Q	84.6	Confident	82.4	Confident	58 Å²	58	43.8 Å²	43.8	27%	0.271	23%	0.225	S	C	.	.	H	α-helix	trans	-65.3	-41	175	-78.1	-67.5	-7.1	0	0	112.9	D793 I795 A800 S801 S972	D793-Q797 WeakPolarHBondContact O-CB 3.49Å; D793-Q797 WeakPolarHBondContact O-CG 3.48Å; D793-Q797 PolarHBondContact O-N 2.89Å; I795-Q797 VanDerWaalsContact C-N 3.32Å; I795-Q797 PolarHBondContact O-N 3.39Å; Q797-A800 PolarHBondContact O-N 3.04Å; Q797-S801 PolarHBondContact O-N 3.35Å; Q797-S972 PolarHBondContact NE2-O 3.31Å; Q797-S972 PolarHBondContact OE1-O 3.02Å
798	Q	84	Confident	81.9	Confident	61 Å²	61	44.9 Å²	44.9	29%	0.285	24%	0.236	S	C	.	.	H	α-helix	trans	-67.3	-41.6	175.8	-67.3	-65.4	-57.4	0	0	111.8	L760 S794 I795 A800 S801 I802	L760-Q798 HydrophobicContact CB-CB 4.18Å; S794-Q798 VanDerWaalsContact O-CG 3.28Å; S794-Q798 WeakPolarHBondContact O-CG 3.37Å; S794-Q798 PolarHBondContact O-N 3.02Å; I795-Q798 PolarHBondContact O-N 2.87Å; Q798-A800 VanDerWaalsContact C-N 3.33Å; Q798-A800 PolarHBondContact O-N 3.26Å; Q798-S801 WeakPolarHBondContact O-CB 3.41Å; Q798-S801 PolarHBondContact O-N 3.02Å; Q798-I802 WeakPolarHBondContact O-CG1 3.29Å; Q798-I802 PolarHBondContact O-N 3.48Å
799	L	84.9	Confident	81.2	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.4	-42.7	174.1	-74.5	172	0	0	0	111.8	L760 M783 I786 L787 I795 N796 S801 I802 F803	L760-L799 HydrophobicContact CD1-CD2 4.04Å; L760-L799 HydrophobicContact CD1-CG 3.96Å; L760-L799 HydrophobicContact CD2-CD2 3.6Å; L760-L799 HydrophobicContact CD2-CG 4.41Å; L760-L799 HydrophobicContact CG-CD2 4.47Å; M783-L799 HydrophobicContact CB-CD2 3.97Å; M783-L799 HydrophobicContact CG-CD2 3.93Å; M783-L799 HydrophobicContact SD-CD2 4.26Å; I786-L799 HydrophobicContact CB-CD1 4.19Å; I786-L799 HydrophobicContact CG2-CD1 3.83Å; L787-L799 HydrophobicContact CB-CD1 4.08Å; I795-L799 HydrophobicContact CG2-CD1 4Å; I795-L799 HydrophobicContact CG2-CG 4.43Å; I795-L799 WeakPolarHBondContact O-CG 3.46Å; I795-L799 PolarHBondContact O-N 2.99Å; N796-L799 PolarHBondContact O-N 3.2Å; L799-S801 VanDerWaalsContact C-N 3.34Å; L799-S801 PolarHBondContact O-N 2.98Å; L799-I802 WeakPolarHBondContact O-CB 3.43Å; L799-I802 PolarHBondContact O-N 3.21Å; L799-I802 VanDerWaalsContact O-N 3.14Å; L799-F803 HydrophobicContact CB-CE2 4.04Å; L799-F803 HydrophobicContact CB-CZ 4.49Å; L799-F803 WeakPolarHBondContact O-CD2 3.47Å; L799-F803 VanDerWaalsContact O-CG 3.26Å; L799-F803 WeakPolarHBondContact O-CG 3.27Å; L799-F803 PolarHBondContact O-N 2.83Å
800	A	83.8	Confident	80.3	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.9	-40.2	175.2	0	0	0	0	0	112.7	N796 Q797 Q798 I802 F803 T804 M971 L975	N796-A800 WeakPolarHBondContact O-CB 3.47Å; N796-A800 PolarHBondContact O-N 3.29Å; Q797-A800 PolarHBondContact O-N 3.04Å; Q798-A800 VanDerWaalsContact C-N 3.33Å; Q798-A800 PolarHBondContact O-N 3.26Å; A800-I802 VanDerWaalsContact C-N 3.29Å; A800-I802 PolarHBondContact O-N 3.47Å; A800-F803 PolarHBondContact O-N 3.2Å; A800-T804 WeakPolarHBondContact O-CB 3.36Å; A800-T804 PolarHBondContact O-N 3.16Å; A800-T804 PolarHBondContact O-OG1 3.28Å; A800-T804 VanDerWaalsContact O-OG1 3.1Å; A800-M971 HydrophobicContact CB-CB 4.01Å; A800-M971 HydrophobicContact CB-CG 3.85Å; A800-L975 HydrophobicContact CB-CD1 3.51Å; A800-L975 HydrophobicContact CB-CG 4.4Å
801	S	84.7	Confident	79.5	Confident	61 Å²	61	51.3 Å²	51.3	43%	0.427	28%	0.283	S	S	.	.	H	α-helix	trans	-59.5	-41.1	172.1	-174.6	0	0	0	0	111.9	Q797 Q798 L799 H805	Q797-S801 PolarHBondContact O-N 3.35Å; Q798-S801 WeakPolarHBondContact O-CB 3.41Å; Q798-S801 PolarHBondContact O-N 3.02Å; L799-S801 VanDerWaalsContact C-N 3.34Å; L799-S801 PolarHBondContact O-N 2.98Å; S801-H805 WeakPolarHBondContact O-CB 3.44Å; S801-H805 PolarHBondContact O-N 3.24Å
802	I	84.4	Confident	79.3	Confident	5 Å²	5	43 Å²	43	3%	0.026	25%	0.248	C	C	.	.	H	α-helix	trans	-65.6	-46.7	176.7	-68	165	0	0	0	110.5	L760 F763 M783 Q798 L799 A800 T804 H805 C806	L760-I802 HydrophobicContact CB-CD1 4.01Å; L760-I802 HydrophobicContact CD2-CD1 3.7Å; L760-I802 HydrophobicContact CG-CD1 4.43Å; L760-I802 WeakPolarHBondContact O-CD1 3.48Å; F763-I802 HydrophobicContact CB-CD1 3.95Å; F763-I802 HydrophobicContact CB-CG1 4.13Å; F763-I802 HydrophobicContact CD1-CB 4.28Å; F763-I802 HydrophobicContact CD1-CD1 4.42Å; F763-I802 HydrophobicContact CD1-CG1 3.89Å; F763-I802 HydrophobicContact CD1-CG2 3.62Å; F763-I802 HydrophobicContact CE1-CG2 3.6Å; F763-I802 HydrophobicContact CG-CD1 4.21Å; F763-I802 HydrophobicContact CG-CG1 4.17Å; F763-I802 HydrophobicContact CG-CG2 4.17Å; F763-I802 HydrophobicContact CZ-CG2 4.14Å; M783-I802 HydrophobicContact SD-CG2 3.89Å; Q798-I802 WeakPolarHBondContact O-CG1 3.29Å; Q798-I802 PolarHBondContact O-N 3.48Å; L799-I802 WeakPolarHBondContact O-CB 3.43Å; L799-I802 PolarHBondContact O-N 3.21Å; L799-I802 VanDerWaalsContact O-N 3.14Å; A800-I802 VanDerWaalsContact C-N 3.29Å; A800-I802 PolarHBondContact O-N 3.47Å; I802-T804 VanDerWaalsContact C-N 3.33Å; I802-T804 PolarHBondContact O-N 2.65Å; I802-H805 CarbonylContact O-C 3.3Å; I802-H805 WeakPolarHBondContact O-CB 3.49Å; I802-H805 PolarHBondContact O-N 3.36Å; I802-H805 VanDerWaalsContact O-N 3.13Å; I802-C806 WeakPolarHBondContact O-CB 3.32Å; I802-C806 PolarHBondContact O-N 3.39Å; I802-C806 PolarHBondContact O-SG 2.88Å
803	F	85	Confident	78.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62.2	-40.4	179.1	-62.7	-40.2	0	0	0	112.4	M783 F784 L787 L799 A800 H805 C806 Y807 M971 L1004	M783-F803 HydrophobicContact CB-CE1 3.79Å; M783-F803 HydrophobicContact CB-CZ 3.77Å; M783-F803 HydrophobicContact CE-CE1 4.13Å; M783-F803 HydrophobicContact SD-CE1 4.17Å; F784-F803 HydrophobicContact CD1-CZ 4.44Å; F784-F803 HydrophobicContact CD2-CE1 4.25Å; F784-F803 HydrophobicContact CD2-CZ 4.13Å; F784-F803 HydrophobicContact CE1-CE2 4.41Å; F784-F803 HydrophobicContact CE1-CZ 4.37Å; F784-F803 HydrophobicContact CE2-CD1 4.48Å; F784-F803 AromaticContact CE2-CE1 3.91Å; F784-F803 HydrophobicContact CE2-CE1 3.91Å; F784-F803 HydrophobicContact CE2-CZ 4.03Å; F784-F803 HydrophobicContact CG-CZ 4.33Å; F784-F803 HydrophobicContact CZ-CE1 4.28Å; F784-F803 HydrophobicContact CZ-CE2 4.41Å; F784-F803 HydrophobicContact CZ-CZ 4.16Å; L787-F803 HydrophobicContact CD2-CE2 4.2Å; L799-F803 HydrophobicContact CB-CE2 4.04Å; L799-F803 HydrophobicContact CB-CZ 4.49Å; L799-F803 WeakPolarHBondContact O-CD2 3.47Å; L799-F803 VanDerWaalsContact O-CG 3.26Å; L799-F803 WeakPolarHBondContact O-CG 3.27Å; L799-F803 PolarHBondContact O-N 2.83Å; A800-F803 PolarHBondContact O-N 3.2Å; F803-H805 VanDerWaalsContact C-N 3.35Å; F803-C806 PolarHBondContact O-N 2.63Å; F803-Y807 WeakPolarHBondContact O-CB 3.33Å; F803-Y807 PolarHBondContact O-N 2.83Å; F803-M971 HydrophobicContact CB-SD 3.99Å; F803-M971 HydrophobicContact CD2-CE 4.16Å; F803-M971 HydrophobicContact CD2-SD 3.53Å; F803-M971 VanDerWaalsContact CD2-SD 3.53Å; F803-M971 HydrophobicContact CE2-SD 4.43Å; F803-M971 HydrophobicContact CG-SD 4.17Å; F803-L1004 HydrophobicContact CB-CD1 3.95Å; F803-L1004 HydrophobicContact CD1-CD1 3.89Å; F803-L1004 HydrophobicContact CG-CD1 4.24Å
804	T	83.9	Confident	78.3	Confident	37 Å²	37	44.2 Å²	44.2	23%	0.227	27%	0.267	C	S	.	.	H	α-helix	trans	-64.4	-40.2	173.6	-61.8	0	0	0	0	111.7	A800 I802 Y807 G808 L968 K969	A800-T804 WeakPolarHBondContact O-CB 3.36Å; A800-T804 PolarHBondContact O-N 3.16Å; A800-T804 PolarHBondContact O-OG1 3.28Å; A800-T804 VanDerWaalsContact O-OG1 3.1Å; I802-T804 VanDerWaalsContact C-N 3.33Å; I802-T804 PolarHBondContact O-N 2.65Å; T804-Y807 PolarHBondContact O-N 2.83Å; T804-G808 PolarHBondContact O-N 3.11Å; T804-L968 WeakPolarHBondContact CA-O 3.32Å; T804-L968 PolarHBondContact OG1-O 2.91Å; T804-K969 WeakPolarHBondContact CG2-O 3.31Å
805	H	81.8	Confident	78	Confident	67 Å²	67	43.2 Å²	43.2	31%	0.31	26%	0.259	S	S	.	.	H	α-helix	trans	-64	-48.1	174.7	-177.1	60	0	0	0	112	E768 S801 I802 F803 Y807 G808	E768-H805 IonicContact OE1-CE1 3.85Å; S801-H805 WeakPolarHBondContact O-CB 3.44Å; S801-H805 PolarHBondContact O-N 3.24Å; I802-H805 CarbonylContact O-C 3.3Å; I802-H805 WeakPolarHBondContact O-CB 3.49Å; I802-H805 PolarHBondContact O-N 3.36Å; I802-H805 VanDerWaalsContact O-N 3.13Å; F803-H805 VanDerWaalsContact C-N 3.35Å; H805-Y807 VanDerWaalsContact C-N 3.27Å; H805-Y807 PolarHBondContact O-N 2.99Å; H805-G808 PolarHBondContact O-N 2.82Å
806	C	78.8	Confident	77.5	Confident	7 Å²	7	47.3 Å²	47.3	5%	0.047	29%	0.286	C	S	.	.	H	α-helix	trans	-63	-28.3	178	-69.3	0	0	0	0	113.6	I802 F803 G808 L1004 L1008	I802-C806 WeakPolarHBondContact O-CB 3.32Å; I802-C806 PolarHBondContact O-N 3.39Å; I802-C806 PolarHBondContact O-SG 2.88Å; F803-C806 PolarHBondContact O-N 2.63Å; C806-G808 VanDerWaalsContact C-N 3.3Å; C806-L1004 HydrophobicContact CB-CD2 4.45Å; C806-L1008 HydrophobicContact CB-CD2 4.24Å
807	Y	75.5	Confident	76.8	Confident	12 Å²	12	52.5 Å²	52.5	5%	0.047	31%	0.31	C	S	.	.	H	α-helix	trans	-73	-26.1	175.5	-164.4	-93.2	0	0	0	112.5	F803 T804 H805 I812 G965 L968 K969 R1007	F803-Y807 WeakPolarHBondContact O-CB 3.33Å; F803-Y807 PolarHBondContact O-N 2.83Å; T804-Y807 PolarHBondContact O-N 2.83Å; H805-Y807 VanDerWaalsContact C-N 3.27Å; H805-Y807 PolarHBondContact O-N 2.99Å; Y807-I812 HydrophobicContact CE1-CG1 4.34Å; Y807-G965 VanDerWaalsContact OH-CA 3.29Å; Y807-G965 WeakPolarHBondContact OH-CA 3.24Å; Y807-L968 HydrophobicContact CD2-CB 3.65Å; Y807-L968 HydrophobicContact CD2-CD1 3.67Å; Y807-L968 HydrophobicContact CD2-CG 4.32Å; Y807-L968 HydrophobicContact CE2-CB 4.1Å; Y807-L968 HydrophobicContact CE2-CD1 3.83Å; Y807-L968 HydrophobicContact CG-CB 4.06Å; Y807-K969 HydrophobicContact CD1-CB 4.35Å; Y807-R1007 VanDerWaalsContact CE1-CZ 3.41Å; Y807-R1007 VanDerWaalsContact CZ-NH1 3.31Å; Y807-R1007 PolarHBondContact O-NE 2.96Å; Y807-R1007 PolarHBondContact OH-NH1 3.33Å
808	G	73.1	Confident	76	Confident	23 Å²	23	53.1 Å²	53.1	24%	0.237	31%	0.314	C	S	.	.			trans	76.9	177.9	175.9	0	0	0	0	0	114.9	T804 H805 C806 S810	T804-G808 PolarHBondContact O-N 3.11Å; H805-G808 PolarHBondContact O-N 2.82Å; C806-G808 VanDerWaalsContact C-N 3.3Å; G808-S810 VanDerWaalsContact C-N 3.31Å; G808-S810 PolarHBondContact O-N 3.03Å
809	N	66.8	Low	74.8	Confident	168 Å²	168	59.4 Å²	59.4	90%	0.898	34%	0.335	S	S	*	.	S	Bend	trans	-82.7	-4.6	-176.8	-68.1	-36.2	0	0	0	114.2
810	S	62.5	Low	73.4	Confident	54 Å²	54	65 Å²	65	38%	0.378	36%	0.359	S	S	.	.	S	Bend	trans	-67	146.7	-176.7	35.8	0	0	0	0	111.6	G808 R1007	G808-S810 VanDerWaalsContact C-N 3.31Å; G808-S810 PolarHBondContact O-N 3.03Å; S810-R1007 VanDerWaalsContact C-NH2 3.27Å; S810-R1007 PolarHBondContact O-NH2 3.47Å; S810-R1007 PolarHBondContact OG-NH2 2.84Å
811	P	65	Low	72.2	Confident	106 Å²	106	69.9 Å²	69.9	69%	0.688	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-62.1	155	179.5	25.2	-32.6	0	0	0	111.3	R1007	P811-R1007 PolarHBondContact O-NH1 3.03Å; P811-R1007 PolarHBondContact O-NH2 2.89Å
812	I	73.8	Confident	71.1	Confident	29 Å²	29	68.3 Å²	68.3	15%	0.149	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-70.9	134.5	173.3	-56.5	163.4	0	0	0	106.7	Y807 S814 F962 F966 K969	Y807-I812 HydrophobicContact CE1-CG1 4.34Å; I812-S814 PolarHBondContact O-N 3.29Å; I812-F962 HydrophobicContact CB-CD2 4.34Å; I812-F962 HydrophobicContact CB-CE2 3.94Å; I812-F962 HydrophobicContact CG2-CD2 3.47Å; I812-F962 VanDerWaalsContact CG2-CD2 3.47Å; I812-F962 HydrophobicContact CG2-CE2 3.57Å; I812-F962 HydrophobicContact CG2-CG 4.21Å; I812-F962 HydrophobicContact CG2-CZ 4.38Å; I812-F966 HydrophobicContact CD1-CB 3.96Å; I812-F966 HydrophobicContact CD1-CD2 4.2Å; I812-K969 HydrophobicContact CD1-CD 4.44Å; I812-K969 HydrophobicContact CG1-CD 4.48Å
813	P	70	Confident	69.7	Low	90 Å²	90	73.3 Å²	73.3	58%	0.584	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-56.1	126.4	179.7	-24.2	34.3	0	0	0	110.8	F962	P813-F962 WeakPolarHBondContact O-CD2 3.4Å
814	S	70.4	Confident	68.5	Low	103 Å²	103	75 Å²	75	72%	0.72	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-68.1	139.5	177.1	54.9	0	0	0	0	110.4	I812 P816	I812-S814 PolarHBondContact O-N 3.29Å; S814-P816 VanDerWaalsContact O-CD 3.26Å; S814-P816 WeakPolarHBondContact O-CD 3.47Å
815	I	77.6	Confident	67.4	Low	17 Å²	17	81.2 Å²	81.2	9%	0.087	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-63.8	116.8	178.1	-64.3	-178.9	0	0	0	109.2	E817 E932 I933 A936 L959 F962	I815-E817 PolarHBondContact O-N 3.38Å; I815-E932 HydrophobicContact CD1-CB 4.12Å; I815-E932 HydrophobicContact CG2-CB 4.41Å; I815-I933 HydrophobicContact CB-CG1 4.06Å; I815-I933 HydrophobicContact CG2-CG1 3.85Å; I815-A936 HydrophobicContact CD1-CB 3.89Å; I815-L959 HydrophobicContact CD1-CB 4.47Å; I815-L959 HydrophobicContact CD1-CD1 4.25Å; I815-F962 HydrophobicContact CD1-CB 3.99Å; I815-F962 HydrophobicContact CD1-CG 4.24Å; I815-F962 HydrophobicContact CG1-CB 4.15Å; I815-F962 HydrophobicContact CG1-CD2 4.26Å; I815-F962 HydrophobicContact CG1-CG 4.35Å
816	P	72.1	Confident	66.6	Low	88 Å²	88	81 Å²	81	57%	0.571	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-68.1	133.5	-176.4	19.5	-29.5	0	0	0	112.4	S814 R929	S814-P816 VanDerWaalsContact O-CD 3.26Å; S814-P816 WeakPolarHBondContact O-CD 3.47Å; P816-R929 VanDerWaalsContact CG-NH2 3.28Å; P816-R929 PolarHBondContact O-NE 2.77Å; P816-R929 PolarHBondContact O-NH2 3.26Å
817	E	69.9	Low	65.9	Low	117 Å²	117	85.5 Å²	85.5	55%	0.547	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-66.4	131.8	178	-76.9	-179.3	-177.3	0	0	112.4	I815 R819 I933	I815-E817 PolarHBondContact O-N 3.38Å; E817-R819 IonicContact OE2-CZ 3.23Å; E817-R819 IonicContact OE2-NE 2.84Å; E817-R819 PolarHBondContact OE2-NE 3.21Å; E817-R819 IonicContact OE2-NH2 2.75Å; E817-R819 PolarHBondContact OE2-NH2 2.92Å; E817-R819 VanDerWaalsContact OE2-NH2 3.09Å; E817-I933 HydrophobicContact CB-CD1 4.44Å; E817-I933 HydrophobicContact CG-CD1 3.58Å
818	I	68.5	Low	65.5	Low	71 Å²	71	87.5 Å²	87.5	36%	0.364	48%	0.481	S	S	.	.			trans	-97.6	101.1	167.6	-63.9	171.9	0	0	0	108.2	K820 R929	I818-K820 VanDerWaalsContact C-N 3.29Å; I818-K820 HydrophobicContact CG2-CB 4.15Å; I818-K820 HydrophobicContact CG2-CD 3.95Å; I818-K820 HydrophobicContact CG2-CG 3.63Å; I818-K820 PolarHBondContact O-N 2.96Å; I818-K820 VanDerWaalsContact O-N 3.09Å; I818-R929 HydrophobicContact CB-CB 4.42Å; I818-R929 HydrophobicContact CB-CG 4.1Å; I818-R929 HydrophobicContact CD1-CB 4.32Å; I818-R929 HydrophobicContact CD1-CG 4.08Å; I818-R929 HydrophobicContact CG1-CG 4Å
819	R	57.6	Low	65.4	Low	193 Å²	193	92.8 Å²	92.8	73%	0.728	50%	0.499	S	S	*	.			trans	-84.3	69.9	171.7	-63.9	-173.1	-175	-166.4	-0.5	110.8	E817 T821	E817-R819 IonicContact OE2-CZ 3.23Å; E817-R819 IonicContact OE2-NE 2.84Å; E817-R819 PolarHBondContact OE2-NE 3.21Å; E817-R819 IonicContact OE2-NH2 2.75Å; E817-R819 PolarHBondContact OE2-NH2 2.92Å; E817-R819 VanDerWaalsContact OE2-NH2 3.09Å; R819-T821 PolarHBondContact O-N 3.41Å
820	K	57	Low	65.5	Low	118 Å²	118	87.7 Å²	87.7	51%	0.513	47%	0.469	S	S	.	.			trans	-84.5	107	168.8	-84.2	179.6	-174.8	179.6	0	108.9	I818 L822 D925	I818-K820 VanDerWaalsContact C-N 3.29Å; I818-K820 HydrophobicContact CG2-CB 4.15Å; I818-K820 HydrophobicContact CG2-CD 3.95Å; I818-K820 HydrophobicContact CG2-CG 3.63Å; I818-K820 PolarHBondContact O-N 2.96Å; I818-K820 VanDerWaalsContact O-N 3.09Å; K820-L822 PolarHBondContact O-N 3Å; K820-D925 IonicContact NZ-OD2 3.6Å; K820-D925 PolarHBondContact NZ-OD2 2.88Å
821	T	57.5	Low	66.2	Low	102 Å²	102	86.8 Å²	86.8	63%	0.626	46%	0.459	S	S	*	.			trans	-75.5	120.9	169.3	51.8	0	0	0	0	109.7	R819	R819-T821 PolarHBondContact O-N 3.41Å
822	L	61.5	Low	66.8	Low	27 Å²	27	84.4 Å²	84.4	14%	0.141	44%	0.441	C	S	.	.			trans	-62.3	138.2	174.7	-74.6	161	0	0	0	110.4	K820 A824 A858 Y896 L897	K820-L822 PolarHBondContact O-N 3Å; L822-A824 VanDerWaalsContact C-N 3.34Å; L822-A824 PolarHBondContact O-N 3.25Å; L822-A858 HydrophobicContact CD2-CB 4Å; L822-Y896 HydrophobicContact CD1-CE1 3.95Å; L822-L897 HydrophobicContact CD1-CD2 4.04Å
823	P	55.7	Low	67.1	Low	111 Å²	111	85 Å²	85	72%	0.721	45%	0.445	S	S	*	.	S	Bend	trans	-75.5	-16.2	-170.9	28.7	-35.5	0	0	0	114.5	T857	P823-T857 HydrophobicContact CG-CG2 3.82Å
824	A	59.5	Low	67.3	Low	35 Å²	35	87.8 Å²	87.8	29%	0.289	45%	0.447	S	S	.	.			trans	-119.7	114	178.2	0	0	0	0	0	109.8	L822 T857	L822-A824 VanDerWaalsContact C-N 3.34Å; L822-A824 PolarHBondContact O-N 3.25Å; A824-T857 HydrophobicContact CB-CG2 4.44Å
825	R	61.3	Low	67.2	Low	168 Å²	168	91.1 Å²	91.1	63%	0.634	45%	0.452	S	S	*	.			trans	-108.3	120.7	176.1	-66.6	-177.9	176.9	-174.5	-5.9	109.1
826	L	64.6	Low	66.7	Low	61 Å²	61	96.2 Å²	96.2	32%	0.319	48%	0.477	S	S	.	.			trans	-105.2	141.4	165.7	-85.4	162.6	0	0	0	107.9	F830 H851 L854 Y898	L826-F830 HydrophobicContact CD2-CD2 4.3Å; L826-H851 HydrophobicContact CD1-CB 4.11Å; L826-L854 HydrophobicContact CB-CD1 3.91Å; L826-L854 HydrophobicContact CD1-CB 4.17Å; L826-L854 HydrophobicContact CD1-CD1 3.75Å; L826-L854 HydrophobicContact CG-CD1 4.12Å; L826-Y898 HydrophobicContact CB-CD1 4.04Å; L826-Y898 HydrophobicContact CB-CE1 4.26Å; L826-Y898 VanDerWaalsContact O-O 3.06Å
827	D	63.8	Low	66.7	Low	103 Å²	103	93.4 Å²	93.4	55%	0.551	46%	0.459	S	S	*	.			trans	-56.3	136.5	179.6	-165.3	-50.1	0	0	0	110.4	H829 F830	D827-H829 PolarHBondContact O-N 2.95Å; D827-H829 PolarHBondContact OD1-N 3.44Å; D827-H829 VanDerWaalsContact OD1-N 3.11Å; D827-F830 HydrophobicContact CB-CD2 3.86Å; D827-F830 HydrophobicContact CB-CE2 3.96Å; D827-F830 WeakPolarHBondContact O-CD2 3.41Å; D827-F830 PolarHBondContact O-N 3.39Å
828	P	67.2	Low	67	Low	53 Å²	53	90.7 Å²	90.7	34%	0.344	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-48.8	-23.5	175.2	-32.3	37.9	0	0	0	115.4	F830 L831 Y899	P828-F830 PolarHBondContact O-N 3.23Å; P828-L831 VanDerWaalsContact O-CB 3.3Å; P828-L831 WeakPolarHBondContact O-CB 3.3Å; P828-L831 PolarHBondContact O-N 2.87Å; P828-L831 VanDerWaalsContact O-N 3.16Å; P828-Y899 HydrophobicContact CB-CD1 4.01Å; P828-Y899 HydrophobicContact CB-CE1 3.37Å; P828-Y899 HydrophobicContact CG-CD1 3.36Å; P828-Y899 HydrophobicContact CG-CE1 3.22Å
829	H	70.4	Confident	67.4	Low	135 Å²	135	87.4 Å²	87.4	63%	0.625	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-57.3	-24.9	172.6	-174.6	73.2	0	0	0	114	D827	D827-H829 PolarHBondContact O-N 2.95Å; D827-H829 PolarHBondContact OD1-N 3.44Å; D827-H829 VanDerWaalsContact OD1-N 3.11Å
830	F	70.1	Confident	68.5	Low	61 Å²	61	79.3 Å²	79.3	27%	0.268	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-87.8	0.3	-179.7	-64.2	-73	0	0	0	114.1	L826 D827 P828 N832 Y898	L826-F830 HydrophobicContact CD2-CD2 4.3Å; D827-F830 HydrophobicContact CB-CD2 3.86Å; D827-F830 HydrophobicContact CB-CE2 3.96Å; D827-F830 WeakPolarHBondContact O-CD2 3.41Å; D827-F830 PolarHBondContact O-N 3.39Å; P828-F830 PolarHBondContact O-N 3.23Å; F830-N832 PolarHBondContact O-N 3.28Å; F830-Y898 HydrophobicContact CB-CD1 4.47Å; F830-Y898 HydrophobicContact CB-CE1 4.05Å
831	L	76.7	Confident	69.7	Low	34 Å²	34	73.7 Å²	73.7	18%	0.178	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	119.6	176.9	-175	74.5	0	0	0	110.6	P828 N833 F848 M894 Q895 Y898	P828-L831 VanDerWaalsContact O-CB 3.3Å; P828-L831 WeakPolarHBondContact O-CB 3.3Å; P828-L831 PolarHBondContact O-N 2.87Å; P828-L831 VanDerWaalsContact O-N 3.16Å; L831-N833 VanDerWaalsContact C-N 3.28Å; L831-N833 PolarHBondContact O-N 2.73Å; L831-F848 HydrophobicContact CD1-CZ 4.08Å; L831-M894 HydrophobicContact CD1-CB 3.98Å; L831-Q895 HydrophobicContact CD1-CG 4.5Å; L831-Q895 HydrophobicContact CD2-CG 3.56Å; L831-Y898 HydrophobicContact CD1-CD2 3.84Å; L831-Y898 HydrophobicContact CD1-CE2 4.14Å; L831-Y898 HydrophobicContact CD1-CG 4.09Å
832	N	78.3	Confident	70.9	Confident	57 Å²	57	71 Å²	71	31%	0.305	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	34	177.7	-163	34.4	0	0	0	114.6	F830 F848 Y849	F830-N832 PolarHBondContact O-N 3.28Å; N832-F848 HydrophobicContact CB-CD2 4.48Å; N832-F848 HydrophobicContact CB-CE1 4.46Å; N832-F848 HydrophobicContact CB-CE2 4.05Å; N832-F848 HydrophobicContact CB-CZ 4.03Å; N832-F848 WeakPolarHBondContact OD1-CA 3.3Å; N832-Y849 WeakPolarHBondContact CA-O 2.9Å; N832-Y849 PolarHBondContact N-O 3.19Å; N832-Y849 PolarHBondContact OD1-N 3.12Å
833	N	78.5	Confident	71.9	Confident	41 Å²	41	69.7 Å²	69.7	22%	0.219	35%	0.354	C	S	.	.			trans	-90.2	128.5	175.7	-169.2	-15.1	0	0	0	111.2	L831 E835 Y849	L831-N833 VanDerWaalsContact C-N 3.28Å; L831-N833 PolarHBondContact O-N 2.73Å; N833-E835 PolarHBondContact OD1-N 3.28Å; N833-Y849 WeakPolarHBondContact O-CB 3.45Å
834	K	75.4	Confident	73	Confident	148 Å²	148	70.1 Å²	70.1	64%	0.643	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-26	-176	-174.8	175.2	179.5	-176.3	0	113.9	Y849	K834-Y849 HydrophobicContact CB-CD1 4.49Å; K834-Y849 HydrophobicContact CB-CD2 4.2Å; K834-Y849 HydrophobicContact CB-CE1 4.39Å; K834-Y849 HydrophobicContact CB-CE2 4.08Å; K834-Y849 HydrophobicContact CB-CG 4.42Å; K834-Y849 HydrophobicContact CD-CE2 4.41Å; K834-Y849 HydrophobicContact CG-CD1 4.39Å; K834-Y849 HydrophobicContact CG-CE1 3.89Å; K834-Y849 HydrophobicContact CG-CE2 4.14Å
835	E	67.7	Low	73.5	Confident	174 Å²	174	71.6 Å²	71.6	81%	0.813	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-26.8	-170.5	-64.2	-171.6	170	0	0	113.7	N833	N833-E835 PolarHBondContact OD1-N 3.28Å
836	M	66.9	Low	74.4	Confident	124 Å²	124	69.2 Å²	69.2	61%	0.611	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120	2	-170.7	-64	-66	-76.6	0	0	114.5	H851	M836-H851 PolarHBondContact O-CD2 3.05Å; M836-H851 VanDerWaalsContact O-CD2 3.26Å; M836-H851 PolarHBondContact O-NE2 3.38Å
837	S	73.4	Confident	75.2	Confident	29 Å²	29	70.3 Å²	70.3	20%	0.203	37%	0.365	C	S	.	.			trans	-80.3	139.5	179.7	62.6	0	0	0	0	113.3	Y849 A850	S837-Y849 WeakPolarHBondContact OG-CD1 3.43Å; S837-A850 WeakPolarHBondContact CB-O 3.5Å
838	D	74.4	Confident	76.1	Confident	59 Å²	59	65.4 Å²	65.4	32%	0.316	34%	0.339	S	S	.	.	S	Bend	trans	-106.3	-4.8	176	61.1	-2.1	0	0	0	113.2	A850 H851 K852	D838-A850 PolarHBondContact N-O 2.92Å; D838-H851 WeakPolarHBondContact OD1-CA 3.3Å; D838-K852 WeakPolarHBondContact O-CE 3.37Å; D838-K852 PolarHBondContact OD1-N 3.27Å; D838-K852 VanDerWaalsContact OD2-CB 3.27Å; D838-K852 WeakPolarHBondContact OD2-CB 3.42Å; D838-K852 WeakPolarHBondContact OD2-CG 3.5Å; D838-K852 PolarHBondContact OD2-N 3.25Å
839	V	77.9	Confident	76.8	Confident	3 Å²	3	65 Å²	65	2%	0.018	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	143.5	171	171.6	0	0	0	0	111.7	F841 A850 K852 M866 V880	V839-F841 HydrophobicContact CB-CE2 4.45Å; V839-F841 HydrophobicContact CG1-CD2 3.85Å; V839-F841 HydrophobicContact CG1-CE2 3.45Å; V839-F841 VanDerWaalsContact CG1-CE2 3.45Å; V839-F841 HydrophobicContact CG1-CZ 3.84Å; V839-A850 PolarHBondContact N-O 3.45Å; V839-A850 VanDerWaalsContact N-O 3.15Å; V839-A850 PolarHBondContact O-N 3.37Å; V839-K852 HydrophobicContact CB-CG 4.38Å; V839-K852 HydrophobicContact CG2-CD 3.81Å; V839-K852 HydrophobicContact CG2-CG 3.21Å; V839-M866 HydrophobicContact CG1-CE 4.45Å; V839-M866 HydrophobicContact CG2-CE 3.4Å; V839-M866 HydrophobicContact CG2-SD 4.37Å; V839-V880 HydrophobicContact CG1-CG2 4.34Å
840	T	81.1	Confident	77.4	Confident	22 Å²	22	58.6 Å²	58.6	14%	0.135	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	130.6	169.8	44	0	0	0	0	110.3	F848 Y849 K878 T879 V880	T840-F848 CarbonylContact C-O 3.53Å; T840-F848 WeakPolarHBondContact CA-O 3.38Å; T840-Y849 HydrophobicContact CG2-CD1 3.43Å; T840-Y849 VanDerWaalsContact CG2-CD1 3.43Å; T840-Y849 HydrophobicContact CG2-CE1 3.45Å; T840-Y849 VanDerWaalsContact CG2-CE1 3.45Å; T840-Y849 HydrophobicContact CG2-CG 4.5Å; T840-K878 PolarHBondContact N-O 3.34Å; T840-K878 VanDerWaalsContact OG1-C 3.32Å; T840-K878 PolarHBondContact OG1-O 2.89Å; T840-T879 CarbonylContact O-C 3.51Å; T840-T879 VanDerWaalsContact O-CA 3.25Å; T840-T879 WeakPolarHBondContact O-CA 3.47Å; T840-T879 VanDerWaalsContact OG1-CG2 3.32Å; T840-T879 WeakPolarHBondContact OG1-CG2 3.45Å; T840-V880 PolarHBondContact O-N 3.5Å
841	F	82.2	Confident	78	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	142.7	170.1	-68.2	-89.3	0	0	0	110.1	V839 V843 L847 F848 A850 L855 F862 V880 I882 F890	V839-F841 HydrophobicContact CB-CE2 4.45Å; V839-F841 HydrophobicContact CG1-CD2 3.85Å; V839-F841 HydrophobicContact CG1-CE2 3.45Å; V839-F841 VanDerWaalsContact CG1-CE2 3.45Å; V839-F841 HydrophobicContact CG1-CZ 3.84Å; F841-V843 HydrophobicContact CB-CG2 4.23Å; F841-L847 CarbonylContact O-C 3.58Å; F841-L847 WeakPolarHBondContact O-CA 3.44Å; F841-F848 HydrophobicContact CB-CB 4.3Å; F841-F848 PolarHBondContact N-O 3.15Å; F841-F848 PolarHBondContact O-N 2.92Å; F841-A850 HydrophobicContact CD2-CB 4.18Å; F841-A850 HydrophobicContact CE2-CB 3.99Å; F841-L855 HydrophobicContact CE2-CD1 3.59Å; F841-L855 HydrophobicContact CZ-CD1 3.77Å; F841-F862 HydrophobicContact CZ-CE1 4.34Å; F841-V880 CarbonylContact C-O 3.44Å; F841-V880 WeakPolarHBondContact CA-O 3.22Å; F841-V880 HydrophobicContact CD1-CB 3.56Å; F841-V880 HydrophobicContact CD1-CG1 3.73Å; F841-V880 HydrophobicContact CE1-CB 3.67Å; F841-V880 HydrophobicContact CE1-CG1 3.61Å; F841-V880 HydrophobicContact CE1-CG2 4.28Å; F841-V880 HydrophobicContact CG-CB 4.41Å; F841-I882 HydrophobicContact CD1-CD1 3.64Å; F841-I882 HydrophobicContact CD1-CG1 4.11Å; F841-I882 HydrophobicContact CE1-CD1 4.13Å; F841-I882 HydrophobicContact CG-CD1 4.44Å; F841-F890 HydrophobicContact CB-CE1 3.82Å; F841-F890 HydrophobicContact CB-CZ 3.96Å; F841-F890 AromaticContact CD1-CZ 3.91Å; F841-F890 HydrophobicContact CD1-CZ 3.91Å; F841-F890 HydrophobicContact CD2-CE1 4.1Å; F841-F890 AromaticContact CD2-CZ 3.76Å; F841-F890 HydrophobicContact CD2-CZ 3.76Å; F841-F890 HydrophobicContact CE1-CZ 4.35Å; F841-F890 HydrophobicContact CE2-CZ 4.22Å; F841-F890 AromaticContact CG-CE1 3.94Å; F841-F890 HydrophobicContact CG-CE1 3.94Å; F841-F890 AromaticContact CG-CZ 3.6Å; F841-F890 HydrophobicContact CG-CZ 3.6Å
842	L	82.5	Confident	77.9	Confident	46 Å²	46	59.3 Å²	59.3	24%	0.241	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	113.1	169.7	-177	70.6	0	0	0	107.9	L847 V880 E881 I882	L842-L847 HydrophobicContact CD1-CD2 3.91Å; L842-V880 PolarHBondContact N-O 2.93Å; L842-E881 HydrophobicContact CB-CG 4.19Å; L842-E881 HydrophobicContact CD2-CG 4Å; L842-E881 WeakPolarHBondContact CD2-OE1 3.47Å; L842-E881 WeakPolarHBondContact O-CA 3.27Å; L842-I882 PolarHBondContact O-N 3.43Å
843	V	81.9	Confident	77.8	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	120.4	-178.1	-171	0	0	0	0	108.3	F841 G845 K846 I882 M885 Y887 F890	F841-V843 HydrophobicContact CB-CG2 4.23Å; V843-G845 PolarHBondContact O-N 3.24Å; V843-G845 VanDerWaalsContact O-N 3.17Å; V843-K846 PolarHBondContact N-O 2.83Å; V843-K846 PolarHBondContact O-N 3.24Å; V843-I882 HydrophobicContact CG2-CB 4.14Å; V843-I882 HydrophobicContact CG2-CD1 4.26Å; V843-M885 WeakPolarHBondContact CG1-O 3.42Å; V843-Y887 HydrophobicContact CB-CD2 4.24Å; V843-F890 HydrophobicContact CG1-CB 4.25Å; V843-F890 HydrophobicContact CG2-CB 4.42Å; V843-F890 HydrophobicContact CG2-CD1 3.65Å; V843-F890 HydrophobicContact CG2-CE1 3.99Å; V843-F890 HydrophobicContact CG2-CG 3.99Å
844	E	79.2	Confident	77.8	Confident	119 Å²	119	60 Å²	60	56%	0.556	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	40	-174.7	-64.3	-175.3	133.7	0	0	114	K846 K886 Y887	E844-K846 PolarHBondContact O-N 3.06Å; E844-K886 WeakPolarHBondContact OE2-CA 3.5Å; E844-Y887 PolarHBondContact OE2-N 3.27Å
845	G	70.1	Confident	77.9	Confident	67 Å²	67	53 Å²	53	69%	0.691	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.8	4.2	-178.7	0	0	0	0	0	115.3	V843	V843-G845 PolarHBondContact O-N 3.24Å; V843-G845 VanDerWaalsContact O-N 3.17Å
846	K	80.1	Confident	78.3	Confident	117 Å²	117	47.1 Å²	47.1	51%	0.509	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	139.8	174.9	-66.8	175.9	-176.9	169.6	0	111.3	V843 E844 Y887	V843-K846 PolarHBondContact N-O 2.83Å; V843-K846 PolarHBondContact O-N 3.24Å; E844-K846 PolarHBondContact O-N 3.06Å; K846-Y887 HydrophobicContact CB-CD2 3.49Å; K846-Y887 VanDerWaalsContact CB-CD2 3.49Å; K846-Y887 HydrophobicContact CB-CE2 3.55Å; K846-Y887 HydrophobicContact CB-CG 4.22Å; K846-Y887 HydrophobicContact CD-CD1 4Å; K846-Y887 HydrophobicContact CD-CD2 3.92Å; K846-Y887 HydrophobicContact CD-CE1 4.33Å; K846-Y887 HydrophobicContact CD-CE2 4.26Å; K846-Y887 HydrophobicContact CD-CG 3.77Å; K846-Y887 HydrophobicContact CG-CD2 4.33Å
847	L	81.1	Confident	78.8	Confident	84 Å²	84	44.8 Å²	44.8	44%	0.44	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	138.8	176.9	-64.2	171.3	0	0	0	111	F841 L842	F841-L847 CarbonylContact O-C 3.58Å; F841-L847 WeakPolarHBondContact O-CA 3.44Å; L842-L847 HydrophobicContact CD1-CD2 3.91Å
848	F	82.9	Confident	78.8	Confident	1 Å²	1	44.5 Å²	44.5	0%	0.004	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	126.7	174.5	-166	-78.6	0	0	0	110.5	L831 N832 T840 F841 A850 Y887 F890 K891 M894	L831-F848 HydrophobicContact CD1-CZ 4.08Å; N832-F848 HydrophobicContact CB-CD2 4.48Å; N832-F848 HydrophobicContact CB-CE1 4.46Å; N832-F848 HydrophobicContact CB-CE2 4.05Å; N832-F848 HydrophobicContact CB-CZ 4.03Å; N832-F848 WeakPolarHBondContact OD1-CA 3.3Å; T840-F848 CarbonylContact C-O 3.53Å; T840-F848 WeakPolarHBondContact CA-O 3.38Å; F841-F848 HydrophobicContact CB-CB 4.3Å; F841-F848 PolarHBondContact N-O 3.15Å; F841-F848 PolarHBondContact O-N 2.92Å; F848-A850 HydrophobicContact CD1-CB 4.44Å; F848-A850 HydrophobicContact CE1-CB 4.48Å; F848-Y887 HydrophobicContact CB-CE2 4.28Å; F848-Y887 HydrophobicContact CD2-CE2 4.05Å; F848-F890 HydrophobicContact CB-CD1 4.26Å; F848-F890 HydrophobicContact CB-CE1 3.97Å; F848-F890 HydrophobicContact CD1-CD1 4.34Å; F848-F890 AromaticContact CD1-CE1 3.77Å; F848-F890 HydrophobicContact CD1-CE1 3.77Å; F848-F890 HydrophobicContact CD2-CD1 4.22Å; F848-F890 HydrophobicContact CD2-CE1 4.43Å; F848-F890 HydrophobicContact CE1-CE1 4.42Å; F848-F890 HydrophobicContact CG-CD1 4.01Å; F848-F890 AromaticContact CG-CE1 3.79Å; F848-F890 HydrophobicContact CG-CE1 3.79Å; F848-K891 HydrophobicContact CE2-CB 4.17Å; F848-K891 HydrophobicContact CE2-CG 4.2Å; F848-M894 HydrophobicContact CD1-CG 4.22Å; F848-M894 HydrophobicContact CE1-CB 3.8Å; F848-M894 HydrophobicContact CE1-CG 3.48Å; F848-M894 VanDerWaalsContact CE1-CG 3.48Å; F848-M894 HydrophobicContact CE1-SD 4.12Å; F848-M894 HydrophobicContact CZ-CB 3.55Å; F848-M894 HydrophobicContact CZ-CG 3.66Å
849	Y	82.1	Confident	79.2	Confident	45 Å²	45	42 Å²	42	18%	0.176	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	125.9	-175.1	-62.4	-79.7	0	0	0	111.2	N832 N833 K834 S837 T840	N832-Y849 WeakPolarHBondContact CA-O 2.9Å; N832-Y849 PolarHBondContact N-O 3.19Å; N832-Y849 PolarHBondContact OD1-N 3.12Å; N833-Y849 WeakPolarHBondContact O-CB 3.45Å; K834-Y849 HydrophobicContact CB-CD1 4.49Å; K834-Y849 HydrophobicContact CB-CD2 4.2Å; K834-Y849 HydrophobicContact CB-CE1 4.39Å; K834-Y849 HydrophobicContact CB-CE2 4.08Å; K834-Y849 HydrophobicContact CB-CG 4.42Å; K834-Y849 HydrophobicContact CD-CE2 4.41Å; K834-Y849 HydrophobicContact CG-CD1 4.39Å; K834-Y849 HydrophobicContact CG-CE1 3.89Å; K834-Y849 HydrophobicContact CG-CE2 4.14Å; S837-Y849 WeakPolarHBondContact OG-CD1 3.43Å; T840-Y849 HydrophobicContact CG2-CD1 3.43Å; T840-Y849 VanDerWaalsContact CG2-CD1 3.43Å; T840-Y849 HydrophobicContact CG2-CE1 3.45Å; T840-Y849 VanDerWaalsContact CG2-CE1 3.45Å; T840-Y849 HydrophobicContact CG2-CG 4.5Å
850	A	82.1	Confident	79.1	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	173.3	-175	0	0	0	0	0	113.8	S837 D838 V839 F841 F848 L855 M894	S837-A850 WeakPolarHBondContact CB-O 3.5Å; D838-A850 PolarHBondContact N-O 2.92Å; V839-A850 PolarHBondContact N-O 3.45Å; V839-A850 VanDerWaalsContact N-O 3.15Å; V839-A850 PolarHBondContact O-N 3.37Å; F841-A850 HydrophobicContact CD2-CB 4.18Å; F841-A850 HydrophobicContact CE2-CB 3.99Å; F848-A850 HydrophobicContact CD1-CB 4.44Å; F848-A850 HydrophobicContact CE1-CB 4.48Å; A850-L855 HydrophobicContact CB-CD1 4.06Å; A850-M894 HydrophobicContact CB-SD 4.48Å
851	H	83.5	Confident	79.1	Confident	21 Å²	21	49.6 Å²	49.6	10%	0.097	27%	0.269	C	S	.	.			trans	-112.5	122.5	-175.6	-59.2	87.4	0	0	0	112.2	L826 M836 D838 V853 L854 L855 Y898	L826-H851 HydrophobicContact CD1-CB 4.11Å; M836-H851 PolarHBondContact O-CD2 3.05Å; M836-H851 VanDerWaalsContact O-CD2 3.26Å; M836-H851 PolarHBondContact O-NE2 3.38Å; D838-H851 WeakPolarHBondContact OD1-CA 3.3Å; H851-V853 PolarHBondContact O-N 3.28Å; H851-L854 HydrophobicContact CB-CB 4.42Å; H851-L854 PolarHBondContact O-N 3.22Å; H851-L855 WeakPolarHBondContact O-CG 3.44Å; H851-L855 PolarHBondContact O-N 2.93Å; H851-Y898 PolarHBondContact N-OH 2.99Å; H851-Y898 AromaticContact ND1-CE1 3.7Å; H851-Y898 AromaticContact ND1-CZ 3.61Å; H851-Y898 PolarHBondContact ND1-OH 3.29Å
852	K	75.4	Confident	79	Confident	89 Å²	89	49.6 Å²	49.6	39%	0.387	27%	0.269	S	S	.	.	H	α-helix	trans	-57.9	-46.9	-176.1	-71.1	-179.2	-178.2	-176.9	0	112.3	D838 V839 L854 L855 V856 M866	D838-K852 WeakPolarHBondContact O-CE 3.37Å; D838-K852 PolarHBondContact OD1-N 3.27Å; D838-K852 VanDerWaalsContact OD2-CB 3.27Å; D838-K852 WeakPolarHBondContact OD2-CB 3.42Å; D838-K852 WeakPolarHBondContact OD2-CG 3.5Å; D838-K852 PolarHBondContact OD2-N 3.25Å; V839-K852 HydrophobicContact CB-CG 4.38Å; V839-K852 HydrophobicContact CG2-CD 3.81Å; V839-K852 HydrophobicContact CG2-CG 3.21Å; K852-L854 VanDerWaalsContact C-N 3.3Å; K852-L854 PolarHBondContact O-N 3.02Å; K852-L855 PolarHBondContact O-N 3.43Å; K852-V856 WeakPolarHBondContact O-CB 3.43Å; K852-V856 VanDerWaalsContact O-CG2 3.25Å; K852-V856 WeakPolarHBondContact O-CG2 3.44Å; K852-V856 PolarHBondContact O-N 3.27Å; K852-M866 HydrophobicContact CD-CE 4.19Å; K852-M866 HydrophobicContact CG-CE 4.14Å
853	V	75.9	Confident	78.7	Confident	106 Å²	106	52.4 Å²	52.4	64%	0.642	28%	0.279	S	S	*	.	H	α-helix	trans	-58.6	-46.3	-174.7	178.4	0	0	0	0	110	H851 L855 T857	H851-V853 PolarHBondContact O-N 3.28Å; V853-L855 PolarHBondContact O-N 3.02Å; V853-T857 WeakPolarHBondContact O-CB 3.44Å; V853-T857 PolarHBondContact O-N 2.88Å; V853-T857 PolarHBondContact O-OG1 3.5Å
854	L	77.9	Confident	78.4	Confident	6 Å²	6	55.6 Å²	55.6	3%	0.031	30%	0.299	C	S	.	.	H	α-helix	trans	-63.6	-42.1	179.1	-176.6	137.2	0	0	0	112.2	L826 H851 K852 A858 L897 Y898	L826-L854 HydrophobicContact CB-CD1 3.91Å; L826-L854 HydrophobicContact CD1-CB 4.17Å; L826-L854 HydrophobicContact CD1-CD1 3.75Å; L826-L854 HydrophobicContact CG-CD1 4.12Å; H851-L854 HydrophobicContact CB-CB 4.42Å; H851-L854 PolarHBondContact O-N 3.22Å; K852-L854 VanDerWaalsContact C-N 3.3Å; K852-L854 PolarHBondContact O-N 3.02Å; L854-A858 WeakPolarHBondContact O-CB 3.23Å; L854-A858 PolarHBondContact O-N 2.87Å; L854-A858 VanDerWaalsContact O-N 3.07Å; L854-L897 HydrophobicContact CD2-CB 3.76Å; L854-Y898 HydrophobicContact CD2-CD2 4Å; L854-Y898 HydrophobicContact CD2-CE2 3.86Å
855	L	77.3	Confident	78.2	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-69	-43.9	179.8	-64.8	172.9	0	0	0	112.9	F841 A850 H851 K852 V853 T857 A858 S859 F862 M894 L897	F841-L855 HydrophobicContact CE2-CD1 3.59Å; F841-L855 HydrophobicContact CZ-CD1 3.77Å; A850-L855 HydrophobicContact CB-CD1 4.06Å; H851-L855 WeakPolarHBondContact O-CG 3.44Å; H851-L855 PolarHBondContact O-N 2.93Å; K852-L855 PolarHBondContact O-N 3.43Å; V853-L855 PolarHBondContact O-N 3.02Å; L855-T857 VanDerWaalsContact C-N 3.35Å; L855-A858 PolarHBondContact O-N 2.73Å; L855-S859 PolarHBondContact O-N 3.32Å; L855-F862 HydrophobicContact CB-CB 4.05Å; L855-F862 HydrophobicContact CB-CG 4.15Å; L855-F862 HydrophobicContact CD2-CD1 4.39Å; L855-F862 HydrophobicContact CD2-CD2 4.17Å; L855-F862 HydrophobicContact CD2-CE1 4.38Å; L855-F862 HydrophobicContact CD2-CE2 4.2Å; L855-F862 HydrophobicContact CD2-CG 4.32Å; L855-F862 HydrophobicContact CD2-CZ 4.31Å; L855-F862 VanDerWaalsContact O-CB 3.31Å; L855-F862 WeakPolarHBondContact O-CB 3.19Å; L855-M894 HydrophobicContact CD2-CE 3.65Å; L855-M894 HydrophobicContact CD2-SD 3.87Å; L855-L897 HydrophobicContact CD2-CD1 3.69Å
856	V	77.3	Confident	78.4	Confident	51 Å²	51	50 Å²	50	31%	0.309	26%	0.257	S	S	.	.	H	α-helix	trans	-68.1	-35.6	-179.6	171.5	0	0	0	0	111.4	K852 K863 M866	K852-V856 WeakPolarHBondContact O-CB 3.43Å; K852-V856 VanDerWaalsContact O-CG2 3.25Å; K852-V856 WeakPolarHBondContact O-CG2 3.44Å; K852-V856 PolarHBondContact O-N 3.27Å; V856-K863 HydrophobicContact CG1-CB 4.05Å; V856-K863 HydrophobicContact CG1-CD 4.15Å; V856-K863 HydrophobicContact CG1-CG 3.89Å; V856-M866 HydrophobicContact CG2-CG 4.46Å
857	T	76	Confident	77.8	Confident	75 Å²	75	47.7 Å²	47.7	46%	0.46	25%	0.252	S	S	.	.	H	α-helix	trans	-75.9	-28.9	176.8	-56.3	0	0	0	0	112.3	P823 A824 V853 L855	P823-T857 HydrophobicContact CG-CG2 3.82Å; A824-T857 HydrophobicContact CB-CG2 4.44Å; V853-T857 WeakPolarHBondContact O-CB 3.44Å; V853-T857 PolarHBondContact O-N 2.88Å; V853-T857 PolarHBondContact O-OG1 3.5Å; L855-T857 VanDerWaalsContact C-N 3.35Å
858	A	73.9	Confident	76.9	Confident	23 Å²	23	48.8 Å²	48.8	19%	0.19	26%	0.258	C	S	.	.	H	α-helix	trans	-83.9	-30.4	-176.9	0	0	0	0	0	115	L822 L854 L855 L897	L822-A858 HydrophobicContact CD2-CB 4Å; L854-A858 WeakPolarHBondContact O-CB 3.23Å; L854-A858 PolarHBondContact O-N 2.87Å; L854-A858 VanDerWaalsContact O-N 3.07Å; L855-A858 PolarHBondContact O-N 2.73Å; A858-L897 HydrophobicContact CB-CD2 3.59Å
859	S	81.9	Confident	75.7	Confident	6 Å²	6	52.9 Å²	52.9	4%	0.042	28%	0.276	C	S	.	.			trans	-149.4	138.5	-179.6	165.8	0	0	0	0	113.4	L855 R861 F862 K863 F922	L855-S859 PolarHBondContact O-N 3.32Å; S859-R861 VanDerWaalsContact C-N 3.26Å; S859-R861 PolarHBondContact O-N 3.33Å; S859-R861 PolarHBondContact OG-N 3.11Å; S859-F862 PolarHBondContact O-N 3.46Å; S859-K863 PolarHBondContact O-N 3.44Å; S859-F922 VanDerWaalsContact CB-O 3.29Å; S859-F922 WeakPolarHBondContact CB-O 3.29Å; S859-F922 PolarHBondContact OG-O 2.85Å
860	N	76.9	Confident	74.3	Confident	113 Å²	113	56.4 Å²	56.4	60%	0.604	30%	0.303	S	S	*	.	H	α-helix	trans	-64.7	-29.3	173.9	-74.5	-32.2	0	0	0	112.9	K863 T864	N860-K863 WeakPolarHBondContact O-CB 3.4Å; N860-K863 PolarHBondContact O-N 2.59Å; N860-T864 PolarHBondContact O-N 3.21Å; N860-T864 PolarHBondContact O-OG1 3.26Å
861	R	80.4	Confident	72.7	Confident	72 Å²	72	64.8 Å²	64.8	27%	0.272	34%	0.342	S	S	.	.	H	α-helix	trans	-69.1	-45.1	175.7	-166.2	-62.7	-139.7	-128.6	19.1	110.5	S859 K863 T864 L865 L921	S859-R861 VanDerWaalsContact C-N 3.26Å; S859-R861 PolarHBondContact O-N 3.33Å; S859-R861 PolarHBondContact OG-N 3.11Å; R861-K863 VanDerWaalsContact C-N 3.25Å; R861-K863 PolarHBondContact O-N 2.71Å; R861-T864 WeakPolarHBondContact CA-OG1 3.42Å; R861-T864 PolarHBondContact O-N 3.04Å; R861-T864 PolarHBondContact O-OG1 3.23Å; R861-L865 VanDerWaalsContact NH1-CD1 3.3Å; R861-L865 PolarHBondContact O-N 3.48Å; R861-L921 WeakPolarHBondContact CG-O 3.37Å
862	F	80.1	Confident	71	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-61.6	-38.3	173.9	-81.7	-58.2	0	0	0	110.7	F841 L855 S859 T864 L865 M866 L893 M894 L897 F922	F841-F862 HydrophobicContact CZ-CE1 4.34Å; L855-F862 HydrophobicContact CB-CB 4.05Å; L855-F862 HydrophobicContact CB-CG 4.15Å; L855-F862 HydrophobicContact CD2-CD1 4.39Å; L855-F862 HydrophobicContact CD2-CD2 4.17Å; L855-F862 HydrophobicContact CD2-CE1 4.38Å; L855-F862 HydrophobicContact CD2-CE2 4.2Å; L855-F862 HydrophobicContact CD2-CG 4.32Å; L855-F862 HydrophobicContact CD2-CZ 4.31Å; L855-F862 VanDerWaalsContact O-CB 3.31Å; L855-F862 WeakPolarHBondContact O-CB 3.19Å; S859-F862 PolarHBondContact O-N 3.46Å; F862-T864 PolarHBondContact O-N 2.81Å; F862-L865 HydrophobicContact CD1-CD1 4.12Å; F862-L865 HydrophobicContact CE1-CD1 4.49Å; F862-L865 PolarHBondContact O-N 3.29Å; F862-M866 WeakPolarHBondContact O-CG 3.33Å; F862-M866 PolarHBondContact O-N 3.48Å; F862-L893 HydrophobicContact CE2-CD2 4.01Å; F862-L893 HydrophobicContact CZ-CD2 3.97Å; F862-M894 HydrophobicContact CE1-CE 4.29Å; F862-M894 HydrophobicContact CE2-CE 4.23Å; F862-M894 HydrophobicContact CZ-CE 3.65Å; F862-L897 HydrophobicContact CE2-CD1 4.09Å; F862-F922 HydrophobicContact CD1-CD1 4.02Å; F862-F922 HydrophobicContact CD1-CE1 4.09Å; F862-F922 HydrophobicContact CD2-CD1 4.13Å; F862-F922 AromaticContact CE1-CD1 3.47Å; F862-F922 HydrophobicContact CE1-CD1 3.47Å; F862-F922 VanDerWaalsContact CE1-CD1 3.47Å; F862-F922 AromaticContact CE1-CE1 3.35Å; F862-F922 HydrophobicContact CE1-CE1 3.35Å; F862-F922 HydrophobicContact CE1-CG 4.4Å; F862-F922 HydrophobicContact CE1-CZ 4.23Å; F862-F922 HydrophobicContact CE2-CB 3.94Å; F862-F922 AromaticContact CE2-CD1 3.57Å; F862-F922 HydrophobicContact CE2-CD1 3.57Å; F862-F922 HydrophobicContact CE2-CE1 4.28Å; F862-F922 AromaticContact CE2-CG 3.85Å; F862-F922 HydrophobicContact CE2-CG 3.85Å; F862-F922 HydrophobicContact CG-CD1 4.31Å; F862-F922 HydrophobicContact CZ-CB 4.31Å; F862-F922 AromaticContact CZ-CD1 3.19Å; F862-F922 HydrophobicContact CZ-CD1 3.19Å; F862-F922 HydrophobicContact CZ-CD2 4.33Å; F862-F922 AromaticContact CZ-CE1 3.45Å; F862-F922 HydrophobicContact CZ-CE1 3.45Å; F862-F922 VanDerWaalsContact CZ-CE1 3.45Å; F862-F922 AromaticContact CZ-CG 3.7Å; F862-F922 HydrophobicContact CZ-CG 3.7Å; F862-F922 HydrophobicContact CZ-CZ 4.15Å
863	K	75.9	Confident	69.5	Low	105 Å²	105	72.7 Å²	72.7	46%	0.457	38%	0.384	S	S	.	.	H	α-helix	trans	-57.3	-48	171.4	-175.9	175.9	-179.8	-176.3	0	112.8	V856 S859 N860 R861 M866 T867	V856-K863 HydrophobicContact CG1-CB 4.05Å; V856-K863 HydrophobicContact CG1-CD 4.15Å; V856-K863 HydrophobicContact CG1-CG 3.89Å; S859-K863 PolarHBondContact O-N 3.44Å; N860-K863 WeakPolarHBondContact O-CB 3.4Å; N860-K863 PolarHBondContact O-N 2.59Å; R861-K863 VanDerWaalsContact C-N 3.25Å; R861-K863 PolarHBondContact O-N 2.71Å; K863-M866 PolarHBondContact O-N 2.97Å; K863-T867 WeakPolarHBondContact O-CG2 3.48Å; K863-T867 PolarHBondContact O-N 2.96Å; K863-T867 PolarHBondContact O-OG1 3.35Å
864	T	76.4	Confident	68.2	Low	68 Å²	68	73.9 Å²	73.9	42%	0.417	40%	0.396	S	S	.	.	H	α-helix	trans	-66.8	-38.2	180	6.5	0	0	0	0	113.2	N860 R861 F862 M866 T867 N868	N860-T864 PolarHBondContact O-N 3.21Å; N860-T864 PolarHBondContact O-OG1 3.26Å; R861-T864 WeakPolarHBondContact CA-OG1 3.42Å; R861-T864 PolarHBondContact O-N 3.04Å; R861-T864 PolarHBondContact O-OG1 3.23Å; F862-T864 PolarHBondContact O-N 2.81Å; T864-M866 PolarHBondContact O-N 3.42Å; T864-T867 WeakPolarHBondContact CA-OG1 3.17Å; T864-T867 PolarHBondContact O-N 3.2Å; T864-T867 PolarHBondContact O-OG1 3.26Å; T864-N868 WeakPolarHBondContact O-CB 3.46Å; T864-N868 PolarHBondContact O-N 2.83Å
865	L	75.9	Confident	66.6	Low	36 Å²	36	81.5 Å²	81.5	19%	0.188	43%	0.432	C	S	.	.	H	α-helix	trans	-57.1	-39.4	173.9	-90.3	176.2	0	0	0	112.7	R861 F862 F922	R861-L865 VanDerWaalsContact NH1-CD1 3.3Å; R861-L865 PolarHBondContact O-N 3.48Å; F862-L865 HydrophobicContact CD1-CD1 4.12Å; F862-L865 HydrophobicContact CE1-CD1 4.49Å; F862-L865 PolarHBondContact O-N 3.29Å; L865-F922 HydrophobicContact CD1-CE1 4.08Å
866	M	72.9	Confident	65.4	Low	33 Å²	33	85.5 Å²	85.5	16%	0.163	47%	0.473	C	S	.	.	H	α-helix	trans	-81.8	-29.5	-176.7	-61.3	-51.5	-59.7	0	0	112.2	V839 K852 V856 F862 K863 T864 V880	V839-M866 HydrophobicContact CG1-CE 4.45Å; V839-M866 HydrophobicContact CG2-CE 3.4Å; V839-M866 HydrophobicContact CG2-SD 4.37Å; K852-M866 HydrophobicContact CD-CE 4.19Å; K852-M866 HydrophobicContact CG-CE 4.14Å; V856-M866 HydrophobicContact CG2-CG 4.46Å; F862-M866 WeakPolarHBondContact O-CG 3.33Å; F862-M866 PolarHBondContact O-N 3.48Å; K863-M866 PolarHBondContact O-N 2.97Å; T864-M866 PolarHBondContact O-N 3.42Å; M866-V880 HydrophobicContact SD-CG2 4.25Å
867	T	68.4	Low	64.2	Low	68 Å²	68	86.6 Å²	86.6	42%	0.417	48%	0.483	S	S	.	.	H	α-helix	trans	-81.7	-34.1	177.8	55.7	0	0	0	0	113.6	K863 T864 K869 T870	K863-T867 WeakPolarHBondContact O-CG2 3.48Å; K863-T867 PolarHBondContact O-N 2.96Å; K863-T867 PolarHBondContact O-OG1 3.35Å; T864-T867 WeakPolarHBondContact CA-OG1 3.17Å; T864-T867 PolarHBondContact O-N 3.2Å; T864-T867 PolarHBondContact O-OG1 3.26Å; T867-K869 VanDerWaalsContact C-N 3.3Å; T867-K869 PolarHBondContact O-N 3.01Å; T867-T870 PolarHBondContact O-N 2.9Å; T867-T870 PolarHBondContact O-OG1 2.87Å
868	N	61.5	Low	63.5	Low	106 Å²	106	90.6 Å²	90.6	57%	0.567	49%	0.494	S	S	*	.	H	α-helix	trans	-70.1	-27.2	-179.7	-74.4	1.9	0	0	0	112.7	T864	T864-N868 WeakPolarHBondContact O-CB 3.46Å; T864-N868 PolarHBondContact O-N 2.83Å
869	K	57	Low	63.1	Low	88 Å²	88	91.6 Å²	91.6	38%	0.383	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-18	176.9	-80.7	-163.8	171.8	-154.9	0	114.3	T867 E871 T879 V880	T867-K869 VanDerWaalsContact C-N 3.3Å; T867-K869 PolarHBondContact O-N 3.01Å; K869-E871 PolarHBondContact O-N 3.12Å; K869-T879 PolarHBondContact NZ-O 3.19Å; K869-T879 VanDerWaalsContact NZ-O 3.08Å; K869-V880 HydrophobicContact CD-CG2 4.45Å
870	T	52.8	Low	62.8	Low	119 Å²	119	91.7 Å²	91.7	73%	0.73	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-13	176.2	34	0	0	0	0	113.6	T867	T867-T870 PolarHBondContact O-N 2.9Å; T867-T870 PolarHBondContact O-OG1 2.87Å
871	E	49.6	Very low	62.8	Low	175 Å²	175	92.9 Å²	92.9	82%	0.818	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-16.3	-178.6	-64.7	-171.6	166.4	0	0	114.7	K869	K869-E871 PolarHBondContact O-N 3.12Å
872	Q	48.4	Very low	62.7	Low	170 Å²	170	90.3 Å²	90.3	79%	0.794	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.1	-15.7	-170.8	-78.1	-171.8	-13.7	0	0	117.2
873	D	43.8	Very low	62.2	Low	107 Å²	107	95 Å²	95	57%	0.572	53%	0.525	S	S	*	.			trans	-121.7	97.5	-176.3	-81.9	-30.3	0	0	0	113.8	Q875	D873-Q875 PolarHBondContact O-N 2.84Å; D873-Q875 VanDerWaalsContact O-N 3.12Å
874	S	47.5	Very low	61.8	Low	130 Å²	130	96.7 Å²	96.7	91%	0.909	54%	0.538	S	S	*	.			trans	-73.1	14.6	169.4	-48	0	0	0	0	113.8
875	Q	45.4	Very low	62.1	Low	167 Å²	167	94.4 Å²	94.4	78%	0.78	52%	0.523	S	S	*	.	S	Bend	trans	-140.2	91.8	177.1	-80.6	-177.8	-14.2	0	0	111.9	D873 S877	D873-Q875 PolarHBondContact O-N 2.84Å; D873-Q875 VanDerWaalsContact O-N 3.12Å; Q875-S877 VanDerWaalsContact C-N 3.26Å; Q875-S877 PolarHBondContact O-N 3.48Å
876	G	51.5	Low	62.5	Low	84 Å²	84	96.8 Å²	96.8	87%	0.866	53%	0.532	S	S	*	.			trans	53.1	-3	134.7	0	0	0	0	0	123	K878	G876-K878 PolarHBondContact O-N 2.96Å
877	S	51.5	Low	63	Low	73 Å²	73	97.2 Å²	97.2	51%	0.51	53%	0.532	S	S	.	.			trans	-84.7	100.3	-178.8	178.6	0	0	0	0	110.6	Q875 T879	Q875-S877 VanDerWaalsContact C-N 3.26Å; Q875-S877 PolarHBondContact O-N 3.48Å; S877-T879 PolarHBondContact O-N 3.13Å; S877-T879 PolarHBondContact OG-OG1 3.38Å
878	K	61.2	Low	63.7	Low	160 Å²	160	96.5 Å²	96.5	70%	0.696	53%	0.53	S	S	*	.			trans	-70.8	11.8	171.7	-67	-177	179.1	179.9	0	113.4	T840 G876	T840-K878 PolarHBondContact N-O 3.34Å; T840-K878 VanDerWaalsContact OG1-C 3.32Å; T840-K878 PolarHBondContact OG1-O 2.89Å; G876-K878 PolarHBondContact O-N 2.96Å
879	T	66.1	Low	64.8	Low	43 Å²	43	91.5 Å²	91.5	26%	0.264	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	128.9	-172	64	0	0	0	0	112.1	T840 K869 S877	T840-T879 CarbonylContact O-C 3.51Å; T840-T879 VanDerWaalsContact O-CA 3.25Å; T840-T879 WeakPolarHBondContact O-CA 3.47Å; T840-T879 VanDerWaalsContact OG1-CG2 3.32Å; T840-T879 WeakPolarHBondContact OG1-CG2 3.45Å; K869-T879 PolarHBondContact NZ-O 3.19Å; K869-T879 VanDerWaalsContact NZ-O 3.08Å; S877-T879 PolarHBondContact O-N 3.13Å; S877-T879 PolarHBondContact OG-OG1 3.38Å
880	V	74.6	Confident	66.1	Low	9 Å²	9	87.3 Å²	87.3	6%	0.055	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	111.2	174.1	-179.3	0	0	0	0	108.3	V839 T840 F841 L842 M866 K869	V839-V880 HydrophobicContact CG1-CG2 4.34Å; T840-V880 PolarHBondContact O-N 3.5Å; F841-V880 CarbonylContact C-O 3.44Å; F841-V880 WeakPolarHBondContact CA-O 3.22Å; F841-V880 HydrophobicContact CD1-CB 3.56Å; F841-V880 HydrophobicContact CD1-CG1 3.73Å; F841-V880 HydrophobicContact CE1-CB 3.67Å; F841-V880 HydrophobicContact CE1-CG1 3.61Å; F841-V880 HydrophobicContact CE1-CG2 4.28Å; F841-V880 HydrophobicContact CG-CB 4.41Å; L842-V880 PolarHBondContact N-O 2.93Å; M866-V880 HydrophobicContact SD-CG2 4.25Å; K869-V880 HydrophobicContact CD-CG2 4.45Å
881	E	76.8	Confident	67.5	Low	138 Å²	138	86 Å²	86	65%	0.645	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	131.6	177.4	-56.7	-168.2	157.4	0	0	110.4	L842	L842-E881 HydrophobicContact CB-CG 4.19Å; L842-E881 HydrophobicContact CD2-CG 4Å; L842-E881 WeakPolarHBondContact CD2-OE1 3.47Å; L842-E881 WeakPolarHBondContact O-CA 3.27Å
882	I	79.2	Confident	69.1	Low	18 Å²	18	78.5 Å²	78.5	9%	0.092	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	103.8	168.6	-57.5	172.7	0	0	0	106.1	F841 L842 V843 M885 F890 F922	F841-I882 HydrophobicContact CD1-CD1 3.64Å; F841-I882 HydrophobicContact CD1-CG1 4.11Å; F841-I882 HydrophobicContact CE1-CD1 4.13Å; F841-I882 HydrophobicContact CG-CD1 4.44Å; L842-I882 PolarHBondContact O-N 3.43Å; V843-I882 HydrophobicContact CG2-CB 4.14Å; V843-I882 HydrophobicContact CG2-CD1 4.26Å; I882-M885 HydrophobicContact CD1-CE 4.15Å; I882-M885 HydrophobicContact CG2-CB 4.03Å; I882-M885 HydrophobicContact CG2-CE 3.74Å; I882-F890 HydrophobicContact CD1-CD2 3.91Å; I882-F890 HydrophobicContact CD1-CE2 3.34Å; I882-F890 HydrophobicContact CD1-CZ 3.73Å; I882-F922 HydrophobicContact CD1-CZ 4.18Å
883	S	69.3	Low	70.8	Confident	99 Å²	99	70.4 Å²	70.4	69%	0.692	40%	0.396	S	S	*	.			trans	-79.5	-29	-178.7	51	0	0	0	0	113.1
884	D	68.6	Low	72.6	Confident	139 Å²	139	65.3 Å²	65.3	74%	0.743	37%	0.369	S	S	*	.	S	Bend	trans	-108.2	41.5	-162.6	-54.8	-14.4	0	0	0	112.5
885	M	82.1	Confident	74.2	Confident	21 Å²	21	61.2 Å²	61.2	10%	0.103	34%	0.336	C	S	.	.	S	Bend	trans	-160.9	141.8	177.1	-177.8	168.6	35.9	0	0	112	V843 I882 I889 F890 A918 F922	V843-M885 WeakPolarHBondContact CG1-O 3.42Å; I882-M885 HydrophobicContact CD1-CE 4.15Å; I882-M885 HydrophobicContact CG2-CB 4.03Å; I882-M885 HydrophobicContact CG2-CE 3.74Å; M885-I889 HydrophobicContact CG-CB 4.04Å; M885-I889 HydrophobicContact CG-CG2 4.12Å; M885-I889 HydrophobicContact SD-CB 4.37Å; M885-I889 HydrophobicContact SD-CG2 3.97Å; M885-F890 HydrophobicContact CE-CB 3.87Å; M885-F890 HydrophobicContact CE-CD2 3.25Å; M885-F890 HydrophobicContact CE-CE2 4.07Å; M885-F890 HydrophobicContact CE-CG 3.94Å; M885-F890 HydrophobicContact CG-CB 4.4Å; M885-F890 HydrophobicContact SD-CB 4.03Å; M885-F890 HydrophobicContact SD-CD2 4.2Å; M885-A918 HydrophobicContact SD-CB 3.7Å; M885-F922 HydrophobicContact CE-CE2 3.57Å; M885-F922 HydrophobicContact CE-CZ 3.98Å; M885-F922 HydrophobicContact SD-CE2 4.34Å
886	K	84.2	Confident	75.9	Confident	85 Å²	85	53.7 Å²	53.7	37%	0.37	30%	0.3	S	S	.	.			trans	-68.6	146.3	174.4	-65	-179.3	-170.1	147.4	0	112.1	E844 S888 I889 F890 E914	E844-K886 WeakPolarHBondContact OE2-CA 3.5Å; K886-S888 VanDerWaalsContact C-N 3.26Å; K886-S888 PolarHBondContact O-N 3.19Å; K886-I889 HydrophobicContact CB-CG1 4.11Å; K886-I889 PolarHBondContact O-N 3.46Å; K886-F890 PolarHBondContact O-N 2.9Å; K886-F890 VanDerWaalsContact O-N 3.09Å; K886-E914 WeakPolarHBondContact CD-OE2 3.4Å; K886-E914 WeakPolarHBondContact CE-OE2 3.44Å; K886-E914 IonicContact NZ-OE1 2.68Å; K886-E914 PolarHBondContact NZ-OE1 3.44Å; K886-E914 IonicContact NZ-OE2 2.82Å; K886-E914 PolarHBondContact NZ-OE2 3.05Å
887	Y	83.4	Confident	77.2	Confident	42 Å²	42	49.8 Å²	49.8	17%	0.165	26%	0.259	C	S	.	.	H	α-helix	trans	-59.3	-35	178.7	-176.5	-92.7	0	0	0	113	V843 E844 K846 F848 K891	V843-Y887 HydrophobicContact CB-CD2 4.24Å; E844-Y887 PolarHBondContact OE2-N 3.27Å; K846-Y887 HydrophobicContact CB-CD2 3.49Å; K846-Y887 VanDerWaalsContact CB-CD2 3.49Å; K846-Y887 HydrophobicContact CB-CE2 3.55Å; K846-Y887 HydrophobicContact CB-CG 4.22Å; K846-Y887 HydrophobicContact CD-CD1 4Å; K846-Y887 HydrophobicContact CD-CD2 3.92Å; K846-Y887 HydrophobicContact CD-CE1 4.33Å; K846-Y887 HydrophobicContact CD-CE2 4.26Å; K846-Y887 HydrophobicContact CD-CG 3.77Å; K846-Y887 HydrophobicContact CG-CD2 4.33Å; F848-Y887 HydrophobicContact CB-CE2 4.28Å; F848-Y887 HydrophobicContact CD2-CE2 4.05Å; Y887-K891 WeakPolarHBondContact O-CB 3.44Å; Y887-K891 PolarHBondContact O-N 2.71Å
888	S	83.3	Confident	78.4	Confident	53 Å²	53	46.5 Å²	46.5	37%	0.371	24%	0.236	S	C	.	.	H	α-helix	trans	-63.5	-46.8	177.2	50	0	0	0	0	112.3	K886 K891 M892	K886-S888 VanDerWaalsContact C-N 3.26Å; K886-S888 PolarHBondContact O-N 3.19Å; S888-K891 WeakPolarHBondContact O-CB 3.44Å; S888-K891 PolarHBondContact O-N 3.01Å; S888-M892 WeakPolarHBondContact O-CG 3.39Å; S888-M892 PolarHBondContact O-N 2.98Å
889	I	83.9	Confident	79	Confident	1 Å²	1	43 Å²	43	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-64.5	-43.1	179.4	-55.7	-61	0	0	0	110.7	M885 K886 K891 M892 L893 D911 E914 L915 A918	M885-I889 HydrophobicContact CG-CB 4.04Å; M885-I889 HydrophobicContact CG-CG2 4.12Å; M885-I889 HydrophobicContact SD-CB 4.37Å; M885-I889 HydrophobicContact SD-CG2 3.97Å; K886-I889 HydrophobicContact CB-CG1 4.11Å; K886-I889 PolarHBondContact O-N 3.46Å; I889-K891 VanDerWaalsContact C-N 3.33Å; I889-K891 PolarHBondContact O-N 2.86Å; I889-M892 PolarHBondContact O-N 3.32Å; I889-L893 PolarHBondContact O-N 3.44Å; I889-D911 HydrophobicContact CD1-CB 3.58Å; I889-E914 HydrophobicContact CD1-CB 3.96Å; I889-E914 HydrophobicContact CG1-CB 4.07Å; I889-L915 HydrophobicContact CG2-CB 4.4Å; I889-L915 HydrophobicContact CG2-CD1 4.02Å; I889-A918 HydrophobicContact CG2-CB 3.92Å
890	F	83.8	Confident	79.1	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.7	-40.9	176.2	-172.4	-114.1	0	0	0	112.1	F841 V843 F848 I882 M885 K886 M892 L893 M894	F841-F890 HydrophobicContact CB-CE1 3.82Å; F841-F890 HydrophobicContact CB-CZ 3.96Å; F841-F890 AromaticContact CD1-CZ 3.91Å; F841-F890 HydrophobicContact CD1-CZ 3.91Å; F841-F890 HydrophobicContact CD2-CE1 4.1Å; F841-F890 AromaticContact CD2-CZ 3.76Å; F841-F890 HydrophobicContact CD2-CZ 3.76Å; F841-F890 HydrophobicContact CE1-CZ 4.35Å; F841-F890 HydrophobicContact CE2-CZ 4.22Å; F841-F890 AromaticContact CG-CE1 3.94Å; F841-F890 HydrophobicContact CG-CE1 3.94Å; F841-F890 AromaticContact CG-CZ 3.6Å; F841-F890 HydrophobicContact CG-CZ 3.6Å; V843-F890 HydrophobicContact CG1-CB 4.25Å; V843-F890 HydrophobicContact CG2-CB 4.42Å; V843-F890 HydrophobicContact CG2-CD1 3.65Å; V843-F890 HydrophobicContact CG2-CE1 3.99Å; V843-F890 HydrophobicContact CG2-CG 3.99Å; F848-F890 HydrophobicContact CB-CD1 4.26Å; F848-F890 HydrophobicContact CB-CE1 3.97Å; F848-F890 HydrophobicContact CD1-CD1 4.34Å; F848-F890 AromaticContact CD1-CE1 3.77Å; F848-F890 HydrophobicContact CD1-CE1 3.77Å; F848-F890 HydrophobicContact CD2-CD1 4.22Å; F848-F890 HydrophobicContact CD2-CE1 4.43Å; F848-F890 HydrophobicContact CE1-CE1 4.42Å; F848-F890 HydrophobicContact CG-CD1 4.01Å; F848-F890 AromaticContact CG-CE1 3.79Å; F848-F890 HydrophobicContact CG-CE1 3.79Å; I882-F890 HydrophobicContact CD1-CD2 3.91Å; I882-F890 HydrophobicContact CD1-CE2 3.34Å; I882-F890 HydrophobicContact CD1-CZ 3.73Å; M885-F890 HydrophobicContact CE-CB 3.87Å; M885-F890 HydrophobicContact CE-CD2 3.25Å; M885-F890 HydrophobicContact CE-CE2 4.07Å; M885-F890 HydrophobicContact CE-CG 3.94Å; M885-F890 HydrophobicContact CG-CB 4.4Å; M885-F890 HydrophobicContact SD-CB 4.03Å; M885-F890 HydrophobicContact SD-CD2 4.2Å; K886-F890 PolarHBondContact O-N 2.9Å; K886-F890 VanDerWaalsContact O-N 3.09Å; F890-M892 VanDerWaalsContact C-N 3.32Å; F890-M892 PolarHBondContact O-N 2.71Å; F890-L893 PolarHBondContact O-N 3.03Å; F890-M894 HydrophobicContact CD1-CG 4.27Å; F890-M894 HydrophobicContact CD2-CE 4.37Å; F890-M894 HydrophobicContact CE1-CE 4.5Å; F890-M894 HydrophobicContact CE1-CG 4Å; F890-M894 HydrophobicContact CE1-SD 4.48Å; F890-M894 HydrophobicContact CE2-CE 3.64Å; F890-M894 HydrophobicContact CE2-CG 4.46Å; F890-M894 HydrophobicContact CZ-CE 3.72Å; F890-M894 HydrophobicContact CZ-CG 4.14Å; F890-M894 HydrophobicContact CZ-SD 4.16Å; F890-M894 VanDerWaalsContact O-CG 3.26Å; F890-M894 WeakPolarHBondContact O-CG 3.41Å; F890-M894 PolarHBondContact O-N 3.42Å
891	K	83.5	Confident	78.9	Confident	93 Å²	93	41.8 Å²	41.8	40%	0.404	22%	0.217	S	C	.	.	H	α-helix	trans	-60.2	-42	174.6	-179.6	-177.7	176.4	-171.1	0	111.4	F848 Y887 S888 I889 M894 Q895	F848-K891 HydrophobicContact CE2-CB 4.17Å; F848-K891 HydrophobicContact CE2-CG 4.2Å; Y887-K891 WeakPolarHBondContact O-CB 3.44Å; Y887-K891 PolarHBondContact O-N 2.71Å; S888-K891 WeakPolarHBondContact O-CB 3.44Å; S888-K891 PolarHBondContact O-N 3.01Å; I889-K891 VanDerWaalsContact C-N 3.33Å; I889-K891 PolarHBondContact O-N 2.86Å; K891-M894 PolarHBondContact O-N 2.87Å; K891-Q895 VanDerWaalsContact O-CG 3.32Å; K891-Q895 WeakPolarHBondContact O-CG 3.37Å; K891-Q895 PolarHBondContact O-N 3.07Å
892	M	82.8	Confident	78.4	Confident	17 Å²	17	36.8 Å²	36.8	8%	0.084	20%	0.196	C	C	.	.	H	α-helix	trans	-67.2	-41.1	177.8	-68	171.1	71.6	0	0	112.4	S888 I889 F890 M894 Q895 Y896 M905 I907 L915	S888-M892 WeakPolarHBondContact O-CG 3.39Å; S888-M892 PolarHBondContact O-N 2.98Å; I889-M892 PolarHBondContact O-N 3.32Å; F890-M892 VanDerWaalsContact C-N 3.32Å; F890-M892 PolarHBondContact O-N 2.71Å; M892-M894 VanDerWaalsContact C-N 3.29Å; M892-M894 PolarHBondContact O-N 2.67Å; M892-Q895 WeakPolarHBondContact O-CB 3.18Å; M892-Q895 PolarHBondContact O-N 3.5Å; M892-Q895 VanDerWaalsContact O-N 3.17Å; M892-Y896 PolarHBondContact O-N 3.33Å; M892-M905 HydrophobicContact CB-CE 4.11Å; M892-M905 WeakPolarHBondContact O-CE 3.46Å; M892-I907 HydrophobicContact CE-CB 3.87Å; M892-I907 HydrophobicContact CE-CG1 3.6Å; M892-I907 HydrophobicContact CE-CG2 3.75Å; M892-L915 HydrophobicContact CB-CD1 4.19Å; M892-L915 HydrophobicContact CE-CD2 4.12Å
893	L	84.5	Confident	77.6	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61	-40.5	173.6	-170.6	150.2	0	0	0	111.3	F862 I889 F890 Y896 L897 L915 A918 F922 L924 L927	F862-L893 HydrophobicContact CE2-CD2 4.01Å; F862-L893 HydrophobicContact CZ-CD2 3.97Å; I889-L893 PolarHBondContact O-N 3.44Å; F890-L893 PolarHBondContact O-N 3.03Å; L893-Y896 WeakPolarHBondContact O-CB 3.18Å; L893-Y896 PolarHBondContact O-N 2.84Å; L893-L897 HydrophobicContact CD2-CD1 4.02Å; L893-L897 WeakPolarHBondContact O-CG 3.39Å; L893-L897 PolarHBondContact O-N 2.79Å; L893-L915 HydrophobicContact CB-CD1 4.45Å; L893-A918 HydrophobicContact CD1-CB 3.86Å; L893-F922 HydrophobicContact CD1-CB 4.38Å; L893-F922 HydrophobicContact CD1-CD2 3.56Å; L893-F922 HydrophobicContact CD1-CE2 4.25Å; L893-F922 HydrophobicContact CD1-CG 4.28Å; L893-L924 HydrophobicContact CD1-CD1 4.1Å; L893-L924 HydrophobicContact CD2-CD1 3.85Å; L893-L924 HydrophobicContact CG-CD1 3.82Å; L893-L927 HydrophobicContact CG-CD2 4.29Å
894	M	81.8	Confident	77.3	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-67.8	-38.5	173.9	-67.1	-71	121.6	0	0	112	L831 F848 A850 L855 F862 F890 K891 M892 Y896 L897 Y898	L831-M894 HydrophobicContact CD1-CB 3.98Å; F848-M894 HydrophobicContact CD1-CG 4.22Å; F848-M894 HydrophobicContact CE1-CB 3.8Å; F848-M894 HydrophobicContact CE1-CG 3.48Å; F848-M894 VanDerWaalsContact CE1-CG 3.48Å; F848-M894 HydrophobicContact CE1-SD 4.12Å; F848-M894 HydrophobicContact CZ-CB 3.55Å; F848-M894 HydrophobicContact CZ-CG 3.66Å; A850-M894 HydrophobicContact CB-SD 4.48Å; L855-M894 HydrophobicContact CD2-CE 3.65Å; L855-M894 HydrophobicContact CD2-SD 3.87Å; F862-M894 HydrophobicContact CE1-CE 4.29Å; F862-M894 HydrophobicContact CE2-CE 4.23Å; F862-M894 HydrophobicContact CZ-CE 3.65Å; F890-M894 HydrophobicContact CD1-CG 4.27Å; F890-M894 HydrophobicContact CD2-CE 4.37Å; F890-M894 HydrophobicContact CE1-CE 4.5Å; F890-M894 HydrophobicContact CE1-CG 4Å; F890-M894 HydrophobicContact CE1-SD 4.48Å; F890-M894 HydrophobicContact CE2-CE 3.64Å; F890-M894 HydrophobicContact CE2-CG 4.46Å; F890-M894 HydrophobicContact CZ-CE 3.72Å; F890-M894 HydrophobicContact CZ-CG 4.14Å; F890-M894 HydrophobicContact CZ-SD 4.16Å; F890-M894 VanDerWaalsContact O-CG 3.26Å; F890-M894 WeakPolarHBondContact O-CG 3.41Å; F890-M894 PolarHBondContact O-N 3.42Å; K891-M894 PolarHBondContact O-N 2.87Å; M892-M894 VanDerWaalsContact C-N 3.29Å; M892-M894 PolarHBondContact O-N 2.67Å; M894-Y896 VanDerWaalsContact C-N 3.33Å; M894-Y896 PolarHBondContact O-N 2.96Å; M894-L897 HydrophobicContact CE-CD1 3.82Å; M894-L897 PolarHBondContact O-N 3.33Å; M894-L897 VanDerWaalsContact O-N 3.16Å; M894-L897 HydrophobicContact SD-CD1 4.41Å; M894-Y898 VanDerWaalsContact O-CD2 3.22Å; M894-Y898 WeakPolarHBondContact O-CD2 3.38Å; M894-Y898 PolarHBondContact O-N 3.19Å; M894-Y898 VanDerWaalsContact O-N 3.12Å
895	Q	80.6	Confident	77.3	Confident	43 Å²	43	37.8 Å²	37.8	20%	0.201	19%	0.194	C	C	.	.	H	α-helix	trans	-56.6	-46.8	174	-79.6	173.3	-29	0	0	111.4	L831 K891 M892 L897 Y898 Y899 M905	L831-Q895 HydrophobicContact CD1-CG 4.5Å; L831-Q895 HydrophobicContact CD2-CG 3.56Å; K891-Q895 VanDerWaalsContact O-CG 3.32Å; K891-Q895 WeakPolarHBondContact O-CG 3.37Å; K891-Q895 PolarHBondContact O-N 3.07Å; M892-Q895 WeakPolarHBondContact O-CB 3.18Å; M892-Q895 PolarHBondContact O-N 3.5Å; M892-Q895 VanDerWaalsContact O-N 3.17Å; Q895-L897 VanDerWaalsContact C-N 3.29Å; Q895-L897 PolarHBondContact O-N 3.45Å; Q895-Y898 PolarHBondContact O-N 3.29Å; Q895-Y899 HydrophobicContact CB-CD2 3.83Å; Q895-Y899 HydrophobicContact CB-CE2 3.69Å; Q895-Y899 HydrophobicContact CG-CD2 4.46Å; Q895-Y899 HydrophobicContact CG-CE2 3.82Å; Q895-Y899 WeakPolarHBondContact O-CB 3.41Å; Q895-Y899 WeakPolarHBondContact O-CD2 3.49Å; Q895-Y899 PolarHBondContact O-N 3.04Å; Q895-M905 HydrophobicContact CB-CE 4.4Å
896	Y	80.6	Confident	76.6	Confident	10 Å²	10	45.9 Å²	45.9	4%	0.039	23%	0.231	C	C	.	.	H	α-helix	trans	-54.1	-45.1	175.2	170.5	-105.2	0	0	0	112.6	L822 M892 L893 M894 Y898 G900 T902 M905 L924 L927	L822-Y896 HydrophobicContact CD1-CE1 3.95Å; M892-Y896 PolarHBondContact O-N 3.33Å; L893-Y896 WeakPolarHBondContact O-CB 3.18Å; L893-Y896 PolarHBondContact O-N 2.84Å; M894-Y896 VanDerWaalsContact C-N 3.33Å; M894-Y896 PolarHBondContact O-N 2.96Å; Y896-Y898 PolarHBondContact O-N 3.31Å; Y896-G900 PolarHBondContact O-N 3.08Å; Y896-T902 HydrophobicContact CD2-CG2 3.67Å; Y896-T902 HydrophobicContact CE2-CG2 3.61Å; Y896-M905 HydrophobicContact CD2-SD 4.33Å; Y896-M905 HydrophobicContact CG-SD 4.48Å; Y896-L924 HydrophobicContact CD1-CD1 4.31Å; Y896-L924 HydrophobicContact CE1-CD1 4.48Å; Y896-L927 HydrophobicContact CD1-CB 3.8Å; Y896-L927 HydrophobicContact CD1-CD2 3.98Å; Y896-L927 HydrophobicContact CD1-CG 4.32Å; Y896-L927 HydrophobicContact CD2-CB 4.1Å; Y896-L927 HydrophobicContact CD2-CD1 3.87Å; Y896-L927 HydrophobicContact CD2-CG 4.45Å; Y896-L927 HydrophobicContact CE1-CB 3.69Å; Y896-L927 HydrophobicContact CE2-CB 3.99Å; Y896-L927 HydrophobicContact CE2-CD1 4.45Å; Y896-L927 HydrophobicContact CG-CB 4Å; Y896-L927 HydrophobicContact CG-CD1 3.9Å; Y896-L927 HydrophobicContact CG-CD2 4.03Å; Y896-L927 HydrophobicContact CG-CG 4.19Å; Y896-L927 PolarHBondContact OH-N 3.3Å
897	L	78.6	Confident	76.3	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-68.2	-32.2	-177.6	-65.3	178	0	0	0	113.5	L822 L854 L855 A858 F862 L893 M894 Q895 L924	L822-L897 HydrophobicContact CD1-CD2 4.04Å; L854-L897 HydrophobicContact CD2-CB 3.76Å; L855-L897 HydrophobicContact CD2-CD1 3.69Å; A858-L897 HydrophobicContact CB-CD2 3.59Å; F862-L897 HydrophobicContact CE2-CD1 4.09Å; L893-L897 HydrophobicContact CD2-CD1 4.02Å; L893-L897 WeakPolarHBondContact O-CG 3.39Å; L893-L897 PolarHBondContact O-N 2.79Å; M894-L897 HydrophobicContact CE-CD1 3.82Å; M894-L897 PolarHBondContact O-N 3.33Å; M894-L897 VanDerWaalsContact O-N 3.16Å; M894-L897 HydrophobicContact SD-CD1 4.41Å; Q895-L897 VanDerWaalsContact C-N 3.29Å; Q895-L897 PolarHBondContact O-N 3.45Å; L897-L924 HydrophobicContact CD2-CD1 4.18Å; L897-L924 HydrophobicContact CD2-CD2 3.86Å
898	Y	77.4	Confident	76	Confident	3 Å²	3	43.9 Å²	43.9	1%	0.012	23%	0.231	C	C	.	.	H	α-helix	trans	-85.7	-39.3	178.3	-78.3	-110.4	0	0	0	112.3	L826 F830 L831 H851 L854 M894 Q895 Y896 G900	L826-Y898 HydrophobicContact CB-CD1 4.04Å; L826-Y898 HydrophobicContact CB-CE1 4.26Å; L826-Y898 VanDerWaalsContact O-O 3.06Å; F830-Y898 HydrophobicContact CB-CD1 4.47Å; F830-Y898 HydrophobicContact CB-CE1 4.05Å; L831-Y898 HydrophobicContact CD1-CD2 3.84Å; L831-Y898 HydrophobicContact CD1-CE2 4.14Å; L831-Y898 HydrophobicContact CD1-CG 4.09Å; H851-Y898 PolarHBondContact N-OH 2.99Å; H851-Y898 AromaticContact ND1-CE1 3.7Å; H851-Y898 AromaticContact ND1-CZ 3.61Å; H851-Y898 PolarHBondContact ND1-OH 3.29Å; L854-Y898 HydrophobicContact CD2-CD2 4Å; L854-Y898 HydrophobicContact CD2-CE2 3.86Å; M894-Y898 VanDerWaalsContact O-CD2 3.22Å; M894-Y898 WeakPolarHBondContact O-CD2 3.38Å; M894-Y898 PolarHBondContact O-N 3.19Å; M894-Y898 VanDerWaalsContact O-N 3.12Å; Q895-Y898 PolarHBondContact O-N 3.29Å; Y896-Y898 PolarHBondContact O-N 3.31Å; Y898-G900 PolarHBondContact O-N 3.02Å
899	Y	74.4	Confident	75.5	Confident	87 Å²	87	46.3 Å²	46.3	34%	0.341	24%	0.243	S	C	.	.	H	α-helix	trans	-70.5	-19.9	176.7	-67.9	-57.7	0	0	0	112.7	P828 Q895 G901	P828-Y899 HydrophobicContact CB-CD1 4.01Å; P828-Y899 HydrophobicContact CB-CE1 3.37Å; P828-Y899 HydrophobicContact CG-CD1 3.36Å; P828-Y899 HydrophobicContact CG-CE1 3.22Å; Q895-Y899 HydrophobicContact CB-CD2 3.83Å; Q895-Y899 HydrophobicContact CB-CE2 3.69Å; Q895-Y899 HydrophobicContact CG-CD2 4.46Å; Q895-Y899 HydrophobicContact CG-CE2 3.82Å; Q895-Y899 WeakPolarHBondContact O-CB 3.41Å; Q895-Y899 WeakPolarHBondContact O-CD2 3.49Å; Q895-Y899 PolarHBondContact O-N 3.04Å; Y899-G901 PolarHBondContact O-N 3.28Å
900	G	67	Low	75.2	Confident	4 Å²	4	51.3 Å²	51.3	4%	0.041	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.2	21.2	174.6	0	0	0	0	0	113.9	Y896 Y898	Y896-G900 PolarHBondContact O-N 3.08Å; Y898-G900 PolarHBondContact O-N 3.02Å
901	G	70.5	Confident	75.2	Confident	23 Å²	23	52.7 Å²	52.7	24%	0.237	28%	0.281	C	S	.	.	S	Bend	trans	174.9	176.9	-178.2	0	0	0	0	0	112.2	Y899	Y899-G901 PolarHBondContact O-N 3.28Å
902	T	67.3	Low	75.1	Confident	32 Å²	32	48.5 Å²	48.5	20%	0.196	26%	0.263	C	S	.	.	S	Bend	trans	-103.7	-2.1	-176.8	53.4	0	0	0	0	114.1	Y896 S904 M905 L927 H930	Y896-T902 HydrophobicContact CD2-CG2 3.67Å; Y896-T902 HydrophobicContact CE2-CG2 3.61Å; T902-S904 PolarHBondContact O-N 3.14Å; T902-S904 VanDerWaalsContact O-N 3.13Å; T902-M905 PolarHBondContact O-N 3.45Å; T902-L927 HydrophobicContact CG2-CD1 4.32Å; T902-H930 VanDerWaalsContact CB-CD2 3.48Å; T902-H930 WeakPolarHBondContact CB-CD2 3.35Å; T902-H930 HydrophobicContact CG2-CB 3.63Å; T902-H930 PolarHBondContact OG1-ND1 2.83Å
903	E	62.8	Low	75.1	Confident	178 Å²	178	49.6 Å²	49.6	83%	0.832	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-16.6	-173.2	-62.5	179	174.3	0	0	114.5
904	S	61.8	Low	75.1	Confident	78 Å²	78	52.6 Å²	52.6	55%	0.545	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120	14.9	-176.1	64.6	0	0	0	0	114.3	T902	T902-S904 PolarHBondContact O-N 3.14Å; T902-S904 VanDerWaalsContact O-N 3.13Å
905	M	69.6	Low	75.2	Confident	22 Å²	22	52.6 Å²	52.6	11%	0.108	28%	0.283	C	S	.	.			trans	-104.6	118.4	-177.3	-68.7	-175.9	66.3	0	0	111.6	M892 Q895 Y896 T902 I907	M892-M905 HydrophobicContact CB-CE 4.11Å; M892-M905 WeakPolarHBondContact O-CE 3.46Å; Q895-M905 HydrophobicContact CB-CE 4.4Å; Y896-M905 HydrophobicContact CD2-SD 4.33Å; Y896-M905 HydrophobicContact CG-SD 4.48Å; T902-M905 PolarHBondContact O-N 3.45Å; M905-I907 HydrophobicContact CB-CG1 4.35Å
906	E	67.4	Low	75.4	Confident	190 Å²	190	50.5 Å²	50.5	89%	0.888	27%	0.274	S	S	*	.			trans	-89.3	109.6	166.7	-68.4	-178.3	179.5	0	0	109.1
907	I	77.1	Confident	75.5	Confident	23 Å²	23	51.6 Å²	51.6	12%	0.118	28%	0.283	C	S	.	.			trans	-103.7	115.9	-179	-59	168.8	0	0	0	108.1	M892 M905 I912 L915 L934	M892-I907 HydrophobicContact CE-CB 3.87Å; M892-I907 HydrophobicContact CE-CG1 3.6Å; M892-I907 HydrophobicContact CE-CG2 3.75Å; M905-I907 HydrophobicContact CB-CG1 4.35Å; I907-I912 HydrophobicContact CG2-CB 4.46Å; I907-I912 HydrophobicContact CG2-CG1 3.65Å; I907-L915 HydrophobicContact CD1-CD2 3.64Å; I907-L915 HydrophobicContact CG1-CD2 4.06Å; I907-L915 HydrophobicContact CG2-CD2 3.99Å; I907-L934 HydrophobicContact CB-CD1 4.12Å; I907-L934 HydrophobicContact CD1-CD1 3.69Å; I907-L934 HydrophobicContact CG1-CD1 4.39Å
908	P	77.2	Confident	75.8	Confident	63 Å²	63	51.8 Å²	51.8	41%	0.409	28%	0.284	S	S	.	.			trans	-69	144.5	176.2	24.4	-27.4	0	0	0	111	T910 D911 I912	P908-T910 PolarHBondContact O-N 3.09Å; P908-T910 VanDerWaalsContact O-N 3.14Å; P908-D911 HydrophobicContact CG-CB 3.95Å; P908-D911 PolarHBondContact O-N 3.04Å; P908-I912 PolarHBondContact O-N 3.36Å
909	T	74	Confident	76.1	Confident	103 Å²	103	51.6 Å²	51.6	63%	0.632	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-27.9	-171.7	53	0	0	0	0	114.6	D911 I912 T938	T909-D911 VanDerWaalsContact C-N 3.29Å; T909-D911 PolarHBondContact O-N 3.35Å; T909-I912 HydrophobicContact CG2-CD1 4.38Å; T909-T938 HydrophobicContact CG2-CG2 3.89Å
910	T	77.4	Confident	76.6	Confident	107 Å²	107	48.9 Å²	48.9	66%	0.656	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-26.7	176.3	54	0	0	0	0	113.3	P908	P908-T910 PolarHBondContact O-N 3.09Å; P908-T910 VanDerWaalsContact O-N 3.14Å
911	D	82.2	Confident	77.4	Confident	28 Å²	28	52.9 Å²	52.9	15%	0.15	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-9.6	-168.5	-68.1	11.9	0	0	0	111.4	I889 P908 T909 L913 E914 L915	I889-D911 HydrophobicContact CD1-CB 3.58Å; P908-D911 HydrophobicContact CG-CB 3.95Å; P908-D911 PolarHBondContact O-N 3.04Å; T909-D911 VanDerWaalsContact C-N 3.29Å; T909-D911 PolarHBondContact O-N 3.35Å; D911-L913 PolarHBondContact O-N 3.25Å; D911-E914 PolarHBondContact O-N 3.47Å; D911-L915 VanDerWaalsContact O-CB 3.26Å; D911-L915 WeakPolarHBondContact O-CB 3.44Å; D911-L915 PolarHBondContact O-N 3.15Å
912	I	82.8	Confident	78	Confident	5 Å²	5	51.9 Å²	51.9	3%	0.026	29%	0.286	C	S	.	.	H	α-helix	trans	-58.7	-46.2	-178	-58.4	172.6	0	0	0	111.4	I907 P908 T909 L915 L916 C931 L934 C935 T938	I907-I912 HydrophobicContact CG2-CB 4.46Å; I907-I912 HydrophobicContact CG2-CG1 3.65Å; P908-I912 PolarHBondContact O-N 3.36Å; T909-I912 HydrophobicContact CG2-CD1 4.38Å; I912-L915 PolarHBondContact O-N 2.83Å; I912-L916 WeakPolarHBondContact O-CB 3.34Å; I912-L916 PolarHBondContact O-N 3.23Å; I912-C931 HydrophobicContact CG2-CB 4.44Å; I912-L934 HydrophobicContact CD1-CB 4.08Å; I912-L934 HydrophobicContact CG2-CB 4.41Å; I912-C935 WeakPolarHBondContact CG2-SG 3.34Å; I912-T938 HydrophobicContact CD1-CG2 4.19Å
913	L	83.3	Confident	78.7	Confident	41 Å²	41	55.7 Å²	55.7	22%	0.215	30%	0.302	C	S	.	.	H	α-helix	trans	-68.9	-38.8	-177.8	-67.8	177.3	0	0	0	112.4	D911 L916 S917 I947 Y950	D911-L913 PolarHBondContact O-N 3.25Å; L913-L916 PolarHBondContact O-N 3Å; L913-S917 PolarHBondContact O-N 3.09Å; L913-I947 HydrophobicContact CD2-CG1 4.17Å; L913-Y950 HydrophobicContact CD1-CD2 4.12Å; L913-Y950 HydrophobicContact CD1-CE2 4.32Å; L913-Y950 HydrophobicContact CD2-CD2 4.41Å; L913-Y950 HydrophobicContact CD2-CG 4.25Å
914	E	82.9	Confident	79.7	Confident	62 Å²	62	47.4 Å²	47.4	29%	0.29	26%	0.263	S	S	.	.	H	α-helix	trans	-69	-37.7	175	-67	-175.1	-177.2	0	0	110.8	K886 I889 D911 S917 A918	K886-E914 WeakPolarHBondContact CD-OE2 3.4Å; K886-E914 WeakPolarHBondContact CE-OE2 3.44Å; K886-E914 IonicContact NZ-OE1 2.68Å; K886-E914 PolarHBondContact NZ-OE1 3.44Å; K886-E914 IonicContact NZ-OE2 2.82Å; K886-E914 PolarHBondContact NZ-OE2 3.05Å; I889-E914 HydrophobicContact CD1-CB 3.96Å; I889-E914 HydrophobicContact CG1-CB 4.07Å; D911-E914 PolarHBondContact O-N 3.47Å; E914-S917 PolarHBondContact O-N 3.36Å; E914-S917 PolarHBondContact O-OG 2.85Å; E914-A918 PolarHBondContact O-N 3.19Å
915	L	84.7	Confident	80.6	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-66.9	-38.3	174.2	-173.1	65.1	0	0	0	112.2	I889 M892 L893 I907 D911 I912 S917 A918 A919 L927	I889-L915 HydrophobicContact CG2-CB 4.4Å; I889-L915 HydrophobicContact CG2-CD1 4.02Å; M892-L915 HydrophobicContact CB-CD1 4.19Å; M892-L915 HydrophobicContact CE-CD2 4.12Å; L893-L915 HydrophobicContact CB-CD1 4.45Å; I907-L915 HydrophobicContact CD1-CD2 3.64Å; I907-L915 HydrophobicContact CG1-CD2 4.06Å; I907-L915 HydrophobicContact CG2-CD2 3.99Å; D911-L915 VanDerWaalsContact O-CB 3.26Å; D911-L915 WeakPolarHBondContact O-CB 3.44Å; D911-L915 PolarHBondContact O-N 3.15Å; I912-L915 PolarHBondContact O-N 2.83Å; L915-S917 VanDerWaalsContact C-N 3.32Å; L915-S917 PolarHBondContact O-N 3.41Å; L915-A918 PolarHBondContact O-N 3.5Å; L915-A919 WeakPolarHBondContact O-CB 3.49Å; L915-A919 PolarHBondContact O-N 3.4Å; L915-L927 HydrophobicContact CD1-CD2 4.3Å; L915-L927 HydrophobicContact CD2-CD1 4.46Å
916	L	83.7	Confident	81.1	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60	-44.5	172.5	-178.1	72.2	0	0	0	110.7	I912 L913 A918 A919 S920 Q928 C931 E932 L959	I912-L916 WeakPolarHBondContact O-CB 3.34Å; I912-L916 PolarHBondContact O-N 3.23Å; L913-L916 PolarHBondContact O-N 3Å; L916-A918 VanDerWaalsContact C-N 3.32Å; L916-A918 PolarHBondContact O-N 2.83Å; L916-A919 PolarHBondContact O-N 3.44Å; L916-S920 PolarHBondContact O-N 3.39Å; L916-Q928 HydrophobicContact CD1-CG 3.91Å; L916-C931 HydrophobicContact CB-CB 4.19Å; L916-C931 HydrophobicContact CD1-CB 3.85Å; L916-E932 HydrophobicContact CD1-CG 4.2Å; L916-L959 HydrophobicContact CD2-CD2 3.96Å
917	S	84.4	Confident	81.7	Confident	33 Å²	33	38 Å²	38	23%	0.231	22%	0.215	C	C	.	.	H	α-helix	trans	-60.7	-42.2	176.6	79	0	0	0	0	112.1	L913 E914 L915 L921 H954	L913-S917 PolarHBondContact O-N 3.09Å; E914-S917 PolarHBondContact O-N 3.36Å; E914-S917 PolarHBondContact O-OG 2.85Å; L915-S917 VanDerWaalsContact C-N 3.32Å; L915-S917 PolarHBondContact O-N 3.41Å; S917-L921 WeakPolarHBondContact O-CB 3.49Å; S917-L921 PolarHBondContact O-N 2.85Å; S917-H954 WeakPolarHBondContact CB-CE1 3.14Å; S917-H954 WeakPolarHBondContact CB-NE2 3.33Å
918	A	83.8	Confident	82	Confident	5 Å²	5	37.9 Å²	37.9	4%	0.041	22%	0.215	C	C	.	.	H	α-helix	trans	-68.4	-43	176.9	0	0	0	0	0	111.7	M885 I889 L893 E914 L915 L916 S920 L921 F922	M885-A918 HydrophobicContact SD-CB 3.7Å; I889-A918 HydrophobicContact CG2-CB 3.92Å; L893-A918 HydrophobicContact CD1-CB 3.86Å; E914-A918 PolarHBondContact O-N 3.19Å; L915-A918 PolarHBondContact O-N 3.5Å; L916-A918 VanDerWaalsContact C-N 3.32Å; L916-A918 PolarHBondContact O-N 2.83Å; A918-S920 VanDerWaalsContact C-N 3.32Å; A918-S920 PolarHBondContact O-N 3.12Å; A918-L921 PolarHBondContact O-N 3.14Å; A918-F922 WeakPolarHBondContact O-CD2 3.46Å; A918-F922 PolarHBondContact O-N 3.29Å
919	A	84.8	Confident	82.3	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.2	-41.8	178.3	0	0	0	0	0	111.8	L915 L916 F922 Q923 L924 L927 Q928	L915-A919 WeakPolarHBondContact O-CB 3.49Å; L915-A919 PolarHBondContact O-N 3.4Å; L916-A919 PolarHBondContact O-N 3.44Å; A919-F922 CarbonylContact O-C 3.55Å; A919-Q923 PolarHBondContact O-N 3.28Å; A919-L924 PolarHBondContact O-N 3.02Å; A919-L927 HydrophobicContact CB-CB 4.32Å; A919-L927 HydrophobicContact CB-CD2 4.1Å; A919-L927 HydrophobicContact CB-CG 4.07Å; A919-Q928 HydrophobicContact CB-CB 4.1Å
920	S	84.2	Confident	82.7	Confident	30 Å²	30	32.1 Å²	32.1	21%	0.21	17%	0.174	C	C	.	.	H	α-helix	trans	-65.6	-47.1	173.6	176.6	0	0	0	0	111.8	L916 A918 F922 Q923 H954	L916-S920 PolarHBondContact O-N 3.39Å; A918-S920 VanDerWaalsContact C-N 3.32Å; A918-S920 PolarHBondContact O-N 3.12Å; S920-F922 PolarHBondContact O-N 3.17Å; S920-Q923 PolarHBondContact O-N 3.14Å; S920-H954 PolarHBondContact OG-O 3.47Å
921	L	84.2	Confident	82.9	Confident	88 Å²	88	27 Å²	27	46%	0.461	14%	0.143	S	C	.	.	H	α-helix	trans	-58.1	-36.6	178.8	-169.6	152	0	0	0	112.4	R861 S917 A918	R861-L921 WeakPolarHBondContact CG-O 3.37Å; S917-L921 WeakPolarHBondContact O-CB 3.49Å; S917-L921 PolarHBondContact O-N 2.85Å; A918-L921 PolarHBondContact O-N 3.14Å
922	F	83.2	Confident	83	Confident	1 Å²	1	25.9 Å²	25.9	0%	0.004	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	8.7	177.5	-66.7	-75.9	0	0	0	114.1	S859 F862 L865 I882 M885 L893 A918 A919 S920 L924	S859-F922 VanDerWaalsContact CB-O 3.29Å; S859-F922 WeakPolarHBondContact CB-O 3.29Å; S859-F922 PolarHBondContact OG-O 2.85Å; F862-F922 HydrophobicContact CD1-CD1 4.02Å; F862-F922 HydrophobicContact CD1-CE1 4.09Å; F862-F922 HydrophobicContact CD2-CD1 4.13Å; F862-F922 AromaticContact CE1-CD1 3.47Å; F862-F922 HydrophobicContact CE1-CD1 3.47Å; F862-F922 VanDerWaalsContact CE1-CD1 3.47Å; F862-F922 AromaticContact CE1-CE1 3.35Å; F862-F922 HydrophobicContact CE1-CE1 3.35Å; F862-F922 HydrophobicContact CE1-CG 4.4Å; F862-F922 HydrophobicContact CE1-CZ 4.23Å; F862-F922 HydrophobicContact CE2-CB 3.94Å; F862-F922 AromaticContact CE2-CD1 3.57Å; F862-F922 HydrophobicContact CE2-CD1 3.57Å; F862-F922 HydrophobicContact CE2-CE1 4.28Å; F862-F922 AromaticContact CE2-CG 3.85Å; F862-F922 HydrophobicContact CE2-CG 3.85Å; F862-F922 HydrophobicContact CG-CD1 4.31Å; F862-F922 HydrophobicContact CZ-CB 4.31Å; F862-F922 AromaticContact CZ-CD1 3.19Å; F862-F922 HydrophobicContact CZ-CD1 3.19Å; F862-F922 HydrophobicContact CZ-CD2 4.33Å; F862-F922 AromaticContact CZ-CE1 3.45Å; F862-F922 HydrophobicContact CZ-CE1 3.45Å; F862-F922 VanDerWaalsContact CZ-CE1 3.45Å; F862-F922 AromaticContact CZ-CG 3.7Å; F862-F922 HydrophobicContact CZ-CG 3.7Å; F862-F922 HydrophobicContact CZ-CZ 4.15Å; L865-F922 HydrophobicContact CD1-CE1 4.08Å; I882-F922 HydrophobicContact CD1-CZ 4.18Å; M885-F922 HydrophobicContact CE-CE2 3.57Å; M885-F922 HydrophobicContact CE-CZ 3.98Å; M885-F922 HydrophobicContact SD-CE2 4.34Å; L893-F922 HydrophobicContact CD1-CB 4.38Å; L893-F922 HydrophobicContact CD1-CD2 3.56Å; L893-F922 HydrophobicContact CD1-CE2 4.25Å; L893-F922 HydrophobicContact CD1-CG 4.28Å; A918-F922 WeakPolarHBondContact O-CD2 3.46Å; A918-F922 PolarHBondContact O-N 3.29Å; A919-F922 CarbonylContact O-C 3.55Å; S920-F922 PolarHBondContact O-N 3.17Å; F922-L924 HydrophobicContact CB-CD1 4.35Å; F922-L924 HydrophobicContact CB-CG 4.28Å; F922-L924 PolarHBondContact O-N 2.91Å
923	Q	81.9	Confident	83	Confident	112 Å²	112	27 Å²	27	52%	0.523	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	46.7	176.6	-59.4	177.3	-13.6	0	0	113.8	A919 S920	A919-Q923 PolarHBondContact O-N 3.28Å; S920-Q923 PolarHBondContact O-N 3.14Å
924	L	83.5	Confident	83	Confident	5 Å²	5	26.7 Å²	26.7	3%	0.026	14%	0.141	C	C	.	.			trans	-102.2	81	179.7	-64.2	175.9	0	0	0	111.1	L893 Y896 L897 A919 F922 G926 L927 Q928	L893-L924 HydrophobicContact CD1-CD1 4.1Å; L893-L924 HydrophobicContact CD2-CD1 3.85Å; L893-L924 HydrophobicContact CG-CD1 3.82Å; Y896-L924 HydrophobicContact CD1-CD1 4.31Å; Y896-L924 HydrophobicContact CE1-CD1 4.48Å; L897-L924 HydrophobicContact CD2-CD1 4.18Å; L897-L924 HydrophobicContact CD2-CD2 3.86Å; A919-L924 PolarHBondContact O-N 3.02Å; F922-L924 HydrophobicContact CB-CD1 4.35Å; F922-L924 HydrophobicContact CB-CG 4.28Å; F922-L924 PolarHBondContact O-N 2.91Å; L924-G926 VanDerWaalsContact C-N 3.3Å; L924-G926 PolarHBondContact O-N 3.48Å; L924-G926 VanDerWaalsContact O-N 3.16Å; L924-L927 HydrophobicContact CB-CB 4.17Å; L924-L927 HydrophobicContact CD1-CD2 4.26Å; L924-L927 PolarHBondContact O-N 2.72Å; L924-L927 VanDerWaalsContact O-N 3.17Å; L924-Q928 WeakPolarHBondContact O-CB 3.47Å; L924-Q928 PolarHBondContact O-N 2.78Å
925	D	79.6	Confident	82.9	Confident	82 Å²	82	23.8 Å²	23.8	44%	0.439	13%	0.128	S	C	.	.	H	α-helix	trans	-52.4	-41.6	-174	-50.2	-23	0	0	0	114.1	K820 R929	K820-D925 IonicContact NZ-OD2 3.6Å; K820-D925 PolarHBondContact NZ-OD2 2.88Å; D925-R929 VanDerWaalsContact O-CB 3.32Å; D925-R929 WeakPolarHBondContact O-CB 3.46Å; D925-R929 PolarHBondContact O-N 2.94Å
926	G	79.9	Confident	82.8	Confident	9 Å²	9	24.6 Å²	24.6	9%	0.093	13%	0.134	C	C	.	.	H	α-helix	trans	-69.6	-38.2	-176.8	0	0	0	0	0	113.2	L924 H930	L924-G926 VanDerWaalsContact C-N 3.3Å; L924-G926 PolarHBondContact O-N 3.48Å; L924-G926 VanDerWaalsContact O-N 3.16Å; G926-H930 PolarHBondContact O-N 2.94Å
927	L	81.8	Confident	82.7	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-73.6	-41.5	175.5	-178.7	61.6	0	0	0	110.7	L893 Y896 T902 L915 A919 L924 R929 H930 C931	L893-L927 HydrophobicContact CG-CD2 4.29Å; Y896-L927 HydrophobicContact CD1-CB 3.8Å; Y896-L927 HydrophobicContact CD1-CD2 3.98Å; Y896-L927 HydrophobicContact CD1-CG 4.32Å; Y896-L927 HydrophobicContact CD2-CB 4.1Å; Y896-L927 HydrophobicContact CD2-CD1 3.87Å; Y896-L927 HydrophobicContact CD2-CG 4.45Å; Y896-L927 HydrophobicContact CE1-CB 3.69Å; Y896-L927 HydrophobicContact CE2-CB 3.99Å; Y896-L927 HydrophobicContact CE2-CD1 4.45Å; Y896-L927 HydrophobicContact CG-CB 4Å; Y896-L927 HydrophobicContact CG-CD1 3.9Å; Y896-L927 HydrophobicContact CG-CD2 4.03Å; Y896-L927 HydrophobicContact CG-CG 4.19Å; Y896-L927 PolarHBondContact OH-N 3.3Å; T902-L927 HydrophobicContact CG2-CD1 4.32Å; L915-L927 HydrophobicContact CD1-CD2 4.3Å; L915-L927 HydrophobicContact CD2-CD1 4.46Å; A919-L927 HydrophobicContact CB-CB 4.32Å; A919-L927 HydrophobicContact CB-CD2 4.1Å; A919-L927 HydrophobicContact CB-CG 4.07Å; L924-L927 HydrophobicContact CB-CB 4.17Å; L924-L927 HydrophobicContact CD1-CD2 4.26Å; L924-L927 PolarHBondContact O-N 2.72Å; L924-L927 VanDerWaalsContact O-N 3.17Å; L927-R929 VanDerWaalsContact C-N 3.3Å; L927-R929 PolarHBondContact O-N 3.22Å; L927-H930 PolarHBondContact O-N 2.91Å; L927-C931 PolarHBondContact O-N 3.03Å; L927-C931 PolarHBondContact O-SG 3.12Å
928	Q	83.1	Confident	82.5	Confident	22 Å²	22	32.4 Å²	32.4	10%	0.103	17%	0.171	C	C	.	.	H	α-helix	trans	-54.6	-50.1	173.8	-179.6	177.3	-17.8	0	0	109.8	L916 A919 L924 H930 C931 E932	L916-Q928 HydrophobicContact CD1-CG 3.91Å; A919-Q928 HydrophobicContact CB-CB 4.1Å; L924-Q928 WeakPolarHBondContact O-CB 3.47Å; L924-Q928 PolarHBondContact O-N 2.78Å; Q928-H930 VanDerWaalsContact C-N 3.34Å; Q928-H930 PolarHBondContact O-N 2.95Å; Q928-C931 WeakPolarHBondContact O-CB 3.46Å; Q928-C931 PolarHBondContact O-N 3.16Å; Q928-C931 VanDerWaalsContact O-N 3.11Å; Q928-E932 PolarHBondContact NE2-OE1 2.78Å; Q928-E932 VanDerWaalsContact O-CG 3.31Å; Q928-E932 WeakPolarHBondContact O-CG 3.31Å; Q928-E932 PolarHBondContact O-N 2.8Å
929	R	82.8	Confident	82.5	Confident	8 Å²	8	33.5 Å²	33.5	3%	0.03	18%	0.175	C	C	.	.	H	α-helix	trans	-59.7	-40.1	179.2	-173.5	50.3	158.5	-146	-0.7	114.2	P816 I818 D925 L927 E932 I933 E958	P816-R929 VanDerWaalsContact CG-NH2 3.28Å; P816-R929 PolarHBondContact O-NE 2.77Å; P816-R929 PolarHBondContact O-NH2 3.26Å; I818-R929 HydrophobicContact CB-CB 4.42Å; I818-R929 HydrophobicContact CB-CG 4.1Å; I818-R929 HydrophobicContact CD1-CB 4.32Å; I818-R929 HydrophobicContact CD1-CG 4.08Å; I818-R929 HydrophobicContact CG1-CG 4Å; D925-R929 VanDerWaalsContact O-CB 3.32Å; D925-R929 WeakPolarHBondContact O-CB 3.46Å; D925-R929 PolarHBondContact O-N 2.94Å; L927-R929 VanDerWaalsContact C-N 3.3Å; L927-R929 PolarHBondContact O-N 3.22Å; R929-E932 WeakPolarHBondContact CD-OE2 3.17Å; R929-E932 IonicContact CZ-OE2 3.8Å; R929-E932 IonicContact NE-OE2 3.05Å; R929-E932 IonicContact NH1-OE2 4Å; R929-E932 PolarHBondContact NH1-OE2 2.95Å; R929-E932 WeakPolarHBondContact O-CB 3.18Å; R929-E932 PolarHBondContact O-N 2.97Å; R929-I933 WeakPolarHBondContact O-CG1 3.35Å; R929-I933 PolarHBondContact O-N 3.32Å; R929-I933 VanDerWaalsContact O-N 3.15Å; R929-E958 IonicContact CZ-OE1 3.48Å; R929-E958 IonicContact NH1-OE1 3.23Å; R929-E958 PolarHBondContact NH1-OE1 3.36Å; R929-E958 IonicContact NH1-OE2 2.9Å; R929-E958 PolarHBondContact NH1-OE2 3.36Å; R929-E958 IonicContact NH2-OE1 3.2Å
930	H	81.9	Confident	82.4	Confident	36 Å²	36	35.6 Å²	35.6	17%	0.167	19%	0.19	C	C	.	.	H	α-helix	trans	-69.3	-37.7	176.9	-175	68.4	0	0	0	112.1	T902 G926 L927 Q928 E932 I933 L934	T902-H930 VanDerWaalsContact CB-CD2 3.48Å; T902-H930 WeakPolarHBondContact CB-CD2 3.35Å; T902-H930 HydrophobicContact CG2-CB 3.63Å; T902-H930 PolarHBondContact OG1-ND1 2.83Å; G926-H930 PolarHBondContact O-N 2.94Å; L927-H930 PolarHBondContact O-N 2.91Å; Q928-H930 VanDerWaalsContact C-N 3.34Å; Q928-H930 PolarHBondContact O-N 2.95Å; H930-E932 VanDerWaalsContact C-N 3.28Å; H930-E932 PolarHBondContact O-N 3.14Å; H930-I933 PolarHBondContact O-N 3.19Å; H930-L934 PolarHBondContact O-N 3.26Å; H930-L934 VanDerWaalsContact O-N 3.07Å
931	C	82.1	Confident	82	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.8	-36.3	172	-62.3	0	0	0	0	111.4	I912 L916 L927 Q928 L934 C935	I912-C931 HydrophobicContact CG2-CB 4.44Å; L916-C931 HydrophobicContact CB-CB 4.19Å; L916-C931 HydrophobicContact CD1-CB 3.85Å; L927-C931 PolarHBondContact O-N 3.03Å; L927-C931 PolarHBondContact O-SG 3.12Å; Q928-C931 WeakPolarHBondContact O-CB 3.46Å; Q928-C931 PolarHBondContact O-N 3.16Å; Q928-C931 VanDerWaalsContact O-N 3.11Å; C931-L934 PolarHBondContact O-N 3.5Å; C931-C935 WeakPolarHBondContact O-CB 3.37Å; C931-C935 PolarHBondContact O-N 3.06Å; C931-C935 PolarHBondContact O-SG 3.42Å
932	E	84.3	Confident	81.7	Confident	4 Å²	4	39.8 Å²	39.8	2%	0.019	21%	0.205	C	C	.	.	H	α-helix	trans	-61.6	-42.3	174	-65.6	170.1	-175.9	0	0	112.2	I815 L916 Q928 R929 H930 C935 A936 A956 L959	I815-E932 HydrophobicContact CD1-CB 4.12Å; I815-E932 HydrophobicContact CG2-CB 4.41Å; L916-E932 HydrophobicContact CD1-CG 4.2Å; Q928-E932 PolarHBondContact NE2-OE1 2.78Å; Q928-E932 VanDerWaalsContact O-CG 3.31Å; Q928-E932 WeakPolarHBondContact O-CG 3.31Å; Q928-E932 PolarHBondContact O-N 2.8Å; R929-E932 WeakPolarHBondContact CD-OE2 3.17Å; R929-E932 IonicContact CZ-OE2 3.8Å; R929-E932 IonicContact NE-OE2 3.05Å; R929-E932 IonicContact NH1-OE2 4Å; R929-E932 PolarHBondContact NH1-OE2 2.95Å; R929-E932 WeakPolarHBondContact O-CB 3.18Å; R929-E932 PolarHBondContact O-N 2.97Å; H930-E932 VanDerWaalsContact C-N 3.28Å; H930-E932 PolarHBondContact O-N 3.14Å; E932-C935 WeakPolarHBondContact O-CB 3.46Å; E932-C935 PolarHBondContact O-N 3.44Å; E932-A936 PolarHBondContact O-N 3.02Å; E932-A956 HydrophobicContact CG-CB 4.26Å; E932-A956 WeakPolarHBondContact OE1-CB 3.31Å; E932-L959 HydrophobicContact CB-CB 3.95Å; E932-L959 HydrophobicContact CG-CB 3.72Å; E932-L959 HydrophobicContact CG-CD2 4.22Å
933	I	83.9	Confident	81.6	Confident	28 Å²	28	43.6 Å²	43.6	14%	0.144	23%	0.225	C	C	.	.	H	α-helix	trans	-64.2	-46.7	177.1	-65.9	165.4	0	0	0	110.9	I815 E817 R929 H930 C935 A936 E937	I815-I933 HydrophobicContact CB-CG1 4.06Å; I815-I933 HydrophobicContact CG2-CG1 3.85Å; E817-I933 HydrophobicContact CB-CD1 4.44Å; E817-I933 HydrophobicContact CG-CD1 3.58Å; R929-I933 WeakPolarHBondContact O-CG1 3.35Å; R929-I933 PolarHBondContact O-N 3.32Å; R929-I933 VanDerWaalsContact O-N 3.15Å; H930-I933 PolarHBondContact O-N 3.19Å; I933-C935 VanDerWaalsContact C-N 3.32Å; I933-C935 PolarHBondContact O-N 3.17Å; I933-A936 WeakPolarHBondContact O-CB 3.18Å; I933-A936 PolarHBondContact O-N 2.84Å; I933-E937 PolarHBondContact O-N 3.14Å; I933-E937 VanDerWaalsContact O-N 3.08Å
934	L	81.5	Confident	81.6	Confident	35 Å²	35	38.3 Å²	38.3	18%	0.183	20%	0.2	C	C	.	.	H	α-helix	trans	-64.8	-36.1	177.5	-66.3	175.3	0	0	0	112.2	I907 I912 H930 C931 A936 E937 T938	I907-L934 HydrophobicContact CB-CD1 4.12Å; I907-L934 HydrophobicContact CD1-CD1 3.69Å; I907-L934 HydrophobicContact CG1-CD1 4.39Å; I912-L934 HydrophobicContact CD1-CB 4.08Å; I912-L934 HydrophobicContact CG2-CB 4.41Å; H930-L934 PolarHBondContact O-N 3.26Å; H930-L934 VanDerWaalsContact O-N 3.07Å; C931-L934 PolarHBondContact O-N 3.5Å; L934-A936 VanDerWaalsContact C-N 3.31Å; L934-A936 PolarHBondContact O-N 3.15Å; L934-E937 PolarHBondContact O-N 3.34Å; L934-T938 WeakPolarHBondContact O-CB 3.34Å; L934-T938 WeakPolarHBondContact O-CG2 3.36Å; L934-T938 PolarHBondContact O-N 3.08Å; L934-T938 VanDerWaalsContact O-N 3.11Å; L934-T938 PolarHBondContact O-OG1 3.39Å
935	C	81.9	Confident	81.6	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.014	20%	0.199	C	C	.	.	H	α-helix	trans	-62.1	-37.8	170.9	-78.9	0	0	0	0	112.1	I912 C931 E932 I933 T938 I939 I947 L959	I912-C935 WeakPolarHBondContact CG2-SG 3.34Å; C931-C935 WeakPolarHBondContact O-CB 3.37Å; C931-C935 PolarHBondContact O-N 3.06Å; C931-C935 PolarHBondContact O-SG 3.42Å; E932-C935 WeakPolarHBondContact O-CB 3.46Å; E932-C935 PolarHBondContact O-N 3.44Å; I933-C935 VanDerWaalsContact C-N 3.32Å; I933-C935 PolarHBondContact O-N 3.17Å; C935-T938 WeakPolarHBondContact CA-OG1 3.22Å; C935-T938 PolarHBondContact O-N 2.86Å; C935-T938 PolarHBondContact O-OG1 2.89Å; C935-I939 PolarHBondContact O-N 2.96Å; C935-I947 HydrophobicContact CB-CG2 4.11Å; C935-L959 HydrophobicContact CB-CD1 3.67Å; C935-L959 HydrophobicContact CB-CD2 3.91Å; C935-L959 HydrophobicContact CB-CG 4.47Å
936	A	81.7	Confident	81.7	Confident	16 Å²	16	38 Å²	38	13%	0.132	20%	0.199	C	C	.	.	H	α-helix	trans	-67.9	-34.8	177.7	0	0	0	0	0	112.5	I815 E932 I933 L934 I939 F962	I815-A936 HydrophobicContact CD1-CB 3.89Å; E932-A936 PolarHBondContact O-N 3.02Å; I933-A936 WeakPolarHBondContact O-CB 3.18Å; I933-A936 PolarHBondContact O-N 2.84Å; L934-A936 VanDerWaalsContact C-N 3.31Å; L934-A936 PolarHBondContact O-N 3.15Å; A936-I939 WeakPolarHBondContact O-CG2 3.31Å; A936-F962 HydrophobicContact CB-CD1 3.67Å; A936-F962 HydrophobicContact CB-CD2 4.36Å; A936-F962 HydrophobicContact CB-CE1 3.45Å; A936-F962 VanDerWaalsContact CB-CE1 3.45Å; A936-F962 HydrophobicContact CB-CE2 4.18Å; A936-F962 HydrophobicContact CB-CG 4.13Å; A936-F962 HydrophobicContact CB-CZ 3.73Å
937	E	82.4	Confident	81.9	Confident	148 Å²	148	37.9 Å²	37.9	69%	0.692	20%	0.196	S	C	*	.	H	α-helix	trans	-74.6	-29.4	176.4	-68.4	178.9	174.2	0	0	113.3	I933 L934	I933-E937 PolarHBondContact O-N 3.14Å; I933-E937 VanDerWaalsContact O-N 3.08Å; L934-E937 PolarHBondContact O-N 3.34Å
938	T	80.4	Confident	81.9	Confident	50 Å²	50	37.9 Å²	37.9	31%	0.307	20%	0.196	S	C	.	.	S	Bend	trans	-95.6	2.7	-176.2	54.4	0	0	0	0	113.7	T909 I912 L934 C935 S940	T909-T938 HydrophobicContact CG2-CG2 3.89Å; I912-T938 HydrophobicContact CD1-CG2 4.19Å; L934-T938 WeakPolarHBondContact O-CB 3.34Å; L934-T938 WeakPolarHBondContact O-CG2 3.36Å; L934-T938 PolarHBondContact O-N 3.08Å; L934-T938 VanDerWaalsContact O-N 3.11Å; L934-T938 PolarHBondContact O-OG1 3.39Å; C935-T938 WeakPolarHBondContact CA-OG1 3.22Å; C935-T938 PolarHBondContact O-N 2.86Å; C935-T938 PolarHBondContact O-OG1 2.89Å; T938-S940 PolarHBondContact O-N 3.35Å
939	I	83.2	Confident	81.9	Confident	27 Å²	27	40.3 Å²	40.3	14%	0.138	21%	0.206	C	C	.	.			trans	-64.4	128	-177.8	-159.3	164.4	0	0	0	111	C935 A936 I947 F962 F966	C935-I939 PolarHBondContact O-N 2.96Å; A936-I939 WeakPolarHBondContact O-CG2 3.31Å; I939-I947 HydrophobicContact CB-CD1 4.46Å; I939-I947 HydrophobicContact CG1-CD1 4.21Å; I939-F962 HydrophobicContact CG2-CE1 4.15Å; I939-F966 HydrophobicContact CD1-CB 3.95Å; I939-F966 HydrophobicContact CD1-CD1 3.78Å; I939-F966 HydrophobicContact CD1-CD2 4.29Å; I939-F966 HydrophobicContact CD1-CE1 4.37Å; I939-F966 HydrophobicContact CD1-CG 3.74Å; I939-F966 HydrophobicContact CG1-CD1 4.09Å; I939-F966 HydrophobicContact CG1-CD2 4.49Å; I939-F966 HydrophobicContact CG1-CE1 4.17Å; I939-F966 HydrophobicContact CG1-CG 4.26Å; I939-F966 HydrophobicContact CG1-CZ 4.41Å; I939-F966 HydrophobicContact CG2-CD2 3.8Å; I939-F966 HydrophobicContact CG2-CE2 3.79Å; I939-F966 HydrophobicContact CG2-CG 4.35Å; I939-F966 HydrophobicContact CG2-CZ 4.33Å
940	S	81.9	Confident	81.8	Confident	44 Å²	44	44.3 Å²	44.3	31%	0.308	22%	0.222	S	C	.	.			trans	-132.2	165.1	176.2	75	0	0	0	0	109.8	T938 E942 N943 S944	T938-S940 PolarHBondContact O-N 3.35Å; S940-E942 PolarHBondContact O-N 2.81Å; S940-N943 PolarHBondContact O-N 3.27Å; S940-N943 PolarHBondContact OG-N 3.16Å; S940-S944 VanDerWaalsContact O-CB 3.28Å; S940-S944 WeakPolarHBondContact O-CB 3.12Å; S940-S944 PolarHBondContact O-N 2.93Å
941	M	76.4	Confident	81.9	Confident	60 Å²	60	42.6 Å²	42.6	30%	0.296	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-41	-179.7	-59.7	-64.6	-116	0	0	111.8	S944 F966 H970 L974 Q977	M941-S944 PolarHBondContact O-OG 2.99Å; M941-S944 VanDerWaalsContact O-OG 3.04Å; M941-F966 HydrophobicContact SD-CE1 4.24Å; M941-F966 HydrophobicContact SD-CZ 4.11Å; M941-H970 HydrophobicContact CE-CB 3.93Å; M941-H970 HydrophobicContact SD-CB 3.93Å; M941-L974 HydrophobicContact CB-CD2 4.47Å; M941-L974 HydrophobicContact SD-CD2 4.07Å; M941-L974 HydrophobicContact SD-CG 4.29Å; M941-Q977 PolarHBondContact O-OE1 3.47Å; M941-Q977 VanDerWaalsContact O-OE1 3.06Å
942	E	77.6	Confident	81.9	Confident	147 Å²	147	45.5 Å²	45.5	69%	0.687	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-34.6	-177.8	-61	179	178.3	0	0	113.6	S940	S940-E942 PolarHBondContact O-N 2.81Å
943	N	82.8	Confident	81.9	Confident	81 Å²	81	50.7 Å²	50.7	43%	0.433	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-16.5	-174	-69.4	-14.1	0	0	0	113.9	S940 V945 N946 I947	S940-N943 PolarHBondContact O-N 3.27Å; S940-N943 PolarHBondContact OG-N 3.16Å; N943-V945 PolarHBondContact O-N 3.01Å; N943-N946 PolarHBondContact O-N 2.59Å; N943-N946 VanDerWaalsContact O-N 3.12Å; N943-I947 HydrophobicContact CB-CD1 4.09Å; N943-I947 WeakPolarHBondContact O-CG1 3.21Å; N943-I947 PolarHBondContact O-N 2.61Å
944	S	81.8	Confident	81.7	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-54.6	-43.9	-173.2	63.5	0	0	0	0	114.3	S940 M941 N946 I947 Y948	S940-S944 VanDerWaalsContact O-CB 3.28Å; S940-S944 WeakPolarHBondContact O-CB 3.12Å; S940-S944 PolarHBondContact O-N 2.93Å; M941-S944 PolarHBondContact O-OG 2.99Å; M941-S944 VanDerWaalsContact O-OG 3.04Å; S944-N946 VanDerWaalsContact C-N 3.35Å; S944-N946 PolarHBondContact O-N 3.44Å; S944-I947 PolarHBondContact O-N 3.35Å; S944-Y948 WeakPolarHBondContact O-CB 3.35Å; S944-Y948 PolarHBondContact O-N 3.21Å
945	V	81.9	Confident	81.7	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.006	28%	0.279	C	S	.	.	H	α-helix	trans	-64.8	-38.6	179.5	175.9	0	0	0	0	111.9	N943 K949 F980 L983	N943-V945 PolarHBondContact O-N 3.01Å; V945-K949 WeakPolarHBondContact O-CG 3.37Å; V945-K949 PolarHBondContact O-N 3.39Å; V945-F980 HydrophobicContact CG2-CB 4Å; V945-F980 HydrophobicContact CG2-CD2 4Å; V945-L983 HydrophobicContact CG1-CB 4.33Å; V945-L983 HydrophobicContact CG1-CD2 4.3Å
946	N	82.1	Confident	81.6	Confident	80 Å²	80	55.6 Å²	55.6	43%	0.428	28%	0.279	S	S	.	.	H	α-helix	trans	-71.5	-47	-179.8	-68	-25	0	0	0	110.1	N943 S944 Y948 K949 Y950	N943-N946 PolarHBondContact O-N 2.59Å; N943-N946 VanDerWaalsContact O-N 3.12Å; S944-N946 VanDerWaalsContact C-N 3.35Å; S944-N946 PolarHBondContact O-N 3.44Å; N946-Y948 VanDerWaalsContact C-N 3.27Å; N946-Y948 PolarHBondContact O-N 3.34Å; N946-K949 PolarHBondContact O-N 3.18Å; N946-K949 VanDerWaalsContact O-N 3.16Å; N946-Y950 VanDerWaalsContact O-CD2 3.32Å; N946-Y950 WeakPolarHBondContact O-CD2 3.44Å; N946-Y950 PolarHBondContact O-N 3.14Å
947	I	83.5	Confident	81.6	Confident	7 Å²	7	58.6 Å²	58.6	4%	0.036	30%	0.297	C	S	.	.	H	α-helix	trans	-55.7	-43.8	177.3	-63.3	165.5	0	0	0	110.8	L913 C935 I939 N943 S944 Y950 A951 L959	L913-I947 HydrophobicContact CD2-CG1 4.17Å; C935-I947 HydrophobicContact CB-CG2 4.11Å; I939-I947 HydrophobicContact CB-CD1 4.46Å; I939-I947 HydrophobicContact CG1-CD1 4.21Å; N943-I947 HydrophobicContact CB-CD1 4.09Å; N943-I947 WeakPolarHBondContact O-CG1 3.21Å; N943-I947 PolarHBondContact O-N 2.61Å; S944-I947 PolarHBondContact O-N 3.35Å; I947-Y950 PolarHBondContact O-N 2.99Å; I947-A951 WeakPolarHBondContact O-CB 3.34Å; I947-A951 PolarHBondContact O-N 3.05Å; I947-L959 HydrophobicContact CG2-CD1 4.15Å; I947-L959 HydrophobicContact CG2-CD2 4.07Å; I947-L959 HydrophobicContact CG2-CG 4.31Å
948	Y	83.3	Confident	81.6	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-63.5	-43.2	177.8	176.4	-101.8	0	0	0	113.5	S944 N946 Y950 A951 K952 C963 E964 F967 L983 P996 D999	S944-Y948 WeakPolarHBondContact O-CB 3.35Å; S944-Y948 PolarHBondContact O-N 3.21Å; N946-Y948 VanDerWaalsContact C-N 3.27Å; N946-Y948 PolarHBondContact O-N 3.34Å; Y948-Y950 VanDerWaalsContact C-N 3.33Å; Y948-Y950 PolarHBondContact O-N 3.45Å; Y948-A951 PolarHBondContact O-N 3.27Å; Y948-K952 HydrophobicContact CE1-CG 4.29Å; Y948-K952 HydrophobicContact CE2-CD 4.49Å; Y948-K952 VanDerWaalsContact CE2-CE 3.47Å; Y948-K952 HydrophobicContact CE2-CG 4.11Å; Y948-K952 PolarHBondContact O-N 2.92Å; Y948-K952 VanDerWaalsContact OH-CE 3.25Å; Y948-K952 WeakPolarHBondContact OH-CE 3.42Å; Y948-C963 HydrophobicContact CD2-CB 3.89Å; Y948-C963 HydrophobicContact CG-CB 4.49Å; Y948-E964 HydrophobicContact CE2-CG 3.89Å; Y948-F967 HydrophobicContact CD1-CE2 4.11Å; Y948-F967 AromaticContact CD2-CE2 3.81Å; Y948-F967 HydrophobicContact CD2-CE2 3.81Å; Y948-F967 HydrophobicContact CE2-CE2 4.37Å; Y948-F967 AromaticContact CG-CE2 3.65Å; Y948-F967 HydrophobicContact CG-CE2 3.65Å; Y948-F967 HydrophobicContact CG-CZ 4.02Å; Y948-L983 HydrophobicContact CD1-CD1 4.36Å; Y948-L983 HydrophobicContact CD1-CD2 3.93Å; Y948-L983 HydrophobicContact CE1-CD1 4.43Å; Y948-L983 HydrophobicContact CE1-CD2 4.18Å; Y948-P996 HydrophobicContact CE1-CB 4.15Å; Y948-P996 HydrophobicContact CE1-CG 4.11Å; Y948-P996 WeakPolarHBondContact OH-CA 3.48Å; Y948-D999 PolarHBondContact OH-OD2 3.4Å
949	K	82.2	Confident	81.7	Confident	72 Å²	72	52.6 Å²	52.6	31%	0.313	27%	0.266	S	S	.	.	H	α-helix	trans	-59.5	-45	175.6	-73.8	174.3	-177	174.5	0	111.1	V945 N946 K952 I953 L983	V945-K949 WeakPolarHBondContact O-CG 3.37Å; V945-K949 PolarHBondContact O-N 3.39Å; N946-K949 PolarHBondContact O-N 3.18Å; N946-K949 VanDerWaalsContact O-N 3.16Å; K949-K952 PolarHBondContact O-N 2.92Å; K949-I953 WeakPolarHBondContact O-CB 3.27Å; K949-I953 WeakPolarHBondContact O-CD1 3.44Å; K949-I953 WeakPolarHBondContact O-CG1 3.42Å; K949-I953 PolarHBondContact O-N 3.5Å; K949-L983 HydrophobicContact CG-CD1 4.38Å
950	Y	81.1	Confident	81.7	Confident	92 Å²	92	51.4 Å²	51.4	36%	0.361	26%	0.26	S	S	.	.	H	α-helix	trans	-63.3	-42.5	176.1	-85.5	-87.1	0	0	0	111.9	L913 N946 I947 Y948 K952 I953 H954	L913-Y950 HydrophobicContact CD1-CD2 4.12Å; L913-Y950 HydrophobicContact CD1-CE2 4.32Å; L913-Y950 HydrophobicContact CD2-CD2 4.41Å; L913-Y950 HydrophobicContact CD2-CG 4.25Å; N946-Y950 VanDerWaalsContact O-CD2 3.32Å; N946-Y950 WeakPolarHBondContact O-CD2 3.44Å; N946-Y950 PolarHBondContact O-N 3.14Å; I947-Y950 PolarHBondContact O-N 2.99Å; Y948-Y950 VanDerWaalsContact C-N 3.33Å; Y948-Y950 PolarHBondContact O-N 3.45Å; Y950-K952 VanDerWaalsContact C-N 3.35Å; Y950-K952 PolarHBondContact O-N 2.69Å; Y950-I953 PolarHBondContact O-N 3.2Å; Y950-H954 AromaticContact CD1-CD2 3.81Å; Y950-H954 AromaticContact CD1-NE2 3.74Å; Y950-H954 WeakPolarHBondContact O-CB 3.4Å; Y950-H954 PolarHBondContact O-CD2 3.31Å; Y950-H954 PolarHBondContact O-N 3.04Å
951	A	84.3	Confident	81.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-58.2	-44.8	178.1	0	0	0	0	0	112.3	I947 Y948 N955 A956 L959 A960	I947-A951 WeakPolarHBondContact O-CB 3.34Å; I947-A951 PolarHBondContact O-N 3.05Å; Y948-A951 PolarHBondContact O-N 3.27Å; A951-N955 PolarHBondContact O-N 3.29Å; A951-N955 VanDerWaalsContact O-N 3.12Å; A951-A956 HydrophobicContact CB-CB 4.33Å; A951-A956 PolarHBondContact O-N 2.86Å; A951-L959 HydrophobicContact CB-CB 4.2Å; A951-L959 HydrophobicContact CB-CD2 3.87Å; A951-L959 HydrophobicContact CB-CG 3.91Å; A951-A960 HydrophobicContact CB-CB 4.33Å
952	K	82.6	Confident	82.1	Confident	62 Å²	62	50.7 Å²	50.7	27%	0.27	26%	0.258	S	S	.	.	H	α-helix	trans	-73.4	-40.6	179.5	-68.6	-74.9	-174.4	-179.9	0	113	Y948 K949 Y950 H954 N955 A960 E964 L994 D999	Y948-K952 HydrophobicContact CE1-CG 4.29Å; Y948-K952 HydrophobicContact CE2-CD 4.49Å; Y948-K952 VanDerWaalsContact CE2-CE 3.47Å; Y948-K952 HydrophobicContact CE2-CG 4.11Å; Y948-K952 PolarHBondContact O-N 2.92Å; Y948-K952 VanDerWaalsContact OH-CE 3.25Å; Y948-K952 WeakPolarHBondContact OH-CE 3.42Å; K949-K952 PolarHBondContact O-N 2.92Å; Y950-K952 VanDerWaalsContact C-N 3.35Å; Y950-K952 PolarHBondContact O-N 2.69Å; K952-H954 VanDerWaalsContact C-N 3.27Å; K952-H954 PolarHBondContact O-N 2.97Å; K952-N955 PolarHBondContact O-N 3.24Å; K952-A960 HydrophobicContact CD-CB 4.16Å; K952-E964 WeakPolarHBondContact CE-OE1 3.41Å; K952-E964 IonicContact NZ-OE1 2.85Å; K952-E964 PolarHBondContact NZ-OE1 3.38Å; K952-L994 HydrophobicContact CB-CD2 3.2Å; K952-L994 HydrophobicContact CD-CD2 4.4Å; K952-L994 HydrophobicContact CG-CD2 3.59Å; K952-D999 WeakPolarHBondContact CE-OD2 3.33Å; K952-D999 VanDerWaalsContact NZ-CG 3.25Å; K952-D999 IonicContact NZ-OD1 3.34Å; K952-D999 IonicContact NZ-OD2 2.71Å; K952-D999 PolarHBondContact NZ-OD2 3.45Å
953	I	82.6	Confident	82.4	Confident	113 Å²	113	43.7 Å²	43.7	58%	0.579	23%	0.225	S	C	*	.	H	α-helix	trans	-61.2	-38.8	177	-69.8	165.8	0	0	0	111.1	K949 Y950	K949-I953 WeakPolarHBondContact O-CB 3.27Å; K949-I953 WeakPolarHBondContact O-CD1 3.44Å; K949-I953 WeakPolarHBondContact O-CG1 3.42Å; K949-I953 PolarHBondContact O-N 3.5Å; Y950-I953 PolarHBondContact O-N 3.2Å
954	H	81.3	Confident	82.4	Confident	36 Å²	36	40.5 Å²	40.5	17%	0.167	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	8.3	-177.4	-66.3	-61.7	0	0	0	114.3	S917 S920 Y950 K952	S917-H954 WeakPolarHBondContact CB-CE1 3.14Å; S917-H954 WeakPolarHBondContact CB-NE2 3.33Å; S920-H954 PolarHBondContact OG-O 3.47Å; Y950-H954 AromaticContact CD1-CD2 3.81Å; Y950-H954 AromaticContact CD1-NE2 3.74Å; Y950-H954 WeakPolarHBondContact O-CB 3.4Å; Y950-H954 PolarHBondContact O-CD2 3.31Å; Y950-H954 PolarHBondContact O-N 3.04Å; K952-H954 VanDerWaalsContact C-N 3.27Å; K952-H954 PolarHBondContact O-N 2.97Å
955	N	80.1	Confident	82.4	Confident	130 Å²	130	40.5 Å²	40.5	70%	0.695	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.4	52.7	177.9	-162.7	36.9	0	0	0	113.7	A951 K952 P957	A951-N955 PolarHBondContact O-N 3.29Å; A951-N955 VanDerWaalsContact O-N 3.12Å; K952-N955 PolarHBondContact O-N 3.24Å; N955-P957 VanDerWaalsContact O-CD 3.26Å; N955-P957 WeakPolarHBondContact O-CD 3.24Å
956	A	81.5	Confident	82.5	Confident	2 Å²	2	41.5 Å²	41.5	2%	0.017	21%	0.212	C	C	.	.			trans	-102.9	88	174.3	0	0	0	0	0	110.2	E932 A951 E958 L959 A960	E932-A956 HydrophobicContact CG-CB 4.26Å; E932-A956 WeakPolarHBondContact OE1-CB 3.31Å; A951-A956 HydrophobicContact CB-CB 4.33Å; A951-A956 PolarHBondContact O-N 2.86Å; A956-E958 PolarHBondContact O-N 3.36Å; A956-L959 HydrophobicContact CB-CB 4.26Å; A956-A960 WeakPolarHBondContact O-CB 3.47Å; A956-A960 PolarHBondContact O-N 3.33Å; A956-A960 VanDerWaalsContact O-N 3.1Å
957	P	80.4	Confident	82.6	Confident	79 Å²	79	37.8 Å²	37.8	51%	0.513	19%	0.192	S	C	.	.	H	α-helix	trans	-71	-31.4	-168	25.2	-30	0	0	0	113.4	N955 A960 S961	N955-P957 VanDerWaalsContact O-CD 3.26Å; N955-P957 WeakPolarHBondContact O-CD 3.24Å; P957-A960 PolarHBondContact O-N 3.08Å; P957-S961 PolarHBondContact O-N 3.32Å
958	E	81.6	Confident	82.6	Confident	70 Å²	70	37.4 Å²	37.4	33%	0.327	19%	0.19	S	C	.	.	H	α-helix	trans	-82	-31	-178.6	-56.6	96.8	132.1	0	0	113.4	R929 A956 A960 S961 F962	R929-E958 IonicContact CZ-OE1 3.48Å; R929-E958 IonicContact NH1-OE1 3.23Å; R929-E958 PolarHBondContact NH1-OE1 3.36Å; R929-E958 IonicContact NH1-OE2 2.9Å; R929-E958 PolarHBondContact NH1-OE2 3.36Å; R929-E958 IonicContact NH2-OE1 3.2Å; A956-E958 PolarHBondContact O-N 3.36Å; E958-A960 VanDerWaalsContact C-N 3.32Å; E958-S961 WeakPolarHBondContact CA-OG 3.46Å; E958-S961 PolarHBondContact O-OG 3.43Å; E958-F962 WeakPolarHBondContact O-CB 3.19Å; E958-F962 PolarHBondContact O-N 3.49Å
959	L	83.4	Confident	82.6	Confident	1 Å²	1	41 Å²	41	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-67.4	-38.2	167.6	179	61.4	0	0	0	110.8	I815 L916 E932 C935 I947 A951 A956 F962 C963	I815-L959 HydrophobicContact CD1-CB 4.47Å; I815-L959 HydrophobicContact CD1-CD1 4.25Å; L916-L959 HydrophobicContact CD2-CD2 3.96Å; E932-L959 HydrophobicContact CB-CB 3.95Å; E932-L959 HydrophobicContact CG-CB 3.72Å; E932-L959 HydrophobicContact CG-CD2 4.22Å; C935-L959 HydrophobicContact CB-CD1 3.67Å; C935-L959 HydrophobicContact CB-CD2 3.91Å; C935-L959 HydrophobicContact CB-CG 4.47Å; I947-L959 HydrophobicContact CG2-CD1 4.15Å; I947-L959 HydrophobicContact CG2-CD2 4.07Å; I947-L959 HydrophobicContact CG2-CG 4.31Å; A951-L959 HydrophobicContact CB-CB 4.2Å; A951-L959 HydrophobicContact CB-CD2 3.87Å; A951-L959 HydrophobicContact CB-CG 3.91Å; A956-L959 HydrophobicContact CB-CB 4.26Å; L959-F962 PolarHBondContact O-N 3.38Å; L959-C963 WeakPolarHBondContact O-CB 3.29Å; L959-C963 PolarHBondContact O-N 3.46Å; L959-C963 PolarHBondContact O-SG 2.96Å
960	A	83.5	Confident	82.6	Confident	3 Å²	3	40.4 Å²	40.4	3%	0.025	20%	0.204	C	C	.	.	H	α-helix	trans	-60.8	-47.9	174	0	0	0	0	0	111.5	A951 K952 A956 P957 E958 F962 C963 E964	A951-A960 HydrophobicContact CB-CB 4.33Å; K952-A960 HydrophobicContact CD-CB 4.16Å; A956-A960 WeakPolarHBondContact O-CB 3.47Å; A956-A960 PolarHBondContact O-N 3.33Å; A956-A960 VanDerWaalsContact O-N 3.1Å; P957-A960 PolarHBondContact O-N 3.08Å; E958-A960 VanDerWaalsContact C-N 3.32Å; A960-F962 VanDerWaalsContact C-N 3.33Å; A960-F962 PolarHBondContact O-N 3.31Å; A960-C963 PolarHBondContact O-N 3.12Å; A960-E964 WeakPolarHBondContact O-CB 2.82Å; A960-E964 WeakPolarHBondContact O-CG 3.46Å; A960-E964 PolarHBondContact O-N 3.47Å
961	S	82.3	Confident	82.7	Confident	62 Å²	62	36 Å²	36	43%	0.434	19%	0.187	S	C	.	.	H	α-helix	trans	-65.8	-34	178.2	71.7	0	0	0	0	113	P957 E958 E964 G965	P957-S961 PolarHBondContact O-N 3.32Å; E958-S961 WeakPolarHBondContact CA-OG 3.46Å; E958-S961 PolarHBondContact O-OG 3.43Å; S961-E964 PolarHBondContact O-N 2.9Å; S961-G965 PolarHBondContact O-N 3.49Å
962	F	84	Confident	82.5	Confident	27 Å²	27	37.9 Å²	37.9	12%	0.118	20%	0.2	C	C	.	.	H	α-helix	trans	-64.8	-45.5	172	-174.7	-91.4	0	0	0	111.8	I812 P813 I815 A936 I939 E958 L959 A960 E964 G965 F966	I812-F962 HydrophobicContact CB-CD2 4.34Å; I812-F962 HydrophobicContact CB-CE2 3.94Å; I812-F962 HydrophobicContact CG2-CD2 3.47Å; I812-F962 VanDerWaalsContact CG2-CD2 3.47Å; I812-F962 HydrophobicContact CG2-CE2 3.57Å; I812-F962 HydrophobicContact CG2-CG 4.21Å; I812-F962 HydrophobicContact CG2-CZ 4.38Å; P813-F962 WeakPolarHBondContact O-CD2 3.4Å; I815-F962 HydrophobicContact CD1-CB 3.99Å; I815-F962 HydrophobicContact CD1-CG 4.24Å; I815-F962 HydrophobicContact CG1-CB 4.15Å; I815-F962 HydrophobicContact CG1-CD2 4.26Å; I815-F962 HydrophobicContact CG1-CG 4.35Å; A936-F962 HydrophobicContact CB-CD1 3.67Å; A936-F962 HydrophobicContact CB-CD2 4.36Å; A936-F962 HydrophobicContact CB-CE1 3.45Å; A936-F962 VanDerWaalsContact CB-CE1 3.45Å; A936-F962 HydrophobicContact CB-CE2 4.18Å; A936-F962 HydrophobicContact CB-CG 4.13Å; A936-F962 HydrophobicContact CB-CZ 3.73Å; I939-F962 HydrophobicContact CG2-CE1 4.15Å; E958-F962 WeakPolarHBondContact O-CB 3.19Å; E958-F962 PolarHBondContact O-N 3.49Å; L959-F962 PolarHBondContact O-N 3.38Å; A960-F962 VanDerWaalsContact C-N 3.33Å; A960-F962 PolarHBondContact O-N 3.31Å; F962-E964 VanDerWaalsContact C-N 3.34Å; F962-E964 PolarHBondContact O-N 2.98Å; F962-G965 PolarHBondContact O-N 3.31Å; F962-F966 PolarHBondContact O-N 3.34Å
963	C	83.3	Confident	82.3	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.3	-41.2	175.3	-68.2	0	0	0	0	111.6	Y948 L959 A960 G965 F966 F967	Y948-C963 HydrophobicContact CD2-CB 3.89Å; Y948-C963 HydrophobicContact CG-CB 4.49Å; L959-C963 WeakPolarHBondContact O-CB 3.29Å; L959-C963 PolarHBondContact O-N 3.46Å; L959-C963 PolarHBondContact O-SG 2.96Å; A960-C963 PolarHBondContact O-N 3.12Å; C963-G965 VanDerWaalsContact C-N 3.35Å; C963-G965 PolarHBondContact O-N 3.19Å; C963-F966 WeakPolarHBondContact O-CB 3.3Å; C963-F966 PolarHBondContact O-N 3.46Å; C963-F967 HydrophobicContact CB-CE2 4.35Å; C963-F967 VanDerWaalsContact O-CD2 3.27Å; C963-F967 WeakPolarHBondContact O-CD2 3.18Å; C963-F967 WeakPolarHBondContact O-CG 3.2Å; C963-F967 PolarHBondContact O-N 3.43Å
964	E	83.7	Confident	82.2	Confident	13 Å²	13	32.2 Å²	32.2	6%	0.061	18%	0.178	C	C	.	.	H	α-helix	trans	-60	-43.7	174.6	-70.6	156.7	-161.5	0	0	111.1	Y948 K952 A960 S961 F962 F967 L968 D999 L1000 A1003	Y948-E964 HydrophobicContact CE2-CG 3.89Å; K952-E964 WeakPolarHBondContact CE-OE1 3.41Å; K952-E964 IonicContact NZ-OE1 2.85Å; K952-E964 PolarHBondContact NZ-OE1 3.38Å; A960-E964 WeakPolarHBondContact O-CB 2.82Å; A960-E964 WeakPolarHBondContact O-CG 3.46Å; A960-E964 PolarHBondContact O-N 3.47Å; S961-E964 PolarHBondContact O-N 2.9Å; F962-E964 VanDerWaalsContact C-N 3.34Å; F962-E964 PolarHBondContact O-N 2.98Å; E964-F967 PolarHBondContact O-N 3.42Å; E964-L968 WeakPolarHBondContact O-CG 3.47Å; E964-L968 PolarHBondContact O-N 2.9Å; E964-D999 HydrophobicContact CG-CB 4.3Å; E964-D999 WeakPolarHBondContact OE1-CB 3.31Å; E964-L1000 HydrophobicContact CB-CD2 4.21Å; E964-L1000 HydrophobicContact CG-CD2 4.48Å; E964-A1003 HydrophobicContact CB-CB 4.1Å
965	G	82.1	Confident	82	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-62.8	-40.1	173	0	0	0	0	0	113.8	Y807 S961 F962 C963 L968 K969	Y807-G965 VanDerWaalsContact OH-CA 3.29Å; Y807-G965 WeakPolarHBondContact OH-CA 3.24Å; S961-G965 PolarHBondContact O-N 3.49Å; F962-G965 PolarHBondContact O-N 3.31Å; C963-G965 VanDerWaalsContact C-N 3.35Å; C963-G965 PolarHBondContact O-N 3.19Å; G965-L968 PolarHBondContact O-N 3.37Å; G965-K969 PolarHBondContact O-N 3.38Å; G965-K969 VanDerWaalsContact O-N 3.13Å
966	F	83.8	Confident	81.9	Confident	21 Å²	21	31.3 Å²	31.3	9%	0.092	17%	0.17	C	C	.	.	H	α-helix	trans	-64.1	-42.4	174.9	-176.4	-93.4	0	0	0	111.8	I812 I939 M941 F962 C963 L968 K969 H970	I812-F966 HydrophobicContact CD1-CB 3.96Å; I812-F966 HydrophobicContact CD1-CD2 4.2Å; I939-F966 HydrophobicContact CD1-CB 3.95Å; I939-F966 HydrophobicContact CD1-CD1 3.78Å; I939-F966 HydrophobicContact CD1-CD2 4.29Å; I939-F966 HydrophobicContact CD1-CE1 4.37Å; I939-F966 HydrophobicContact CD1-CG 3.74Å; I939-F966 HydrophobicContact CG1-CD1 4.09Å; I939-F966 HydrophobicContact CG1-CD2 4.49Å; I939-F966 HydrophobicContact CG1-CE1 4.17Å; I939-F966 HydrophobicContact CG1-CG 4.26Å; I939-F966 HydrophobicContact CG1-CZ 4.41Å; I939-F966 HydrophobicContact CG2-CD2 3.8Å; I939-F966 HydrophobicContact CG2-CE2 3.79Å; I939-F966 HydrophobicContact CG2-CG 4.35Å; I939-F966 HydrophobicContact CG2-CZ 4.33Å; M941-F966 HydrophobicContact SD-CE1 4.24Å; M941-F966 HydrophobicContact SD-CZ 4.11Å; F962-F966 PolarHBondContact O-N 3.34Å; C963-F966 WeakPolarHBondContact O-CB 3.3Å; C963-F966 PolarHBondContact O-N 3.46Å; F966-L968 PolarHBondContact O-N 3.34Å; F966-K969 PolarHBondContact O-N 3.42Å; F966-H970 AromaticContact CD2-CD2 3.81Å; F966-H970 AromaticContact CE2-CD2 3.53Å; F966-H970 AromaticContact CE2-NE2 3.9Å; F966-H970 AromaticContact CZ-CD2 3.76Å; F966-H970 PolarHBondContact O-N 2.99Å; F966-H970 VanDerWaalsContact O-N 3.12Å
967	F	84.6	Confident	81.9	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.009	18%	0.18	C	C	.	.	H	α-helix	trans	-60.5	-45	176	-66.5	-30.7	0	0	0	112.1	Y948 C963 E964 K969 H970 M971 L974 F980 L983 L1000	Y948-F967 HydrophobicContact CD1-CE2 4.11Å; Y948-F967 AromaticContact CD2-CE2 3.81Å; Y948-F967 HydrophobicContact CD2-CE2 3.81Å; Y948-F967 HydrophobicContact CE2-CE2 4.37Å; Y948-F967 AromaticContact CG-CE2 3.65Å; Y948-F967 HydrophobicContact CG-CE2 3.65Å; Y948-F967 HydrophobicContact CG-CZ 4.02Å; C963-F967 HydrophobicContact CB-CE2 4.35Å; C963-F967 VanDerWaalsContact O-CD2 3.27Å; C963-F967 WeakPolarHBondContact O-CD2 3.18Å; C963-F967 WeakPolarHBondContact O-CG 3.2Å; C963-F967 PolarHBondContact O-N 3.43Å; E964-F967 PolarHBondContact O-N 3.42Å; F967-K969 PolarHBondContact O-N 2.95Å; F967-H970 CarbonylContact O-C 3.51Å; F967-H970 PolarHBondContact O-N 3.49Å; F967-M971 WeakPolarHBondContact O-CA 3.32Å; F967-M971 VanDerWaalsContact O-CB 3.25Å; F967-M971 WeakPolarHBondContact O-CB 3.47Å; F967-M971 PolarHBondContact O-N 3.45Å; F967-L974 HydrophobicContact CB-CD1 4.4Å; F967-L974 HydrophobicContact CD1-CD1 3.71Å; F967-F980 HydrophobicContact CB-CE2 4.18Å; F967-F980 HydrophobicContact CB-CZ 4.26Å; F967-F980 HydrophobicContact CD1-CD2 4.33Å; F967-F980 AromaticContact CD1-CE2 3.73Å; F967-F980 HydrophobicContact CD1-CE2 3.73Å; F967-F980 HydrophobicContact CD2-CE2 4.13Å; F967-F980 HydrophobicContact CE1-CD2 4.27Å; F967-F980 HydrophobicContact CE1-CE2 4.02Å; F967-F980 HydrophobicContact CE2-CE2 4.44Å; F967-F980 AromaticContact CG-CE2 3.77Å; F967-F980 HydrophobicContact CG-CE2 3.77Å; F967-F980 HydrophobicContact CG-CZ 4.35Å; F967-F980 HydrophobicContact CZ-CE2 4.39Å; F967-L983 HydrophobicContact CE2-CD2 4.39Å; F967-L983 HydrophobicContact CZ-CD2 4.45Å; F967-L1000 HydrophobicContact CB-CD2 3.78Å; F967-L1000 HydrophobicContact CD2-CD2 4.19Å
968	L	82.3	Confident	81.7	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65	-38.3	179.2	-68.1	173.4	0	0	0	112.5	T804 Y807 E964 G965 F966 H970 M971 L1000 A1003 L1004	T804-L968 WeakPolarHBondContact CA-O 3.32Å; T804-L968 PolarHBondContact OG1-O 2.91Å; Y807-L968 HydrophobicContact CD2-CB 3.65Å; Y807-L968 HydrophobicContact CD2-CD1 3.67Å; Y807-L968 HydrophobicContact CD2-CG 4.32Å; Y807-L968 HydrophobicContact CE2-CB 4.1Å; Y807-L968 HydrophobicContact CE2-CD1 3.83Å; Y807-L968 HydrophobicContact CG-CB 4.06Å; E964-L968 WeakPolarHBondContact O-CG 3.47Å; E964-L968 PolarHBondContact O-N 2.9Å; G965-L968 PolarHBondContact O-N 3.37Å; F966-L968 PolarHBondContact O-N 3.34Å; L968-H970 VanDerWaalsContact C-N 3.34Å; L968-H970 PolarHBondContact O-N 2.83Å; L968-M971 HydrophobicContact CD2-SD 4.22Å; L968-L1000 HydrophobicContact CD2-CB 4.29Å; L968-L1000 HydrophobicContact CD2-CD2 3.92Å; L968-L1000 HydrophobicContact CG-CD2 3.86Å; L968-A1003 HydrophobicContact CD1-CB 4.13Å; L968-L1004 HydrophobicContact CD1-CB 3.73Å; L968-L1004 HydrophobicContact CD1-CD1 4.25Å; L968-L1004 HydrophobicContact CD1-CG 4.35Å; L968-L1004 HydrophobicContact CD2-CB 4.42Å; L968-L1004 HydrophobicContact CD2-CD1 3.84Å
969	K	83.3	Confident	81.4	Confident	74 Å²	74	34.2 Å²	34.2	32%	0.322	19%	0.185	S	C	.	.	H	α-helix	trans	-69.4	-30.4	178.7	-170.8	173.5	-177.5	173.6	0	113.5	T804 Y807 I812 G965 F966 F967	T804-K969 WeakPolarHBondContact CG2-O 3.31Å; Y807-K969 HydrophobicContact CD1-CB 4.35Å; I812-K969 HydrophobicContact CD1-CD 4.44Å; I812-K969 HydrophobicContact CG1-CD 4.48Å; G965-K969 PolarHBondContact O-N 3.38Å; G965-K969 VanDerWaalsContact O-N 3.13Å; F966-K969 PolarHBondContact O-N 3.42Å; F967-K969 PolarHBondContact O-N 2.95Å
970	H	82.9	Confident	81.3	Confident	61 Å²	61	34.2 Å²	34.2	28%	0.282	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.3	20.4	-175.1	-68.4	-66.6	0	0	0	113.2	M941 F966 F967 L968 S972 S973 L974	M941-H970 HydrophobicContact CE-CB 3.93Å; M941-H970 HydrophobicContact SD-CB 3.93Å; F966-H970 AromaticContact CD2-CD2 3.81Å; F966-H970 AromaticContact CE2-CD2 3.53Å; F966-H970 AromaticContact CE2-NE2 3.9Å; F966-H970 AromaticContact CZ-CD2 3.76Å; F966-H970 PolarHBondContact O-N 2.99Å; F966-H970 VanDerWaalsContact O-N 3.12Å; F967-H970 CarbonylContact O-C 3.51Å; F967-H970 PolarHBondContact O-N 3.49Å; L968-H970 VanDerWaalsContact C-N 3.34Å; L968-H970 PolarHBondContact O-N 2.83Å; H970-S972 VanDerWaalsContact C-N 3.33Å; H970-S972 PolarHBondContact O-N 3.43Å; H970-S973 PolarHBondContact O-N 3.31Å; H970-L974 HydrophobicContact CB-CD1 3.99Å; H970-L974 HydrophobicContact CB-CG 4.25Å; H970-L974 WeakPolarHBondContact O-CB 3.25Å; H970-L974 WeakPolarHBondContact O-CG 3.19Å; H970-L974 PolarHBondContact O-N 3.3Å
971	M	82.4	Confident	81	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.4	-37.1	-167.2	-159.3	162.2	-167.1	0	0	113.4	L787 A800 F803 F967 L968 S973 L974 L975 F980 I984 L1000	L787-M971 HydrophobicContact CD2-CE 4.07Å; A800-M971 HydrophobicContact CB-CB 4.01Å; A800-M971 HydrophobicContact CB-CG 3.85Å; F803-M971 HydrophobicContact CB-SD 3.99Å; F803-M971 HydrophobicContact CD2-CE 4.16Å; F803-M971 HydrophobicContact CD2-SD 3.53Å; F803-M971 VanDerWaalsContact CD2-SD 3.53Å; F803-M971 HydrophobicContact CE2-SD 4.43Å; F803-M971 HydrophobicContact CG-SD 4.17Å; F967-M971 WeakPolarHBondContact O-CA 3.32Å; F967-M971 VanDerWaalsContact O-CB 3.25Å; F967-M971 WeakPolarHBondContact O-CB 3.47Å; F967-M971 PolarHBondContact O-N 3.45Å; L968-M971 HydrophobicContact CD2-SD 4.22Å; M971-S973 PolarHBondContact O-N 2.9Å; M971-L974 PolarHBondContact O-N 3.41Å; M971-L975 WeakPolarHBondContact O-CG 3.25Å; M971-L975 PolarHBondContact O-N 3.06Å; M971-F980 HydrophobicContact CG-CE1 4.47Å; M971-I984 HydrophobicContact CE-CD1 4.34Å; M971-L1000 HydrophobicContact CE-CD1 4.25Å
972	S	80.6	Confident	80.7	Confident	39 Å²	39	40.3 Å²	40.3	27%	0.273	21%	0.205	S	C	.	.	H	α-helix	trans	-60.2	-46.1	179.5	51.7	0	0	0	0	112.3	Q797 H970	Q797-S972 PolarHBondContact NE2-O 3.31Å; Q797-S972 PolarHBondContact OE1-O 3.02Å; H970-S972 VanDerWaalsContact C-N 3.33Å; H970-S972 PolarHBondContact O-N 3.43Å
973	S	79.8	Confident	80.3	Confident	55 Å²	55	39.3 Å²	39.3	39%	0.385	20%	0.201	S	C	.	.	H	α-helix	trans	-77	-34.1	177.9	-54.5	0	0	0	0	112.8	H970 M971 L975 E976	H970-S973 PolarHBondContact O-N 3.31Å; M971-S973 PolarHBondContact O-N 2.9Å; S973-L975 VanDerWaalsContact C-N 3.34Å; S973-L975 PolarHBondContact O-N 2.63Å; S973-E976 WeakPolarHBondContact O-CB 3.41Å; S973-E976 PolarHBondContact O-N 2.92Å
974	L	78.8	Confident	80	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-69.3	-31.7	179.1	-74.1	169.5	0	0	0	112.6	M941 F967 H970 M971 E976 Q977 F980	M941-L974 HydrophobicContact CB-CD2 4.47Å; M941-L974 HydrophobicContact SD-CD2 4.07Å; M941-L974 HydrophobicContact SD-CG 4.29Å; F967-L974 HydrophobicContact CB-CD1 4.4Å; F967-L974 HydrophobicContact CD1-CD1 3.71Å; H970-L974 HydrophobicContact CB-CD1 3.99Å; H970-L974 HydrophobicContact CB-CG 4.25Å; H970-L974 WeakPolarHBondContact O-CB 3.25Å; H970-L974 WeakPolarHBondContact O-CG 3.19Å; H970-L974 PolarHBondContact O-N 3.3Å; M971-L974 PolarHBondContact O-N 3.41Å; L974-E976 PolarHBondContact O-N 3.42Å; L974-Q977 WeakPolarHBondContact O-CB 3.27Å; L974-Q977 PolarHBondContact O-N 3Å; L974-F980 HydrophobicContact CB-CD1 3.72Å; L974-F980 HydrophobicContact CB-CD2 4.45Å; L974-F980 HydrophobicContact CB-CE1 3.91Å; L974-F980 HydrophobicContact CB-CG 4Å; L974-F980 HydrophobicContact CB-CZ 4.38Å; L974-F980 HydrophobicContact CD1-CE2 4.5Å; L974-F980 WeakPolarHBondContact O-CB 3.36Å; L974-F980 WeakPolarHBondContact O-CD1 3.42Å
975	L	78.5	Confident	79.4	Confident	6 Å²	6	43.8 Å²	43.8	3%	0.031	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-12.5	173.8	-79.9	-176.8	0	0	0	113.7	N796 A800 M971 S973 Q977 F980 K981 I984	N796-L975 HydrophobicContact CB-CD1 4.33Å; N796-L975 WeakPolarHBondContact O-CD1 3.3Å; A800-L975 HydrophobicContact CB-CD1 3.51Å; A800-L975 HydrophobicContact CB-CG 4.4Å; M971-L975 WeakPolarHBondContact O-CG 3.25Å; M971-L975 PolarHBondContact O-N 3.06Å; S973-L975 VanDerWaalsContact C-N 3.34Å; S973-L975 PolarHBondContact O-N 2.63Å; L975-Q977 VanDerWaalsContact C-N 3.34Å; L975-F980 HydrophobicContact CD2-CD1 4.06Å; L975-F980 HydrophobicContact CD2-CE1 4.01Å; L975-F980 HydrophobicContact CG-CE1 4.33Å; L975-K981 WeakPolarHBondContact O-CE 3.46Å; L975-I984 HydrophobicContact CD2-CD1 4.06Å
976	E	78.1	Confident	78.9	Confident	141 Å²	141	45.9 Å²	45.9	66%	0.659	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79	-20.4	171.2	-60.8	-176.7	166.3	0	0	112.2	S973 L974	S973-E976 WeakPolarHBondContact O-CB 3.41Å; S973-E976 PolarHBondContact O-N 2.92Å; L974-E976 PolarHBondContact O-N 3.42Å
977	Q	79.9	Confident	77.5	Confident	50 Å²	50	55.2 Å²	55.2	23%	0.234	27%	0.268	C	S	.	.	S	Bend	trans	-85.4	130.2	-178.7	-61.7	-166.8	-10.8	0	0	112.6	M941 L974 L975 S979 F980 K981	M941-Q977 PolarHBondContact O-OE1 3.47Å; M941-Q977 VanDerWaalsContact O-OE1 3.06Å; L974-Q977 WeakPolarHBondContact O-CB 3.27Å; L974-Q977 PolarHBondContact O-N 3Å; L975-Q977 VanDerWaalsContact C-N 3.34Å; Q977-S979 VanDerWaalsContact C-N 3.26Å; Q977-S979 PolarHBondContact O-N 2.9Å; Q977-F980 PolarHBondContact O-N 3.39Å; Q977-K981 PolarHBondContact O-N 2.93Å; Q977-K981 VanDerWaalsContact O-N 3.1Å
978	D	76.2	Confident	76	Confident	116 Å²	116	60.6 Å²	60.6	62%	0.62	30%	0.297	S	S	*	.	H	α-helix	trans	-62.6	-32.2	178.9	-71.8	-33.4	0	0	0	113	F980 K981 Q982	D978-F980 PolarHBondContact O-N 3.3Å; D978-K981 PolarHBondContact O-N 3.06Å; D978-Q982 WeakPolarHBondContact O-CB 3.36Å; D978-Q982 VanDerWaalsContact O-CG 3.27Å; D978-Q982 WeakPolarHBondContact O-CG 3.38Å; D978-Q982 PolarHBondContact O-N 3.36Å
979	S	76.9	Confident	74.7	Confident	46 Å²	46	61.2 Å²	61.2	32%	0.322	30%	0.301	S	S	.	.	H	α-helix	trans	-61.8	-41.9	177.7	54.4	0	0	0	0	112.4	Q977 L983	Q977-S979 VanDerWaalsContact C-N 3.26Å; Q977-S979 PolarHBondContact O-N 2.9Å; S979-L983 PolarHBondContact O-N 2.93Å
980	F	79.6	Confident	73.1	Confident	1 Å²	1	63.4 Å²	63.4	0%	0.004	31%	0.31	C	S	.	.	H	α-helix	trans	-77.6	-38.8	179	-172.4	-109.7	0	0	0	111.6	V945 F967 M971 L974 L975 Q977 D978 Q982 L983 I984	V945-F980 HydrophobicContact CG2-CB 4Å; V945-F980 HydrophobicContact CG2-CD2 4Å; F967-F980 HydrophobicContact CB-CE2 4.18Å; F967-F980 HydrophobicContact CB-CZ 4.26Å; F967-F980 HydrophobicContact CD1-CD2 4.33Å; F967-F980 AromaticContact CD1-CE2 3.73Å; F967-F980 HydrophobicContact CD1-CE2 3.73Å; F967-F980 HydrophobicContact CD2-CE2 4.13Å; F967-F980 HydrophobicContact CE1-CD2 4.27Å; F967-F980 HydrophobicContact CE1-CE2 4.02Å; F967-F980 HydrophobicContact CE2-CE2 4.44Å; F967-F980 AromaticContact CG-CE2 3.77Å; F967-F980 HydrophobicContact CG-CE2 3.77Å; F967-F980 HydrophobicContact CG-CZ 4.35Å; F967-F980 HydrophobicContact CZ-CE2 4.39Å; M971-F980 HydrophobicContact CG-CE1 4.47Å; L974-F980 HydrophobicContact CB-CD1 3.72Å; L974-F980 HydrophobicContact CB-CD2 4.45Å; L974-F980 HydrophobicContact CB-CE1 3.91Å; L974-F980 HydrophobicContact CB-CG 4Å; L974-F980 HydrophobicContact CB-CZ 4.38Å; L974-F980 HydrophobicContact CD1-CE2 4.5Å; L974-F980 WeakPolarHBondContact O-CB 3.36Å; L974-F980 WeakPolarHBondContact O-CD1 3.42Å; L975-F980 HydrophobicContact CD2-CD1 4.06Å; L975-F980 HydrophobicContact CD2-CE1 4.01Å; L975-F980 HydrophobicContact CG-CE1 4.33Å; Q977-F980 PolarHBondContact O-N 3.39Å; D978-F980 PolarHBondContact O-N 3.3Å; F980-Q982 VanDerWaalsContact C-N 3.28Å; F980-Q982 PolarHBondContact O-N 2.89Å; F980-L983 HydrophobicContact CD2-CD2 4.38Å; F980-L983 WeakPolarHBondContact O-CB 3.34Å; F980-L983 PolarHBondContact O-N 3.49Å; F980-L983 VanDerWaalsContact O-N 3.08Å; F980-I984 HydrophobicContact CD1-CD1 3.8Å; F980-I984 HydrophobicContact CE1-CD1 3.28Å; F980-I984 HydrophobicContact CE1-CG1 4.36Å; F980-I984 HydrophobicContact CE2-CD1 4.32Å; F980-I984 HydrophobicContact CZ-CD1 3.59Å; F980-I984 HydrophobicContact CZ-CG1 4.4Å; F980-I984 PolarHBondContact O-N 3.23Å; F980-I984 VanDerWaalsContact O-N 3.08Å
981	K	77.6	Confident	71.4	Confident	63 Å²	63	66.5 Å²	66.5	27%	0.274	33%	0.333	S	S	.	.	H	α-helix	trans	-56.8	-43.2	170.3	-70.4	-172.3	-174	-176.1	0	111.5	L975 Q977 D978 L983 I984 Y985	L975-K981 WeakPolarHBondContact O-CE 3.46Å; Q977-K981 PolarHBondContact O-N 2.93Å; Q977-K981 VanDerWaalsContact O-N 3.1Å; D978-K981 PolarHBondContact O-N 3.06Å; K981-L983 VanDerWaalsContact C-N 3.33Å; K981-L983 PolarHBondContact O-N 3.12Å; K981-I984 PolarHBondContact O-N 2.98Å; K981-Y985 HydrophobicContact CB-CD2 4.22Å; K981-Y985 WeakPolarHBondContact O-CB 3.41Å; K981-Y985 VanDerWaalsContact O-CD2 3.25Å; K981-Y985 WeakPolarHBondContact O-CD2 3.36Å; K981-Y985 PolarHBondContact O-N 3.25Å
982	Q	77.6	Confident	70	Confident	130 Å²	130	73.2 Å²	73.2	61%	0.607	37%	0.365	S	S	*	.	H	α-helix	trans	-64.1	-36	175.9	-74.9	178.9	14.8	0	0	112.5	D978 F980 S986	D978-Q982 WeakPolarHBondContact O-CB 3.36Å; D978-Q982 VanDerWaalsContact O-CG 3.27Å; D978-Q982 WeakPolarHBondContact O-CG 3.38Å; D978-Q982 PolarHBondContact O-N 3.36Å; F980-Q982 VanDerWaalsContact C-N 3.28Å; F980-Q982 PolarHBondContact O-N 2.89Å; Q982-S986 WeakPolarHBondContact O-CB 3.47Å; Q982-S986 PolarHBondContact O-N 3.19Å; Q982-S986 VanDerWaalsContact O-N 3.09Å
983	L	75.7	Confident	68.9	Low	6 Å²	6	74.8 Å²	74.8	3%	0.031	39%	0.387	C	S	.	.	H	α-helix	trans	-63.5	-42.3	176.1	-174.7	70.8	0	0	0	111.8	V945 Y948 K949 F967 S979 F980 K981 P996	V945-L983 HydrophobicContact CG1-CB 4.33Å; V945-L983 HydrophobicContact CG1-CD2 4.3Å; Y948-L983 HydrophobicContact CD1-CD1 4.36Å; Y948-L983 HydrophobicContact CD1-CD2 3.93Å; Y948-L983 HydrophobicContact CE1-CD1 4.43Å; Y948-L983 HydrophobicContact CE1-CD2 4.18Å; K949-L983 HydrophobicContact CG-CD1 4.38Å; F967-L983 HydrophobicContact CE2-CD2 4.39Å; F967-L983 HydrophobicContact CZ-CD2 4.45Å; S979-L983 PolarHBondContact O-N 2.93Å; F980-L983 HydrophobicContact CD2-CD2 4.38Å; F980-L983 WeakPolarHBondContact O-CB 3.34Å; F980-L983 PolarHBondContact O-N 3.49Å; F980-L983 VanDerWaalsContact O-N 3.08Å; K981-L983 VanDerWaalsContact C-N 3.33Å; K981-L983 PolarHBondContact O-N 3.12Å; L983-P996 HydrophobicContact CD1-CG 4.14Å; L983-P996 HydrophobicContact CG-CB 4.39Å; L983-P996 HydrophobicContact CG-CG 4Å
984	I	74.9	Confident	68	Low	13 Å²	13	72.6 Å²	72.6	7%	0.067	37%	0.371	C	S	.	.	H	α-helix	trans	-77.4	-45.8	-177.2	-70	176	0	0	0	112.5	M971 L975 F980 K981 L997	M971-I984 HydrophobicContact CE-CD1 4.34Å; L975-I984 HydrophobicContact CD2-CD1 4.06Å; F980-I984 HydrophobicContact CD1-CD1 3.8Å; F980-I984 HydrophobicContact CE1-CD1 3.28Å; F980-I984 HydrophobicContact CE1-CG1 4.36Å; F980-I984 HydrophobicContact CE2-CD1 4.32Å; F980-I984 HydrophobicContact CZ-CD1 3.59Å; F980-I984 HydrophobicContact CZ-CG1 4.4Å; F980-I984 PolarHBondContact O-N 3.23Å; F980-I984 VanDerWaalsContact O-N 3.08Å; K981-I984 PolarHBondContact O-N 2.98Å; I984-L997 HydrophobicContact CG2-CD1 4.23Å; I984-L997 HydrophobicContact CG2-CD2 3.88Å; I984-L997 HydrophobicContact CG2-CG 4.22Å
985	Y	73	Confident	67.7	Low	94 Å²	94	75.4 Å²	75.4	37%	0.369	39%	0.386	S	S	.	.	H	α-helix	trans	-97.6	-13.4	-169.6	-63.4	-67.3	0	0	0	114.7	N796 K981	N796-Y985 PolarHBondContact ND2-OH 2.88Å; N796-Y985 VanDerWaalsContact ND2-OH 3.08Å; K981-Y985 HydrophobicContact CB-CD2 4.22Å; K981-Y985 WeakPolarHBondContact O-CB 3.41Å; K981-Y985 VanDerWaalsContact O-CD2 3.25Å; K981-Y985 WeakPolarHBondContact O-CD2 3.36Å; K981-Y985 PolarHBondContact O-N 3.25Å
986	S	69.9	Low	67.5	Low	45 Å²	45	75.4 Å²	75.4	32%	0.315	39%	0.386	S	S	.	.			trans	-72.2	135.5	-177.2	-175.5	0	0	0	0	112.1	Q982 N988 S989	Q982-S986 WeakPolarHBondContact O-CB 3.47Å; Q982-S986 PolarHBondContact O-N 3.19Å; Q982-S986 VanDerWaalsContact O-N 3.09Å; S986-N988 PolarHBondContact O-N 3.45Å; S986-N988 PolarHBondContact OG-N 3.15Å; S986-S989 PolarHBondContact O-OG 2.88Å
987	R	55.6	Low	67.5	Low	218 Å²	218	69.6 Å²	69.6	82%	0.823	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-20.1	171.3	-76.1	-177.1	174.5	-174.8	-2.6	113	S989	R987-S989 PolarHBondContact O-N 3.1Å
988	N	51.7	Low	67.5	Low	115 Å²	115	75 Å²	75	62%	0.615	38%	0.378	S	S	*	.	H	α-helix	trans	-75.5	-20.1	-175.5	-70.6	-7.2	0	0	0	113.6	S986 V991	S986-N988 PolarHBondContact O-N 3.45Å; S986-N988 PolarHBondContact OG-N 3.15Å; N988-V991 PolarHBondContact O-N 2.99Å
989	S	55	Low	67.7	Low	12 Å²	12	71.2 Å²	71.2	8%	0.084	36%	0.358	C	S	.	.	H	α-helix	trans	-65	-40.7	175.3	51.2	0	0	0	0	111.6	S986 R987 V991 Q992 L994	S986-S989 PolarHBondContact O-OG 2.88Å; R987-S989 PolarHBondContact O-N 3.1Å; S989-V991 VanDerWaalsContact C-N 3.31Å; S989-V991 PolarHBondContact O-N 3.49Å; S989-Q992 PolarHBondContact O-N 2.9Å; S989-Q992 VanDerWaalsContact O-N 3.15Å; S989-L994 CarbonylContact C-O 3.58Å; S989-L994 VanDerWaalsContact C-O 3.25Å; S989-L994 WeakPolarHBondContact O-CB 3.34Å; S989-L994 PolarHBondContact O-N 3.34Å; S989-L994 VanDerWaalsContact O-O 3.11Å
990	K	51.4	Low	68	Low	120 Å²	120	69.2 Å²	69.2	52%	0.522	34%	0.343	S	S	.	.	H	α-helix	trans	-64.6	-32.5	178.8	-64.3	-170.5	175.2	-168.9	0	114	Q992 G993	K990-Q992 VanDerWaalsContact C-N 3.26Å; K990-Q992 PolarHBondContact O-N 3.47Å; K990-G993 PolarHBondContact O-N 3.08Å
991	V	46.3	Very low	68.2	Low	126 Å²	126	70.7 Å²	70.7	76%	0.764	35%	0.35	S	S	*	.	H	α-helix	trans	-72.5	-23.5	179.1	-177	0	0	0	0	111.3	N988 S989	N988-V991 PolarHBondContact O-N 2.99Å; S989-V991 VanDerWaalsContact C-N 3.31Å; S989-V991 PolarHBondContact O-N 3.49Å
992	Q	52.8	Low	68.4	Low	141 Å²	141	71.6 Å²	71.6	66%	0.659	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	8.2	176.1	-68.5	179.1	-12.8	0	0	113.4	S989 K990 L994	S989-Q992 PolarHBondContact O-N 2.9Å; S989-Q992 VanDerWaalsContact O-N 3.15Å; K990-Q992 VanDerWaalsContact C-N 3.26Å; K990-Q992 PolarHBondContact O-N 3.47Å; Q992-L994 VanDerWaalsContact C-N 3.27Å; Q992-L994 HydrophobicContact CB-CD1 4.38Å; Q992-L994 HydrophobicContact CB-CG 4.43Å; Q992-L994 PolarHBondContact O-N 3.06Å
993	G	57.1	Low	68.5	Low	72 Å²	72	66.7 Å²	66.7	74%	0.742	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	11.8	-177.4	0	0	0	0	0	114.6	K990	K990-G993 PolarHBondContact O-N 3.08Å
994	L	62.1	Low	68.8	Low	10 Å²	10	66.4 Å²	66.4	5%	0.052	34%	0.341	C	S	.	.			trans	-91.5	118.6	175.5	-58.5	169.9	0	0	0	108.9	K952 S989 Q992 P996	K952-L994 HydrophobicContact CB-CD2 3.2Å; K952-L994 HydrophobicContact CD-CD2 4.4Å; K952-L994 HydrophobicContact CG-CD2 3.59Å; S989-L994 CarbonylContact C-O 3.58Å; S989-L994 VanDerWaalsContact C-O 3.25Å; S989-L994 WeakPolarHBondContact O-CB 3.34Å; S989-L994 PolarHBondContact O-N 3.34Å; S989-L994 VanDerWaalsContact O-O 3.11Å; Q992-L994 VanDerWaalsContact C-N 3.27Å; Q992-L994 HydrophobicContact CB-CD1 4.38Å; Q992-L994 HydrophobicContact CB-CG 4.43Å; Q992-L994 PolarHBondContact O-N 3.06Å; L994-P996 VanDerWaalsContact C-CD 3.47Å; L994-P996 HydrophobicContact CB-CG 4.5Å; L994-P996 WeakPolarHBondContact O-CD 3Å
995	D	71.4	Confident	69.1	Low	59 Å²	59	66.8 Å²	66.8	32%	0.316	35%	0.347	S	S	.	.			trans	-120.1	72.1	168.6	-162	8.7	0	0	0	110.8	L997 R998 D999	D995-L997 PolarHBondContact O-N 3.48Å; D995-L997 VanDerWaalsContact O-N 3.11Å; D995-R998 HydrophobicContact CB-CB 4.21Å; D995-R998 PolarHBondContact O-N 3.4Å; D995-R998 VanDerWaalsContact O-N 3.08Å; D995-R998 WeakPolarHBondContact OD2-CB 3.46Å; D995-D999 PolarHBondContact O-N 3.33Å; D995-D999 VanDerWaalsContact O-N 3.11Å
996	P	75.1	Confident	69.4	Low	5 Å²	5	64.6 Å²	64.6	3%	0.032	35%	0.352	C	S	.	.	H	α-helix	trans	-60.8	-28.8	-170	-20.5	32.2	0	0	0	113.2	Y948 L983 L994 L1000	Y948-P996 HydrophobicContact CE1-CB 4.15Å; Y948-P996 HydrophobicContact CE1-CG 4.11Å; Y948-P996 WeakPolarHBondContact OH-CA 3.48Å; L983-P996 HydrophobicContact CD1-CG 4.14Å; L983-P996 HydrophobicContact CG-CB 4.39Å; L983-P996 HydrophobicContact CG-CG 4Å; L994-P996 VanDerWaalsContact C-CD 3.47Å; L994-P996 HydrophobicContact CB-CG 4.5Å; L994-P996 WeakPolarHBondContact O-CD 3Å; P996-L1000 WeakPolarHBondContact O-CB 3.25Å; P996-L1000 WeakPolarHBondContact O-CD1 3.15Å; P996-L1000 WeakPolarHBondContact O-CG 3.43Å; P996-L1000 PolarHBondContact O-N 2.65Å
997	L	78.3	Confident	69.7	Low	19 Å²	19	63.8 Å²	63.8	10%	0.099	34%	0.342	C	S	.	.	H	α-helix	trans	-68.7	-42.3	178.4	-74.5	170.7	0	0	0	111.9	F784 L787 K788 I984 D995 Q1001	F784-L997 HydrophobicContact CD1-CD2 3.94Å; F784-L997 HydrophobicContact CE1-CD2 4.3Å; L787-L997 HydrophobicContact CD2-CD2 3.82Å; K788-L997 HydrophobicContact CB-CD1 4.33Å; K788-L997 HydrophobicContact CG-CD1 4.39Å; I984-L997 HydrophobicContact CG2-CD1 4.23Å; I984-L997 HydrophobicContact CG2-CD2 3.88Å; I984-L997 HydrophobicContact CG2-CG 4.22Å; D995-L997 PolarHBondContact O-N 3.48Å; D995-L997 VanDerWaalsContact O-N 3.11Å; L997-Q1001 WeakPolarHBondContact O-CB 3.37Å; L997-Q1001 PolarHBondContact O-N 3.19Å
998	R	79.7	Confident	70.7	Confident	165 Å²	165	53.7 Å²	53.7	62%	0.623	31%	0.305	S	S	*	.	H	α-helix	trans	-67.9	-40.2	176.9	-172.8	177.1	176.1	178.4	-2.1	110.8	D995 Q1001 T1002	D995-R998 HydrophobicContact CB-CB 4.21Å; D995-R998 PolarHBondContact O-N 3.4Å; D995-R998 VanDerWaalsContact O-N 3.08Å; D995-R998 WeakPolarHBondContact OD2-CB 3.46Å; R998-Q1001 WeakPolarHBondContact O-CB 3.38Å; R998-Q1001 PolarHBondContact O-N 3.28Å; R998-T1002 WeakPolarHBondContact O-CG2 2.91Å; R998-T1002 PolarHBondContact O-N 3.03Å; R998-T1002 PolarHBondContact O-OG1 2.7Å
999	D	80.2	Confident	71.8	Confident	36 Å²	36	52.4 Å²	52.4	19%	0.193	30%	0.295	C	S	.	.	H	α-helix	trans	-61.5	-50.3	175.8	-69.3	-21.8	0	0	0	111.3	Y948 K952 E964 D995 Q1001 T1002 A1003	Y948-D999 PolarHBondContact OH-OD2 3.4Å; K952-D999 WeakPolarHBondContact CE-OD2 3.33Å; K952-D999 VanDerWaalsContact NZ-CG 3.25Å; K952-D999 IonicContact NZ-OD1 3.34Å; K952-D999 IonicContact NZ-OD2 2.71Å; K952-D999 PolarHBondContact NZ-OD2 3.45Å; E964-D999 HydrophobicContact CG-CB 4.3Å; E964-D999 WeakPolarHBondContact OE1-CB 3.31Å; D995-D999 PolarHBondContact O-N 3.33Å; D995-D999 VanDerWaalsContact O-N 3.11Å; D999-Q1001 VanDerWaalsContact C-N 3.3Å; D999-Q1001 PolarHBondContact O-N 3.03Å; D999-T1002 PolarHBondContact O-N 3.19Å; D999-T1002 VanDerWaalsContact O-N 3.12Å; D999-T1002 PolarHBondContact O-OG1 3.14Å; D999-A1003 PolarHBondContact O-N 3.29Å
1000	L	82.4	Confident	72.7	Confident	3 Å²	3	54.8 Å²	54.8	2%	0.016	31%	0.311	C	S	.	.	H	α-helix	trans	-58.4	-41.3	175.3	-72.7	169.8	0	0	0	112.3	F784 E964 F967 L968 M971 P996 A1003 L1004	F784-L1000 HydrophobicContact CE1-CB 3.99Å; F784-L1000 HydrophobicContact CZ-CB 4.06Å; E964-L1000 HydrophobicContact CB-CD2 4.21Å; E964-L1000 HydrophobicContact CG-CD2 4.48Å; F967-L1000 HydrophobicContact CB-CD2 3.78Å; F967-L1000 HydrophobicContact CD2-CD2 4.19Å; L968-L1000 HydrophobicContact CD2-CB 4.29Å; L968-L1000 HydrophobicContact CD2-CD2 3.92Å; L968-L1000 HydrophobicContact CG-CD2 3.86Å; M971-L1000 HydrophobicContact CE-CD1 4.25Å; P996-L1000 WeakPolarHBondContact O-CB 3.25Å; P996-L1000 WeakPolarHBondContact O-CD1 3.15Å; P996-L1000 WeakPolarHBondContact O-CG 3.43Å; P996-L1000 PolarHBondContact O-N 2.65Å; L1000-A1003 PolarHBondContact O-N 3.03Å; L1000-L1004 WeakPolarHBondContact O-CB 3.34Å; L1000-L1004 PolarHBondContact O-N 3.09Å
1001	Q	83.4	Confident	73.5	Confident	32 Å²	32	51.4 Å²	51.4	15%	0.15	30%	0.301	C	S	.	.	H	α-helix	trans	-61.2	-46.1	175.3	-177.8	-173.5	-9	0	0	111.3	F784 L997 R998 D999 L1004 A1005	F784-Q1001 HydrophobicContact CD2-CB 3.8Å; F784-Q1001 HydrophobicContact CD2-CG 3.85Å; F784-Q1001 HydrophobicContact CE2-CB 3.77Å; F784-Q1001 HydrophobicContact CE2-CG 4.08Å; F784-Q1001 HydrophobicContact CG-CB 4.25Å; F784-Q1001 HydrophobicContact CZ-CB 4.16Å; L997-Q1001 WeakPolarHBondContact O-CB 3.37Å; L997-Q1001 PolarHBondContact O-N 3.19Å; R998-Q1001 WeakPolarHBondContact O-CB 3.38Å; R998-Q1001 PolarHBondContact O-N 3.28Å; D999-Q1001 VanDerWaalsContact C-N 3.3Å; D999-Q1001 PolarHBondContact O-N 3.03Å; Q1001-L1004 PolarHBondContact O-N 3.21Å; Q1001-A1005 WeakPolarHBondContact O-CB 3.23Å; Q1001-A1005 PolarHBondContact O-N 2.91Å
1002	T	82.6	Confident	74.3	Confident	83 Å²	83	46.8 Å²	46.8	51%	0.509	27%	0.27	S	S	.	.	H	α-helix	trans	-65.2	-39.7	178.3	56.4	0	0	0	0	112.7	R998 D999 A1005 G1006	R998-T1002 WeakPolarHBondContact O-CG2 2.91Å; R998-T1002 PolarHBondContact O-N 3.03Å; R998-T1002 PolarHBondContact O-OG1 2.7Å; D999-T1002 PolarHBondContact O-N 3.19Å; D999-T1002 VanDerWaalsContact O-N 3.12Å; D999-T1002 PolarHBondContact O-OG1 3.14Å; T1002-A1005 PolarHBondContact O-N 3.01Å; T1002-G1006 PolarHBondContact O-N 2.93Å
1003	A	80.3	Confident	74.6	Confident	27 Å²	27	43.7 Å²	43.7	22%	0.223	26%	0.26	C	S	.	.	H	α-helix	trans	-64.5	-42.7	176.9	0	0	0	0	0	111.8	E964 L968 D999 L1000 R1007	E964-A1003 HydrophobicContact CB-CB 4.1Å; L968-A1003 HydrophobicContact CD1-CB 4.13Å; D999-A1003 PolarHBondContact O-N 3.29Å; L1000-A1003 PolarHBondContact O-N 3.03Å; A1003-R1007 PolarHBondContact O-N 3.14Å
1004	L	81.4	Confident	74.6	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-69.8	-41.7	177.3	-164.4	147.1	0	0	0	111.5	L780 F803 C806 L968 L1000 Q1001 G1006 R1007 L1008	L780-L1004 HydrophobicContact CD1-CD2 3.4Å; L780-L1004 HydrophobicContact CD2-CD2 3.28Å; L780-L1004 HydrophobicContact CG-CD2 3.93Å; F803-L1004 HydrophobicContact CB-CD1 3.95Å; F803-L1004 HydrophobicContact CD1-CD1 3.89Å; F803-L1004 HydrophobicContact CG-CD1 4.24Å; C806-L1004 HydrophobicContact CB-CD2 4.45Å; L968-L1004 HydrophobicContact CD1-CB 3.73Å; L968-L1004 HydrophobicContact CD1-CD1 4.25Å; L968-L1004 HydrophobicContact CD1-CG 4.35Å; L968-L1004 HydrophobicContact CD2-CB 4.42Å; L968-L1004 HydrophobicContact CD2-CD1 3.84Å; L1000-L1004 WeakPolarHBondContact O-CB 3.34Å; L1000-L1004 PolarHBondContact O-N 3.09Å; Q1001-L1004 PolarHBondContact O-N 3.21Å; L1004-G1006 PolarHBondContact O-N 2.89Å; L1004-R1007 PolarHBondContact O-N 3.25Å; L1004-L1008 HydrophobicContact CD2-CD1 3.5Å; L1004-L1008 HydrophobicContact CD2-CG 3.95Å; L1004-L1008 PolarHBondContact O-N 3.45Å
1005	A	81.6	Confident	74.1	Confident	21 Å²	21	47.9 Å²	47.9	17%	0.174	28%	0.275	C	S	.	.	H	α-helix	trans	-59.4	-45.6	175.3	0	0	0	0	0	111.9	V776 L780 Q1001 T1002 R1007 L1008 H1009	V776-A1005 HydrophobicContact CG1-CB 3.69Å; L780-A1005 HydrophobicContact CD1-CB 3.9Å; Q1001-A1005 WeakPolarHBondContact O-CB 3.23Å; Q1001-A1005 PolarHBondContact O-N 2.91Å; T1002-A1005 PolarHBondContact O-N 3.01Å; A1005-R1007 VanDerWaalsContact C-N 3.3Å; A1005-R1007 PolarHBondContact O-N 2.82Å; A1005-L1008 PolarHBondContact O-N 3.38Å; A1005-H1009 WeakPolarHBondContact O-CB 3.44Å; A1005-H1009 PolarHBondContact O-N 3.24Å
1006	G	79	Confident	73	Confident	47 Å²	47	53.4 Å²	53.4	49%	0.485	29%	0.291	S	S	.	.	H	α-helix	trans	-60.9	-37.3	177.4	0	0	0	0	0	113	T1002 L1004 S1010	T1002-G1006 PolarHBondContact O-N 2.93Å; L1004-G1006 PolarHBondContact O-N 2.89Å; G1006-S1010 PolarHBondContact O-N 3.11Å; G1006-S1010 VanDerWaalsContact O-N 3.16Å
1007	R	76.5	Confident	71.2	Confident	29 Å²	29	61.5 Å²	61.5	11%	0.109	34%	0.34	C	S	.	.	H	α-helix	trans	-76.1	-40.2	177.6	-166.3	165.2	-174.5	122.2	-7.2	113	Y807 S810 P811 A1003 L1004 A1005 H1009 S1010 V1011	Y807-R1007 VanDerWaalsContact CE1-CZ 3.41Å; Y807-R1007 VanDerWaalsContact CZ-NH1 3.31Å; Y807-R1007 PolarHBondContact O-NE 2.96Å; Y807-R1007 PolarHBondContact OH-NH1 3.33Å; S810-R1007 VanDerWaalsContact C-NH2 3.27Å; S810-R1007 PolarHBondContact O-NH2 3.47Å; S810-R1007 PolarHBondContact OG-NH2 2.84Å; P811-R1007 PolarHBondContact O-NH1 3.03Å; P811-R1007 PolarHBondContact O-NH2 2.89Å; A1003-R1007 PolarHBondContact O-N 3.14Å; L1004-R1007 PolarHBondContact O-N 3.25Å; A1005-R1007 VanDerWaalsContact C-N 3.3Å; A1005-R1007 PolarHBondContact O-N 2.82Å; R1007-H1009 PolarHBondContact O-N 2.63Å; R1007-S1010 PolarHBondContact O-N 2.99Å; R1007-S1010 PolarHBondContact O-OG 3.18Å; R1007-V1011 WeakPolarHBondContact O-CG2 3.43Å; R1007-V1011 PolarHBondContact O-N 2.92Å
1008	L	76.6	Confident	70.8	Confident	6 Å²	6	63.6 Å²	63.6	3%	0.031	35%	0.352	C	S	.	.	H	α-helix	trans	-62.9	-35.6	172.2	-77.9	-178.5	0	0	0	111.4	Y771 L775 V776 L780 C806 L1004 A1005 V1011 Y1012	Y771-L1008 HydrophobicContact CD2-CD2 4.04Å; Y771-L1008 HydrophobicContact CE2-CD2 4.2Å; L775-L1008 HydrophobicContact CD2-CD1 4.32Å; L775-L1008 HydrophobicContact CG-CD1 4.44Å; V776-L1008 HydrophobicContact CG2-CB 3.87Å; V776-L1008 HydrophobicContact CG2-CD1 4.4Å; L780-L1008 HydrophobicContact CD1-CD1 4.1Å; L780-L1008 HydrophobicContact CD2-CD1 3.97Å; L780-L1008 HydrophobicContact CG-CD1 4.29Å; C806-L1008 HydrophobicContact CB-CD2 4.24Å; L1004-L1008 HydrophobicContact CD2-CD1 3.5Å; L1004-L1008 HydrophobicContact CD2-CG 3.95Å; L1004-L1008 PolarHBondContact O-N 3.45Å; A1005-L1008 PolarHBondContact O-N 3.38Å; L1008-V1011 PolarHBondContact O-N 2.77Å; L1008-Y1012 WeakPolarHBondContact O-CB 3.13Å; L1008-Y1012 PolarHBondContact O-N 2.89Å
1009	H	75.2	Confident	70.4	Confident	88 Å²	88	58.3 Å²	58.3	41%	0.407	34%	0.338	S	S	.	.	H	α-helix	trans	-65.3	-38.3	175.1	-157.6	72.7	0	0	0	112	A1005 R1007 Y1012 V1013	A1005-H1009 WeakPolarHBondContact O-CB 3.44Å; A1005-H1009 PolarHBondContact O-N 3.24Å; R1007-H1009 PolarHBondContact O-N 2.63Å; H1009-Y1012 PolarHBondContact O-N 3.19Å; H1009-V1013 WeakPolarHBondContact O-CB 3.36Å; H1009-V1013 WeakPolarHBondContact O-CG2 3.37Å; H1009-V1013 PolarHBondContact O-N 2.97Å
1010	S	72.7	Confident	69.8	Low	62 Å²	62	59.5 Å²	59.5	43%	0.434	35%	0.346	S	S	.	.	H	α-helix	trans	-69.5	-37.2	175.2	68.4	0	0	0	0	113	G1006 R1007 T1014	G1006-S1010 PolarHBondContact O-N 3.11Å; G1006-S1010 VanDerWaalsContact O-N 3.16Å; R1007-S1010 PolarHBondContact O-N 2.99Å; R1007-S1010 PolarHBondContact O-OG 3.18Å; S1010-T1014 WeakPolarHBondContact O-CB 3.05Å; S1010-T1014 WeakPolarHBondContact O-CG2 3.1Å; S1010-T1014 PolarHBondContact O-N 2.82Å; S1010-T1014 PolarHBondContact O-OG1 3.45Å
1011	V	68.2	Low	69.1	Low	49 Å²	49	62.8 Å²	62.8	30%	0.297	37%	0.365	S	S	.	.	H	α-helix	trans	-65.3	-43.9	172.8	174.5	0	0	0	0	110.9	R1007 L1008 T1014 S1015	R1007-V1011 WeakPolarHBondContact O-CG2 3.43Å; R1007-V1011 PolarHBondContact O-N 2.92Å; L1008-V1011 PolarHBondContact O-N 2.77Å; V1011-T1014 WeakPolarHBondContact CA-OG1 3.34Å; V1011-T1014 PolarHBondContact O-N 3.35Å; V1011-T1014 PolarHBondContact O-OG1 3.27Å; V1011-S1015 PolarHBondContact O-N 3.01Å; V1011-S1015 VanDerWaalsContact O-N 3.08Å
1012	Y	63.2	Low	68.2	Low	29 Å²	29	64.8 Å²	64.8	11%	0.114	38%	0.379	C	S	.	.	H	α-helix	trans	-61.3	-48	176.5	176.2	-108.4	0	0	0	112.3	Y771 E773 L1008 H1009 T1014 S1015 R1016	Y771-Y1012 WeakPolarHBondContact O-CD2 3.44Å; Y771-Y1012 WeakPolarHBondContact O-CE2 3.44Å; E773-Y1012 HydrophobicContact CG-CE1 3.91Å; L1008-Y1012 WeakPolarHBondContact O-CB 3.13Å; L1008-Y1012 PolarHBondContact O-N 2.89Å; H1009-Y1012 PolarHBondContact O-N 3.19Å; Y1012-T1014 VanDerWaalsContact C-N 3.31Å; Y1012-T1014 PolarHBondContact O-N 3.16Å; Y1012-S1015 PolarHBondContact O-N 3.38Å; Y1012-S1015 PolarHBondContact O-OG 2.89Å; Y1012-R1016 PolarHBondContact OH-NE 3.48Å; Y1012-R1016 PolarHBondContact OH-NH2 3.04Å
1013	V	60.2	Low	67.2	Low	75 Å²	75	63.5 Å²	63.5	46%	0.455	37%	0.37	S	S	.	.	H	α-helix	trans	-63.5	-36.3	178.6	170.9	0	0	0	0	111.7	H1009	H1009-V1013 WeakPolarHBondContact O-CB 3.36Å; H1009-V1013 WeakPolarHBondContact O-CG2 3.37Å; H1009-V1013 PolarHBondContact O-N 2.97Å
1014	T	55.9	Low	66.3	Low	100 Å²	100	66.1 Å²	66.1	61%	0.613	38%	0.381	S	S	*	.	H	α-helix	trans	-74.9	-21.8	177.9	47.3	0	0	0	0	114	S1010 V1011 Y1012	S1010-T1014 WeakPolarHBondContact O-CB 3.05Å; S1010-T1014 WeakPolarHBondContact O-CG2 3.1Å; S1010-T1014 PolarHBondContact O-N 2.82Å; S1010-T1014 PolarHBondContact O-OG1 3.45Å; V1011-T1014 WeakPolarHBondContact CA-OG1 3.34Å; V1011-T1014 PolarHBondContact O-N 3.35Å; V1011-T1014 PolarHBondContact O-OG1 3.27Å; Y1012-T1014 VanDerWaalsContact C-N 3.31Å; Y1012-T1014 PolarHBondContact O-N 3.16Å
1015	S	51.3	Low	65.1	Low	70 Å²	70	71.2 Å²	71.2	49%	0.49	41%	0.41	S	S	.	.	H	α-helix	trans	-78.9	-17.1	176.8	71.5	0	0	0	0	115	V1011 Y1012	V1011-S1015 PolarHBondContact O-N 3.01Å; V1011-S1015 VanDerWaalsContact O-N 3.08Å; Y1012-S1015 PolarHBondContact O-N 3.38Å; Y1012-S1015 PolarHBondContact O-OG 2.89Å
1016	R	48.4	Very low	63.7	Low	175 Å²	175	75.4 Å²	75.4	66%	0.66	43%	0.43	S	S	*	.			trans	-100.5	-7.3	-179.2	-77.7	-167.9	173.6	-160.9	0.1	114.6	Y1012	Y1012-R1016 PolarHBondContact OH-NE 3.48Å; Y1012-R1016 PolarHBondContact OH-NH2 3.04Å
1017	V	37.7	Very low	62.3	Low	175 Å²	175	78 Å²	78	100%	1.061	43%	0.425	S	S	*	.			trans	-97.5	0	173.6	179.9	0	0	0	0	108.1

Retrieved 1,017 of 1,017 residues in 299.2 ms (Link to these results)

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