A0A087Y8Q7_POEFO Loading...

Short transient receptor potential channel 1

AlphaFold DB , UniProt , Accession A0A087Y8Q7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 805 aa.

						>A0A087Y8Q7_POEFO|A0A087Y8Q7
MHISAWPYSLSVVMAALYQGTDTSSPDKFLALKDVREVKEETTLDEKLFLLACEKGDYYMVKKLLEENRHGELNVNCVDVLGRDAVTITIENENLDILQLLLEHGCQATDALLVAIDSEVVGAVDILLNHRPRRSSKPSIAKLMQRIQNPEYSTTMDVAPVILAAHRNNYEILTMLLKQDISLPRPHAVGCECMLCNAKNKKDSLRHSRFRLDIYRCLASPSLIMLTEEDPILRAFELSADLKELSLVEVEFRNDYEELAKQCKMFAKDLLAQARNSRELEVILNHTSSDDHVDKRGLLEERMNLSRLKLAIKYNQKEFVAQSNCQQFLNTVWFGEMASYRRKHTCLKMGTVLSLALLWPLLSICYLLVPRSRVGQIIHTPFVKFIIHSASYFTFLLLLNLYSLVYNEGKKNMMGPPLEMIDYLLILWIIGMVWSDVKRLWYEGLEDFLEESRNQLSFVMNSLYLATFTLRIVAHSKFKNCKNDTDTSTPERKDWDAFHPILVAEGLFAFANVLSYLRLFFMYTTSSILGPLQISMGQMLQEFGKFLGLFLLVLFSFTIGLTQLYGKDYAKETKGQSNQTKDCEGIFCQQQSNDAFHTFMGTCYALFWYIFSLAHVALFVTRISYTEELRSFVGALIIGTYNIVVVIVLTKLLVAMLHKSFRQIANHEDKEWKFARAKLWLSYFDDKCTLPPPLNVLTSPKTVCYLVTSLRKWICSHTTKGKVKRQNSLKEWKNLKQKRDENYQKIMCCLVHRYLTSTRQKMQSMDQATVENLNDLRQDLSKFRNEMRDLLGFRTSKYAMFYPRS
					

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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	34.6	Very low	32.4	Very low	234 Å²	234	152.2 Å²	152.2	100%	1.153	81%	0.808	S	S	*	*				0	77.3	0	-78.5	172.7	150.6	0	0	106.8
2	H	31.2	Very low	33	Very low	192 Å²	192	147.8 Å²	147.8	89%	0.889	79%	0.791	S	S	*	*				47.7	78.4	67.7	-94	-64.6	0	0	0	112.8
3	I	29.2	Very low	33.1	Very low	166 Å²	166	145.1 Å²	145.1	85%	0.851	78%	0.783	S	S	*	*			trans	-139.3	104.9	151.5	-59.8	-176.7	0	0	0	107.5
4	S	29.1	Very low	33	Very low	93 Å²	93	147.3 Å²	147.3	65%	0.65	79%	0.789	S	S	*	*			trans	-75.5	127.5	169.5	46.4	0	0	0	0	110.3
5	A	29.1	Very low	33	Very low	99 Å²	99	142.4 Å²	142.4	82%	0.818	78%	0.777	S	S	*	*			trans	-96.3	125.7	162.2	0	0	0	0	0	108.7
6	W	33	Very low	33.1	Very low	217 Å²	217	138.8 Å²	138.8	82%	0.822	77%	0.772	S	S	*	*			trans	-116.1	132.6	168.9	-83.8	56.8	0	0	0	108.5
7	P	35.9	Very low	33.1	Very low	100 Å²	100	140 Å²	140	65%	0.649	78%	0.776	S	S	*	*			trans	-116	136.7	148.8	13.4	7.2	0	0	0	111
8	Y	33.2	Very low	33.1	Very low	219 Å²	219	144 Å²	144	86%	0.859	78%	0.779	S	S	*	*	S	Bend	trans	39.7	109.4	145.1	-59.1	-82.8	0	0	0	119.7
9	S	32.3	Very low	33.3	Very low	93 Å²	93	146.2 Å²	146.2	65%	0.65	78%	0.783	S	S	*	*			trans	159.4	76.8	132	50.2	0	0	0	0	112.4	S11	S9-S11 VanDerWaalsContact C-N 3.3Å; S9-S11 PolarHBondContact O-N 3.36Å
10	L	33.8	Very low	33.1	Very low	158 Å²	158	142.7 Å²	142.7	83%	0.827	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	25.2	175.8	-118.1	149.2	0	0	0	113.2
11	S	35.3	Very low	33.5	Very low	103 Å²	103	142.2 Å²	142.2	72%	0.72	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104	-1.8	175.9	62.4	0	0	0	0	114.1	S9	S9-S11 VanDerWaalsContact C-N 3.3Å; S9-S11 PolarHBondContact O-N 3.36Å
12	V	39.2	Very low	33.3	Very low	100 Å²	100	138.8 Å²	138.8	61%	0.606	77%	0.771	S	S	*	*	S	Bend	trans	-111.2	-16.7	-171.4	-176.8	0	0	0	0	113.6
13	V	34.3	Very low	33.9	Very low	112 Å²	112	136.4 Å²	136.4	68%	0.679	77%	0.77	S	S	*	*	S	Bend	trans	-85.9	-18.5	-176	-176.4	0	0	0	0	113.6
14	M	32	Very low	34.3	Very low	176 Å²	176	133.4 Å²	133.4	87%	0.867	76%	0.764	S	S	*	*	S	Bend	trans	-80.2	-13.9	174.9	-101.7	-177.7	165.9	0	0	114.2
15	A	33.2	Very low	34.6	Very low	74 Å²	74	132.4 Å²	132.4	61%	0.612	76%	0.757	S	S	*	*	S	Bend	trans	-84.8	-15.3	-178.4	0	0	0	0	0	113.8
16	A	34.1	Very low	35.2	Very low	84 Å²	84	133 Å²	133	69%	0.694	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-4.1	-174	0	0	0	0	0	114.8
17	L	32.9	Very low	35.9	Very low	160 Å²	160	128 Å²	128	84%	0.838	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	2	175.7	-81.2	164.2	0	0	0	113.7
18	Y	32.8	Very low	36.2	Very low	212 Å²	212	131.1 Å²	131.1	83%	0.831	75%	0.745	S	S	*	*			trans	-113.8	35.2	-178.8	-88.1	-78.6	0	0	0	113.7
19	Q	37.2	Very low	36.5	Very low	185 Å²	185	129.5 Å²	129.5	86%	0.864	74%	0.743	S	S	*	*			trans	-123.4	69.1	165.1	-78	-175.6	-18.8	0	0	110
20	G	29.6	Very low	37.1	Very low	76 Å²	76	130.7 Å²	130.7	78%	0.784	74%	0.741	S	S	*	*			trans	-85	109.7	156.6	0	0	0	0	0	108.5	D22	G20-D22 PolarHBondContact O-N 3.36Å
21	T	40.8	Very low	37.4	Very low	134 Å²	134	125.4 Å²	125.4	82%	0.822	72%	0.721	S	S	*	*			trans	-62.1	112.7	167	44.6	0	0	0	0	109.6
22	D	31.1	Very low	37.7	Very low	161 Å²	161	126.7 Å²	126.7	86%	0.861	72%	0.719	S	S	*	*			trans	-153.8	111	157.2	-92.2	-30.1	0	0	0	110.6	G20	G20-D22 PolarHBondContact O-N 3.36Å
23	T	43.8	Very low	37.7	Very low	142 Å²	142	130.1 Å²	130.1	87%	0.871	73%	0.726	S	S	*	*			trans	-85	98.1	168.1	46.5	0	0	0	0	108.9
24	S	37.1	Very low	38	Very low	104 Å²	104	130.9 Å²	130.9	73%	0.727	73%	0.726	S	S	*	*			trans	179.4	140.4	151	45.6	0	0	0	0	113.9
25	S	36.3	Very low	38.4	Very low	72 Å²	72	128 Å²	128	50%	0.503	72%	0.718	S	S	.	*			trans	79.6	118.6	169.7	74.1	0	0	0	0	118.4	D27	S25-D27 PolarHBondContact O-N 3.11Å
26	P	42	Very low	38.9	Very low	110 Å²	110	134.2 Å²	134.2	71%	0.714	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	5.7	171.7	27.3	-25.4	0	0	0	114.4
27	D	46.3	Very low	39.5	Very low	112 Å²	112	138.8 Å²	138.8	60%	0.599	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-12.7	-171.3	-65.7	-30.5	0	0	0	114.9	S25 F29 L30 A31	S25-D27 PolarHBondContact O-N 3.11Å; D27-F29 PolarHBondContact O-N 3.18Å; D27-L30 PolarHBondContact O-N 3.06Å; D27-A31 PolarHBondContact O-N 3.49Å
28	K	42.4	Very low	40	Very low	166 Å²	166	134.5 Å²	134.5	72%	0.722	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-23.2	-179.1	-89.2	-179.9	177.3	173.1	0	114.8
29	F	41.1	Very low	40.8	Very low	186 Å²	186	131.6 Å²	131.6	82%	0.816	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-17.1	175.3	-75.8	-80.3	0	0	0	113.1	D27	D27-F29 PolarHBondContact O-N 3.18Å
30	L	43.1	Very low	41.5	Very low	117 Å²	117	130.5 Å²	130.5	61%	0.613	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-27.6	170.8	-84.9	151.5	0	0	0	112.2	D27 L32 K33	D27-L30 PolarHBondContact O-N 3.06Å; L30-L32 VanDerWaalsContact C-N 3.32Å; L30-L32 PolarHBondContact O-N 3.34Å; L30-K33 WeakPolarHBondContact O-CB 3.22Å; L30-K33 PolarHBondContact O-N 3.32Å
31	A	40.9	Very low	42.8	Very low	48 Å²	48	135.2 Å²	135.2	40%	0.397	70%	0.701	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.8	-17.9	179.7	0	0	0	0	0	115.1	D27 K33 D34	D27-A31 PolarHBondContact O-N 3.49Å; A31-K33 PolarHBondContact O-N 2.73Å; A31-D34 PolarHBondContact O-N 3.44Å
32	L	41.2	Very low	43.9	Very low	129 Å²	129	129.8 Å²	129.8	68%	0.675	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-11.4	174.9	-88.5	158.9	0	0	0	113.3	L30 D34	L30-L32 VanDerWaalsContact C-N 3.32Å; L30-L32 PolarHBondContact O-N 3.34Å; L32-D34 VanDerWaalsContact C-N 3.34Å
33	K	39.7	Very low	46.1	Very low	172 Å²	172	125.3 Å²	125.3	75%	0.748	65%	0.646	S	S	*	*	S	Bend	trans	-75.1	-27.7	169.7	-130.5	178.4	-178.7	-175.5	0	111.6	L30 A31	L30-K33 WeakPolarHBondContact O-CB 3.22Å; L30-K33 PolarHBondContact O-N 3.32Å; A31-K33 PolarHBondContact O-N 2.73Å
34	D	41.5	Very low	47.8	Very low	128 Å²	128	125.2 Å²	125.2	68%	0.684	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-11.8	-176	-64.8	-20.7	0	0	0	113.8	A31 L32	A31-D34 PolarHBondContact O-N 3.44Å; L32-D34 VanDerWaalsContact C-N 3.34Å
35	V	39.4	Very low	49.8	Very low	116 Å²	116	124.7 Å²	124.7	70%	0.703	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-12.6	178.5	-174.4	0	0	0	0	112.6	E37	V35-E37 VanDerWaalsContact C-N 3.32Å; V35-E37 PolarHBondContact O-N 3.39Å
36	R	44.6	Very low	52	Low	204 Å²	204	122.2 Å²	122.2	77%	0.77	61%	0.609	S	S	*	*	S	Bend	trans	-77.1	98.8	151.8	-70.5	-177.9	-158.6	179.6	5.2	104.4	V38	R36-V38 HydrophobicContact CB-CG2 4.04Å; R36-V38 PolarHBondContact O-N 3.1Å
37	E	45.5	Very low	54	Low	181 Å²	181	122 Å²	122	85%	0.846	60%	0.597	S	S	*	*			trans	-58.7	76.1	155	-73.5	179.4	170.7	0	0	107	V35 K39	V35-E37 VanDerWaalsContact C-N 3.32Å; V35-E37 PolarHBondContact O-N 3.39Å; E37-K39 VanDerWaalsContact C-N 3.33Å; E37-K39 PolarHBondContact O-N 3.28Å
38	V	44.8	Very low	55.9	Low	69 Å²	69	120.2 Å²	120.2	42%	0.418	59%	0.587	S	S	.	*			trans	-62.6	109.1	158.1	-178.4	0	0	0	0	101.9	R36 E40 V80	R36-V38 HydrophobicContact CB-CG2 4.04Å; R36-V38 PolarHBondContact O-N 3.1Å; V38-E40 HydrophobicContact CG1-CG 4.04Å; V38-E40 PolarHBondContact O-N 2.77Å; V38-V80 HydrophobicContact CG1-CG1 3.96Å
39	K	49.1	Very low	58	Low	152 Å²	152	112.3 Å²	112.3	66%	0.661	55%	0.553	S	S	*	*			trans	-60.3	80	170.1	-79.5	-178.8	173.1	-179.8	0	107.9	E37 E41 V78	E37-K39 VanDerWaalsContact C-N 3.33Å; E37-K39 PolarHBondContact O-N 3.28Å; K39-E41 PolarHBondContact O-N 2.94Å; K39-V78 HydrophobicContact CD-CG2 4.43Å
40	E	52	Low	60.2	Low	161 Å²	161	103.9 Å²	103.9	75%	0.752	52%	0.516	S	S	*	.			trans	-86	35.6	176.3	-110.9	-178.4	-169.1	0	0	110.4	V38	V38-E40 HydrophobicContact CG1-CG 4.04Å; V38-E40 PolarHBondContact O-N 2.77Å
41	E	56	Low	62.3	Low	176 Å²	176	102 Å²	102	82%	0.822	51%	0.506	S	S	*	.			trans	-103.8	28.5	179.6	-64.6	-170.3	165.9	0	0	112.4	K39	K39-E41 PolarHBondContact O-N 2.94Å
42	T	64	Low	64.4	Low	20 Å²	20	100 Å²	100	12%	0.123	49%	0.49	C	S	.	.			trans	-90.1	119.9	170.4	44.7	0	0	0	0	110.8	E46 K47 V78	T42-E46 WeakPolarHBondContact CA-OE2 3.34Å; T42-K47 WeakPolarHBondContact O-CE 3.42Å; T42-K47 WeakPolarHBondContact OG1-CE 3.45Å; T42-V78 WeakPolarHBondContact CG2-O 3.46Å
43	T	77.5	Confident	66.6	Low	66 Å²	66	93.8 Å²	93.8	41%	0.405	46%	0.457	S	S	.	.			trans	-65.1	160.8	175.1	60.9	0	0	0	0	111	D45 E46 K47	T43-D45 PolarHBondContact O-N 3.35Å; T43-E46 PolarHBondContact N-OE2 3.28Å; T43-E46 PolarHBondContact O-N 3.07Å; T43-E46 WeakPolarHBondContact OG1-CB 3.44Å; T43-E46 WeakPolarHBondContact OG1-CG 3.47Å; T43-E46 PolarHBondContact OG1-N 2.88Å; T43-E46 PolarHBondContact OG1-OE2 3.43Å; T43-K47 PolarHBondContact O-N 2.99Å
44	L	80	Confident	68.8	Low	141 Å²	141	89.7 Å²	89.7	74%	0.738	44%	0.441	S	S	*	.	H	α-helix	trans	-58.1	-37.6	179.2	-169.8	77.4	0	0	0	111.4	K47 L48	L44-K47 PolarHBondContact O-N 3.49Å; L44-L48 WeakPolarHBondContact O-CB 3.36Å; L44-L48 PolarHBondContact O-N 3.26Å
45	D	79.3	Confident	70.8	Confident	93 Å²	93	88.6 Å²	88.6	50%	0.497	43%	0.43	S	S	.	.	H	α-helix	trans	-71	-36.9	179.2	-62.7	-29.2	0	0	0	111.7	T43 L48 F49 L73	T43-D45 PolarHBondContact O-N 3.35Å; D45-L48 PolarHBondContact O-N 2.95Å; D45-F49 WeakPolarHBondContact O-CB 3.48Å; D45-F49 PolarHBondContact O-N 3.39Å; D45-L73 HydrophobicContact CB-CD1 3.82Å; D45-L73 WeakPolarHBondContact O-CD1 3.26Å
46	E	82.3	Confident	72.8	Confident	19 Å²	19	83.1 Å²	83.1	9%	0.089	40%	0.397	C	S	.	.	H	α-helix	trans	-65.8	-41.8	172.4	-74.6	165.3	-179	0	0	112.2	T42 T43 L48 F49 L50 L73 N74 C77	T42-E46 WeakPolarHBondContact CA-OE2 3.34Å; T43-E46 PolarHBondContact N-OE2 3.28Å; T43-E46 PolarHBondContact O-N 3.07Å; T43-E46 WeakPolarHBondContact OG1-CB 3.44Å; T43-E46 WeakPolarHBondContact OG1-CG 3.47Å; T43-E46 PolarHBondContact OG1-N 2.88Å; T43-E46 PolarHBondContact OG1-OE2 3.43Å; E46-L48 VanDerWaalsContact C-N 3.28Å; E46-L48 PolarHBondContact O-N 3.03Å; E46-F49 PolarHBondContact O-N 3.36Å; E46-L50 WeakPolarHBondContact O-CG 3.39Å; E46-L50 PolarHBondContact O-N 3.43Å; E46-L73 HydrophobicContact CB-CD1 4.48Å; E46-L73 HydrophobicContact CG-CD1 3.94Å; E46-L73 HydrophobicContact CG-CG 4.27Å; E46-N74 VanDerWaalsContact OE1-CB 3.26Å; E46-N74 WeakPolarHBondContact OE1-CB 3.38Å; E46-N74 PolarHBondContact OE1-N 3.45Å; E46-C77 HydrophobicContact CB-CB 4.04Å; E46-C77 HydrophobicContact CG-CB 3.85Å
47	K	83.9	Confident	74.8	Confident	106 Å²	106	74.3 Å²	74.3	46%	0.461	37%	0.365	S	S	.	.	H	α-helix	trans	-61.3	-40.5	173.2	-71.6	179.5	-177.3	176	0	111.1	T42 T43 L44 L51	T42-K47 WeakPolarHBondContact O-CE 3.42Å; T42-K47 WeakPolarHBondContact OG1-CE 3.45Å; T43-K47 PolarHBondContact O-N 2.99Å; L44-K47 PolarHBondContact O-N 3.49Å; K47-L51 WeakPolarHBondContact O-CB 3.43Å; K47-L51 PolarHBondContact O-N 3.26Å
48	L	85.4	Confident	76.6	Confident	75 Å²	75	70.1 Å²	70.1	39%	0.393	34%	0.343	S	S	.	.	H	α-helix	trans	-69.4	-36.9	179	-165.9	138.9	0	0	0	111.8	L44 D45 E46 A52 M60 L64	L44-L48 WeakPolarHBondContact O-CB 3.36Å; L44-L48 PolarHBondContact O-N 3.26Å; D45-L48 PolarHBondContact O-N 2.95Å; E46-L48 VanDerWaalsContact C-N 3.28Å; E46-L48 PolarHBondContact O-N 3.03Å; L48-A52 WeakPolarHBondContact O-CB 3.45Å; L48-A52 PolarHBondContact O-N 3.3Å; L48-M60 HydrophobicContact CD2-CE 3.47Å; L48-M60 VanDerWaalsContact CD2-CE 3.47Å; L48-L64 HydrophobicContact CD2-CD1 3.92Å
49	F	87.2	Confident	78.5	Confident	0 Å²	0	72 Å²	72	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-63.8	-49.2	172.4	172.5	-107.6	0	0	0	112.5	D45 E46 L51 A52 C53 V61 L64 L65 L73 V75 A85 L101	D45-F49 WeakPolarHBondContact O-CB 3.48Å; D45-F49 PolarHBondContact O-N 3.39Å; E46-F49 PolarHBondContact O-N 3.36Å; F49-L51 PolarHBondContact O-N 2.87Å; F49-A52 WeakPolarHBondContact O-CB 3.19Å; F49-A52 PolarHBondContact O-N 3.48Å; F49-C53 PolarHBondContact O-N 2.82Å; F49-C53 PolarHBondContact O-SG 3.14Å; F49-V61 HydrophobicContact CE2-CG1 4Å; F49-L64 HydrophobicContact CB-CD1 4.14Å; F49-L64 HydrophobicContact CD2-CB 4.35Å; F49-L64 HydrophobicContact CD2-CD1 4.24Å; F49-L65 HydrophobicContact CE2-CD2 3.94Å; F49-L65 HydrophobicContact CE2-CG 4.1Å; F49-L65 HydrophobicContact CZ-CD2 4.19Å; F49-L73 HydrophobicContact CB-CD1 4.05Å; F49-L73 HydrophobicContact CB-CD2 4.35Å; F49-L73 HydrophobicContact CD1-CD2 4.44Å; F49-L73 HydrophobicContact CD2-CD2 4.23Å; F49-L73 HydrophobicContact CG-CD2 4.1Å; F49-V75 HydrophobicContact CE1-CG1 4.49Å; F49-V75 HydrophobicContact CZ-CG1 4.13Å; F49-A85 HydrophobicContact CD1-CB 4.49Å; F49-A85 HydrophobicContact CE1-CB 3.58Å; F49-A85 HydrophobicContact CZ-CB 4.06Å; F49-L101 HydrophobicContact CE2-CD2 4.34Å; F49-L101 HydrophobicContact CZ-CD2 3.76Å
50	L	87.3	Confident	80.1	Confident	9 Å²	9	66.5 Å²	66.5	5%	0.047	32%	0.32	C	S	.	.	H	α-helix	trans	-62.7	-42.3	177.5	-68.5	171.4	0	0	0	111.5	E46 A52 C53 E54 D79 A85 I88	E46-L50 WeakPolarHBondContact O-CG 3.39Å; E46-L50 PolarHBondContact O-N 3.43Å; L50-A52 VanDerWaalsContact C-N 3.31Å; L50-A52 PolarHBondContact O-N 2.84Å; L50-C53 WeakPolarHBondContact O-CB 3.1Å; L50-C53 PolarHBondContact O-N 3.35Å; L50-E54 WeakPolarHBondContact O-CB 3.35Å; L50-E54 PolarHBondContact O-N 3.37Å; L50-D79 HydrophobicContact CD1-CB 4.36Å; L50-A85 HydrophobicContact CD2-CB 3.95Å; L50-I88 HydrophobicContact CB-CD1 4.46Å; L50-I88 HydrophobicContact CD2-CD1 3.91Å
51	L	87.1	Confident	81.8	Confident	76 Å²	76	58.8 Å²	58.8	40%	0.398	28%	0.284	S	S	.	.	H	α-helix	trans	-64.3	-34.4	175.4	-168.4	99.5	0	0	0	112.3	K47 F49 K55	K47-L51 WeakPolarHBondContact O-CB 3.43Å; K47-L51 PolarHBondContact O-N 3.26Å; F49-L51 PolarHBondContact O-N 2.87Å; L51-K55 HydrophobicContact CD2-CD 4.22Å; L51-K55 HydrophobicContact CG-CD 4.25Å; L51-K55 WeakPolarHBondContact O-CB 3.21Å; L51-K55 VanDerWaalsContact O-CG 3.31Å; L51-K55 WeakPolarHBondContact O-CG 3.36Å; L51-K55 PolarHBondContact O-N 3.46Å
52	A	85.6	Confident	83.2	Confident	6 Å²	6	54 Å²	54	5%	0.05	26%	0.26	C	S	.	.	H	α-helix	trans	-68.1	-39.5	175.1	0	0	0	0	0	111.4	L48 F49 L50 K55 G56 D57 M60 V61	L48-A52 WeakPolarHBondContact O-CB 3.45Å; L48-A52 PolarHBondContact O-N 3.3Å; F49-A52 WeakPolarHBondContact O-CB 3.19Å; F49-A52 PolarHBondContact O-N 3.48Å; L50-A52 VanDerWaalsContact C-N 3.31Å; L50-A52 PolarHBondContact O-N 2.84Å; A52-K55 PolarHBondContact O-N 3.48Å; A52-G56 PolarHBondContact O-N 3.33Å; A52-D57 PolarHBondContact O-N 3.27Å; A52-M60 HydrophobicContact CB-CB 4.31Å; A52-M60 HydrophobicContact CB-CG 4.17Å; A52-V61 HydrophobicContact CB-CG2 3.81Å
53	C	86.8	Confident	84.2	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64.1	-44.1	172.8	-63.4	0	0	0	0	111.5	F49 L50 K55 G56 T89	F49-C53 PolarHBondContact O-N 2.82Å; F49-C53 PolarHBondContact O-SG 3.14Å; L50-C53 WeakPolarHBondContact O-CB 3.1Å; L50-C53 PolarHBondContact O-N 3.35Å; C53-K55 VanDerWaalsContact C-N 3.34Å; C53-K55 PolarHBondContact O-N 2.98Å; C53-G56 PolarHBondContact O-N 2.8Å; C53-T89 HydrophobicContact CB-CG2 4.12Å
54	E	85.2	Confident	84.5	Confident	86 Å²	86	53.6 Å²	53.6	40%	0.402	25%	0.252	S	S	.	.	H	α-helix	trans	-64.3	-35.7	176.8	-170.9	-177.4	-160.9	0	0	112.4	L50 G56 I88 Q778	L50-E54 WeakPolarHBondContact O-CB 3.35Å; L50-E54 PolarHBondContact O-N 3.37Å; E54-G56 VanDerWaalsContact C-N 3.31Å; E54-G56 PolarHBondContact O-N 3.27Å; E54-I88 HydrophobicContact CB-CG2 3.89Å; E54-I88 HydrophobicContact CG-CG2 4.38Å; E54-Q778 PolarHBondContact O-NE2 3.44Å
55	K	83.2	Confident	84.7	Confident	104 Å²	104	47.4 Å²	47.4	45%	0.452	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-6	179.2	-74.6	179.2	179.1	176.2	0	114.7	L51 A52 C53 S781	L51-K55 HydrophobicContact CD2-CD 4.22Å; L51-K55 HydrophobicContact CG-CD 4.25Å; L51-K55 WeakPolarHBondContact O-CB 3.21Å; L51-K55 VanDerWaalsContact O-CG 3.31Å; L51-K55 WeakPolarHBondContact O-CG 3.36Å; L51-K55 PolarHBondContact O-N 3.46Å; A52-K55 PolarHBondContact O-N 3.48Å; C53-K55 VanDerWaalsContact C-N 3.34Å; C53-K55 PolarHBondContact O-N 2.98Å; K55-S781 PolarHBondContact O-OG 3.03Å
56	G	82.4	Confident	84.8	Confident	2 Å²	2	47.4 Å²	47.4	2%	0.021	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	31.4	-175.4	0	0	0	0	0	113.6	A52 C53 E54 Y58	A52-G56 PolarHBondContact O-N 3.33Å; C53-G56 PolarHBondContact O-N 2.8Å; E54-G56 VanDerWaalsContact C-N 3.31Å; E54-G56 PolarHBondContact O-N 3.27Å; G56-Y58 PolarHBondContact O-N 3.1Å
57	D	85.6	Confident	84.6	Confident	18 Å²	18	51 Å²	51	10%	0.096	23%	0.234	C	C	.	.			trans	-89.2	80.4	-176.4	-166.7	5.2	0	0	0	112.2	A52 Y59 M60 V61 R794	A52-D57 PolarHBondContact O-N 3.27Å; D57-Y59 VanDerWaalsContact C-N 3.35Å; D57-Y59 PolarHBondContact O-N 3.11Å; D57-M60 HydrophobicContact CB-CB 4.15Å; D57-M60 PolarHBondContact O-N 2.83Å; D57-M60 VanDerWaalsContact OD2-CB 3.31Å; D57-M60 WeakPolarHBondContact OD2-CB 3.39Å; D57-V61 WeakPolarHBondContact O-CG2 2.89Å; D57-V61 PolarHBondContact O-N 3.29Å; D57-R794 IonicContact OD1-CZ 2.74Å; D57-R794 IonicContact OD1-NH1 3.98Å; D57-R794 PolarHBondContact OD1-NH1 3.43Å; D57-R794 IonicContact OD1-NH2 3.13Å; D57-R794 PolarHBondContact OD1-NH2 3.49Å; D57-R794 IonicContact OD2-CZ 2.78Å; D57-R794 IonicContact OD2-NH1 3.73Å; D57-R794 IonicContact OD2-NH2 2.88Å; D57-R794 PolarHBondContact OD2-NH2 3.45Å
58	Y	84.8	Confident	83.8	Confident	94 Å²	94	47.5 Å²	47.5	37%	0.369	22%	0.22	S	C	.	.	H	α-helix	trans	-52.3	-46.3	-174.5	179.6	-96.4	0	0	0	113.9	G56 M60 V61 K62 D96 I97 L100	G56-Y58 PolarHBondContact O-N 3.1Å; Y58-M60 PolarHBondContact O-N 2.96Å; Y58-V61 PolarHBondContact O-N 3.37Å; Y58-K62 HydrophobicContact CE1-CD 4.17Å; Y58-K62 WeakPolarHBondContact O-CB 3.25Å; Y58-K62 PolarHBondContact O-N 3.49Å; Y58-D96 HydrophobicContact CD2-CB 4.16Å; Y58-D96 HydrophobicContact CE2-CB 4.3Å; Y58-I97 HydrophobicContact CD2-CG1 4.15Å; Y58-L100 HydrophobicContact CD2-CD2 4.29Å; Y58-L100 HydrophobicContact CE2-CB 4.12Å; Y58-L100 HydrophobicContact CE2-CD1 4.45Å; Y58-L100 HydrophobicContact CE2-CD2 3.95Å; Y58-L100 HydrophobicContact CE2-CG 4.41Å
59	Y	83.7	Confident	82.6	Confident	109 Å²	109	54.1 Å²	54.1	43%	0.427	24%	0.24	S	C	.	.	H	α-helix	trans	-64.1	-42.8	-178.6	177.9	-94.5	0	0	0	112.1	D57 K62 K63 D789	D57-Y59 VanDerWaalsContact C-N 3.35Å; D57-Y59 PolarHBondContact O-N 3.11Å; Y59-K62 PolarHBondContact O-N 2.96Å; Y59-K63 HydrophobicContact CE1-CD 4.23Å; Y59-K63 VanDerWaalsContact O-CB 3.29Å; Y59-K63 WeakPolarHBondContact O-CB 3.28Å; Y59-K63 PolarHBondContact O-N 3.31Å; Y59-D789 VanDerWaalsContact CB-OD2 3.24Å; Y59-D789 WeakPolarHBondContact CB-OD2 3.5Å
60	M	82.9	Confident	81.1	Confident	35 Å²	35	62.3 Å²	62.3	17%	0.172	28%	0.277	C	S	.	.	H	α-helix	trans	-67.2	-42.4	-179.7	-168.6	63.6	-176.9	0	0	111.1	L48 A52 D57 Y58 K63 L64	L48-M60 HydrophobicContact CD2-CE 3.47Å; L48-M60 VanDerWaalsContact CD2-CE 3.47Å; A52-M60 HydrophobicContact CB-CB 4.31Å; A52-M60 HydrophobicContact CB-CG 4.17Å; D57-M60 HydrophobicContact CB-CB 4.15Å; D57-M60 PolarHBondContact O-N 2.83Å; D57-M60 VanDerWaalsContact OD2-CB 3.31Å; D57-M60 WeakPolarHBondContact OD2-CB 3.39Å; Y58-M60 PolarHBondContact O-N 2.96Å; M60-K63 PolarHBondContact O-N 2.91Å; M60-L64 HydrophobicContact CE-CD1 4.17Å; M60-L64 HydrophobicContact CE-CD2 4.13Å; M60-L64 HydrophobicContact CE-CG 4.14Å; M60-L64 HydrophobicContact CG-CD1 4.12Å; M60-L64 WeakPolarHBondContact O-CB 3.27Å; M60-L64 VanDerWaalsContact O-CG 3.26Å; M60-L64 WeakPolarHBondContact O-CG 3.43Å; M60-L64 PolarHBondContact O-N 3.23Å
61	V	86.9	Confident	79.8	Confident	0 Å²	0	65 Å²	65	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-61.4	-46.4	175.3	177.7	0	0	0	0	110.6	F49 A52 D57 Y58 K63 L64 L65 I97 L100 L101	F49-V61 HydrophobicContact CE2-CG1 4Å; A52-V61 HydrophobicContact CB-CG2 3.81Å; D57-V61 WeakPolarHBondContact O-CG2 2.89Å; D57-V61 PolarHBondContact O-N 3.29Å; Y58-V61 PolarHBondContact O-N 3.37Å; V61-K63 PolarHBondContact O-N 3.35Å; V61-L64 PolarHBondContact O-N 2.96Å; V61-L65 HydrophobicContact CG1-CD1 3.79Å; V61-L65 HydrophobicContact CG1-CG 4.38Å; V61-L65 WeakPolarHBondContact O-CB 3.23Å; V61-L65 VanDerWaalsContact O-CG 3.24Å; V61-L65 WeakPolarHBondContact O-CG 3.24Å; V61-L65 PolarHBondContact O-N 3.21Å; V61-I97 HydrophobicContact CB-CG2 4.42Å; V61-I97 HydrophobicContact CG1-CG2 3.94Å; V61-I97 HydrophobicContact CG2-CG2 4.33Å; V61-L100 HydrophobicContact CB-CD2 4.45Å; V61-L100 HydrophobicContact CG1-CD2 4.02Å; V61-L101 HydrophobicContact CG1-CD2 4.4Å
62	K	86.6	Confident	78.8	Confident	76 Å²	76	69.5 Å²	69.5	33%	0.33	33%	0.326	S	S	.	.	H	α-helix	trans	-60.1	-46.1	176.8	-176.8	173.3	175.2	176.9	0	112.4	Y58 Y59 L65 E66 L100	Y58-K62 HydrophobicContact CE1-CD 4.17Å; Y58-K62 WeakPolarHBondContact O-CB 3.25Å; Y58-K62 PolarHBondContact O-N 3.49Å; Y59-K62 PolarHBondContact O-N 2.96Å; K62-L65 PolarHBondContact O-N 3.18Å; K62-E66 WeakPolarHBondContact CE-OE1 3.29Å; K62-E66 HydrophobicContact CG-CG 4.43Å; K62-E66 IonicContact NZ-OE1 3.99Å; K62-E66 WeakPolarHBondContact O-CB 3.24Å; K62-E66 WeakPolarHBondContact O-CG 3.43Å; K62-E66 PolarHBondContact O-N 2.95Å; K62-L100 HydrophobicContact CB-CD1 4.44Å; K62-L100 HydrophobicContact CB-CD2 3.79Å; K62-L100 HydrophobicContact CD-CD1 4.48Å; K62-L100 HydrophobicContact CG-CD1 4.24Å; K62-L100 HydrophobicContact CG-CD2 4.46Å
63	K	84.6	Confident	78.3	Confident	53 Å²	53	70.1 Å²	70.1	23%	0.23	33%	0.329	C	S	.	.	H	α-helix	trans	-61.5	-47.9	178.9	-175.9	-178.4	170.9	-172.9	0	111.3	Y59 M60 V61 L65 E66 E67	Y59-K63 HydrophobicContact CE1-CD 4.23Å; Y59-K63 VanDerWaalsContact O-CB 3.29Å; Y59-K63 WeakPolarHBondContact O-CB 3.28Å; Y59-K63 PolarHBondContact O-N 3.31Å; M60-K63 PolarHBondContact O-N 2.91Å; V61-K63 PolarHBondContact O-N 3.35Å; K63-L65 VanDerWaalsContact C-N 3.33Å; K63-L65 PolarHBondContact O-N 3.33Å; K63-E66 PolarHBondContact O-N 3.4Å; K63-E67 WeakPolarHBondContact CE-OE1 3.45Å; K63-E67 WeakPolarHBondContact CE-OE2 3.43Å; K63-E67 HydrophobicContact CG-CG 4.35Å; K63-E67 IonicContact NZ-OE1 3.08Å; K63-E67 WeakPolarHBondContact O-CB 3.17Å; K63-E67 WeakPolarHBondContact O-CG 3.34Å; K63-E67 PolarHBondContact O-N 3.47Å
64	L	83.9	Confident	77.8	Confident	24 Å²	24	74 Å²	74	13%	0.126	35%	0.35	C	S	.	.	H	α-helix	trans	-61.4	-40.9	177.7	-70.5	170.7	0	0	0	111.5	L48 F49 M60 V61 N68	L48-L64 HydrophobicContact CD2-CD1 3.92Å; F49-L64 HydrophobicContact CB-CD1 4.14Å; F49-L64 HydrophobicContact CD2-CB 4.35Å; F49-L64 HydrophobicContact CD2-CD1 4.24Å; M60-L64 HydrophobicContact CE-CD1 4.17Å; M60-L64 HydrophobicContact CE-CD2 4.13Å; M60-L64 HydrophobicContact CE-CG 4.14Å; M60-L64 HydrophobicContact CG-CD1 4.12Å; M60-L64 WeakPolarHBondContact O-CB 3.27Å; M60-L64 VanDerWaalsContact O-CG 3.26Å; M60-L64 WeakPolarHBondContact O-CG 3.43Å; M60-L64 PolarHBondContact O-N 3.23Å; V61-L64 PolarHBondContact O-N 2.96Å; L64-N68 WeakPolarHBondContact O-CB 3.5Å; L64-N68 PolarHBondContact O-N 2.87Å; L64-N68 VanDerWaalsContact O-N 3.07Å
65	L	83.6	Confident	77.5	Confident	11 Å²	11	71.5 Å²	71.5	6%	0.058	34%	0.34	C	S	.	.	H	α-helix	trans	-67.4	-36.1	176.3	-70.5	169.8	0	0	0	113	F49 V61 K62 K63 V75 L100 L101 H104	F49-L65 HydrophobicContact CE2-CD2 3.94Å; F49-L65 HydrophobicContact CE2-CG 4.1Å; F49-L65 HydrophobicContact CZ-CD2 4.19Å; V61-L65 HydrophobicContact CG1-CD1 3.79Å; V61-L65 HydrophobicContact CG1-CG 4.38Å; V61-L65 WeakPolarHBondContact O-CB 3.23Å; V61-L65 VanDerWaalsContact O-CG 3.24Å; V61-L65 WeakPolarHBondContact O-CG 3.24Å; V61-L65 PolarHBondContact O-N 3.21Å; K62-L65 PolarHBondContact O-N 3.18Å; K63-L65 VanDerWaalsContact C-N 3.33Å; K63-L65 PolarHBondContact O-N 3.33Å; L65-V75 HydrophobicContact CD2-CG1 3.8Å; L65-V75 HydrophobicContact CD2-CG2 4.28Å; L65-L100 HydrophobicContact CD1-CD2 3.99Å; L65-L100 HydrophobicContact CD1-CG 4.02Å; L65-L101 HydrophobicContact CD1-CD2 4.09Å; L65-H104 HydrophobicContact CD2-CB 4.45Å
66	E	82.4	Confident	77.2	Confident	93 Å²	93	69.2 Å²	69.2	44%	0.435	33%	0.333	S	S	.	.	H	α-helix	trans	-73.5	-38	177.4	-75.6	178.1	175.2	0	0	112.7	K62 K63 N68 R69	K62-E66 WeakPolarHBondContact CE-OE1 3.29Å; K62-E66 HydrophobicContact CG-CG 4.43Å; K62-E66 IonicContact NZ-OE1 3.99Å; K62-E66 WeakPolarHBondContact O-CB 3.24Å; K62-E66 WeakPolarHBondContact O-CG 3.43Å; K62-E66 PolarHBondContact O-N 2.95Å; K63-E66 PolarHBondContact O-N 3.4Å; E66-N68 VanDerWaalsContact C-N 3.29Å; E66-R69 WeakPolarHBondContact O-CG 3.38Å
67	E	77	Confident	77.2	Confident	94 Å²	94	69.3 Å²	69.3	44%	0.439	33%	0.333	S	S	.	.	H	α-helix	trans	-70.2	-27.3	175.9	-73.9	177.5	160.1	0	0	111.8	K63 R69	K63-E67 WeakPolarHBondContact CE-OE1 3.45Å; K63-E67 WeakPolarHBondContact CE-OE2 3.43Å; K63-E67 HydrophobicContact CG-CG 4.35Å; K63-E67 IonicContact NZ-OE1 3.08Å; K63-E67 WeakPolarHBondContact O-CB 3.17Å; K63-E67 WeakPolarHBondContact O-CG 3.34Å; K63-E67 PolarHBondContact O-N 3.47Å; E67-R69 PolarHBondContact O-N 3.5Å
68	N	68.6	Low	76.9	Confident	32 Å²	32	70.4 Å²	70.4	17%	0.171	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-73.2	15.5	-179	-158.3	21.9	0	0	0	115.3	L64 E66 H70 G71 E72 L73 V75	L64-N68 WeakPolarHBondContact O-CB 3.5Å; L64-N68 PolarHBondContact O-N 2.87Å; L64-N68 VanDerWaalsContact O-N 3.07Å; E66-N68 VanDerWaalsContact C-N 3.29Å; N68-H70 PolarHBondContact O-N 3Å; N68-G71 PolarHBondContact O-N 3.37Å; N68-E72 PolarHBondContact OD1-N 2.99Å; N68-L73 WeakPolarHBondContact ND2-CB 2.78Å; N68-L73 PolarHBondContact ND2-O 2.98Å; N68-L73 WeakPolarHBondContact OD1-CB 3.48Å; N68-L73 PolarHBondContact OD1-N 3.26Å; N68-L73 PolarHBondContact OD1-O 3.26Å; N68-V75 WeakPolarHBondContact ND2-CG2 3.36Å
69	R	59.3	Low	76.7	Confident	215 Å²	215	68 Å²	68	81%	0.811	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-63.8	-14.5	169.9	-71.9	-176.2	-166.8	-151.7	5.2	113.2	E66 E67	E66-R69 WeakPolarHBondContact O-CG 3.38Å; E67-R69 PolarHBondContact O-N 3.5Å
70	H	55.4	Low	76.5	Confident	171 Å²	171	67.5 Å²	67.5	79%	0.792	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-94.7	-5.6	-179.7	-66.6	-68.5	0	0	0	114.8	N68	N68-H70 PolarHBondContact O-N 3Å
71	G	60.2	Low	76.2	Confident	66 Å²	66	72.2 Å²	72.2	68%	0.68	37%	0.367	S	S	*	.	S	Bend	trans	85.7	19.2	167.1	0	0	0	0	0	117	N68	N68-G71 PolarHBondContact O-N 3.37Å
72	E	65.9	Low	75.7	Confident	170 Å²	170	74.6 Å²	74.6	79%	0.794	39%	0.392	S	S	*	.			trans	-86	-24.8	-178.5	-69.8	-179.3	163.5	0	0	113.9	N68	N68-E72 PolarHBondContact OD1-N 2.99Å
73	L	74.6	Confident	75.4	Confident	19 Å²	19	73.2 Å²	73.2	10%	0.099	39%	0.385	C	S	.	.	S	Bend	trans	-109	124.9	-177.6	177.4	112.3	0	0	0	111.2	D45 E46 F49 N68 V75	D45-L73 HydrophobicContact CB-CD1 3.82Å; D45-L73 WeakPolarHBondContact O-CD1 3.26Å; E46-L73 HydrophobicContact CB-CD1 4.48Å; E46-L73 HydrophobicContact CG-CD1 3.94Å; E46-L73 HydrophobicContact CG-CG 4.27Å; F49-L73 HydrophobicContact CB-CD1 4.05Å; F49-L73 HydrophobicContact CB-CD2 4.35Å; F49-L73 HydrophobicContact CD1-CD2 4.44Å; F49-L73 HydrophobicContact CD2-CD2 4.23Å; F49-L73 HydrophobicContact CG-CD2 4.1Å; N68-L73 WeakPolarHBondContact ND2-CB 2.78Å; N68-L73 PolarHBondContact ND2-O 2.98Å; N68-L73 WeakPolarHBondContact OD1-CB 3.48Å; N68-L73 PolarHBondContact OD1-N 3.26Å; N68-L73 PolarHBondContact OD1-O 3.26Å; L73-V75 PolarHBondContact O-N 3.06Å
74	N	77	Confident	75.4	Confident	83 Å²	83	73 Å²	73	44%	0.444	39%	0.386	S	S	.	.			trans	-75.2	113.2	169.8	-177.5	8.7	0	0	0	109.9	E46 N76 C77	E46-N74 VanDerWaalsContact OE1-CB 3.26Å; E46-N74 WeakPolarHBondContact OE1-CB 3.38Å; E46-N74 PolarHBondContact OE1-N 3.45Å; N74-N76 VanDerWaalsContact C-N 3.26Å; N74-N76 PolarHBondContact O-N 3.15Å; N74-N76 PolarHBondContact OD1-N 2.93Å; N74-C77 WeakPolarHBondContact O-CB 3.35Å; N74-C77 PolarHBondContact O-N 3.06Å; N74-C77 PolarHBondContact O-SG 3.43Å; N74-C77 VanDerWaalsContact O-SG 3.37Å
75	V	78.5	Confident	75.6	Confident	33 Å²	33	71.9 Å²	71.9	20%	0.2	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-24	-179.7	-169.2	0	0	0	0	112.3	F49 L65 N68 L73 C77 C106	F49-V75 HydrophobicContact CE1-CG1 4.49Å; F49-V75 HydrophobicContact CZ-CG1 4.13Å; L65-V75 HydrophobicContact CD2-CG1 3.8Å; L65-V75 HydrophobicContact CD2-CG2 4.28Å; N68-V75 WeakPolarHBondContact ND2-CG2 3.36Å; L73-V75 PolarHBondContact O-N 3.06Å; V75-C77 VanDerWaalsContact C-N 3.29Å; V75-C77 PolarHBondContact O-N 3.39Å; V75-C106 WeakPolarHBondContact CG1-SG 3.47Å
76	N	77.9	Confident	75.7	Confident	55 Å²	55	71.6 Å²	71.6	29%	0.294	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	37.2	175.6	-51.6	-56	0	0	0	111.2	N74 Q107	N74-N76 VanDerWaalsContact C-N 3.26Å; N74-N76 PolarHBondContact O-N 3.15Å; N74-N76 PolarHBondContact OD1-N 2.93Å; N76-Q107 PolarHBondContact OD1-N 2.9Å
77	C	81.1	Confident	75.8	Confident	5 Å²	5	68.1 Å²	68.1	3%	0.034	36%	0.364	C	S	.	.			trans	-69.8	149.1	173.3	59.4	0	0	0	0	110.7	E46 N74 V75	E46-C77 HydrophobicContact CB-CB 4.04Å; E46-C77 HydrophobicContact CG-CB 3.85Å; N74-C77 WeakPolarHBondContact O-CB 3.35Å; N74-C77 PolarHBondContact O-N 3.06Å; N74-C77 PolarHBondContact O-SG 3.43Å; N74-C77 VanDerWaalsContact O-SG 3.37Å; V75-C77 VanDerWaalsContact C-N 3.29Å; V75-C77 PolarHBondContact O-N 3.39Å
78	V	80.3	Confident	76.3	Confident	40 Å²	40	63.7 Å²	63.7	24%	0.242	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-115	139.4	-178.9	-61	0	0	0	0	109.8	K39 T42 R83 D84	K39-V78 HydrophobicContact CD-CG2 4.43Å; T42-V78 WeakPolarHBondContact CG2-O 3.46Å; V78-R83 WeakPolarHBondContact CA-O 3.17Å; V78-D84 WeakPolarHBondContact CG1-OD1 3.22Å
79	D	79.9	Confident	77.2	Confident	44 Å²	44	62.2 Å²	62.2	24%	0.235	34%	0.336	C	S	.	.			trans	-68.5	172	171.9	-169.3	12.8	0	0	0	111.2	L50 L81 G82 R83	L50-D79 HydrophobicContact CD1-CB 4.36Å; D79-L81 PolarHBondContact O-N 3.38Å; D79-L81 VanDerWaalsContact O-N 3.1Å; D79-G82 WeakPolarHBondContact O-CA 3.34Å; D79-G82 PolarHBondContact O-N 3.37Å; D79-R83 PolarHBondContact N-O 3.12Å; D79-R83 IonicContact OD2-CZ 3.1Å; D79-R83 IonicContact OD2-NE 3.96Å; D79-R83 IonicContact OD2-NH2 2.92Å; D79-R83 PolarHBondContact OD2-NH2 3.32Å; D79-R83 VanDerWaalsContact OD2-NH2 3.13Å
80	V	79.2	Confident	78.6	Confident	99 Å²	99	52 Å²	52	60%	0.6	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-26.3	174.7	-173.2	0	0	0	0	111.9	V38 G82	V38-V80 HydrophobicContact CG1-CG1 3.96Å; V80-G82 VanDerWaalsContact C-N 3.32Å
81	L	76.6	Confident	79.9	Confident	133 Å²	133	47.5 Å²	47.5	70%	0.696	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-0.9	175.1	-64.4	171.8	0	0	0	113.7	D79 R83	D79-L81 PolarHBondContact O-N 3.38Å; D79-L81 VanDerWaalsContact O-N 3.1Å; L81-R83 HydrophobicContact CB-CG 4.25Å
82	G	77.6	Confident	81.1	Confident	51 Å²	51	45.8 Å²	45.8	53%	0.526	25%	0.252	S	S	.	.	S	Bend	trans	75.9	21	-177.2	0	0	0	0	0	114.4	D79 V80	D79-G82 WeakPolarHBondContact O-CA 3.34Å; D79-G82 PolarHBondContact O-N 3.37Å; V80-G82 VanDerWaalsContact C-N 3.32Å
83	R	80.2	Confident	82	Confident	47 Å²	47	42.7 Å²	42.7	18%	0.177	24%	0.237	C	C	.	.			trans	-91.2	131.3	177.9	-59.4	-178.9	-62.4	169.1	1.7	110.7	V78 D79 L81 T87 I88 E91	V78-R83 WeakPolarHBondContact CA-O 3.17Å; D79-R83 PolarHBondContact N-O 3.12Å; D79-R83 IonicContact OD2-CZ 3.1Å; D79-R83 IonicContact OD2-NE 3.96Å; D79-R83 IonicContact OD2-NH2 2.92Å; D79-R83 PolarHBondContact OD2-NH2 3.32Å; D79-R83 VanDerWaalsContact OD2-NH2 3.13Å; L81-R83 HydrophobicContact CB-CG 4.25Å; R83-T87 HydrophobicContact CB-CG2 4.32Å; R83-T87 HydrophobicContact CG-CG2 4.4Å; R83-I88 HydrophobicContact CB-CD1 4.34Å; R83-I88 HydrophobicContact CB-CG1 3.9Å; R83-E91 WeakPolarHBondContact CD-OE2 3.27Å; R83-E91 IonicContact CZ-OE2 3.16Å; R83-E91 IonicContact NE-OE2 2.8Å; R83-E91 IonicContact NH1-OE2 3.51Å; R83-E91 PolarHBondContact NH1-OE2 3.01Å
84	D	84.9	Confident	82.6	Confident	47 Å²	47	41.9 Å²	41.9	25%	0.251	23%	0.234	S	C	.	.	B	Isolated β-bridge	trans	-79.3	160.8	172.4	-61.7	-9.3	0	0	0	110.7	V78 V86 T87 I88	V78-D84 WeakPolarHBondContact CG1-OD1 3.22Å; D84-V86 PolarHBondContact O-N 3.32Å; D84-T87 WeakPolarHBondContact O-CB 3.22Å; D84-T87 PolarHBondContact O-N 3.34Å; D84-T87 VanDerWaalsContact O-N 3.07Å; D84-I88 WeakPolarHBondContact O-CG1 3.23Å; D84-I88 PolarHBondContact O-N 3.33Å
85	A	86.3	Confident	83.1	Confident	2 Å²	2	41 Å²	41	2%	0.017	23%	0.228	C	C	.	.	H	α-helix	trans	-53	-37.8	173.5	0	0	0	0	0	112.8	F49 L50 I88 T89 L101	F49-A85 HydrophobicContact CD1-CB 4.49Å; F49-A85 HydrophobicContact CE1-CB 3.58Å; F49-A85 HydrophobicContact CZ-CB 4.06Å; L50-A85 HydrophobicContact CD2-CB 3.95Å; A85-I88 PolarHBondContact O-N 3.29Å; A85-T89 WeakPolarHBondContact O-CG2 3.45Å; A85-T89 PolarHBondContact O-N 3.13Å; A85-T89 PolarHBondContact O-OG1 3.48Å; A85-L101 HydrophobicContact CB-CD1 4.36Å
86	V	86.5	Confident	83.5	Confident	4 Å²	4	43 Å²	43	2%	0.024	24%	0.238	C	C	.	.	H	α-helix	trans	-65.6	-47.1	177	178.1	0	0	0	0	111.1	D84 I88 T89 I90 L98 L101 C106 A111	D84-V86 PolarHBondContact O-N 3.32Å; V86-I88 VanDerWaalsContact C-N 3.33Å; V86-I88 PolarHBondContact O-N 2.94Å; V86-T89 WeakPolarHBondContact CA-OG1 3.3Å; V86-T89 PolarHBondContact O-N 3.2Å; V86-T89 VanDerWaalsContact O-N 3.17Å; V86-T89 PolarHBondContact O-OG1 2.89Å; V86-I90 HydrophobicContact CG1-CD1 3.77Å; V86-I90 VanDerWaalsContact O-CG1 3.3Å; V86-I90 WeakPolarHBondContact O-CG1 3.49Å; V86-I90 PolarHBondContact O-N 3.5Å; V86-L98 HydrophobicContact CG1-CD1 3.78Å; V86-L101 HydrophobicContact CG2-CB 4.43Å; V86-L101 HydrophobicContact CG2-CD1 4.3Å; V86-C106 HydrophobicContact CG2-CB 3.9Å; V86-A111 HydrophobicContact CG1-CB 3.52Å
87	T	85	Confident	84	Confident	20 Å²	20	40.5 Å²	40.5	12%	0.123	23%	0.225	C	C	.	.	H	α-helix	trans	-57.4	-46.5	175.9	-53.2	0	0	0	0	110.9	R83 D84 T89 I90 E91 V114	R83-T87 HydrophobicContact CB-CG2 4.32Å; R83-T87 HydrophobicContact CG-CG2 4.4Å; D84-T87 WeakPolarHBondContact O-CB 3.22Å; D84-T87 PolarHBondContact O-N 3.34Å; D84-T87 VanDerWaalsContact O-N 3.07Å; T87-T89 VanDerWaalsContact C-N 3.32Å; T87-T89 PolarHBondContact O-N 2.85Å; T87-I90 PolarHBondContact O-N 3.44Å; T87-I90 VanDerWaalsContact O-N 3.16Å; T87-E91 WeakPolarHBondContact O-CG 3.37Å; T87-E91 PolarHBondContact O-N 3.38Å; T87-V114 HydrophobicContact CG2-CG1 3.84Å; T87-V114 HydrophobicContact CG2-CG2 4.2Å
88	I	86.4	Confident	84.4	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-61.2	-40.1	177.6	-65.3	168.9	0	0	0	111.2	L50 E54 R83 D84 A85 V86 I90 N92	L50-I88 HydrophobicContact CB-CD1 4.46Å; L50-I88 HydrophobicContact CD2-CD1 3.91Å; E54-I88 HydrophobicContact CB-CG2 3.89Å; E54-I88 HydrophobicContact CG-CG2 4.38Å; R83-I88 HydrophobicContact CB-CD1 4.34Å; R83-I88 HydrophobicContact CB-CG1 3.9Å; D84-I88 WeakPolarHBondContact O-CG1 3.23Å; D84-I88 PolarHBondContact O-N 3.33Å; A85-I88 PolarHBondContact O-N 3.29Å; V86-I88 VanDerWaalsContact C-N 3.33Å; V86-I88 PolarHBondContact O-N 2.94Å; I88-I90 VanDerWaalsContact C-N 3.33Å; I88-N92 WeakPolarHBondContact O-CB 3.48Å; I88-N92 VanDerWaalsContact O-CG 3.25Å; I88-N92 PolarHBondContact O-N 3.49Å; I88-N92 PolarHBondContact O-ND2 3.21Å
89	T	88.1	Confident	84.7	Confident	1 Å²	1	43 Å²	43	1%	0.006	23%	0.233	C	C	.	.	H	α-helix	trans	-69.7	-30.4	177.9	54.2	0	0	0	0	113.4	C53 A85 V86 T87 E93 N94 I97 L101	C53-T89 HydrophobicContact CB-CG2 4.12Å; A85-T89 WeakPolarHBondContact O-CG2 3.45Å; A85-T89 PolarHBondContact O-N 3.13Å; A85-T89 PolarHBondContact O-OG1 3.48Å; V86-T89 WeakPolarHBondContact CA-OG1 3.3Å; V86-T89 PolarHBondContact O-N 3.2Å; V86-T89 VanDerWaalsContact O-N 3.17Å; V86-T89 PolarHBondContact O-OG1 2.89Å; T87-T89 VanDerWaalsContact C-N 3.32Å; T87-T89 PolarHBondContact O-N 2.85Å; T89-E93 PolarHBondContact O-N 3.02Å; T89-N94 PolarHBondContact O-N 3.44Å; T89-I97 HydrophobicContact CG2-CB 3.97Å; T89-I97 HydrophobicContact CG2-CG2 3.59Å; T89-L101 HydrophobicContact CG2-CD1 3.7Å
90	I	88.1	Confident	85.1	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-75.7	-47	178.6	-69.3	166.2	0	0	0	110.8	V86 T87 I88 N92 E93 L98 A111 V114 A115 A123 L127	V86-I90 HydrophobicContact CG1-CD1 3.77Å; V86-I90 VanDerWaalsContact O-CG1 3.3Å; V86-I90 WeakPolarHBondContact O-CG1 3.49Å; V86-I90 PolarHBondContact O-N 3.5Å; T87-I90 PolarHBondContact O-N 3.44Å; T87-I90 VanDerWaalsContact O-N 3.16Å; I88-I90 VanDerWaalsContact C-N 3.33Å; I90-N92 PolarHBondContact O-N 2.95Å; I90-N92 VanDerWaalsContact O-N 3.12Å; I90-E93 PolarHBondContact O-N 3.37Å; I90-E93 VanDerWaalsContact O-N 3.08Å; I90-L98 HydrophobicContact CD1-CD1 4.26Å; I90-L98 HydrophobicContact CG1-CD1 4.06Å; I90-L98 HydrophobicContact CG1-CD2 4.19Å; I90-A111 HydrophobicContact CD1-CB 3.87Å; I90-A111 WeakPolarHBondContact CD1-O 3.26Å; I90-V114 HydrophobicContact CG2-CG1 4.06Å; I90-A115 HydrophobicContact CD1-CB 4.3Å; I90-A115 VanDerWaalsContact CG2-CA 3.45Å; I90-A115 HydrophobicContact CG2-CB 3.79Å; I90-A123 HydrophobicContact CG1-CB 4.36Å; I90-A123 HydrophobicContact CG2-CB 4.47Å; I90-L127 HydrophobicContact CD1-CD1 4.09Å
91	E	84.6	Confident	85.5	Confident	75 Å²	75	36.5 Å²	36.5	35%	0.35	20%	0.195	S	C	.	.	H	α-helix	trans	-55.6	-29.4	176.3	-75.4	176.9	-179	0	0	112.3	R83 T87	R83-E91 WeakPolarHBondContact CD-OE2 3.27Å; R83-E91 IonicContact CZ-OE2 3.16Å; R83-E91 IonicContact NE-OE2 2.8Å; R83-E91 IonicContact NH1-OE2 3.51Å; R83-E91 PolarHBondContact NH1-OE2 3.01Å; T87-E91 WeakPolarHBondContact O-CG 3.37Å; T87-E91 PolarHBondContact O-N 3.38Å
92	N	83.5	Confident	85.9	Confident	31 Å²	31	30.4 Å²	30.4	17%	0.166	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	9	-175.8	-77.7	-30.3	0	0	0	113.9	I88 I90 N94 Q778	I88-N92 WeakPolarHBondContact O-CB 3.48Å; I88-N92 VanDerWaalsContact O-CG 3.25Å; I88-N92 PolarHBondContact O-N 3.49Å; I88-N92 PolarHBondContact O-ND2 3.21Å; I90-N92 PolarHBondContact O-N 2.95Å; I90-N92 VanDerWaalsContact O-N 3.12Å; N92-N94 PolarHBondContact O-N 2.99Å; N92-Q778 PolarHBondContact ND2-NE2 2.99Å; N92-Q778 PolarHBondContact O-OE1 3.33Å; N92-Q778 PolarHBondContact OD1-OE1 2.68Å; N92-Q778 VanDerWaalsContact OD1-OE1 3.1Å
93	E	85.8	Confident	86.2	Confident	104 Å²	104	32.6 Å²	32.6	49%	0.486	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	25.7	-179.9	-54.4	-160.2	151.3	0	0	116.3	T89 I90 L95 V120	T89-E93 PolarHBondContact O-N 3.02Å; I90-E93 PolarHBondContact O-N 3.37Å; I90-E93 VanDerWaalsContact O-N 3.08Å; E93-L95 PolarHBondContact O-N 3.42Å; E93-V120 HydrophobicContact CG-CG1 4.17Å; E93-V120 HydrophobicContact CG-CG2 3.85Å
94	N	87	Confident	86.2	Confident	3 Å²	3	34.4 Å²	34.4	2%	0.016	17%	0.17	C	C	.	.			trans	-84.8	79.4	-179.6	-77.5	-53.7	0	0	0	112.5	T89 N92 D96 I97 L98 Q778	T89-N94 PolarHBondContact O-N 3.44Å; N92-N94 PolarHBondContact O-N 2.99Å; N94-D96 PolarHBondContact O-N 3.5Å; N94-I97 HydrophobicContact CB-CB 4.38Å; N94-I97 HydrophobicContact CB-CD1 4.24Å; N94-I97 HydrophobicContact CB-CG1 4.39Å; N94-I97 PolarHBondContact O-N 3.46Å; N94-L98 PolarHBondContact O-N 3.1Å; N94-Q778 PolarHBondContact ND2-NE2 3.18Å
95	L	88.4	Confident	85.6	Confident	63 Å²	63	34.9 Å²	34.9	33%	0.33	19%	0.186	S	C	.	.	H	α-helix	trans	-60.2	-37	-176.3	-55	-177.7	0	0	0	114.3	E93 L98 Q99 V120 A123 I126	E93-L95 PolarHBondContact O-N 3.42Å; L95-L98 WeakPolarHBondContact O-CB 3.41Å; L95-L98 PolarHBondContact O-N 3.39Å; L95-Q99 PolarHBondContact O-N 3.27Å; L95-V120 HydrophobicContact CD2-CG1 4.33Å; L95-A123 HydrophobicContact CD2-CB 4.12Å; L95-I126 HydrophobicContact CB-CD1 3.99Å; L95-I126 HydrophobicContact CD2-CD1 4.28Å
96	D	86.9	Confident	85.2	Confident	76 Å²	76	35.4 Å²	35.4	41%	0.406	19%	0.189	S	C	.	.	H	α-helix	trans	-68.8	-40	-177.6	-56.3	-48.9	0	0	0	112.1	Y58 N94 Q99 L100 K782	Y58-D96 HydrophobicContact CD2-CB 4.16Å; Y58-D96 HydrophobicContact CE2-CB 4.3Å; N94-D96 PolarHBondContact O-N 3.5Å; D96-Q99 PolarHBondContact O-N 3.4Å; D96-L100 WeakPolarHBondContact O-CB 3.24Å; D96-L100 PolarHBondContact O-N 3.35Å; D96-L100 VanDerWaalsContact O-N 3.1Å; D96-K782 WeakPolarHBondContact OD2-CE 3.49Å; D96-K782 IonicContact OD2-NZ 3.97Å; D96-K782 PolarHBondContact OD2-NZ 3.35Å
97	I	87.4	Confident	84.5	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.015	21%	0.214	C	C	.	.	H	α-helix	trans	-71.8	-39.1	177.2	-55.5	179.8	0	0	0	109.4	Y58 V61 T89 N94 Q99 L100 L101	Y58-I97 HydrophobicContact CD2-CG1 4.15Å; V61-I97 HydrophobicContact CB-CG2 4.42Å; V61-I97 HydrophobicContact CG1-CG2 3.94Å; V61-I97 HydrophobicContact CG2-CG2 4.33Å; T89-I97 HydrophobicContact CG2-CB 3.97Å; T89-I97 HydrophobicContact CG2-CG2 3.59Å; N94-I97 HydrophobicContact CB-CB 4.38Å; N94-I97 HydrophobicContact CB-CD1 4.24Å; N94-I97 HydrophobicContact CB-CG1 4.39Å; N94-I97 PolarHBondContact O-N 3.46Å; I97-Q99 VanDerWaalsContact C-N 3.33Å; I97-Q99 PolarHBondContact O-N 3.38Å; I97-L100 WeakPolarHBondContact O-CB 3.4Å; I97-L100 PolarHBondContact O-N 2.91Å; I97-L101 HydrophobicContact CG2-CD1 4.06Å; I97-L101 HydrophobicContact CG2-CG 4.21Å; I97-L101 WeakPolarHBondContact O-CB 3.46Å; I97-L101 VanDerWaalsContact O-CG 3.27Å; I97-L101 WeakPolarHBondContact O-CG 3.34Å; I97-L101 PolarHBondContact O-N 3.21Å
98	L	88.9	Confident	83.7	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-55.9	-48	173.6	176.5	63.5	0	0	0	111.2	V86 I90 N94 L95 L100 L101 L102 A123	V86-L98 HydrophobicContact CG1-CD1 3.78Å; I90-L98 HydrophobicContact CD1-CD1 4.26Å; I90-L98 HydrophobicContact CG1-CD1 4.06Å; I90-L98 HydrophobicContact CG1-CD2 4.19Å; N94-L98 PolarHBondContact O-N 3.1Å; L95-L98 WeakPolarHBondContact O-CB 3.41Å; L95-L98 PolarHBondContact O-N 3.39Å; L98-L100 VanDerWaalsContact C-N 3.35Å; L98-L100 PolarHBondContact O-N 3.06Å; L98-L101 PolarHBondContact O-N 2.87Å; L98-L102 HydrophobicContact CD1-CD1 4.11Å; L98-L102 HydrophobicContact CD1-CG 4.3Å; L98-L102 HydrophobicContact CG-CD1 4.07Å; L98-L102 WeakPolarHBondContact O-CB 3.31Å; L98-L102 VanDerWaalsContact O-CG 3.23Å; L98-L102 WeakPolarHBondContact O-CG 3.25Å; L98-L102 PolarHBondContact O-N 3.41Å; L98-A123 HydrophobicContact CD2-CB 3.69Å
99	Q	87.9	Confident	82.6	Confident	96 Å²	96	47 Å²	47	45%	0.449	26%	0.256	S	S	.	.	H	α-helix	trans	-61.9	-43.3	177.7	-171.4	175.1	-15.1	0	0	111.8	L95 D96 I97 L101 L102 E103	L95-Q99 PolarHBondContact O-N 3.27Å; D96-Q99 PolarHBondContact O-N 3.4Å; I97-Q99 VanDerWaalsContact C-N 3.33Å; I97-Q99 PolarHBondContact O-N 3.38Å; Q99-L101 PolarHBondContact O-N 3.18Å; Q99-L102 PolarHBondContact O-N 3.44Å; Q99-E103 PolarHBondContact NE2-OE1 3.41Å; Q99-E103 WeakPolarHBondContact O-CG 3.38Å; Q99-E103 PolarHBondContact O-N 3.18Å
100	L	87.6	Confident	81.9	Confident	7 Å²	7	49 Å²	49	4%	0.037	27%	0.267	C	S	.	.	H	α-helix	trans	-60.2	-44.9	176.8	-176.9	75.1	0	0	0	112.4	Y58 V61 K62 L65 D96 I97 L98 E103 H104	Y58-L100 HydrophobicContact CD2-CD2 4.29Å; Y58-L100 HydrophobicContact CE2-CB 4.12Å; Y58-L100 HydrophobicContact CE2-CD1 4.45Å; Y58-L100 HydrophobicContact CE2-CD2 3.95Å; Y58-L100 HydrophobicContact CE2-CG 4.41Å; V61-L100 HydrophobicContact CB-CD2 4.45Å; V61-L100 HydrophobicContact CG1-CD2 4.02Å; K62-L100 HydrophobicContact CB-CD1 4.44Å; K62-L100 HydrophobicContact CB-CD2 3.79Å; K62-L100 HydrophobicContact CD-CD1 4.48Å; K62-L100 HydrophobicContact CG-CD1 4.24Å; K62-L100 HydrophobicContact CG-CD2 4.46Å; L65-L100 HydrophobicContact CD1-CD2 3.99Å; L65-L100 HydrophobicContact CD1-CG 4.02Å; D96-L100 WeakPolarHBondContact O-CB 3.24Å; D96-L100 PolarHBondContact O-N 3.35Å; D96-L100 VanDerWaalsContact O-N 3.1Å; I97-L100 WeakPolarHBondContact O-CB 3.4Å; I97-L100 PolarHBondContact O-N 2.91Å; L98-L100 VanDerWaalsContact C-N 3.35Å; L98-L100 PolarHBondContact O-N 3.06Å; L100-E103 PolarHBondContact O-N 3.28Å; L100-H104 PolarHBondContact O-N 3.26Å; L100-H104 PolarHBondContact O-ND1 2.86Å
101	L	87.4	Confident	81.5	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.5	-43.3	177.8	-71.6	171	0	0	0	111.2	F49 V61 L65 A85 V86 T89 I97 L98 Q99 E103 H104 G105 C106	F49-L101 HydrophobicContact CE2-CD2 4.34Å; F49-L101 HydrophobicContact CZ-CD2 3.76Å; V61-L101 HydrophobicContact CG1-CD2 4.4Å; L65-L101 HydrophobicContact CD1-CD2 4.09Å; A85-L101 HydrophobicContact CB-CD1 4.36Å; V86-L101 HydrophobicContact CG2-CB 4.43Å; V86-L101 HydrophobicContact CG2-CD1 4.3Å; T89-L101 HydrophobicContact CG2-CD1 3.7Å; I97-L101 HydrophobicContact CG2-CD1 4.06Å; I97-L101 HydrophobicContact CG2-CG 4.21Å; I97-L101 WeakPolarHBondContact O-CB 3.46Å; I97-L101 VanDerWaalsContact O-CG 3.27Å; I97-L101 WeakPolarHBondContact O-CG 3.34Å; I97-L101 PolarHBondContact O-N 3.21Å; L98-L101 PolarHBondContact O-N 2.87Å; Q99-L101 PolarHBondContact O-N 3.18Å; L101-E103 PolarHBondContact O-N 2.93Å; L101-H104 PolarHBondContact O-N 3.31Å; L101-G105 PolarHBondContact O-N 3.49Å; L101-C106 HydrophobicContact CB-CB 4.45Å; L101-C106 PolarHBondContact O-N 3.34Å; L101-C106 PolarHBondContact O-SG 2.74Å
102	L	85.4	Confident	81.5	Confident	5 Å²	5	47.5 Å²	47.5	3%	0.026	26%	0.261	C	S	.	.	H	α-helix	trans	-65.1	-38	177.8	-68.7	171.9	0	0	0	112.2	L98 Q99 H104 G105 A108 I126 L127 H130	L98-L102 HydrophobicContact CD1-CD1 4.11Å; L98-L102 HydrophobicContact CD1-CG 4.3Å; L98-L102 HydrophobicContact CG-CD1 4.07Å; L98-L102 WeakPolarHBondContact O-CB 3.31Å; L98-L102 VanDerWaalsContact O-CG 3.23Å; L98-L102 WeakPolarHBondContact O-CG 3.25Å; L98-L102 PolarHBondContact O-N 3.41Å; Q99-L102 PolarHBondContact O-N 3.44Å; L102-H104 VanDerWaalsContact C-N 3.28Å; L102-H104 PolarHBondContact O-N 3.06Å; L102-G105 PolarHBondContact O-N 3.48Å; L102-G105 VanDerWaalsContact O-N 3.14Å; L102-A108 HydrophobicContact CD2-CB 3.94Å; L102-I126 HydrophobicContact CD1-CG2 3.73Å; L102-L127 HydrophobicContact CD1-CD2 3.85Å; L102-L127 HydrophobicContact CD2-CD2 3.97Å; L102-H130 HydrophobicContact CD1-CB 4.31Å; L102-H130 PolarHBondContact O-CE1 3.31Å; L102-H130 VanDerWaalsContact O-CE1 3.3Å; L102-H130 PolarHBondContact O-NE2 2.69Å
103	E	83.3	Confident	81.4	Confident	97 Å²	97	46.7 Å²	46.7	45%	0.453	26%	0.257	S	S	.	.	H	α-helix	trans	-62.7	-32.6	175.6	-76.4	178.3	-170.3	0	0	113.5	Q99 L100 L101 G105	Q99-E103 PolarHBondContact NE2-OE1 3.41Å; Q99-E103 WeakPolarHBondContact O-CG 3.38Å; Q99-E103 PolarHBondContact O-N 3.18Å; L100-E103 PolarHBondContact O-N 3.28Å; L101-E103 PolarHBondContact O-N 2.93Å; E103-G105 VanDerWaalsContact C-N 3.31Å
104	H	80.4	Confident	81.4	Confident	85 Å²	85	43 Å²	43	39%	0.394	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-0.8	177.2	-68.8	79.2	0	0	0	113.4	L65 L100 L101 L102	L65-H104 HydrophobicContact CD2-CB 4.45Å; L100-H104 PolarHBondContact O-N 3.26Å; L100-H104 PolarHBondContact O-ND1 2.86Å; L101-H104 PolarHBondContact O-N 3.31Å; L102-H104 VanDerWaalsContact C-N 3.28Å; L102-H104 PolarHBondContact O-N 3.06Å
105	G	73.6	Confident	81.4	Confident	56 Å²	56	42.9 Å²	42.9	58%	0.577	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.4	28.8	170.3	0	0	0	0	0	115.2	L101 L102 E103	L101-G105 PolarHBondContact O-N 3.49Å; L102-G105 PolarHBondContact O-N 3.48Å; L102-G105 VanDerWaalsContact O-N 3.14Å; E103-G105 VanDerWaalsContact C-N 3.31Å
106	C	76.8	Confident	81.4	Confident	13 Å²	13	39.9 Å²	39.9	9%	0.088	23%	0.225	C	C	.	.			trans	-56.2	148.3	170	-59.3	0	0	0	0	111.6	V75 V86 L101 A108	V75-C106 WeakPolarHBondContact CG1-SG 3.47Å; V86-C106 HydrophobicContact CG2-CB 3.9Å; L101-C106 HydrophobicContact CB-CB 4.45Å; L101-C106 PolarHBondContact O-N 3.34Å; L101-C106 PolarHBondContact O-SG 2.74Å; C106-A108 PolarHBondContact O-N 3.17Å
107	Q	71.3	Confident	81.4	Confident	118 Å²	118	38.6 Å²	38.6	55%	0.551	22%	0.218	S	C	*	.			trans	-68.2	133	174.1	-69.3	-174.6	3.1	0	0	110.3	N76	N76-Q107 PolarHBondContact OD1-N 2.9Å
108	A	68.6	Low	81.3	Confident	37 Å²	37	40.7 Å²	40.7	31%	0.306	23%	0.233	S	C	.	.			trans	-128.1	28	-176.3	0	0	0	0	0	112.1	L102 C106 D110 A111 L127	L102-A108 HydrophobicContact CD2-CB 3.94Å; C106-A108 PolarHBondContact O-N 3.17Å; A108-D110 VanDerWaalsContact C-N 3.31Å; A108-D110 PolarHBondContact O-N 3.28Å; A108-A111 HydrophobicContact CB-CB 4.03Å; A108-L127 HydrophobicContact CB-CD2 4.43Å
109	T	64.5	Low	81.2	Confident	114 Å²	114	43.7 Å²	43.7	70%	0.699	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-39.4	-171.9	53.6	0	0	0	0	112.6
110	D	71.8	Confident	81.3	Confident	45 Å²	45	39.5 Å²	39.5	24%	0.241	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-9.4	-175.5	-64.5	18.2	0	0	0	111.7	A108 L112 L113 V114 T154	A108-D110 VanDerWaalsContact C-N 3.31Å; A108-D110 PolarHBondContact O-N 3.28Å; D110-L112 VanDerWaalsContact C-N 3.25Å; D110-L112 PolarHBondContact O-N 3.01Å; D110-L113 PolarHBondContact O-N 3.37Å; D110-V114 PolarHBondContact O-N 2.95Å; D110-V114 VanDerWaalsContact O-N 3.13Å; D110-T154 WeakPolarHBondContact OD1-CG2 3.42Å
111	A	81	Confident	81.4	Confident	5 Å²	5	41.3 Å²	41.3	4%	0.041	24%	0.239	C	C	.	.	H	α-helix	trans	-56.6	-35.1	-177.6	0	0	0	0	0	113.3	V86 I90 A108 A115 L127	V86-A111 HydrophobicContact CG1-CB 3.52Å; I90-A111 HydrophobicContact CD1-CB 3.87Å; I90-A111 WeakPolarHBondContact CD1-O 3.26Å; A108-A111 HydrophobicContact CB-CB 4.03Å; A111-A115 WeakPolarHBondContact O-CB 3.32Å; A111-A115 PolarHBondContact O-N 3.22Å; A111-L127 HydrophobicContact CB-CD1 4.25Å; A111-L127 HydrophobicContact CB-CD2 4.26Å
112	L	83.3	Confident	81.5	Confident	39 Å²	39	42.6 Å²	42.6	20%	0.204	25%	0.253	C	S	.	.	H	α-helix	trans	-66.8	-39.7	177	-178.9	63.9	0	0	0	112.1	D110 A115 I116 V124 L127 L128 P160	D110-L112 VanDerWaalsContact C-N 3.25Å; D110-L112 PolarHBondContact O-N 3.01Å; L112-A115 PolarHBondContact O-N 3.48Å; L112-I116 HydrophobicContact CD1-CD1 4.25Å; L112-I116 HydrophobicContact CG-CD1 4.1Å; L112-I116 WeakPolarHBondContact O-CD1 2.99Å; L112-I116 WeakPolarHBondContact O-CG1 3.28Å; L112-I116 PolarHBondContact O-N 3.18Å; L112-I116 VanDerWaalsContact O-N 3.13Å; L112-V124 HydrophobicContact CD1-CG1 4.15Å; L112-L127 HydrophobicContact CD1-CB 4.29Å; L112-L128 HydrophobicContact CD1-CD2 4.09Å; L112-L128 HydrophobicContact CD1-CG 4.3Å; L112-L128 HydrophobicContact CD2-CD2 4.14Å; L112-P160 HydrophobicContact CD2-CB 4.22Å; L112-P160 HydrophobicContact CD2-CG 4.1Å
113	L	83.1	Confident	81.6	Confident	14 Å²	14	42.4 Å²	42.4	7%	0.073	25%	0.252	C	S	.	.	H	α-helix	trans	-68.3	-42.1	178.5	-67.4	175.1	0	0	0	110.5	D110 I116 D117 M156 P160 L163	D110-L113 PolarHBondContact O-N 3.37Å; L113-I116 PolarHBondContact O-N 3.36Å; L113-D117 WeakPolarHBondContact O-CB 3.31Å; L113-D117 PolarHBondContact O-N 3.35Å; L113-M156 HydrophobicContact CB-SD 4.41Å; L113-M156 HydrophobicContact CD1-CB 4.32Å; L113-P160 HydrophobicContact CD2-CB 4.07Å; L113-P160 HydrophobicContact CD2-CG 3.76Å; L113-L163 HydrophobicContact CB-CD2 4.13Å; L113-L163 HydrophobicContact CD2-CD2 3.99Å; L113-L163 VanDerWaalsContact O-CD2 3.3Å; L113-L163 WeakPolarHBondContact O-CD2 3.36Å
114	V	84.4	Confident	81.9	Confident	26 Å²	26	37.8 Å²	37.8	16%	0.158	23%	0.231	C	C	.	.	H	α-helix	trans	-60.4	-47.2	174.6	177.7	0	0	0	0	110.9	T87 I90 D110 I116 D117 S118	T87-V114 HydrophobicContact CG2-CG1 3.84Å; T87-V114 HydrophobicContact CG2-CG2 4.2Å; I90-V114 HydrophobicContact CG2-CG1 4.06Å; D110-V114 PolarHBondContact O-N 2.95Å; D110-V114 VanDerWaalsContact O-N 3.13Å; V114-I116 PolarHBondContact O-N 2.93Å; V114-D117 PolarHBondContact O-N 2.89Å; V114-S118 PolarHBondContact O-N 2.85Å; V114-S118 PolarHBondContact O-OG 2.9Å
115	A	88.1	Confident	82.3	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.5	-34.6	179	0	0	0	0	0	113.1	I90 A111 L112 E119 V120 A123 V124 L127	I90-A115 HydrophobicContact CD1-CB 4.3Å; I90-A115 VanDerWaalsContact CG2-CA 3.45Å; I90-A115 HydrophobicContact CG2-CB 3.79Å; A111-A115 WeakPolarHBondContact O-CB 3.32Å; A111-A115 PolarHBondContact O-N 3.22Å; L112-A115 PolarHBondContact O-N 3.48Å; A115-E119 PolarHBondContact O-N 3.3Å; A115-V120 PolarHBondContact O-N 3.46Å; A115-V120 VanDerWaalsContact O-N 3.14Å; A115-A123 HydrophobicContact CB-CB 4.04Å; A115-V124 HydrophobicContact CB-CG2 3.77Å; A115-L127 HydrophobicContact CB-CD1 3.86Å
116	I	87.9	Confident	82.9	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-72.2	-40.4	174.5	-67.4	167.6	0	0	0	110.8	L112 L113 V114 E119 V124 P160 L163 A164 I172 L176	L112-I116 HydrophobicContact CD1-CD1 4.25Å; L112-I116 HydrophobicContact CG-CD1 4.1Å; L112-I116 WeakPolarHBondContact O-CD1 2.99Å; L112-I116 WeakPolarHBondContact O-CG1 3.28Å; L112-I116 PolarHBondContact O-N 3.18Å; L112-I116 VanDerWaalsContact O-N 3.13Å; L113-I116 PolarHBondContact O-N 3.36Å; V114-I116 PolarHBondContact O-N 2.93Å; I116-E119 PolarHBondContact O-N 2.97Å; I116-E119 VanDerWaalsContact O-N 3.16Å; I116-V124 HydrophobicContact CG1-CG2 3.91Å; I116-P160 HydrophobicContact CD1-CB 3.68Å; I116-L163 HydrophobicContact CB-CD2 4.25Å; I116-L163 HydrophobicContact CG2-CB 4.21Å; I116-L163 HydrophobicContact CG2-CD2 4.08Å; I116-L163 HydrophobicContact CG2-CG 3.93Å; I116-A164 VanDerWaalsContact CG2-CA 3.42Å; I116-A164 HydrophobicContact CG2-CB 3.65Å; I116-I172 HydrophobicContact CG1-CG2 3.94Å; I116-I172 HydrophobicContact CG2-CG2 4.35Å; I116-L176 HydrophobicContact CD1-CD1 4.06Å
117	D	86.9	Confident	83.3	Confident	50 Å²	50	37.1 Å²	37.1	27%	0.267	22%	0.215	S	C	.	.	H	α-helix	trans	-66.3	-38.2	-179.5	-155.2	56.4	0	0	0	112.6	L113 V114 E119 M156 L163 R167	L113-D117 WeakPolarHBondContact O-CB 3.31Å; L113-D117 PolarHBondContact O-N 3.35Å; V114-D117 PolarHBondContact O-N 2.89Å; D117-E119 VanDerWaalsContact C-N 3.25Å; D117-E119 PolarHBondContact O-N 2.94Å; D117-M156 HydrophobicContact CB-CE 4.39Å; D117-L163 HydrophobicContact CB-CD2 4.3Å; D117-R167 IonicContact OD1-CZ 3.79Å; D117-R167 IonicContact OD1-NE 3.14Å; D117-R167 PolarHBondContact OD1-NE 3.29Å; D117-R167 IonicContact OD1-NH2 2.85Å; D117-R167 PolarHBondContact OD1-NH2 3.42Å; D117-R167 IonicContact OD2-CZ 2.61Å; D117-R167 IonicContact OD2-NH2 3.97Å; D117-R167 PolarHBondContact OD2-NH2 3.17Å; D117-R167 VanDerWaalsContact OD2-NH2 3.08Å
118	S	85.1	Confident	83.8	Confident	47 Å²	47	32.9 Å²	32.9	33%	0.329	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-1.3	173.4	-55.6	0	0	0	0	113.7	V114 V120	V114-S118 PolarHBondContact O-N 2.85Å; V114-S118 PolarHBondContact O-OG 2.9Å; S118-V120 WeakPolarHBondContact O-CG2 3.46Å; S118-V120 PolarHBondContact O-N 3.44Å; S118-V120 VanDerWaalsContact O-N 3.17Å
119	E	88	Confident	84.5	Confident	63 Å²	63	36 Å²	36	29%	0.294	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	20.4	177.9	-55.9	-174.9	-174.8	0	0	115.9	A115 I116 D117 V121 R167	A115-E119 PolarHBondContact O-N 3.3Å; I116-E119 PolarHBondContact O-N 2.97Å; I116-E119 VanDerWaalsContact O-N 3.16Å; D117-E119 VanDerWaalsContact C-N 3.25Å; D117-E119 PolarHBondContact O-N 2.94Å; E119-V121 PolarHBondContact O-N 3.18Å; E119-R167 HydrophobicContact CG-CB 4.3Å; E119-R167 HydrophobicContact CG-CG 4.48Å
120	V	89.4	Confident	85	Confident	9 Å²	9	33.7 Å²	33.7	6%	0.055	19%	0.189	C	C	.	.			trans	-84.1	96.3	-176.3	-171.4	0	0	0	0	111.4	E93 L95 A115 S118 G122 A123 V124	E93-V120 HydrophobicContact CG-CG1 4.17Å; E93-V120 HydrophobicContact CG-CG2 3.85Å; L95-V120 HydrophobicContact CD2-CG1 4.33Å; A115-V120 PolarHBondContact O-N 3.46Å; A115-V120 VanDerWaalsContact O-N 3.14Å; S118-V120 WeakPolarHBondContact O-CG2 3.46Å; S118-V120 PolarHBondContact O-N 3.44Å; S118-V120 VanDerWaalsContact O-N 3.17Å; V120-G122 PolarHBondContact O-N 3.06Å; V120-A123 HydrophobicContact CB-CB 4.06Å; V120-A123 HydrophobicContact CG1-CB 3.76Å; V120-A123 PolarHBondContact O-N 3.21Å; V120-V124 WeakPolarHBondContact O-CG2 3.37Å; V120-V124 PolarHBondContact O-N 3.19Å
121	V	90.3	Very high	84.7	Confident	44 Å²	44	42.1 Å²	42.1	27%	0.267	22%	0.217	S	C	.	.	H	α-helix	trans	-58	-43.2	-176.3	-177.5	0	0	0	0	112.5	E119 A123 V124 D125 E171 I172 M175	E119-V121 PolarHBondContact O-N 3.18Å; V121-A123 PolarHBondContact O-N 2.67Å; V121-V124 PolarHBondContact O-N 3.27Å; V121-D125 PolarHBondContact O-N 3.49Å; V121-D125 VanDerWaalsContact O-N 3.08Å; V121-E171 HydrophobicContact CG1-CB 4.27Å; V121-E171 HydrophobicContact CG2-CB 4.17Å; V121-I172 HydrophobicContact CG2-CG1 4.14Å; V121-M175 HydrophobicContact CB-CE 4.44Å; V121-M175 HydrophobicContact CG1-CE 3.57Å; V121-M175 HydrophobicContact CG1-SD 4.15Å
122	G	87.6	Confident	83.8	Confident	28 Å²	28	45.8 Å²	45.8	29%	0.289	24%	0.241	S	C	.	.	H	α-helix	trans	-64.5	-40.5	-178.3	0	0	0	0	0	113.2	V120 D125 I126	V120-G122 PolarHBondContact O-N 3.06Å; G122-D125 PolarHBondContact O-N 3.25Å; G122-I126 WeakPolarHBondContact O-CG1 3.34Å; G122-I126 PolarHBondContact O-N 2.9Å; G122-I126 VanDerWaalsContact O-N 3.09Å
123	A	88.9	Confident	82.3	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.008	27%	0.272	C	S	.	.	H	α-helix	trans	-65.4	-41.1	177.5	0	0	0	0	0	111.3	I90 L95 L98 A115 V120 V121 I126 L127	I90-A123 HydrophobicContact CG1-CB 4.36Å; I90-A123 HydrophobicContact CG2-CB 4.47Å; L95-A123 HydrophobicContact CD2-CB 4.12Å; L98-A123 HydrophobicContact CD2-CB 3.69Å; A115-A123 HydrophobicContact CB-CB 4.04Å; V120-A123 HydrophobicContact CB-CB 4.06Å; V120-A123 HydrophobicContact CG1-CB 3.76Å; V120-A123 PolarHBondContact O-N 3.21Å; V121-A123 PolarHBondContact O-N 2.67Å; A123-I126 PolarHBondContact O-N 3.36Å; A123-L127 WeakPolarHBondContact O-CB 3.37Å; A123-L127 VanDerWaalsContact O-CG 3.22Å; A123-L127 WeakPolarHBondContact O-CG 3.12Å; A123-L127 PolarHBondContact O-N 3Å
124	V	88.3	Confident	80.6	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-61.5	-45.2	175.8	176.1	0	0	0	0	111.2	L112 A115 I116 V120 V121 I126 L127 L128 I172 M175	L112-V124 HydrophobicContact CD1-CG1 4.15Å; A115-V124 HydrophobicContact CB-CG2 3.77Å; I116-V124 HydrophobicContact CG1-CG2 3.91Å; V120-V124 WeakPolarHBondContact O-CG2 3.37Å; V120-V124 PolarHBondContact O-N 3.19Å; V121-V124 PolarHBondContact O-N 3.27Å; V124-I126 PolarHBondContact O-N 3.43Å; V124-L127 PolarHBondContact O-N 3.43Å; V124-L128 HydrophobicContact CG1-CD1 3.69Å; V124-L128 HydrophobicContact CG1-CG 4.05Å; V124-L128 VanDerWaalsContact O-CB 3.3Å; V124-L128 WeakPolarHBondContact O-CB 3.01Å; V124-L128 VanDerWaalsContact O-CG 3.22Å; V124-L128 WeakPolarHBondContact O-CG 3.42Å; V124-L128 PolarHBondContact O-N 3.04Å; V124-I172 HydrophobicContact CG1-CG2 4.38Å; V124-I172 HydrophobicContact CG2-CD1 4.38Å; V124-I172 HydrophobicContact CG2-CG2 4.49Å; V124-M175 HydrophobicContact CB-CE 3.91Å; V124-M175 HydrophobicContact CG1-CE 3.76Å
125	D	88.6	Confident	78.6	Confident	76 Å²	76	67.7 Å²	67.7	41%	0.406	33%	0.328	S	S	.	.	H	α-helix	trans	-63	-43.6	179.1	-170.3	45.7	0	0	0	112.1	V121 G122 L127 L128 N129 M175	V121-D125 PolarHBondContact O-N 3.49Å; V121-D125 VanDerWaalsContact O-N 3.08Å; G122-D125 PolarHBondContact O-N 3.25Å; D125-L127 PolarHBondContact O-N 3.19Å; D125-L128 PolarHBondContact O-N 3.45Å; D125-N129 WeakPolarHBondContact O-CB 3.27Å; D125-N129 VanDerWaalsContact O-CG 3.31Å; D125-N129 PolarHBondContact O-N 3.09Å; D125-N129 PolarHBondContact O-ND2 3.37Å; D125-N129 PolarHBondContact OD1-ND2 3.08Å; D125-M175 HydrophobicContact CB-SD 3.91Å
126	I	87.3	Confident	76.5	Confident	39 Å²	39	73.1 Å²	73.1	20%	0.2	37%	0.365	C	S	.	.	H	α-helix	trans	-60.2	-48	175.5	-66.3	168.4	0	0	0	110.4	L95 L102 G122 A123 V124 L128 N129 H130	L95-I126 HydrophobicContact CB-CD1 3.99Å; L95-I126 HydrophobicContact CD2-CD1 4.28Å; L102-I126 HydrophobicContact CD1-CG2 3.73Å; G122-I126 WeakPolarHBondContact O-CG1 3.34Å; G122-I126 PolarHBondContact O-N 2.9Å; G122-I126 VanDerWaalsContact O-N 3.09Å; A123-I126 PolarHBondContact O-N 3.36Å; V124-I126 PolarHBondContact O-N 3.43Å; I126-L128 PolarHBondContact O-N 3.5Å; I126-N129 PolarHBondContact O-N 3.43Å; I126-H130 WeakPolarHBondContact O-CB 3.3Å; I126-H130 PolarHBondContact O-N 3.49Å
127	L	85.6	Confident	74.2	Confident	24 Å²	24	82.9 Å²	82.9	13%	0.126	41%	0.408	C	S	.	.	H	α-helix	trans	-65.9	-38.1	-178.5	-72.6	168.9	0	0	0	112.8	I90 L102 A108 A111 L112 A115 A123 V124 D125	I90-L127 HydrophobicContact CD1-CD1 4.09Å; L102-L127 HydrophobicContact CD1-CD2 3.85Å; L102-L127 HydrophobicContact CD2-CD2 3.97Å; A108-L127 HydrophobicContact CB-CD2 4.43Å; A111-L127 HydrophobicContact CB-CD1 4.25Å; A111-L127 HydrophobicContact CB-CD2 4.26Å; L112-L127 HydrophobicContact CD1-CB 4.29Å; A115-L127 HydrophobicContact CB-CD1 3.86Å; A123-L127 WeakPolarHBondContact O-CB 3.37Å; A123-L127 VanDerWaalsContact O-CG 3.22Å; A123-L127 WeakPolarHBondContact O-CG 3.12Å; A123-L127 PolarHBondContact O-N 3Å; V124-L127 PolarHBondContact O-N 3.43Å; D125-L127 PolarHBondContact O-N 3.19Å
128	L	82.1	Confident	72.1	Confident	30 Å²	30	83.1 Å²	83.1	16%	0.157	41%	0.412	C	S	.	.	H	α-helix	trans	-70.8	-33.8	177.9	-74.8	-178.1	0	0	0	112.7	L112 V124 D125 I126 M175 L176	L112-L128 HydrophobicContact CD1-CD2 4.09Å; L112-L128 HydrophobicContact CD1-CG 4.3Å; L112-L128 HydrophobicContact CD2-CD2 4.14Å; V124-L128 HydrophobicContact CG1-CD1 3.69Å; V124-L128 HydrophobicContact CG1-CG 4.05Å; V124-L128 VanDerWaalsContact O-CB 3.3Å; V124-L128 WeakPolarHBondContact O-CB 3.01Å; V124-L128 VanDerWaalsContact O-CG 3.22Å; V124-L128 WeakPolarHBondContact O-CG 3.42Å; V124-L128 PolarHBondContact O-N 3.04Å; D125-L128 PolarHBondContact O-N 3.45Å; I126-L128 PolarHBondContact O-N 3.5Å; L128-M175 HydrophobicContact CD1-CB 4.16Å; L128-L176 HydrophobicContact CD1-CD2 4.01Å; L128-L176 HydrophobicContact CD2-CD2 4.09Å
129	N	81.8	Confident	70.1	Confident	103 Å²	103	84.5 Å²	84.5	55%	0.551	42%	0.422	S	S	*	.	H	α-helix	trans	-87.2	-18	178.5	-67.3	-38.6	0	0	0	113	D125 I126 R131	D125-N129 WeakPolarHBondContact O-CB 3.27Å; D125-N129 VanDerWaalsContact O-CG 3.31Å; D125-N129 PolarHBondContact O-N 3.09Å; D125-N129 PolarHBondContact O-ND2 3.37Å; D125-N129 PolarHBondContact OD1-ND2 3.08Å; I126-N129 PolarHBondContact O-N 3.43Å; N129-R131 PolarHBondContact O-N 3.4Å
130	H	76.2	Confident	68.3	Low	64 Å²	64	85.5 Å²	85.5	30%	0.296	43%	0.428	S	S	.	.			trans	-66.1	126.8	-179.1	-175.3	72.1	0	0	0	111.6	L102 I126	L102-H130 HydrophobicContact CD1-CB 4.31Å; L102-H130 PolarHBondContact O-CE1 3.31Å; L102-H130 VanDerWaalsContact O-CE1 3.3Å; L102-H130 PolarHBondContact O-NE2 2.69Å; I126-H130 WeakPolarHBondContact O-CB 3.3Å; I126-H130 PolarHBondContact O-N 3.49Å
131	R	64.8	Low	66	Low	222 Å²	222	87.9 Å²	87.9	84%	0.838	45%	0.449	S	S	*	.			trans	-102.9	113.3	175.2	-68.3	-172.8	-178.5	-172.9	3	109.4	N129 R133	N129-R131 PolarHBondContact O-N 3.4Å; R131-R133 PolarHBondContact O-N 2.93Å
132	P	61.3	Low	63.8	Low	83 Å²	83	92.3 Å²	92.3	54%	0.539	46%	0.464	S	S	.	.			trans	-62.8	130.8	179.5	22.9	-31.2	0	0	0	110.6	R134	P132-R134 PolarHBondContact O-N 3.13Å; P132-R134 VanDerWaalsContact O-N 3.11Å
133	R	52.1	Low	61.9	Low	227 Å²	227	95.5 Å²	95.5	86%	0.857	47%	0.474	S	S	*	.	S	Bend	trans	-65	-15.4	-173.5	-140.9	172	-177	157.2	0.1	113.8	R131	R131-R133 PolarHBondContact O-N 2.93Å
134	R	48.6	Very low	60	Low	242 Å²	242	97.2 Å²	97.2	91%	0.913	48%	0.482	S	S	*	.	S	Bend	trans	-140.4	74.1	-179	-69.6	-177.8	178.3	159.4	-0.6	111.6	P132	P132-R134 PolarHBondContact O-N 3.13Å; P132-R134 VanDerWaalsContact O-N 3.11Å
135	S	42.8	Very low	57.8	Low	70 Å²	70	102.7 Å²	102.7	49%	0.49	51%	0.508	S	S	.	.			trans	-165.7	120.7	162.3	176.4	0	0	0	0	110.4	K137	S135-K137 PolarHBondContact O-N 3.05Å
136	S	42.2	Very low	55.7	Low	113 Å²	113	106.7 Å²	106.7	79%	0.79	52%	0.518	S	S	*	.			trans	-55.4	125	164.8	52	0	0	0	0	109.4	P138	S136-P138 WeakPolarHBondContact O-CD 3.38Å
137	K	40.1	Very low	53.8	Low	206 Å²	206	107.6 Å²	107.6	90%	0.896	52%	0.522	S	S	*	.			trans	-22.4	100.2	177.9	-70.8	-178.3	178	-179.5	0	113.1	S135 S139	S135-K137 PolarHBondContact O-N 3.05Å; K137-S139 PolarHBondContact O-N 2.94Å
138	P	42.3	Very low	51.8	Low	55 Å²	55	110.9 Å²	110.9	36%	0.357	54%	0.537	S	S	.	.			trans	-71.3	118.9	150.1	21.1	-9.6	0	0	0	105	S136 I140 K142	S136-P138 WeakPolarHBondContact O-CD 3.38Å; P138-I140 PolarHBondContact O-N 3.49Å; P138-K142 HydrophobicContact CB-CB 4.19Å
139	S	44	Very low	49.9	Very low	76 Å²	76	112.8 Å²	112.8	53%	0.531	55%	0.547	S	S	.	.			trans	-50.3	143.8	164	172	0	0	0	0	108.2	K137 A141 K142 L143	K137-S139 PolarHBondContact O-N 2.94Å; S139-A141 CarbonylContact O-C 3.54Å; S139-A141 PolarHBondContact O-N 3.23Å; S139-A141 PolarHBondContact OG-N 3.13Å; S139-K142 WeakPolarHBondContact O-CA 3.47Å; S139-K142 WeakPolarHBondContact O-CB 3.4Å; S139-K142 PolarHBondContact O-N 3.37Å; S139-L143 PolarHBondContact O-N 3.44Å
140	I	50.2	Low	48	Very low	84 Å²	84	110.5 Å²	110.5	43%	0.431	54%	0.538	S	S	.	.	H	α-helix	trans	-46.4	-31.4	172.2	-71.5	160.8	0	0	0	110.6	P138 K142 L143 M144	P138-I140 PolarHBondContact O-N 3.49Å; I140-K142 PolarHBondContact O-N 3.33Å; I140-L143 PolarHBondContact O-N 2.86Å; I140-M144 HydrophobicContact CG2-CG 4.31Å; I140-M144 HydrophobicContact CG2-SD 4.22Å; I140-M144 WeakPolarHBondContact O-CB 3.4Å; I140-M144 WeakPolarHBondContact O-CG 3.36Å; I140-M144 PolarHBondContact O-N 3.04Å
141	A	41.8	Very low	46.2	Very low	58 Å²	58	114.9 Å²	114.9	48%	0.479	56%	0.559	S	S	.	*	H	α-helix	trans	-59.2	-39.1	171.8	0	0	0	0	0	114.6	S139 Q145	S139-A141 CarbonylContact O-C 3.54Å; S139-A141 PolarHBondContact O-N 3.23Å; S139-A141 PolarHBondContact OG-N 3.13Å; A141-Q145 WeakPolarHBondContact O-CB 3.46Å; A141-Q145 PolarHBondContact O-N 3.37Å
142	K	43.3	Very low	45.1	Very low	138 Å²	138	110.8 Å²	110.8	60%	0.6	54%	0.544	S	S	*	.	H	α-helix	trans	-74.2	-28.4	177.5	-116.2	176.9	-177.9	175	0	112.5	P138 S139 I140 R146	P138-K142 HydrophobicContact CB-CB 4.19Å; S139-K142 WeakPolarHBondContact O-CA 3.47Å; S139-K142 WeakPolarHBondContact O-CB 3.4Å; S139-K142 PolarHBondContact O-N 3.37Å; I140-K142 PolarHBondContact O-N 3.33Å; K142-R146 PolarHBondContact O-N 3.03Å; K142-R146 VanDerWaalsContact O-N 3.1Å
143	L	48.3	Very low	43.9	Very low	95 Å²	95	111.7 Å²	111.7	50%	0.497	55%	0.553	S	S	.	*	H	α-helix	trans	-75	-46	173.9	-126.2	151.8	0	0	0	110	S139 I140 Q145 R146 I147	S139-L143 PolarHBondContact O-N 3.44Å; I140-L143 PolarHBondContact O-N 2.86Å; L143-Q145 VanDerWaalsContact C-N 3.32Å; L143-Q145 PolarHBondContact O-N 3.47Å; L143-R146 PolarHBondContact O-N 3.42Å; L143-I147 HydrophobicContact CD2-CD1 3.85Å; L143-I147 WeakPolarHBondContact O-CD1 3.44Å; L143-I147 VanDerWaalsContact O-CG1 3.23Å; L143-I147 WeakPolarHBondContact O-CG1 3.33Å; L143-I147 PolarHBondContact O-N 3.17Å
144	M	47.7	Very low	43.6	Very low	36 Å²	36	103.1 Å²	103.1	18%	0.177	53%	0.526	C	S	.	.	H	α-helix	trans	-60.9	-38.1	170.2	-72	-172.9	77.2	0	0	112.5	I140 R146 I147 Q148 I181	I140-M144 HydrophobicContact CG2-CG 4.31Å; I140-M144 HydrophobicContact CG2-SD 4.22Å; I140-M144 WeakPolarHBondContact O-CB 3.4Å; I140-M144 WeakPolarHBondContact O-CG 3.36Å; I140-M144 PolarHBondContact O-N 3.04Å; M144-R146 VanDerWaalsContact C-N 3.35Å; M144-I147 PolarHBondContact O-N 3.01Å; M144-Q148 VanDerWaalsContact O-CB 3.25Å; M144-Q148 WeakPolarHBondContact O-CB 3.38Å; M144-Q148 VanDerWaalsContact O-CG 3.27Å; M144-Q148 WeakPolarHBondContact O-CG 3.5Å; M144-Q148 PolarHBondContact O-N 3.12Å; M144-I181 HydrophobicContact CE-CG2 4.02Å; M144-I181 HydrophobicContact SD-CG2 3.97Å
145	Q	42.2	Very low	43.5	Very low	116 Å²	116	98.1 Å²	98.1	54%	0.542	52%	0.522	S	S	.	.	H	α-helix	trans	-71.1	-28.1	177.4	-165.2	176.3	20.5	0	0	112.6	A141 L143 N149	A141-Q145 WeakPolarHBondContact O-CB 3.46Å; A141-Q145 PolarHBondContact O-N 3.37Å; L143-Q145 VanDerWaalsContact C-N 3.32Å; L143-Q145 PolarHBondContact O-N 3.47Å; Q145-N149 VanDerWaalsContact O-CB 3.28Å; Q145-N149 WeakPolarHBondContact O-CB 3.43Å; Q145-N149 VanDerWaalsContact O-CG 3.26Å; Q145-N149 PolarHBondContact O-N 3.16Å; Q145-N149 PolarHBondContact O-ND2 2.97Å
146	R	45	Very low	43.9	Very low	160 Å²	160	97.3 Å²	97.3	60%	0.604	51%	0.511	S	S	*	.	H	α-helix	trans	-72.9	-42	169.1	-101.2	-177.7	-175.9	158.4	0.5	112.2	K142 L143 M144 Q148 N149	K142-R146 PolarHBondContact O-N 3.03Å; K142-R146 VanDerWaalsContact O-N 3.1Å; L143-R146 PolarHBondContact O-N 3.42Å; M144-R146 VanDerWaalsContact C-N 3.35Å; R146-Q148 VanDerWaalsContact C-N 3.32Å; R146-N149 PolarHBondContact O-N 3.35Å
147	I	47.6	Very low	44.7	Very low	58 Å²	58	95.9 Å²	95.9	30%	0.297	49%	0.494	S	S	.	.	H	α-helix	trans	-69.8	-29.1	178.2	-66.2	163.8	0	0	0	111.8	L143 M144 A159 P160	L143-I147 HydrophobicContact CD2-CD1 3.85Å; L143-I147 WeakPolarHBondContact O-CD1 3.44Å; L143-I147 VanDerWaalsContact O-CG1 3.23Å; L143-I147 WeakPolarHBondContact O-CG1 3.33Å; L143-I147 PolarHBondContact O-N 3.17Å; M144-I147 PolarHBondContact O-N 3.01Å; I147-A159 HydrophobicContact CG2-CB 4.31Å; I147-P160 HydrophobicContact CD1-CG 4.44Å
148	Q	43.2	Very low	46.1	Very low	93 Å²	93	87.1 Å²	87.1	44%	0.435	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-2.3	175.2	-72.4	173.6	-9.4	0	0	113.6	M144 R146	M144-Q148 VanDerWaalsContact O-CB 3.25Å; M144-Q148 WeakPolarHBondContact O-CB 3.38Å; M144-Q148 VanDerWaalsContact O-CG 3.27Å; M144-Q148 WeakPolarHBondContact O-CG 3.5Å; M144-Q148 PolarHBondContact O-N 3.12Å; R146-Q148 VanDerWaalsContact C-N 3.32Å
149	N	41.3	Very low	47.7	Very low	69 Å²	69	85.5 Å²	85.5	37%	0.369	45%	0.45	S	S	.	.			trans	-86.7	120.8	-178.4	-107	-16.6	0	0	0	110.6	Q145 R146 E151 Y152	Q145-N149 VanDerWaalsContact O-CB 3.28Å; Q145-N149 WeakPolarHBondContact O-CB 3.43Å; Q145-N149 VanDerWaalsContact O-CG 3.26Å; Q145-N149 PolarHBondContact O-N 3.16Å; Q145-N149 PolarHBondContact O-ND2 2.97Å; R146-N149 PolarHBondContact O-N 3.35Å; N149-E151 PolarHBondContact O-N 3.29Å; N149-Y152 HydrophobicContact CB-CD2 4.34Å; N149-Y152 PolarHBondContact O-N 3.19Å
150	P	42.3	Very low	49.5	Very low	56 Å²	56	82.9 Å²	82.9	36%	0.364	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-2.8	-175	26.7	-34.4	0	0	0	115.1	R206	P150-R206 VanDerWaalsContact CB-NH1 3.29Å; P150-R206 PolarHBondContact O-NH1 3.23Å; P150-R206 VanDerWaalsContact O-NH1 3.12Å
151	E	38.9	Very low	51.1	Low	155 Å²	155	79.1 Å²	79.1	72%	0.724	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-9.4	179.4	-70.7	179.4	176.3	0	0	113.8	N149	N149-E151 PolarHBondContact O-N 3.29Å
152	Y	42.3	Very low	53.2	Low	137 Å²	137	76.6 Å²	76.6	54%	0.537	39%	0.39	S	S	.	.			trans	-111	86.3	172	-68.5	-79.8	0	0	0	108.4	N149 T154	N149-Y152 HydrophobicContact CB-CD2 4.34Å; N149-Y152 PolarHBondContact O-N 3.19Å; Y152-T154 PolarHBondContact O-N 3.09Å
153	S	36.4	Very low	55.3	Low	102 Å²	102	70.6 Å²	70.6	71%	0.713	36%	0.364	S	S	*	.			trans	-69.6	92.6	166.6	54.2	0	0	0	0	108.6
154	T	44.2	Very low	57.2	Low	47 Å²	47	66 Å²	66	29%	0.288	34%	0.341	S	S	.	.			trans	-69.8	156.5	152.1	45.2	0	0	0	0	107.9	D110 Y152 M156	D110-T154 WeakPolarHBondContact OD1-CG2 3.42Å; Y152-T154 PolarHBondContact O-N 3.09Å; T154-M156 PolarHBondContact O-N 2.92Å; T154-M156 VanDerWaalsContact O-N 3.08Å; T154-M156 PolarHBondContact OG1-O 3.47Å
155	T	47	Very low	59.3	Low	137 Å²	137	64.4 Å²	64.4	84%	0.84	33%	0.333	S	S	*	.	S	Bend	trans	-60.2	-19.9	-179.9	50.4	0	0	0	0	112.8
156	M	51.5	Low	61.6	Low	53 Å²	53	61 Å²	61	26%	0.261	32%	0.317	S	S	.	.	S	Bend	trans	-119	110.6	170.3	-63.2	176.4	78.2	0	0	110.1	L113 D117 T154 V158 L163	L113-M156 HydrophobicContact CB-SD 4.41Å; L113-M156 HydrophobicContact CD1-CB 4.32Å; D117-M156 HydrophobicContact CB-CE 4.39Å; T154-M156 PolarHBondContact O-N 2.92Å; T154-M156 VanDerWaalsContact O-N 3.08Å; T154-M156 PolarHBondContact OG1-O 3.47Å; M156-V158 PolarHBondContact O-N 3.13Å; M156-L163 HydrophobicContact CE-CD1 3.49Å; M156-L163 VanDerWaalsContact CE-CD1 3.49Å; M156-L163 HydrophobicContact CE-CD2 3.47Å; M156-L163 VanDerWaalsContact CE-CD2 3.47Å; M156-L163 HydrophobicContact CE-CG 4.12Å; M156-L163 HydrophobicContact SD-CD2 4.42Å
157	D	58	Low	63.7	Low	82 Å²	82	58.5 Å²	58.5	44%	0.439	31%	0.307	S	S	.	.			trans	-73.4	25.9	-177.8	-92.3	-36.5	0	0	0	114.4	R206	D157-R206 IonicContact OD1-CZ 2.65Å; D157-R206 IonicContact OD1-NH2 3.57Å; D157-R206 PolarHBondContact OD1-NH2 2.95Å; D157-R206 IonicContact OD2-CZ 3.74Å; D157-R206 IonicContact OD2-NE 2.74Å; D157-R206 IonicContact OD2-NH2 3.92Å
158	V	69.5	Low	65.8	Low	23 Å²	23	58 Å²	58	14%	0.139	31%	0.305	C	S	.	.	S	Bend	trans	-127.1	140.3	-162.2	-175.5	0	0	0	0	112.1	M156 I162 L163	M156-V158 PolarHBondContact O-N 3.13Å; V158-I162 HydrophobicContact CG1-CB 3.59Å; V158-I162 HydrophobicContact CG1-CG2 3.41Å; V158-I162 VanDerWaalsContact CG1-CG2 3.41Å; V158-L163 HydrophobicContact CG1-CB 4.25Å
159	A	76.8	Confident	68	Low	21 Å²	21	55 Å²	55	17%	0.174	29%	0.292	C	S	.	.			trans	-68.6	144.9	175.4	0	0	0	0	0	111.8	I147 V161 I162 L163	I147-A159 HydrophobicContact CG2-CB 4.31Å; A159-V161 VanDerWaalsContact C-N 3.27Å; A159-V161 PolarHBondContact O-N 3.16Å; A159-V161 VanDerWaalsContact O-N 3.13Å; A159-I162 HydrophobicContact CB-CB 4.48Å; A159-I162 HydrophobicContact CB-CD1 3.96Å; A159-I162 HydrophobicContact CB-CG1 4.13Å; A159-I162 WeakPolarHBondContact O-CB 3.21Å; A159-I162 PolarHBondContact O-N 2.72Å; A159-L163 PolarHBondContact O-N 2.9Å
160	P	81.7	Confident	70.3	Confident	20 Å²	20	54.7 Å²	54.7	13%	0.13	29%	0.286	C	S	.	.	H	α-helix	trans	-52.7	-40.3	-177.6	-28.4	33.2	0	0	0	114.5	L112 L113 I116 I147 L163 A164	L112-P160 HydrophobicContact CD2-CB 4.22Å; L112-P160 HydrophobicContact CD2-CG 4.1Å; L113-P160 HydrophobicContact CD2-CB 4.07Å; L113-P160 HydrophobicContact CD2-CG 3.76Å; I116-P160 HydrophobicContact CD1-CB 3.68Å; I147-P160 HydrophobicContact CD1-CG 4.44Å; P160-L163 PolarHBondContact O-N 3.01Å; P160-A164 WeakPolarHBondContact O-CB 3.48Å; P160-A164 PolarHBondContact O-N 3.03Å
161	V	84.3	Confident	72.6	Confident	6 Å²	6	55.7 Å²	55.7	4%	0.036	29%	0.286	C	S	.	.	H	α-helix	trans	-67.5	-37.7	177.9	-178.6	0	0	0	0	112.2	A159 A165 L176 I181 L183	A159-V161 VanDerWaalsContact C-N 3.27Å; A159-V161 PolarHBondContact O-N 3.16Å; A159-V161 VanDerWaalsContact O-N 3.13Å; V161-A165 WeakPolarHBondContact O-CB 3.46Å; V161-A165 PolarHBondContact O-N 3.43Å; V161-L176 HydrophobicContact CG2-CB 4.22Å; V161-L176 HydrophobicContact CG2-CD1 4.29Å; V161-I181 HydrophobicContact CG2-CB 3.91Å; V161-I181 HydrophobicContact CG2-CD1 3.55Å; V161-I181 HydrophobicContact CG2-CG1 4.33Å; V161-I181 HydrophobicContact CG2-CG2 3.59Å; V161-L183 HydrophobicContact CG1-CD2 3.71Å; V161-L183 HydrophobicContact CG1-CG 4.46Å
162	I	86.5	Confident	75.1	Confident	5 Å²	5	48.3 Å²	48.3	3%	0.026	25%	0.251	C	S	.	.	H	α-helix	trans	-65.9	-45	178.3	-63.9	175.3	0	0	0	109.1	V158 A159 A165 H166 F210 D213 I214 C217	V158-I162 HydrophobicContact CG1-CB 3.59Å; V158-I162 HydrophobicContact CG1-CG2 3.41Å; V158-I162 VanDerWaalsContact CG1-CG2 3.41Å; A159-I162 HydrophobicContact CB-CB 4.48Å; A159-I162 HydrophobicContact CB-CD1 3.96Å; A159-I162 HydrophobicContact CB-CG1 4.13Å; A159-I162 WeakPolarHBondContact O-CB 3.21Å; A159-I162 PolarHBondContact O-N 2.72Å; I162-A165 WeakPolarHBondContact O-CB 3.31Å; I162-A165 PolarHBondContact O-N 3.22Å; I162-H166 VanDerWaalsContact CG2-NE2 3.34Å; I162-H166 WeakPolarHBondContact CG2-NE2 3.3Å; I162-H166 PolarHBondContact O-CD2 3.31Å; I162-H166 VanDerWaalsContact O-CG 3.31Å; I162-H166 PolarHBondContact O-N 3.31Å; I162-F210 HydrophobicContact CD1-CE2 4.46Å; I162-D213 HydrophobicContact CG2-CB 4.23Å; I162-I214 HydrophobicContact CD1-CG1 4.28Å; I162-C217 HydrophobicContact CB-CB 4.28Å; I162-C217 HydrophobicContact CG1-CB 4.27Å; I162-C217 HydrophobicContact CG2-CB 3.97Å
163	L	86.9	Confident	77.3	Confident	11 Å²	11	41.8 Å²	41.8	6%	0.058	23%	0.226	C	C	.	.	H	α-helix	trans	-63.5	-45.6	178	-174.2	64.4	0	0	0	112.1	L113 I116 D117 M156 V158 A159 P160 A165 H166 R167	L113-L163 HydrophobicContact CB-CD2 4.13Å; L113-L163 HydrophobicContact CD2-CD2 3.99Å; L113-L163 VanDerWaalsContact O-CD2 3.3Å; L113-L163 WeakPolarHBondContact O-CD2 3.36Å; I116-L163 HydrophobicContact CB-CD2 4.25Å; I116-L163 HydrophobicContact CG2-CB 4.21Å; I116-L163 HydrophobicContact CG2-CD2 4.08Å; I116-L163 HydrophobicContact CG2-CG 3.93Å; D117-L163 HydrophobicContact CB-CD2 4.3Å; M156-L163 HydrophobicContact CE-CD1 3.49Å; M156-L163 VanDerWaalsContact CE-CD1 3.49Å; M156-L163 HydrophobicContact CE-CD2 3.47Å; M156-L163 VanDerWaalsContact CE-CD2 3.47Å; M156-L163 HydrophobicContact CE-CG 4.12Å; M156-L163 HydrophobicContact SD-CD2 4.42Å; V158-L163 HydrophobicContact CG1-CB 4.25Å; A159-L163 PolarHBondContact O-N 2.9Å; P160-L163 PolarHBondContact O-N 3.01Å; L163-A165 PolarHBondContact O-N 3Å; L163-H166 WeakPolarHBondContact O-CB 3.35Å; L163-H166 PolarHBondContact O-N 3.17Å; L163-H166 VanDerWaalsContact O-N 3.07Å; L163-R167 PolarHBondContact O-N 3.01Å
164	A	88.6	Confident	79.9	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60.1	-37	176.7	0	0	0	0	0	112.1	I116 P160 N168 I172 L173 L176	I116-A164 VanDerWaalsContact CG2-CA 3.42Å; I116-A164 HydrophobicContact CG2-CB 3.65Å; P160-A164 WeakPolarHBondContact O-CB 3.48Å; P160-A164 PolarHBondContact O-N 3.03Å; A164-N168 PolarHBondContact O-N 3.38Å; A164-N168 VanDerWaalsContact O-N 3.13Å; A164-I172 HydrophobicContact CB-CG2 3.78Å; A164-L173 HydrophobicContact CB-CD2 3.76Å; A164-L173 HydrophobicContact CB-CG 4.16Å; A164-L176 HydrophobicContact CB-CD1 3.62Å
165	A	90.6	Very high	82	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.008	20%	0.195	C	C	.	.	H	α-helix	trans	-68.7	-37.8	175	0	0	0	0	0	112.2	V161 I162 L163 R167 N168 L173 C217 S220	V161-A165 WeakPolarHBondContact O-CB 3.46Å; V161-A165 PolarHBondContact O-N 3.43Å; I162-A165 WeakPolarHBondContact O-CB 3.31Å; I162-A165 PolarHBondContact O-N 3.22Å; L163-A165 PolarHBondContact O-N 3Å; A165-R167 VanDerWaalsContact C-N 3.32Å; A165-R167 PolarHBondContact O-N 3.25Å; A165-N168 WeakPolarHBondContact O-CA 3.46Å; A165-N168 PolarHBondContact O-N 2.78Å; A165-L173 HydrophobicContact CB-CD2 4.19Å; A165-C217 HydrophobicContact CB-CB 3.87Å; A165-C217 WeakPolarHBondContact CB-SG 3.49Å; A165-S220 WeakPolarHBondContact CB-OG 3.34Å; A165-S220 WeakPolarHBondContact O-CB 3.26Å
166	H	90.7	Very high	83.8	Confident	45 Å²	45	31.2 Å²	31.2	21%	0.208	16%	0.155	C	C	.	.	H	α-helix	trans	-63.1	-38.7	175.8	-69.3	-170.7	0	0	0	112.3	I162 L163 N168 D213	I162-H166 VanDerWaalsContact CG2-NE2 3.34Å; I162-H166 WeakPolarHBondContact CG2-NE2 3.3Å; I162-H166 PolarHBondContact O-CD2 3.31Å; I162-H166 VanDerWaalsContact O-CG 3.31Å; I162-H166 PolarHBondContact O-N 3.31Å; L163-H166 WeakPolarHBondContact O-CB 3.35Å; L163-H166 PolarHBondContact O-N 3.17Å; L163-H166 VanDerWaalsContact O-N 3.07Å; H166-N168 PolarHBondContact O-N 2.88Å; H166-D213 IonicContact CE1-OD1 3.66Å; H166-D213 PolarHBondContact NE2-O 3.21Å
167	R	89.6	Confident	85.4	Confident	108 Å²	108	30.6 Å²	30.6	41%	0.408	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-12.3	172.5	-61.8	-67.3	172.4	177.6	2.6	113.1	D117 E119 L163 A165 N169	D117-R167 IonicContact OD1-CZ 3.79Å; D117-R167 IonicContact OD1-NE 3.14Å; D117-R167 PolarHBondContact OD1-NE 3.29Å; D117-R167 IonicContact OD1-NH2 2.85Å; D117-R167 PolarHBondContact OD1-NH2 3.42Å; D117-R167 IonicContact OD2-CZ 2.61Å; D117-R167 IonicContact OD2-NH2 3.97Å; D117-R167 PolarHBondContact OD2-NH2 3.17Å; D117-R167 VanDerWaalsContact OD2-NH2 3.08Å; E119-R167 HydrophobicContact CG-CB 4.3Å; E119-R167 HydrophobicContact CG-CG 4.48Å; L163-R167 PolarHBondContact O-N 3.01Å; A165-R167 VanDerWaalsContact C-N 3.32Å; A165-R167 PolarHBondContact O-N 3.25Å; R167-N169 PolarHBondContact O-N 3.14Å; R167-N169 VanDerWaalsContact O-N 3.13Å
168	N	91.1	Very high	86.6	Confident	48 Å²	48	34.8 Å²	34.8	26%	0.257	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	25.5	177.6	-169.1	46.4	0	0	0	114	A164 A165 H166 Y170 P221 S222	A164-N168 PolarHBondContact O-N 3.38Å; A164-N168 VanDerWaalsContact O-N 3.13Å; A165-N168 WeakPolarHBondContact O-CA 3.46Å; A165-N168 PolarHBondContact O-N 2.78Å; H166-N168 PolarHBondContact O-N 2.88Å; N168-Y170 PolarHBondContact O-N 3.44Å; N168-P221 WeakPolarHBondContact OD1-CD 3.46Å; N168-S222 PolarHBondContact O-OG 3.26Å; N168-S222 VanDerWaalsContact OD1-CB 3.27Å; N168-S222 WeakPolarHBondContact OD1-CB 3.25Å; N168-S222 PolarHBondContact OD1-N 3.46Å; N168-S222 PolarHBondContact OD1-OG 3.11Å
169	N	90.2	Very high	87	Confident	29 Å²	29	36.6 Å²	36.6	16%	0.155	17%	0.174	C	C	.	.			trans	-82.2	113.3	179.3	-171.8	-30.2	0	0	0	110.9	R167 E171 I172 L173	R167-N169 PolarHBondContact O-N 3.14Å; R167-N169 VanDerWaalsContact O-N 3.13Å; N169-E171 PolarHBondContact O-N 3.02Å; N169-E171 PolarHBondContact OD1-N 3.46Å; N169-I172 HydrophobicContact CB-CB 4.38Å; N169-I172 HydrophobicContact CB-CD1 4.18Å; N169-I172 HydrophobicContact CB-CG1 4.36Å; N169-I172 WeakPolarHBondContact ND2-CD1 3.3Å; N169-L173 WeakPolarHBondContact O-CB 3.36Å; N169-L173 WeakPolarHBondContact O-CD1 3.44Å; N169-L173 WeakPolarHBondContact O-CG 3.22Å; N169-L173 PolarHBondContact O-N 3.46Å
170	Y	90	Very high	86.5	Confident	63 Å²	63	42.8 Å²	42.8	25%	0.247	20%	0.204	C	C	.	.	H	α-helix	trans	-62.6	-39.3	-176.7	-179.8	-93.1	0	0	0	113.1	N168 T174 L226 L755	N168-Y170 PolarHBondContact O-N 3.44Å; Y170-T174 HydrophobicContact CD1-CG2 4.09Å; Y170-T174 HydrophobicContact CE1-CG2 3.7Å; Y170-T174 HydrophobicContact CE2-CG2 4.45Å; Y170-T174 VanDerWaalsContact O-CG2 3.3Å; Y170-T174 WeakPolarHBondContact O-CG2 3.21Å; Y170-T174 PolarHBondContact O-N 3.21Å; Y170-L226 HydrophobicContact CD2-CD1 4.1Å; Y170-L226 HydrophobicContact CD2-CD2 4.24Å; Y170-L226 HydrophobicContact CD2-CG 4.12Å; Y170-L226 HydrophobicContact CE2-CD1 4.08Å; Y170-L226 HydrophobicContact CE2-CD2 3.39Å; Y170-L226 HydrophobicContact CE2-CG 3.67Å; Y170-L226 WeakPolarHBondContact OH-CD2 3.47Å; Y170-L755 HydrophobicContact CD1-CD1 4.48Å; Y170-L755 HydrophobicContact CD1-CD2 4.43Å; Y170-L755 HydrophobicContact CD2-CD1 4.02Å; Y170-L755 HydrophobicContact CD2-CD2 3.53Å; Y170-L755 HydrophobicContact CD2-CG 4.44Å; Y170-L755 HydrophobicContact CE1-CD1 4.09Å; Y170-L755 HydrophobicContact CE2-CD1 3.56Å; Y170-L755 HydrophobicContact CE2-CD2 3.96Å; Y170-L755 HydrophobicContact CE2-CG 4.4Å; Y170-L755 HydrophobicContact CG-CD1 4.45Å; Y170-L755 HydrophobicContact CG-CD2 3.79Å
171	E	90.2	Very high	86	Confident	76 Å²	76	43.3 Å²	43.3	36%	0.355	21%	0.206	S	C	.	.	H	α-helix	trans	-72.7	-46.7	-172.9	-63.6	-174.2	176.6	0	0	111.3	V121 N169 L173 T174 M175 R759	V121-E171 HydrophobicContact CG1-CB 4.27Å; V121-E171 HydrophobicContact CG2-CB 4.17Å; N169-E171 PolarHBondContact O-N 3.02Å; N169-E171 PolarHBondContact OD1-N 3.46Å; E171-L173 VanDerWaalsContact C-N 3.31Å; E171-L173 PolarHBondContact O-N 3.41Å; E171-T174 PolarHBondContact O-N 3.36Å; E171-T174 VanDerWaalsContact O-N 3.11Å; E171-T174 PolarHBondContact O-OG1 3.08Å; E171-M175 WeakPolarHBondContact O-CG 3.43Å; E171-M175 PolarHBondContact O-N 3.07Å; E171-R759 IonicContact OE1-CZ 2.97Å; E171-R759 IonicContact OE1-NH1 2.64Å; E171-R759 PolarHBondContact OE1-NH1 3Å; E171-R759 IonicContact OE1-NH2 3.78Å; E171-R759 PolarHBondContact OE1-NH2 2.88Å
172	I	90.3	Very high	85.1	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-57.4	-45.8	174.9	-61.9	179.4	0	0	0	110.6	I116 V121 V124 A164 N169 T174 M175 L176	I116-I172 HydrophobicContact CG1-CG2 3.94Å; I116-I172 HydrophobicContact CG2-CG2 4.35Å; V121-I172 HydrophobicContact CG2-CG1 4.14Å; V124-I172 HydrophobicContact CG1-CG2 4.38Å; V124-I172 HydrophobicContact CG2-CD1 4.38Å; V124-I172 HydrophobicContact CG2-CG2 4.49Å; A164-I172 HydrophobicContact CB-CG2 3.78Å; N169-I172 HydrophobicContact CB-CB 4.38Å; N169-I172 HydrophobicContact CB-CD1 4.18Å; N169-I172 HydrophobicContact CB-CG1 4.36Å; N169-I172 WeakPolarHBondContact ND2-CD1 3.3Å; I172-T174 VanDerWaalsContact C-N 3.35Å; I172-T174 PolarHBondContact O-N 2.97Å; I172-M175 HydrophobicContact CG1-CE 4.24Å; I172-M175 PolarHBondContact O-N 3.48Å; I172-L176 HydrophobicContact CG2-CD1 3.97Å; I172-L176 HydrophobicContact CG2-CG 4.47Å; I172-L176 WeakPolarHBondContact O-CG 3.4Å; I172-L176 PolarHBondContact O-N 2.88Å
173	L	89.9	Confident	84.5	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.2	-40.8	176.5	-75.4	170.5	0	0	0	112.5	A164 A165 N169 E171 M175 L176 L177 L223 L226	A164-L173 HydrophobicContact CB-CD2 3.76Å; A164-L173 HydrophobicContact CB-CG 4.16Å; A165-L173 HydrophobicContact CB-CD2 4.19Å; N169-L173 WeakPolarHBondContact O-CB 3.36Å; N169-L173 WeakPolarHBondContact O-CD1 3.44Å; N169-L173 WeakPolarHBondContact O-CG 3.22Å; N169-L173 PolarHBondContact O-N 3.46Å; E171-L173 VanDerWaalsContact C-N 3.31Å; E171-L173 PolarHBondContact O-N 3.41Å; L173-M175 VanDerWaalsContact C-N 3.31Å; L173-M175 PolarHBondContact O-N 2.95Å; L173-L176 PolarHBondContact O-N 3.45Å; L173-L177 WeakPolarHBondContact O-CB 3.45Å; L173-L177 VanDerWaalsContact O-CG 3.3Å; L173-L177 WeakPolarHBondContact O-CG 3.48Å; L173-L177 PolarHBondContact O-N 3.21Å; L173-L223 HydrophobicContact CD1-CB 4.46Å; L173-L223 HydrophobicContact CD2-CD1 4.32Å; L173-L226 HydrophobicContact CB-CD1 3.76Å
174	T	90.7	Very high	83.8	Confident	34 Å²	34	50.8 Å²	50.8	21%	0.209	25%	0.254	C	S	.	.	H	α-helix	trans	-63.4	-37.1	175.7	61.3	0	0	0	0	112.7	Y170 E171 I172 K178 L226	Y170-T174 HydrophobicContact CD1-CG2 4.09Å; Y170-T174 HydrophobicContact CE1-CG2 3.7Å; Y170-T174 HydrophobicContact CE2-CG2 4.45Å; Y170-T174 VanDerWaalsContact O-CG2 3.3Å; Y170-T174 WeakPolarHBondContact O-CG2 3.21Å; Y170-T174 PolarHBondContact O-N 3.21Å; E171-T174 PolarHBondContact O-N 3.36Å; E171-T174 VanDerWaalsContact O-N 3.11Å; E171-T174 PolarHBondContact O-OG1 3.08Å; I172-T174 VanDerWaalsContact C-N 3.35Å; I172-T174 PolarHBondContact O-N 2.97Å; T174-K178 VanDerWaalsContact O-CG 3.27Å; T174-K178 WeakPolarHBondContact O-CG 3.33Å; T174-K178 PolarHBondContact O-N 3.41Å; T174-L226 HydrophobicContact CG2-CD1 3.76Å; T174-L226 HydrophobicContact CG2-CD2 3.54Å; T174-L226 HydrophobicContact CG2-CG 4.32Å
175	M	87	Confident	83.3	Confident	29 Å²	29	61.6 Å²	61.6	14%	0.143	30%	0.295	C	S	.	.	H	α-helix	trans	-67.3	-43.5	177.1	-66.6	-171.2	-64.4	0	0	111.2	V121 V124 D125 L128 E171 I172 L173 K178	V121-M175 HydrophobicContact CB-CE 4.44Å; V121-M175 HydrophobicContact CG1-CE 3.57Å; V121-M175 HydrophobicContact CG1-SD 4.15Å; V124-M175 HydrophobicContact CB-CE 3.91Å; V124-M175 HydrophobicContact CG1-CE 3.76Å; D125-M175 HydrophobicContact CB-SD 3.91Å; L128-M175 HydrophobicContact CD1-CB 4.16Å; E171-M175 WeakPolarHBondContact O-CG 3.43Å; E171-M175 PolarHBondContact O-N 3.07Å; I172-M175 HydrophobicContact CG1-CE 4.24Å; I172-M175 PolarHBondContact O-N 3.48Å; L173-M175 VanDerWaalsContact C-N 3.31Å; L173-M175 PolarHBondContact O-N 2.95Å; M175-K178 PolarHBondContact O-N 3.44Å
176	L	85.4	Confident	82.9	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-68.1	-41.1	179.1	-69.7	173.5	0	0	0	112.8	I116 L128 V161 A164 I172 L173 K178 Q179 I181	I116-L176 HydrophobicContact CD1-CD1 4.06Å; L128-L176 HydrophobicContact CD1-CD2 4.01Å; L128-L176 HydrophobicContact CD2-CD2 4.09Å; V161-L176 HydrophobicContact CG2-CB 4.22Å; V161-L176 HydrophobicContact CG2-CD1 4.29Å; A164-L176 HydrophobicContact CB-CD1 3.62Å; I172-L176 HydrophobicContact CG2-CD1 3.97Å; I172-L176 HydrophobicContact CG2-CG 4.47Å; I172-L176 WeakPolarHBondContact O-CG 3.4Å; I172-L176 PolarHBondContact O-N 2.88Å; L173-L176 PolarHBondContact O-N 3.45Å; L176-K178 VanDerWaalsContact C-N 3.31Å; L176-K178 PolarHBondContact O-N 2.95Å; L176-Q179 PolarHBondContact O-N 2.94Å; L176-Q179 VanDerWaalsContact O-N 3.13Å; L176-I181 HydrophobicContact CB-CD1 4.17Å; L176-I181 HydrophobicContact CD2-CD1 4.1Å; L176-I181 WeakPolarHBondContact O-CD1 3.42Å
177	L	85.1	Confident	82.6	Confident	41 Å²	41	65.6 Å²	65.6	22%	0.215	32%	0.316	C	S	.	.	H	α-helix	trans	-68.9	-28.1	179.4	-71.9	174.3	0	0	0	112.8	L173 Q179 D180 L223 L226 T227	L173-L177 WeakPolarHBondContact O-CB 3.45Å; L173-L177 VanDerWaalsContact O-CG 3.3Å; L173-L177 WeakPolarHBondContact O-CG 3.48Å; L173-L177 PolarHBondContact O-N 3.21Å; L177-Q179 PolarHBondContact O-N 2.61Å; L177-D180 PolarHBondContact O-N 3.31Å; L177-L223 HydrophobicContact CD1-CD1 4.23Å; L177-L226 HydrophobicContact CD1-CB 3.75Å; L177-L226 HydrophobicContact CD1-CD1 3.94Å; L177-L226 HydrophobicContact CD1-CG 4.45Å; L177-T227 HydrophobicContact CD1-CG2 4.1Å; L177-T227 HydrophobicContact CD2-CG2 4.48Å
178	K	84.5	Confident	82.2	Confident	170 Å²	170	64 Å²	64	74%	0.739	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-17.8	171.8	-77.9	171.6	-177.3	175.9	0	113.4	T174 M175 L176 D180	T174-K178 VanDerWaalsContact O-CG 3.27Å; T174-K178 WeakPolarHBondContact O-CG 3.33Å; T174-K178 PolarHBondContact O-N 3.41Å; M175-K178 PolarHBondContact O-N 3.44Å; L176-K178 VanDerWaalsContact C-N 3.31Å; L176-K178 PolarHBondContact O-N 2.95Å; K178-D180 VanDerWaalsContact C-N 3.33Å
179	Q	76.8	Confident	81.8	Confident	61 Å²	61	64.2 Å²	64.2	29%	0.285	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	14.7	177.8	-60.6	-161.7	-16.2	0	0	113.7	L176 L177 I181	L176-Q179 PolarHBondContact O-N 2.94Å; L176-Q179 VanDerWaalsContact O-N 3.13Å; L177-Q179 PolarHBondContact O-N 2.61Å; Q179-I181 VanDerWaalsContact C-N 3.32Å; Q179-I181 HydrophobicContact CB-CG1 4.34Å; Q179-I181 PolarHBondContact O-N 3Å
180	D	67.1	Low	81.2	Confident	151 Å²	151	66.1 Å²	66.1	81%	0.807	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	39	178.3	-66.5	-30.9	0	0	0	114.3	L177 K178 S182	L177-D180 PolarHBondContact O-N 3.31Å; K178-D180 VanDerWaalsContact C-N 3.33Å; D180-S182 PolarHBondContact O-N 2.99Å
181	I	69.7	Low	81	Confident	31 Å²	31	65.4 Å²	65.4	16%	0.159	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-74.3	117	176.7	-54.2	171	0	0	0	109.4	M144 V161 L176 Q179 L183	M144-I181 HydrophobicContact CE-CG2 4.02Å; M144-I181 HydrophobicContact SD-CG2 3.97Å; V161-I181 HydrophobicContact CG2-CB 3.91Å; V161-I181 HydrophobicContact CG2-CD1 3.55Å; V161-I181 HydrophobicContact CG2-CG1 4.33Å; V161-I181 HydrophobicContact CG2-CG2 3.59Å; L176-I181 HydrophobicContact CB-CD1 4.17Å; L176-I181 HydrophobicContact CD2-CD1 4.1Å; L176-I181 WeakPolarHBondContact O-CD1 3.42Å; Q179-I181 VanDerWaalsContact C-N 3.32Å; Q179-I181 HydrophobicContact CB-CG1 4.34Å; Q179-I181 PolarHBondContact O-N 3Å; I181-L183 PolarHBondContact O-N 3.03Å
182	S	66.9	Low	80.9	Confident	86 Å²	86	70.2 Å²	70.2	60%	0.601	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-75.5	123.4	177.5	62.6	0	0	0	0	111.7	D180	D180-S182 PolarHBondContact O-N 2.99Å
183	L	73.7	Confident	80.8	Confident	48 Å²	48	72.1 Å²	72.1	25%	0.251	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-74	129.5	172.7	-73.5	151.9	0	0	0	110.8	V161 I181 R185 L223 T227	V161-L183 HydrophobicContact CG1-CD2 3.71Å; V161-L183 HydrophobicContact CG1-CG 4.46Å; I181-L183 PolarHBondContact O-N 3.03Å; L183-R185 PolarHBondContact O-N 3.13Å; L183-L223 HydrophobicContact CD1-CD1 4.13Å; L183-L223 HydrophobicContact CD1-CD2 4.17Å; L183-L223 HydrophobicContact CD2-CD2 4.32Å; L183-T227 HydrophobicContact CD1-CG2 4.33Å
184	P	71.9	Confident	80.6	Confident	44 Å²	44	80 Å²	80	29%	0.286	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-68.6	130.8	174.2	28.5	-32.5	0	0	0	110	I214	P184-I214 HydrophobicContact CB-CD1 4.46Å; P184-I214 HydrophobicContact CG-CD1 4.14Å; P184-I214 HydrophobicContact CG-CG1 4.29Å
185	R	77.6	Confident	80.3	Confident	227 Å²	227	84.3 Å²	84.3	86%	0.857	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-83.2	129.1	171.4	-67.3	-172.9	179	-165.4	-1.8	109.5	L183	L183-R185 PolarHBondContact O-N 3.13Å
186	P	82.3	Confident	80.2	Confident	34 Å²	34	83.7 Å²	83.7	22%	0.221	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-67.1	138.5	178.6	27.2	-31.3	0	0	0	110	I214 Y215 L218	P186-I214 HydrophobicContact CB-CG2 4.16Å; P186-I214 HydrophobicContact CG-CG2 4.07Å; P186-Y215 HydrophobicContact CB-CE2 4.06Å; P186-Y215 HydrophobicContact CG-CD1 4.49Å; P186-Y215 HydrophobicContact CG-CE1 3.79Å; P186-Y215 HydrophobicContact CG-CE2 4.16Å; P186-L218 HydrophobicContact CG-CD1 4.18Å
187	H	84.5	Confident	80.3	Confident	96 Å²	96	86.9 Å²	86.9	44%	0.444	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-77	154.1	168.8	-70.7	-169.4	0	0	0	110	C191 C193 C196	H187-C191 HydrophobicContact CB-CB 3.94Å; H187-C193 PolarHBondContact ND1-SG 2.95Å; H187-C193 VanDerWaalsContact ND1-SG 3.44Å; H187-C196 PolarHBondContact ND1-SG 2.8Å; H187-C196 VanDerWaalsContact ND1-SG 3.37Å
188	A	81.6	Confident	80.3	Confident	75 Å²	75	87.8 Å²	87.8	62%	0.62	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-57.3	149.5	174.2	0	0	0	0	0	111.7	G190 C191	A188-G190 PolarHBondContact O-N 3.1Å; A188-C191 VanDerWaalsContact O-CB 3.31Å; A188-C191 WeakPolarHBondContact O-CB 3.31Å; A188-C191 PolarHBondContact O-N 2.65Å; A188-C191 VanDerWaalsContact O-N 3.12Å
189	V	81.9	Confident	80.1	Confident	53 Å²	53	84.6 Å²	84.6	32%	0.321	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	128.8	173.7	-172.7	0	0	0	0	108.4	L245 V248 E249	V189-L245 HydrophobicContact CG2-CD2 3.36Å; V189-V248 HydrophobicContact CB-CG1 4.08Å; V189-V248 HydrophobicContact CG1-CG1 3.73Å; V189-V248 HydrophobicContact CG2-CG1 4.43Å; V189-E249 HydrophobicContact CG1-CG 4.48Å
190	G	78.2	Confident	80.5	Confident	69 Å²	69	85.6 Å²	85.6	71%	0.711	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.7	12.3	-174.7	0	0	0	0	0	115.2	A188 E192	A188-G190 PolarHBondContact O-N 3.1Å; G190-E192 PolarHBondContact O-N 3.29Å
191	C	86.8	Confident	81.4	Confident	47 Å²	47	86.3 Å²	86.3	32%	0.318	47%	0.473	S	S	.	.			trans	-59.3	123.7	172.9	-177.4	0	0	0	0	112	H187 A188 C193 C196	H187-C191 HydrophobicContact CB-CB 3.94Å; A188-C191 VanDerWaalsContact O-CB 3.31Å; A188-C191 WeakPolarHBondContact O-CB 3.31Å; A188-C191 PolarHBondContact O-N 2.65Å; A188-C191 VanDerWaalsContact O-N 3.12Å; C191-C193 VanDerWaalsContact C-N 3.3Å; C191-C193 PolarHBondContact O-N 3.26Å; C191-C196 WeakPolarHBondContact O-CB 3.42Å
192	E	86.1	Confident	82.1	Confident	178 Å²	178	91.2 Å²	91.2	83%	0.832	49%	0.493	S	S	*	.			trans	-88.1	13.9	-177.9	-59.8	-172.2	160.6	0	0	114.1	G190	G190-E192 PolarHBondContact O-N 3.29Å
193	C	88.8	Confident	82.9	Confident	40 Å²	40	90.5 Å²	90.5	27%	0.27	48%	0.482	S	S	.	.			trans	-64.7	150.8	179.8	80.1	0	0	0	0	111.4	H187 C191 L195 C196 N197	H187-C193 PolarHBondContact ND1-SG 2.95Å; H187-C193 VanDerWaalsContact ND1-SG 3.44Å; C191-C193 VanDerWaalsContact C-N 3.3Å; C191-C193 PolarHBondContact O-N 3.26Å; C193-L195 PolarHBondContact O-N 3.39Å; C193-L195 VanDerWaalsContact O-N 3.1Å; C193-C196 PolarHBondContact O-N 3.43Å; C193-C196 VanDerWaalsContact O-N 3.11Å; C193-C196 PolarHBondContact SG-N 3.39Å; C193-C196 VanDerWaalsContact SG-N 3.4Å; C193-N197 PolarHBondContact O-N 3.34Å
194	M	87.1	Confident	83.4	Confident	164 Å²	164	91.5 Å²	91.5	81%	0.808	49%	0.494	S	S	*	.	H	α-helix	trans	-54.4	-36.3	-175.8	-67.4	-67.6	-84.3	0	0	112.6	A198	M194-A198 WeakPolarHBondContact O-CB 3.35Å; M194-A198 PolarHBondContact O-N 3.19Å
195	L	83.4	Confident	84	Confident	126 Å²	126	93.3 Å²	93.3	66%	0.66	50%	0.5	S	S	*	.	H	α-helix	trans	-70.2	-45.6	179.2	-65.3	173.6	0	0	0	112.7	C193 K199	C193-L195 PolarHBondContact O-N 3.39Å; C193-L195 VanDerWaalsContact O-N 3.1Å; L195-K199 WeakPolarHBondContact O-CB 3.13Å; L195-K199 WeakPolarHBondContact O-CG 3.34Å; L195-K199 PolarHBondContact O-N 3.47Å
196	C	85.1	Confident	84.3	Confident	16 Å²	16	86.4 Å²	86.4	11%	0.108	47%	0.474	C	S	.	.	H	α-helix	trans	-66.4	-43.6	177.9	-76.7	0	0	0	0	110.9	H187 C191 C193 A198 K199 N200	H187-C196 PolarHBondContact ND1-SG 2.8Å; H187-C196 VanDerWaalsContact ND1-SG 3.37Å; C191-C196 WeakPolarHBondContact O-CB 3.42Å; C193-C196 PolarHBondContact O-N 3.43Å; C193-C196 VanDerWaalsContact O-N 3.11Å; C193-C196 PolarHBondContact SG-N 3.39Å; C193-C196 VanDerWaalsContact SG-N 3.4Å; C196-A198 PolarHBondContact O-N 3.46Å; C196-K199 PolarHBondContact O-N 3.45Å; C196-N200 VanDerWaalsContact O-CB 3.25Å; C196-N200 WeakPolarHBondContact O-CB 3.19Å; C196-N200 PolarHBondContact O-N 3.35Å
197	N	86.8	Confident	84.4	Confident	68 Å²	68	86.4 Å²	86.4	36%	0.364	47%	0.471	S	S	.	.	H	α-helix	trans	-64.9	-41.9	178.9	-162.4	1.7	0	0	0	111.6	C193 N200 K201	C193-N197 PolarHBondContact O-N 3.34Å; N197-N200 PolarHBondContact O-N 3.34Å; N197-K201 WeakPolarHBondContact O-CB 3.45Å; N197-K201 VanDerWaalsContact O-CG 3.32Å; N197-K201 WeakPolarHBondContact O-CG 3.47Å; N197-K201 PolarHBondContact O-N 3.29Å; N197-K201 VanDerWaalsContact OD1-CE 3.31Å; N197-K201 WeakPolarHBondContact OD1-CE 3.45Å
198	A	85.4	Confident	84.5	Confident	59 Å²	59	82.5 Å²	82.5	49%	0.488	46%	0.455	S	S	.	.	H	α-helix	trans	-63.3	-44.2	175.1	0	0	0	0	0	112.4	M194 C196 K202	M194-A198 WeakPolarHBondContact O-CB 3.35Å; M194-A198 PolarHBondContact O-N 3.19Å; C196-A198 PolarHBondContact O-N 3.46Å; A198-K202 WeakPolarHBondContact O-CB 3.5Å; A198-K202 PolarHBondContact O-N 3.35Å
199	K	81.1	Confident	84.7	Confident	104 Å²	104	85.6 Å²	85.6	45%	0.452	45%	0.451	S	S	.	.	H	α-helix	trans	-63.4	-46.4	176.8	-75.7	-177.5	178.4	-170.7	0	111.7	L195 C196 K201 K202 D203	L195-K199 WeakPolarHBondContact O-CB 3.13Å; L195-K199 WeakPolarHBondContact O-CG 3.34Å; L195-K199 PolarHBondContact O-N 3.47Å; C196-K199 PolarHBondContact O-N 3.45Å; K199-K201 VanDerWaalsContact C-N 3.35Å; K199-K201 PolarHBondContact O-N 3.14Å; K199-K202 PolarHBondContact O-N 3.36Å; K199-D203 CarbonylContact O-C 3.56Å; K199-D203 PolarHBondContact O-N 3.4Å
200	N	84.4	Confident	84.9	Confident	82 Å²	82	85.8 Å²	85.8	44%	0.439	45%	0.447	S	S	.	.	H	α-helix	trans	-65.6	-36.5	-179.3	-163.2	29	0	0	0	112.4	C196 N197 S204	C196-N200 VanDerWaalsContact O-CB 3.25Å; C196-N200 WeakPolarHBondContact O-CB 3.19Å; C196-N200 PolarHBondContact O-N 3.35Å; N197-N200 PolarHBondContact O-N 3.34Å; N200-S204 PolarHBondContact O-N 3.05Å; N200-S204 WeakPolarHBondContact OD1-CA 3.38Å; N200-S204 WeakPolarHBondContact OD1-CB 3.33Å
201	K	85.4	Confident	85.3	Confident	166 Å²	166	83.7 Å²	83.7	72%	0.722	42%	0.418	S	S	*	.	H	α-helix	trans	-69.3	-33.4	173.8	-77.1	179.5	178.7	-179.9	0	113.3	N197 K199	N197-K201 WeakPolarHBondContact O-CB 3.45Å; N197-K201 VanDerWaalsContact O-CG 3.32Å; N197-K201 WeakPolarHBondContact O-CG 3.47Å; N197-K201 PolarHBondContact O-N 3.29Å; N197-K201 VanDerWaalsContact OD1-CE 3.31Å; N197-K201 WeakPolarHBondContact OD1-CE 3.45Å; K199-K201 VanDerWaalsContact C-N 3.35Å; K199-K201 PolarHBondContact O-N 3.14Å
202	K	84.9	Confident	85.5	Confident	133 Å²	133	82.4 Å²	82.4	58%	0.578	41%	0.408	S	S	*	.	H	α-helix	trans	-74.1	-50.4	177.7	-174.1	173	-179.3	172.9	0	111	A198 K199	A198-K202 WeakPolarHBondContact O-CB 3.5Å; A198-K202 PolarHBondContact O-N 3.35Å; K199-K202 PolarHBondContact O-N 3.36Å
203	D	83.6	Confident	85.6	Confident	71 Å²	71	75.8 Å²	75.8	38%	0.38	38%	0.378	S	S	.	.			trans	-159.1	106.1	178.6	-173.4	-17.4	0	0	0	110.4	K199 L205 R206 H207	K199-D203 CarbonylContact O-C 3.56Å; K199-D203 PolarHBondContact O-N 3.4Å; D203-L205 PolarHBondContact OD1-N 2.99Å; D203-R206 HydrophobicContact CB-CB 4.04Å; D203-R206 VanDerWaalsContact CG-CB 3.47Å; D203-R206 PolarHBondContact OD1-N 3.32Å; D203-R206 VanDerWaalsContact OD2-CB 3.28Å; D203-R206 WeakPolarHBondContact OD2-CB 3.5Å; D203-H207 WeakPolarHBondContact O-CB 3.35Å; D203-H207 PolarHBondContact O-N 3.49Å
204	S	84.8	Confident	85.6	Confident	70 Å²	70	74.4 Å²	74.4	49%	0.49	37%	0.368	S	S	.	.	H	α-helix	trans	-70	-35.1	-179.3	58.3	0	0	0	0	112.9	N200 H207 S208	N200-S204 PolarHBondContact O-N 3.05Å; N200-S204 WeakPolarHBondContact OD1-CA 3.38Å; N200-S204 WeakPolarHBondContact OD1-CB 3.33Å; S204-H207 PolarHBondContact O-N 3.14Å; S204-S208 PolarHBondContact O-N 3.38Å; S204-S208 PolarHBondContact O-OG 3.4Å
205	L	85.3	Confident	85.8	Confident	82 Å²	82	67.7 Å²	67.7	43%	0.429	33%	0.333	S	S	.	.	H	α-helix	trans	-74.8	-40.1	-177	177.8	142.6	0	0	0	111.2	D203 H207 S208 R209	D203-L205 PolarHBondContact OD1-N 2.99Å; L205-H207 VanDerWaalsContact C-N 3.26Å; L205-H207 PolarHBondContact O-N 2.93Å; L205-S208 PolarHBondContact O-N 3.4Å; L205-S208 PolarHBondContact O-OG 3.21Å; L205-R209 WeakPolarHBondContact O-CB 3.28Å; L205-R209 WeakPolarHBondContact O-CG 3.3Å; L205-R209 PolarHBondContact O-N 3.05Å
206	R	83.2	Confident	86.3	Confident	82 Å²	82	67.7 Å²	67.7	31%	0.309	33%	0.325	S	S	.	.	H	α-helix	trans	-65.7	-33.9	172	-167.3	173.2	-175.7	-167.1	1.2	111.3	P150 D157 D203 F210	P150-R206 VanDerWaalsContact CB-NH1 3.29Å; P150-R206 PolarHBondContact O-NH1 3.23Å; P150-R206 VanDerWaalsContact O-NH1 3.12Å; D157-R206 IonicContact OD1-CZ 2.65Å; D157-R206 IonicContact OD1-NH2 3.57Å; D157-R206 PolarHBondContact OD1-NH2 2.95Å; D157-R206 IonicContact OD2-CZ 3.74Å; D157-R206 IonicContact OD2-NE 2.74Å; D157-R206 IonicContact OD2-NH2 3.92Å; D203-R206 HydrophobicContact CB-CB 4.04Å; D203-R206 VanDerWaalsContact CG-CB 3.47Å; D203-R206 PolarHBondContact OD1-N 3.32Å; D203-R206 VanDerWaalsContact OD2-CB 3.28Å; D203-R206 WeakPolarHBondContact OD2-CB 3.5Å; R206-F210 WeakPolarHBondContact O-CB 3.05Å; R206-F210 PolarHBondContact O-N 3.24Å
207	H	84.3	Confident	86.6	Confident	33 Å²	33	67 Å²	67	15%	0.153	32%	0.32	C	S	.	.	H	α-helix	trans	-65.7	-44.2	175.1	-174.4	47.8	0	0	0	112.8	D203 S204 L205 R211	D203-H207 WeakPolarHBondContact O-CB 3.35Å; D203-H207 PolarHBondContact O-N 3.49Å; S204-H207 PolarHBondContact O-N 3.14Å; L205-H207 VanDerWaalsContact C-N 3.26Å; L205-H207 PolarHBondContact O-N 2.93Å; H207-R211 PolarHBondContact O-N 3.23Å
208	S	86.4	Confident	86.8	Confident	15 Å²	15	65.2 Å²	65.2	11%	0.105	31%	0.311	C	S	.	.	H	α-helix	trans	-69.8	-43.6	178.1	57.9	0	0	0	0	112.4	S204 L205 F210 R211 L212	S204-S208 PolarHBondContact O-N 3.38Å; S204-S208 PolarHBondContact O-OG 3.4Å; L205-S208 PolarHBondContact O-N 3.4Å; L205-S208 PolarHBondContact O-OG 3.21Å; S208-F210 PolarHBondContact O-N 3.19Å; S208-R211 WeakPolarHBondContact O-CB 3.49Å; S208-R211 PolarHBondContact O-N 2.96Å; S208-L212 PolarHBondContact O-N 3.38Å
209	R	86.8	Confident	87.3	Confident	140 Å²	140	62.5 Å²	62.5	53%	0.528	29%	0.288	S	S	.	.	H	α-helix	trans	-58.7	-46.2	174.1	-76.3	-176.5	178.3	172.3	0.8	112.6	L205 R211 L212 D213 F252	L205-R209 WeakPolarHBondContact O-CB 3.28Å; L205-R209 WeakPolarHBondContact O-CG 3.3Å; L205-R209 PolarHBondContact O-N 3.05Å; R209-R211 VanDerWaalsContact C-N 3.26Å; R209-R211 PolarHBondContact O-N 2.65Å; R209-L212 WeakPolarHBondContact O-CB 3.32Å; R209-L212 PolarHBondContact O-N 3.24Å; R209-L212 VanDerWaalsContact O-N 3.09Å; R209-D213 PolarHBondContact O-N 3.34Å; R209-F252 HydrophobicContact CG-CZ 4.35Å
210	F	84.9	Confident	87.9	Confident	57 Å²	57	57.6 Å²	57.6	25%	0.25	27%	0.267	C	S	.	.	H	α-helix	trans	-60.6	-36.6	177.8	-179.2	-106.1	0	0	0	112.5	I162 R206 S208 D213 I214	I162-F210 HydrophobicContact CD1-CE2 4.46Å; R206-F210 WeakPolarHBondContact O-CB 3.05Å; R206-F210 PolarHBondContact O-N 3.24Å; S208-F210 PolarHBondContact O-N 3.19Å; F210-D213 PolarHBondContact O-N 3.07Å; F210-I214 HydrophobicContact CD1-CD1 3.81Å; F210-I214 HydrophobicContact CE1-CD1 3.37Å; F210-I214 HydrophobicContact CE1-CG1 4.28Å; F210-I214 HydrophobicContact CZ-CD1 3.78Å; F210-I214 HydrophobicContact CZ-CG1 4.31Å; F210-I214 WeakPolarHBondContact O-CG1 3.45Å; F210-I214 PolarHBondContact O-N 2.98Å; F210-I214 VanDerWaalsContact O-N 3.09Å
211	R	87.4	Confident	88.4	Confident	25 Å²	25	54 Å²	54	9%	0.094	25%	0.248	C	C	.	.	H	α-helix	trans	-65.5	-45	173.8	174.9	168.7	60.3	-138.4	-8.3	111.4	H207 S208 R209 D213 I214 Y215 E249	H207-R211 PolarHBondContact O-N 3.23Å; S208-R211 WeakPolarHBondContact O-CB 3.49Å; S208-R211 PolarHBondContact O-N 2.96Å; R209-R211 VanDerWaalsContact C-N 3.26Å; R209-R211 PolarHBondContact O-N 2.65Å; R211-D213 VanDerWaalsContact C-N 3.3Å; R211-D213 PolarHBondContact O-N 3Å; R211-I214 PolarHBondContact O-N 3.43Å; R211-Y215 HydrophobicContact CG-CD2 3.75Å; R211-Y215 HydrophobicContact CG-CE2 3.59Å; R211-Y215 VanDerWaalsContact O-CD2 3.29Å; R211-Y215 WeakPolarHBondContact O-CD2 3.42Å; R211-Y215 PolarHBondContact O-N 3.03Å; R211-E249 IonicContact CZ-OE1 3.28Å; R211-E249 IonicContact CZ-OE2 2.73Å; R211-E249 IonicContact NE-OE1 3.36Å; R211-E249 IonicContact NE-OE2 3.17Å; R211-E249 PolarHBondContact NE-OE2 3.11Å; R211-E249 IonicContact NH2-OE1 3.85Å; R211-E249 PolarHBondContact NH2-OE1 3.3Å; R211-E249 IonicContact NH2-OE2 2.74Å; R211-E249 PolarHBondContact NH2-OE2 3.07Å
212	L	89.5	Confident	88.7	Confident	20 Å²	20	46.4 Å²	46.4	11%	0.105	22%	0.216	C	C	.	.	H	α-helix	trans	-57.5	-44.2	175.2	-174.6	75.8	0	0	0	111.1	S208 R209 I214 Y215 R216 F252 D255 Y256 L259	S208-L212 PolarHBondContact O-N 3.38Å; R209-L212 WeakPolarHBondContact O-CB 3.32Å; R209-L212 PolarHBondContact O-N 3.24Å; R209-L212 VanDerWaalsContact O-N 3.09Å; L212-I214 VanDerWaalsContact C-N 3.35Å; L212-I214 PolarHBondContact O-N 3.33Å; L212-Y215 PolarHBondContact O-N 2.9Å; L212-Y215 VanDerWaalsContact O-N 3.14Å; L212-R216 WeakPolarHBondContact O-CB 3.48Å; L212-R216 PolarHBondContact O-N 3.19Å; L212-F252 HydrophobicContact CD1-CB 4.45Å; L212-F252 HydrophobicContact CD2-CD1 4.2Å; L212-D255 HydrophobicContact CD1-CB 3.9Å; L212-D255 HydrophobicContact CD2-CB 4.14Å; L212-Y256 HydrophobicContact CD1-CD1 3.86Å; L212-Y256 HydrophobicContact CD1-CD2 4.33Å; L212-Y256 HydrophobicContact CD1-CE1 3.58Å; L212-Y256 HydrophobicContact CD1-CE2 4.09Å; L212-Y256 HydrophobicContact CD1-CG 4.23Å; L212-L259 HydrophobicContact CD1-CD1 4.42Å
213	D	88.8	Confident	89.1	Confident	39 Å²	39	40.1 Å²	40.1	21%	0.209	19%	0.189	C	C	.	.	H	α-helix	trans	-63.4	-38.4	179	-69.7	-33.1	0	0	0	112.7	I162 H166 R209 F210 R211 R216 C217	I162-D213 HydrophobicContact CG2-CB 4.23Å; H166-D213 IonicContact CE1-OD1 3.66Å; H166-D213 PolarHBondContact NE2-O 3.21Å; R209-D213 PolarHBondContact O-N 3.34Å; F210-D213 PolarHBondContact O-N 3.07Å; R211-D213 VanDerWaalsContact C-N 3.3Å; R211-D213 PolarHBondContact O-N 3Å; D213-R216 PolarHBondContact O-N 2.95Å; D213-C217 WeakPolarHBondContact O-CB 3.47Å; D213-C217 PolarHBondContact O-N 3.48Å
214	I	89.1	Confident	89.6	Confident	10 Å²	10	37 Å²	37	5%	0.051	17%	0.171	C	C	.	.	H	α-helix	trans	-62.1	-47	172	-69.7	167.6	0	0	0	110.2	I162 P184 P186 F210 R211 L212 R216 C217 L218	I162-I214 HydrophobicContact CD1-CG1 4.28Å; P184-I214 HydrophobicContact CB-CD1 4.46Å; P184-I214 HydrophobicContact CG-CD1 4.14Å; P184-I214 HydrophobicContact CG-CG1 4.29Å; P186-I214 HydrophobicContact CB-CG2 4.16Å; P186-I214 HydrophobicContact CG-CG2 4.07Å; F210-I214 HydrophobicContact CD1-CD1 3.81Å; F210-I214 HydrophobicContact CE1-CD1 3.37Å; F210-I214 HydrophobicContact CE1-CG1 4.28Å; F210-I214 HydrophobicContact CZ-CD1 3.78Å; F210-I214 HydrophobicContact CZ-CG1 4.31Å; F210-I214 WeakPolarHBondContact O-CG1 3.45Å; F210-I214 PolarHBondContact O-N 2.98Å; F210-I214 VanDerWaalsContact O-N 3.09Å; R211-I214 PolarHBondContact O-N 3.43Å; L212-I214 VanDerWaalsContact C-N 3.35Å; L212-I214 PolarHBondContact O-N 3.33Å; I214-R216 VanDerWaalsContact C-N 3.33Å; I214-R216 PolarHBondContact O-N 3.14Å; I214-C217 WeakPolarHBondContact O-CB 3.33Å; I214-C217 PolarHBondContact O-N 3.45Å; I214-L218 HydrophobicContact CG2-CD1 3.91Å; I214-L218 HydrophobicContact CG2-CG 4.29Å; I214-L218 WeakPolarHBondContact O-CG 3.24Å; I214-L218 PolarHBondContact O-N 2.96Å
215	Y	92.2	Very high	90	Very high	23 Å²	23	34.6 Å²	34.6	9%	0.09	15%	0.153	C	C	.	.	H	α-helix	trans	-64.2	-37.8	178.7	-83.3	-60.3	0	0	0	112.6	P186 R211 L212 C217 L218 A219 L238 L242 L245 Y256	P186-Y215 HydrophobicContact CB-CE2 4.06Å; P186-Y215 HydrophobicContact CG-CD1 4.49Å; P186-Y215 HydrophobicContact CG-CE1 3.79Å; P186-Y215 HydrophobicContact CG-CE2 4.16Å; R211-Y215 HydrophobicContact CG-CD2 3.75Å; R211-Y215 HydrophobicContact CG-CE2 3.59Å; R211-Y215 VanDerWaalsContact O-CD2 3.29Å; R211-Y215 WeakPolarHBondContact O-CD2 3.42Å; R211-Y215 PolarHBondContact O-N 3.03Å; L212-Y215 PolarHBondContact O-N 2.9Å; L212-Y215 VanDerWaalsContact O-N 3.14Å; Y215-C217 VanDerWaalsContact C-N 3.32Å; Y215-C217 PolarHBondContact O-N 3.27Å; Y215-L218 PolarHBondContact O-N 3.05Å; Y215-A219 WeakPolarHBondContact O-CB 3.37Å; Y215-A219 PolarHBondContact O-N 3.33Å; Y215-L238 HydrophobicContact CD1-CD1 4.28Å; Y215-L242 HydrophobicContact CD1-CD2 3.8Å; Y215-L242 HydrophobicContact CG-CD2 3.87Å; Y215-L245 HydrophobicContact CD1-CD1 4.36Å; Y215-L245 HydrophobicContact CD2-CD1 4.11Å; Y215-L245 HydrophobicContact CE1-CD1 3.81Å; Y215-L245 HydrophobicContact CE2-CD1 3.49Å; Y215-L245 VanDerWaalsContact CE2-CD1 3.49Å; Y215-Y256 AromaticContact CD2-CE1 3.88Å; Y215-Y256 HydrophobicContact CD2-CE1 3.88Å; Y215-Y256 HydrophobicContact CG-CE1 4.31Å
216	R	92.7	Very high	90.3	Very high	126 Å²	126	33.1 Å²	33.1	48%	0.475	15%	0.145	S	C	.	.	H	α-helix	trans	-62.4	-39.2	173	-176.2	172.6	-168.1	160.5	4.2	112.1	L212 D213 I214 S220 L259	L212-R216 WeakPolarHBondContact O-CB 3.48Å; L212-R216 PolarHBondContact O-N 3.19Å; D213-R216 PolarHBondContact O-N 2.95Å; I214-R216 VanDerWaalsContact C-N 3.33Å; I214-R216 PolarHBondContact O-N 3.14Å; R216-S220 PolarHBondContact O-N 3.13Å; R216-L259 HydrophobicContact CB-CD1 4Å; R216-L259 HydrophobicContact CB-CD2 4.04Å; R216-L259 HydrophobicContact CG-CD2 3.86Å
217	C	91.4	Very high	90.5	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.014	15%	0.148	C	C	.	.	H	α-helix	trans	-63.3	-50.8	172.8	168	0	0	0	0	111.6	I162 A165 D213 I214 Y215 A219 S220 L223	I162-C217 HydrophobicContact CB-CB 4.28Å; I162-C217 HydrophobicContact CG1-CB 4.27Å; I162-C217 HydrophobicContact CG2-CB 3.97Å; A165-C217 HydrophobicContact CB-CB 3.87Å; A165-C217 WeakPolarHBondContact CB-SG 3.49Å; D213-C217 WeakPolarHBondContact O-CB 3.47Å; D213-C217 PolarHBondContact O-N 3.48Å; I214-C217 WeakPolarHBondContact O-CB 3.33Å; I214-C217 PolarHBondContact O-N 3.45Å; Y215-C217 VanDerWaalsContact C-N 3.32Å; Y215-C217 PolarHBondContact O-N 3.27Å; C217-A219 VanDerWaalsContact C-N 3.27Å; C217-A219 PolarHBondContact O-N 3.02Å; C217-S220 WeakPolarHBondContact O-CB 3.42Å; C217-S220 PolarHBondContact O-N 3.07Å; C217-S220 VanDerWaalsContact O-N 3.14Å; C217-S220 PolarHBondContact O-OG 3.3Å; C217-L223 VanDerWaalsContact O-CD2 3.28Å; C217-L223 WeakPolarHBondContact O-CD2 3.46Å
218	L	92.3	Very high	90.9	Very high	31 Å²	31	34.1 Å²	34.1	16%	0.162	16%	0.158	C	C	.	.	H	α-helix	trans	-64.2	-30.3	179.7	-66.5	175.7	0	0	0	113.4	P186 I214 Y215 S220 L223 I224 L238	P186-L218 HydrophobicContact CG-CD1 4.18Å; I214-L218 HydrophobicContact CG2-CD1 3.91Å; I214-L218 HydrophobicContact CG2-CG 4.29Å; I214-L218 WeakPolarHBondContact O-CG 3.24Å; I214-L218 PolarHBondContact O-N 2.96Å; Y215-L218 PolarHBondContact O-N 3.05Å; L218-S220 VanDerWaalsContact C-N 3.28Å; L218-L223 HydrophobicContact CD2-CD2 4.42Å; L218-I224 WeakPolarHBondContact O-CG1 3.49Å; L218-L238 HydrophobicContact CB-CD1 4.5Å; L218-L238 HydrophobicContact CB-CD2 4.26Å; L218-L238 VanDerWaalsContact O-CD2 3.3Å; L218-L238 WeakPolarHBondContact O-CD2 3.43Å
219	A	95	Very high	90.9	Very high	1 Å²	1	41 Å²	41	1%	0.008	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-8.5	178.3	0	0	0	0	0	113.7	Y215 C217 P221 L238 L242 L259	Y215-A219 WeakPolarHBondContact O-CB 3.37Å; Y215-A219 PolarHBondContact O-N 3.33Å; C217-A219 VanDerWaalsContact C-N 3.27Å; C217-A219 PolarHBondContact O-N 3.02Å; A219-P221 WeakPolarHBondContact O-CD 3.46Å; A219-L238 VanDerWaalsContact CA-CD2 3.49Å; A219-L238 HydrophobicContact CB-CD2 3.99Å; A219-L242 HydrophobicContact CB-CD1 4.3Å; A219-L259 HydrophobicContact CB-CB 4.3Å; A219-L259 HydrophobicContact CB-CD2 4.32Å
220	S	93.8	Very high	91.1	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.007	17%	0.168	C	C	.	.			trans	-66.8	127.3	-179.1	68.5	0	0	0	0	111.4	A165 R216 C217 L218 S222 L223 I224	A165-S220 WeakPolarHBondContact CB-OG 3.34Å; A165-S220 WeakPolarHBondContact O-CB 3.26Å; R216-S220 PolarHBondContact O-N 3.13Å; C217-S220 WeakPolarHBondContact O-CB 3.42Å; C217-S220 PolarHBondContact O-N 3.07Å; C217-S220 VanDerWaalsContact O-N 3.14Å; C217-S220 PolarHBondContact O-OG 3.3Å; L218-S220 VanDerWaalsContact C-N 3.28Å; S220-S222 VanDerWaalsContact C-N 3.31Å; S220-S222 PolarHBondContact O-N 3.07Å; S220-L223 PolarHBondContact O-N 3.16Å; S220-L223 WeakPolarHBondContact OG-CB 3.29Å; S220-I224 WeakPolarHBondContact O-CG1 3.34Å; S220-I224 PolarHBondContact O-N 3.17Å; S220-I224 VanDerWaalsContact O-N 3.14Å
221	P	94.8	Very high	91.5	Very high	7 Å²	7	32.8 Å²	32.8	5%	0.045	16%	0.157	C	C	.	.	H	α-helix	trans	-53.4	-44.5	179	-32.2	37.4	0	0	0	113.8	N168 A219 L223 I224 M225 F266	N168-P221 WeakPolarHBondContact OD1-CD 3.46Å; A219-P221 WeakPolarHBondContact O-CD 3.46Å; P221-L223 VanDerWaalsContact C-N 3.34Å; P221-L223 PolarHBondContact O-N 3.31Å; P221-I224 PolarHBondContact O-N 2.93Å; P221-M225 WeakPolarHBondContact O-CE 3.18Å; P221-M225 WeakPolarHBondContact O-CG 3.4Å; P221-M225 PolarHBondContact O-N 3.46Å; P221-M225 VanDerWaalsContact O-N 3.11Å; P221-F266 HydrophobicContact CB-CD2 3.59Å; P221-F266 HydrophobicContact CB-CE2 3.94Å; P221-F266 HydrophobicContact CB-CG 4.13Å; P221-F266 HydrophobicContact CG-CB 4.25Å; P221-F266 HydrophobicContact CG-CD2 4.15Å; P221-F266 HydrophobicContact CG-CG 4.32Å
222	S	92.4	Very high	91.8	Very high	7 Å²	7	31.6 Å²	31.6	5%	0.049	15%	0.153	C	C	.	.	H	α-helix	trans	-63.2	-38.5	-178.1	-68.6	0	0	0	0	112.4	N168 S220 L226	N168-S222 PolarHBondContact O-OG 3.26Å; N168-S222 VanDerWaalsContact OD1-CB 3.27Å; N168-S222 WeakPolarHBondContact OD1-CB 3.25Å; N168-S222 PolarHBondContact OD1-N 3.46Å; N168-S222 PolarHBondContact OD1-OG 3.11Å; S220-S222 VanDerWaalsContact C-N 3.31Å; S220-S222 PolarHBondContact O-N 3.07Å; S222-L226 WeakPolarHBondContact O-CG 3.2Å; S222-L226 PolarHBondContact O-N 2.87Å
223	L	92.5	Very high	92	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-69.4	-47.1	176.9	-172.2	70.3	0	0	0	111.4	L173 L177 L183 C217 L218 S220 P221 M225 L226 T227	L173-L223 HydrophobicContact CD1-CB 4.46Å; L173-L223 HydrophobicContact CD2-CD1 4.32Å; L177-L223 HydrophobicContact CD1-CD1 4.23Å; L183-L223 HydrophobicContact CD1-CD1 4.13Å; L183-L223 HydrophobicContact CD1-CD2 4.17Å; L183-L223 HydrophobicContact CD2-CD2 4.32Å; C217-L223 VanDerWaalsContact O-CD2 3.28Å; C217-L223 WeakPolarHBondContact O-CD2 3.46Å; L218-L223 HydrophobicContact CD2-CD2 4.42Å; S220-L223 PolarHBondContact O-N 3.16Å; S220-L223 WeakPolarHBondContact OG-CB 3.29Å; P221-L223 VanDerWaalsContact C-N 3.34Å; P221-L223 PolarHBondContact O-N 3.31Å; L223-M225 PolarHBondContact O-N 3.28Å; L223-L226 PolarHBondContact O-N 3.14Å; L223-T227 HydrophobicContact CD1-CG2 3.84Å; L223-T227 HydrophobicContact CG-CG2 4.15Å; L223-T227 PolarHBondContact O-N 3.41Å; L223-T227 PolarHBondContact O-OG1 2.92Å; L223-T227 VanDerWaalsContact O-OG1 3.07Å
224	I	93.8	Very high	92.3	Very high	4 Å²	4	32.7 Å²	32.7	2%	0.021	16%	0.155	C	C	.	.	H	α-helix	trans	-55.8	-41	179.8	-64.4	167.7	0	0	0	110.8	L218 S220 P221 L226 E228 P231 R234 L238 F266	L218-I224 WeakPolarHBondContact O-CG1 3.49Å; S220-I224 WeakPolarHBondContact O-CG1 3.34Å; S220-I224 PolarHBondContact O-N 3.17Å; S220-I224 VanDerWaalsContact O-N 3.14Å; P221-I224 PolarHBondContact O-N 2.93Å; I224-L226 VanDerWaalsContact C-N 3.3Å; I224-L226 PolarHBondContact O-N 3.01Å; I224-E228 HydrophobicContact CG2-CG 4.39Å; I224-E228 WeakPolarHBondContact O-CB 3.44Å; I224-E228 PolarHBondContact O-N 3.32Å; I224-P231 HydrophobicContact CG2-CB 3.77Å; I224-R234 HydrophobicContact CG2-CB 4.34Å; I224-L238 HydrophobicContact CD1-CD2 4.47Å; I224-F266 HydrophobicContact CB-CE1 4.24Å; I224-F266 HydrophobicContact CD1-CD1 4.41Å; I224-F266 HydrophobicContact CD1-CE1 4.47Å; I224-F266 HydrophobicContact CG2-CE1 3.78Å; I224-F266 HydrophobicContact CG2-CZ 4.36Å
225	M	93	Very high	92.6	Very high	20 Å²	20	32.2 Å²	32.2	10%	0.099	15%	0.152	C	C	.	.	H	α-helix	trans	-67.1	-26.8	178	-71	-175.3	-66.6	0	0	114.3	P221 L223 F266 V751 Y754 L755	P221-M225 WeakPolarHBondContact O-CE 3.18Å; P221-M225 WeakPolarHBondContact O-CG 3.4Å; P221-M225 PolarHBondContact O-N 3.46Å; P221-M225 VanDerWaalsContact O-N 3.11Å; L223-M225 PolarHBondContact O-N 3.28Å; M225-F266 HydrophobicContact CG-CE2 3.89Å; M225-F266 HydrophobicContact CG-CZ 3.64Å; M225-F266 HydrophobicContact SD-CE2 3.97Å; M225-F266 HydrophobicContact SD-CZ 4.31Å; M225-V751 HydrophobicContact CB-CG1 4.06Å; M225-V751 HydrophobicContact CG-CG1 4.13Å; M225-V751 HydrophobicContact CG-CG2 4.33Å; M225-V751 HydrophobicContact SD-CG1 3.85Å; M225-Y754 HydrophobicContact CE-CD1 3.84Å; M225-Y754 HydrophobicContact CE-CE1 3.72Å; M225-Y754 HydrophobicContact SD-CD1 3.42Å; M225-Y754 WeakPolarHBondContact SD-CD1 3.37Å; M225-Y754 HydrophobicContact SD-CE1 3.8Å; M225-Y754 HydrophobicContact SD-CG 4.41Å; M225-L755 HydrophobicContact CE-CD2 3.55Å; M225-L755 HydrophobicContact CE-CG 4.23Å; M225-L755 HydrophobicContact SD-CD2 4.25Å; M225-L755 HydrophobicContact SD-CG 4.29Å
226	L	91.1	Very high	92.8	Very high	51 Å²	51	31.1 Å²	31.1	27%	0.267	15%	0.148	S	C	.	.	H	α-helix	trans	-90.3	-34.7	-177.1	-72.4	171.6	0	0	0	112.8	Y170 L173 T174 L177 S222 L223 I224	Y170-L226 HydrophobicContact CD2-CD1 4.1Å; Y170-L226 HydrophobicContact CD2-CD2 4.24Å; Y170-L226 HydrophobicContact CD2-CG 4.12Å; Y170-L226 HydrophobicContact CE2-CD1 4.08Å; Y170-L226 HydrophobicContact CE2-CD2 3.39Å; Y170-L226 HydrophobicContact CE2-CG 3.67Å; Y170-L226 WeakPolarHBondContact OH-CD2 3.47Å; L173-L226 HydrophobicContact CB-CD1 3.76Å; T174-L226 HydrophobicContact CG2-CD1 3.76Å; T174-L226 HydrophobicContact CG2-CD2 3.54Å; T174-L226 HydrophobicContact CG2-CG 4.32Å; L177-L226 HydrophobicContact CD1-CB 3.75Å; L177-L226 HydrophobicContact CD1-CD1 3.94Å; L177-L226 HydrophobicContact CD1-CG 4.45Å; S222-L226 WeakPolarHBondContact O-CG 3.2Å; S222-L226 PolarHBondContact O-N 2.87Å; L223-L226 PolarHBondContact O-N 3.14Å; I224-L226 VanDerWaalsContact C-N 3.3Å; I224-L226 PolarHBondContact O-N 3.01Å
227	T	89.4	Confident	92.8	Very high	61 Å²	61	28.1 Å²	28.1	37%	0.374	14%	0.139	S	C	.	.	H	α-helix	trans	-97.6	-28.3	-171.3	58.7	0	0	0	0	114.1	L177 L183 L223	L177-T227 HydrophobicContact CD1-CG2 4.1Å; L177-T227 HydrophobicContact CD2-CG2 4.48Å; L183-T227 HydrophobicContact CD1-CG2 4.33Å; L223-T227 HydrophobicContact CD1-CG2 3.84Å; L223-T227 HydrophobicContact CG-CG2 4.15Å; L223-T227 PolarHBondContact O-N 3.41Å; L223-T227 PolarHBondContact O-OG1 2.92Å; L223-T227 VanDerWaalsContact O-OG1 3.07Å
228	E	90.8	Very high	93	Very high	76 Å²	76	28.1 Å²	28.1	36%	0.355	14%	0.139	S	C	.	.			trans	-106.3	139.1	-169.5	-57.1	-73.7	172.3	0	0	112.4	I224 R234	I224-E228 HydrophobicContact CG2-CG 4.39Å; I224-E228 WeakPolarHBondContact O-CB 3.44Å; I224-E228 PolarHBondContact O-N 3.32Å; E228-R234 HydrophobicContact CB-CB 4.36Å; E228-R234 HydrophobicContact CG-CB 3.94Å; E228-R234 HydrophobicContact CG-CG 3.75Å; E228-R234 WeakPolarHBondContact OE1-CD 3.38Å; E228-R234 IonicContact OE1-NE 3.79Å; E228-R234 PolarHBondContact OE1-NE 3.01Å
229	E	86.8	Confident	93.2	Very high	159 Å²	159	26.7 Å²	26.7	74%	0.743	13%	0.131	S	C	*	.	S	Bend	trans	-71	-34.7	175.3	-63.2	-173.8	-177.6	0	0	112.4
230	D	91.1	Very high	93.2	Very high	21 Å²	21	28 Å²	28	11%	0.112	14%	0.142	C	C	.	.			trans	-121.8	88.4	177.1	-173	-17.5	0	0	0	110.7	I232 L233 R234 H286 R307 Y743	D230-I232 PolarHBondContact O-N 3.38Å; D230-I232 PolarHBondContact OD1-N 3.47Å; D230-L233 HydrophobicContact CB-CB 4.11Å; D230-L233 PolarHBondContact O-N 3.13Å; D230-L233 PolarHBondContact OD1-N 3.18Å; D230-L233 WeakPolarHBondContact OD2-CB 3.43Å; D230-R234 PolarHBondContact O-N 3.04Å; D230-R234 VanDerWaalsContact O-N 3.16Å; D230-H286 IonicContact OD2-CD2 3.87Å; D230-R307 VanDerWaalsContact CG-NH1 3.31Å; D230-R307 IonicContact OD1-NH1 3.91Å; D230-R307 PolarHBondContact OD1-NH1 3.41Å; D230-R307 VanDerWaalsContact OD1-NH1 3.1Å; D230-R307 IonicContact OD2-CZ 3.19Å; D230-R307 IonicContact OD2-NH1 3.18Å; D230-R307 PolarHBondContact OD2-NH1 3.36Å; D230-R307 IonicContact OD2-NH2 3.13Å; D230-R307 PolarHBondContact OD2-NH2 3.41Å; D230-Y743 VanDerWaalsContact CG-OH 3.26Å; D230-Y743 PolarHBondContact OD1-OH 2.98Å; D230-Y743 PolarHBondContact OD2-OH 3.34Å
231	P	93.9	Very high	93.1	Very high	3 Å²	3	31 Å²	31	2%	0.019	16%	0.159	C	C	.	.	H	α-helix	trans	-66.1	-25.9	-176.1	26.2	-35.6	0	0	0	112.8	I224 A235 F266 L270 M747 V751	I224-P231 HydrophobicContact CG2-CB 3.77Å; P231-A235 VanDerWaalsContact O-CB 3.28Å; P231-A235 WeakPolarHBondContact O-CB 3.28Å; P231-A235 PolarHBondContact O-N 3.44Å; P231-A235 VanDerWaalsContact O-N 3.08Å; P231-F266 HydrophobicContact CB-CE1 4.07Å; P231-F266 HydrophobicContact CB-CZ 4.11Å; P231-L270 HydrophobicContact CB-CD2 4.25Å; P231-L270 HydrophobicContact CG-CD2 3.79Å; P231-M747 HydrophobicContact CG-CE 4.28Å; P231-M747 HydrophobicContact CG-CG 3.99Å; P231-M747 HydrophobicContact CG-SD 3.56Å; P231-M747 VanDerWaalsContact CG-SD 3.56Å; P231-V751 HydrophobicContact CG-CG2 4.41Å
232	I	94.4	Very high	93.1	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-72.2	-45.9	179.1	-62.2	178.3	0	0	0	109.8	D230 A235 F236 L270 I283 F319 M747	D230-I232 PolarHBondContact O-N 3.38Å; D230-I232 PolarHBondContact OD1-N 3.47Å; I232-A235 PolarHBondContact O-N 2.93Å; I232-F236 HydrophobicContact CG2-CD2 4.36Å; I232-F236 HydrophobicContact CG2-CE1 3.9Å; I232-F236 HydrophobicContact CG2-CE2 3.73Å; I232-F236 HydrophobicContact CG2-CZ 3.46Å; I232-F236 VanDerWaalsContact CG2-CZ 3.46Å; I232-F236 WeakPolarHBondContact O-CD1 3.37Å; I232-F236 VanDerWaalsContact O-CG 3.3Å; I232-F236 WeakPolarHBondContact O-CG 3.38Å; I232-F236 PolarHBondContact O-N 2.89Å; I232-F236 VanDerWaalsContact O-N 3.12Å; I232-L270 HydrophobicContact CD1-CD2 4.36Å; I232-L270 HydrophobicContact CG1-CD2 3.75Å; I232-I283 HydrophobicContact CD1-CG2 3.78Å; I232-F319 HydrophobicContact CG2-CE2 3.99Å; I232-F319 HydrophobicContact CG2-CZ 4.36Å; I232-M747 HydrophobicContact CD1-CE 3.81Å; I232-M747 HydrophobicContact CG1-CE 4.06Å
233	L	93.3	Very high	93.2	Very high	23 Å²	23	35.1 Å²	35.1	12%	0.12	18%	0.175	C	C	.	.	H	α-helix	trans	-61.3	-48.2	177.9	-176.8	58.2	0	0	0	110.7	D230 A235 F236 E237 S288 L310	D230-L233 HydrophobicContact CB-CB 4.11Å; D230-L233 PolarHBondContact O-N 3.13Å; D230-L233 PolarHBondContact OD1-N 3.18Å; D230-L233 WeakPolarHBondContact OD2-CB 3.43Å; L233-A235 VanDerWaalsContact C-N 3.3Å; L233-A235 PolarHBondContact O-N 3.43Å; L233-F236 WeakPolarHBondContact O-CB 3.41Å; L233-F236 PolarHBondContact O-N 2.66Å; L233-E237 HydrophobicContact CD1-CG 4.43Å; L233-E237 PolarHBondContact O-N 2.89Å; L233-S288 WeakPolarHBondContact CD2-OG 3.34Å; L233-L310 HydrophobicContact CD1-CD2 3.47Å; L233-L310 VanDerWaalsContact CD1-CD2 3.47Å
234	R	94.1	Very high	93.2	Very high	59 Å²	59	41.4 Å²	41.4	22%	0.223	20%	0.204	C	C	.	.	H	α-helix	trans	-59.9	-42.5	-179.4	-170.1	72.7	177.2	122.1	11	111.8	I224 E228 D230 F236 E237 L238	I224-R234 HydrophobicContact CG2-CB 4.34Å; E228-R234 HydrophobicContact CB-CB 4.36Å; E228-R234 HydrophobicContact CG-CB 3.94Å; E228-R234 HydrophobicContact CG-CG 3.75Å; E228-R234 WeakPolarHBondContact OE1-CD 3.38Å; E228-R234 IonicContact OE1-NE 3.79Å; E228-R234 PolarHBondContact OE1-NE 3.01Å; D230-R234 PolarHBondContact O-N 3.04Å; D230-R234 VanDerWaalsContact O-N 3.16Å; R234-F236 VanDerWaalsContact C-N 3.27Å; R234-F236 PolarHBondContact O-N 3.09Å; R234-E237 IonicContact NH1-OE2 3.91Å; R234-E237 PolarHBondContact O-N 3.02Å; R234-L238 VanDerWaalsContact O-CB 3.24Å; R234-L238 WeakPolarHBondContact O-CB 3.33Å; R234-L238 PolarHBondContact O-N 3.27Å
235	A	96	Very high	93.2	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.3	-36.2	176.1	0	0	0	0	0	112.4	P231 I232 L233 S239 F266 A267	P231-A235 VanDerWaalsContact O-CB 3.28Å; P231-A235 WeakPolarHBondContact O-CB 3.28Å; P231-A235 PolarHBondContact O-N 3.44Å; P231-A235 VanDerWaalsContact O-N 3.08Å; I232-A235 PolarHBondContact O-N 2.93Å; L233-A235 VanDerWaalsContact C-N 3.3Å; L233-A235 PolarHBondContact O-N 3.43Å; A235-S239 WeakPolarHBondContact O-CB 3.47Å; A235-S239 PolarHBondContact O-N 3.05Å; A235-S239 PolarHBondContact O-OG 3.12Å; A235-S239 VanDerWaalsContact O-OG 3.1Å; A235-F266 HydrophobicContact CB-CD1 3.94Å; A235-F266 HydrophobicContact CB-CE1 4.38Å; A235-A267 HydrophobicContact CB-CB 4.13Å
236	F	95.4	Very high	93.3	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.7	-51.4	176.1	-65.8	-10.7	0	0	0	111.9	I232 L233 R234 S239 A240 A267 A311 Y314 Q316 F319	I232-F236 HydrophobicContact CG2-CD2 4.36Å; I232-F236 HydrophobicContact CG2-CE1 3.9Å; I232-F236 HydrophobicContact CG2-CE2 3.73Å; I232-F236 HydrophobicContact CG2-CZ 3.46Å; I232-F236 VanDerWaalsContact CG2-CZ 3.46Å; I232-F236 WeakPolarHBondContact O-CD1 3.37Å; I232-F236 VanDerWaalsContact O-CG 3.3Å; I232-F236 WeakPolarHBondContact O-CG 3.38Å; I232-F236 PolarHBondContact O-N 2.89Å; I232-F236 VanDerWaalsContact O-N 3.12Å; L233-F236 WeakPolarHBondContact O-CB 3.41Å; L233-F236 PolarHBondContact O-N 2.66Å; R234-F236 VanDerWaalsContact C-N 3.27Å; R234-F236 PolarHBondContact O-N 3.09Å; F236-S239 PolarHBondContact O-N 3.22Å; F236-S239 PolarHBondContact O-OG 3.36Å; F236-A240 PolarHBondContact O-N 2.99Å; F236-A240 VanDerWaalsContact O-N 3.16Å; F236-A267 HydrophobicContact CD1-CB 4.2Å; F236-A267 HydrophobicContact CE1-CB 3.7Å; F236-A311 HydrophobicContact CE2-CB 3.68Å; F236-A311 HydrophobicContact CZ-CB 3.79Å; F236-Y314 HydrophobicContact CB-CD2 3.89Å; F236-Y314 HydrophobicContact CB-CE2 4.47Å; F236-Y314 HydrophobicContact CB-CG 4.13Å; F236-Q316 HydrophobicContact CB-CG 4.47Å; F236-Q316 HydrophobicContact CD1-CB 4.43Å; F236-Q316 VanDerWaalsContact CD1-CD 3.45Å; F236-Q316 HydrophobicContact CD1-CG 3.48Å; F236-Q316 VanDerWaalsContact CD1-CG 3.48Å; F236-Q316 HydrophobicContact CD2-CG 4.42Å; F236-Q316 HydrophobicContact CE1-CB 4.13Å; F236-Q316 HydrophobicContact CE1-CG 3.65Å; F236-Q316 HydrophobicContact CG-CG 3.89Å; F236-Q316 HydrophobicContact CZ-CG 4.21Å; F236-F319 HydrophobicContact CE1-CB 4.36Å; F236-F319 HydrophobicContact CE1-CD2 4.02Å; F236-F319 HydrophobicContact CE1-CE2 4.44Å; F236-F319 HydrophobicContact CE1-CG 4.09Å; F236-F319 HydrophobicContact CZ-CB 4.5Å; F236-F319 AromaticContact CZ-CD1 3.91Å; F236-F319 HydrophobicContact CZ-CD1 3.91Å; F236-F319 AromaticContact CZ-CD2 3.84Å; F236-F319 HydrophobicContact CZ-CD2 3.84Å; F236-F319 HydrophobicContact CZ-CE1 4Å; F236-F319 AromaticContact CZ-CE2 3.91Å; F236-F319 HydrophobicContact CZ-CE2 3.91Å; F236-F319 AromaticContact CZ-CG 3.83Å; F236-F319 HydrophobicContact CZ-CG 3.83Å; F236-F319 HydrophobicContact CZ-CZ 4Å
237	E	93.9	Very high	93.3	Very high	63 Å²	63	44.9 Å²	44.9	29%	0.294	22%	0.223	S	C	.	.	H	α-helix	trans	-57.9	-53.1	178	-69.1	173.4	177.9	0	0	110.8	L233 R234 S239 A240 D241	L233-E237 HydrophobicContact CD1-CG 4.43Å; L233-E237 PolarHBondContact O-N 2.89Å; R234-E237 IonicContact NH1-OE2 3.91Å; R234-E237 PolarHBondContact O-N 3.02Å; E237-S239 VanDerWaalsContact C-N 3.32Å; E237-S239 PolarHBondContact O-N 3.08Å; E237-A240 WeakPolarHBondContact O-CA 3.5Å; E237-A240 WeakPolarHBondContact O-CB 3.41Å; E237-A240 PolarHBondContact O-N 3.39Å; E237-D241 VanDerWaalsContact O-CG 3.3Å; E237-D241 PolarHBondContact O-N 2.89Å
238	L	94.6	Very high	93.4	Very high	1 Å²	1	46 Å²	46	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-61.9	-39.8	-177.7	-170.2	66.5	0	0	0	112	Y215 L218 A219 I224 R234 A240 D241 L242	Y215-L238 HydrophobicContact CD1-CD1 4.28Å; L218-L238 HydrophobicContact CB-CD1 4.5Å; L218-L238 HydrophobicContact CB-CD2 4.26Å; L218-L238 VanDerWaalsContact O-CD2 3.3Å; L218-L238 WeakPolarHBondContact O-CD2 3.43Å; A219-L238 VanDerWaalsContact CA-CD2 3.49Å; A219-L238 HydrophobicContact CB-CD2 3.99Å; I224-L238 HydrophobicContact CD1-CD2 4.47Å; R234-L238 VanDerWaalsContact O-CB 3.24Å; R234-L238 WeakPolarHBondContact O-CB 3.33Å; R234-L238 PolarHBondContact O-N 3.27Å; L238-A240 PolarHBondContact O-N 2.74Å; L238-D241 PolarHBondContact O-N 2.76Å; L238-L242 HydrophobicContact CG-CD1 3.99Å; L238-L242 HydrophobicContact CG-CG 4.37Å; L238-L242 WeakPolarHBondContact O-CB 3.36Å; L238-L242 WeakPolarHBondContact O-CD1 3.31Å; L238-L242 WeakPolarHBondContact O-CG 3.49Å; L238-L242 PolarHBondContact O-N 3.22Å
239	S	96.4	Very high	93.4	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.007	22%	0.216	C	C	.	.	H	α-helix	trans	-67.6	-23.9	176.7	73.6	0	0	0	0	113.9	A235 F236 E237 K243 Q316	A235-S239 WeakPolarHBondContact O-CB 3.47Å; A235-S239 PolarHBondContact O-N 3.05Å; A235-S239 PolarHBondContact O-OG 3.12Å; A235-S239 VanDerWaalsContact O-OG 3.1Å; F236-S239 PolarHBondContact O-N 3.22Å; F236-S239 PolarHBondContact O-OG 3.36Å; E237-S239 VanDerWaalsContact C-N 3.32Å; E237-S239 PolarHBondContact O-N 3.08Å; S239-K243 WeakPolarHBondContact O-CB 3.35Å; S239-K243 PolarHBondContact O-N 3.23Å; S239-Q316 PolarHBondContact OG-NE2 2.92Å
240	A	94.8	Very high	93.6	Very high	28 Å²	28	40 Å²	40	23%	0.231	21%	0.208	C	C	.	.	H	α-helix	trans	-80.4	-46.4	174.6	0	0	0	0	0	110.3	F236 E237 L238 L242 K243 E244 Y314	F236-A240 PolarHBondContact O-N 2.99Å; F236-A240 VanDerWaalsContact O-N 3.16Å; E237-A240 WeakPolarHBondContact O-CA 3.5Å; E237-A240 WeakPolarHBondContact O-CB 3.41Å; E237-A240 PolarHBondContact O-N 3.39Å; L238-A240 PolarHBondContact O-N 2.74Å; A240-L242 VanDerWaalsContact C-N 3.33Å; A240-L242 PolarHBondContact O-N 3.5Å; A240-K243 WeakPolarHBondContact O-CB 3.36Å; A240-K243 PolarHBondContact O-N 3.35Å; A240-E244 PolarHBondContact O-N 3.27Å; A240-Y314 HydrophobicContact CB-CD1 3.56Å; A240-Y314 HydrophobicContact CB-CE1 3.98Å
241	D	93.6	Very high	93.5	Very high	66 Å²	66	46.6 Å²	46.6	35%	0.353	24%	0.238	S	C	.	.	H	α-helix	trans	-56	-47.3	175.1	-63.1	-12.3	0	0	0	110.9	E237 L238 K243 E244 L245	E237-D241 VanDerWaalsContact O-CG 3.3Å; E237-D241 PolarHBondContact O-N 2.89Å; L238-D241 PolarHBondContact O-N 2.76Å; D241-K243 VanDerWaalsContact C-N 3.28Å; D241-K243 PolarHBondContact O-N 3.26Å; D241-E244 PolarHBondContact O-N 3.45Å; D241-L245 WeakPolarHBondContact O-CB 3.27Å; D241-L245 WeakPolarHBondContact O-CD1 3.42Å; D241-L245 VanDerWaalsContact O-CG 3.23Å; D241-L245 WeakPolarHBondContact O-CG 3.43Å; D241-L245 PolarHBondContact O-N 3.29Å
242	L	94.9	Very high	93.5	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.3	-34.3	177.4	-69.7	168.2	0	0	0	112.7	Y215 A219 L238 A240 S246 Y256 L259 A260	Y215-L242 HydrophobicContact CD1-CD2 3.8Å; Y215-L242 HydrophobicContact CG-CD2 3.87Å; A219-L242 HydrophobicContact CB-CD1 4.3Å; L238-L242 HydrophobicContact CG-CD1 3.99Å; L238-L242 HydrophobicContact CG-CG 4.37Å; L238-L242 WeakPolarHBondContact O-CB 3.36Å; L238-L242 WeakPolarHBondContact O-CD1 3.31Å; L238-L242 WeakPolarHBondContact O-CG 3.49Å; L238-L242 PolarHBondContact O-N 3.22Å; A240-L242 VanDerWaalsContact C-N 3.33Å; A240-L242 PolarHBondContact O-N 3.5Å; L242-S246 PolarHBondContact O-N 3.33Å; L242-Y256 HydrophobicContact CD2-CD1 3.76Å; L242-Y256 HydrophobicContact CD2-CE1 4.28Å; L242-L259 HydrophobicContact CD1-CB 3.82Å; L242-L259 HydrophobicContact CD2-CB 4.42Å; L242-L259 HydrophobicContact CD2-CD1 4.5Å; L242-A260 HydrophobicContact CB-CB 3.86Å; L242-A260 HydrophobicContact CD1-CB 4.44Å
243	K	94.3	Very high	93.4	Very high	100 Å²	100	53.3 Å²	53.3	44%	0.435	26%	0.264	S	S	.	.	H	α-helix	trans	-74.7	-33	177.6	-171.6	177.1	-179.8	-167.5	0	112.1	S239 A240 D241 S246	S239-K243 WeakPolarHBondContact O-CB 3.35Å; S239-K243 PolarHBondContact O-N 3.23Å; A240-K243 WeakPolarHBondContact O-CB 3.36Å; A240-K243 PolarHBondContact O-N 3.35Å; D241-K243 VanDerWaalsContact C-N 3.28Å; D241-K243 PolarHBondContact O-N 3.26Å; K243-S246 PolarHBondContact O-OG 2.95Å
244	E	92.6	Very high	93.6	Very high	133 Å²	133	57.5 Å²	57.5	62%	0.621	29%	0.286	S	S	*	.	H	α-helix	trans	-69.1	-43.8	171.9	-171.9	175.6	172.8	0	0	110.5	A240 D241 S246 L247 V248	A240-E244 PolarHBondContact O-N 3.27Å; D241-E244 PolarHBondContact O-N 3.45Å; E244-S246 VanDerWaalsContact C-N 3.28Å; E244-S246 PolarHBondContact O-N 2.58Å; E244-L247 WeakPolarHBondContact O-CB 3.46Å; E244-L247 PolarHBondContact O-N 3.28Å; E244-V248 PolarHBondContact O-N 2.97Å
245	L	92.3	Very high	93.6	Very high	17 Å²	17	58 Å²	58	9%	0.089	29%	0.293	C	S	.	.	H	α-helix	trans	-59.3	-36.5	175.7	-72.7	162.4	0	0	0	112.7	V189 Y215 D241 L247 V248 E249 Y256	V189-L245 HydrophobicContact CG2-CD2 3.36Å; Y215-L245 HydrophobicContact CD1-CD1 4.36Å; Y215-L245 HydrophobicContact CD2-CD1 4.11Å; Y215-L245 HydrophobicContact CE1-CD1 3.81Å; Y215-L245 HydrophobicContact CE2-CD1 3.49Å; Y215-L245 VanDerWaalsContact CE2-CD1 3.49Å; D241-L245 WeakPolarHBondContact O-CB 3.27Å; D241-L245 WeakPolarHBondContact O-CD1 3.42Å; D241-L245 VanDerWaalsContact O-CG 3.23Å; D241-L245 WeakPolarHBondContact O-CG 3.43Å; D241-L245 PolarHBondContact O-N 3.29Å; L245-L247 PolarHBondContact O-N 2.84Å; L245-V248 PolarHBondContact O-N 2.88Å; L245-V248 VanDerWaalsContact O-N 3.12Å; L245-E249 PolarHBondContact O-N 3.38Å; L245-Y256 HydrophobicContact CB-CD1 4.41Å; L245-Y256 HydrophobicContact CB-CE1 4.42Å; L245-Y256 HydrophobicContact CB-CG 4.49Å
246	S	95.3	Very high	93.6	Very high	2 Å²	2	58 Å²	58	1%	0.014	29%	0.293	C	S	.	.	H	α-helix	trans	-66.5	-21	177.6	86.4	0	0	0	0	113.6	L242 K243 E244 R253	L242-S246 PolarHBondContact O-N 3.33Å; K243-S246 PolarHBondContact O-OG 2.95Å; E244-S246 VanDerWaalsContact C-N 3.28Å; E244-S246 PolarHBondContact O-N 2.58Å; S246-R253 WeakPolarHBondContact O-CG 3.38Å
247	L	92.3	Very high	93.6	Very high	128 Å²	128	61.9 Å²	61.9	67%	0.67	31%	0.311	S	S	*	.	H	α-helix	trans	-85.3	-28.9	173.3	-61.4	175	0	0	0	112.2	E244 L245	E244-L247 WeakPolarHBondContact O-CB 3.46Å; E244-L247 PolarHBondContact O-N 3.28Å; L245-L247 PolarHBondContact O-N 2.84Å
248	V	91.6	Very high	93.7	Very high	84 Å²	84	65.4 Å²	65.4	51%	0.509	33%	0.328	S	S	.	.	H	α-helix	trans	-80.9	-45.1	178.6	-179.4	0	0	0	0	111.3	V189 E244 L245	V189-V248 HydrophobicContact CB-CG1 4.08Å; V189-V248 HydrophobicContact CG1-CG1 3.73Å; V189-V248 HydrophobicContact CG2-CG1 4.43Å; E244-V248 PolarHBondContact O-N 2.97Å; L245-V248 PolarHBondContact O-N 2.88Å; L245-V248 VanDerWaalsContact O-N 3.12Å
249	E	89.6	Confident	93.8	Very high	16 Å²	16	66 Å²	66	8%	0.075	33%	0.331	C	S	.	.			trans	-104.1	86.6	178.4	-63.2	-159.9	103.5	0	0	110.9	V189 R211 L245 E251 F252 R253 Y256	V189-E249 HydrophobicContact CG1-CG 4.48Å; R211-E249 IonicContact CZ-OE1 3.28Å; R211-E249 IonicContact CZ-OE2 2.73Å; R211-E249 IonicContact NE-OE1 3.36Å; R211-E249 IonicContact NE-OE2 3.17Å; R211-E249 PolarHBondContact NE-OE2 3.11Å; R211-E249 IonicContact NH2-OE1 3.85Å; R211-E249 PolarHBondContact NH2-OE1 3.3Å; R211-E249 IonicContact NH2-OE2 2.74Å; R211-E249 PolarHBondContact NH2-OE2 3.07Å; L245-E249 PolarHBondContact O-N 3.38Å; E249-E251 PolarHBondContact O-N 2.66Å; E249-F252 PolarHBondContact O-N 3.2Å; E249-R253 PolarHBondContact O-N 3.48Å; E249-Y256 HydrophobicContact CB-CE2 3.99Å; E249-Y256 HydrophobicContact CG-CE2 4.48Å; E249-Y256 WeakPolarHBondContact OE2-CE2 3.4Å; E249-Y256 PolarHBondContact OE2-OH 2.98Å
250	V	90.5	Very high	93.8	Very high	95 Å²	95	66.1 Å²	66.1	58%	0.576	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-66	-27.8	-173.4	-175.3	0	0	0	0	112	R253	V250-R253 WeakPolarHBondContact O-CB 3.48Å; V250-R253 PolarHBondContact O-N 2.84Å
251	E	90.6	Very high	93.8	Very high	159 Å²	159	70.5 Å²	70.5	74%	0.743	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-65.2	-39.4	-178.4	-60.2	81.5	179.2	0	0	112.6	E249	E249-E251 PolarHBondContact O-N 2.66Å
252	F	92.4	Very high	94	Very high	42 Å²	42	70.6 Å²	70.6	18%	0.184	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-105.4	19.3	-179.8	-59.4	-72.6	0	0	0	112.7	R209 L212 E249 N254 D255 Y256	R209-F252 HydrophobicContact CG-CZ 4.35Å; L212-F252 HydrophobicContact CD1-CB 4.45Å; L212-F252 HydrophobicContact CD2-CD1 4.2Å; E249-F252 PolarHBondContact O-N 3.2Å; F252-N254 VanDerWaalsContact C-N 3.26Å; F252-N254 PolarHBondContact O-N 3.45Å; F252-D255 PolarHBondContact O-N 3.46Å; F252-D255 VanDerWaalsContact O-N 3.12Å; F252-Y256 HydrophobicContact CB-CD2 3.99Å; F252-Y256 HydrophobicContact CB-CE2 3.87Å; F252-Y256 WeakPolarHBondContact O-CD2 3.48Å; F252-Y256 PolarHBondContact O-N 3Å; F252-Y256 VanDerWaalsContact O-N 3.13Å
253	R	93.8	Very high	94	Very high	103 Å²	103	70.6 Å²	70.6	39%	0.389	34%	0.344	S	S	.	.	H	α-helix	trans	-53.4	-42.4	-175	-179.2	173.5	73	91.8	1.2	113.1	S246 E249 V250 E257	S246-R253 WeakPolarHBondContact O-CG 3.38Å; E249-R253 PolarHBondContact O-N 3.48Å; V250-R253 WeakPolarHBondContact O-CB 3.48Å; V250-R253 PolarHBondContact O-N 2.84Å; R253-E257 HydrophobicContact CG-CG 4.38Å; R253-E257 VanDerWaalsContact CG-OE1 3.28Å; R253-E257 WeakPolarHBondContact CG-OE1 3.39Å; R253-E257 IonicContact CZ-OE1 2.74Å; R253-E257 IonicContact NH1-OE1 3.53Å; R253-E257 PolarHBondContact NH1-OE1 3.44Å; R253-E257 IonicContact NH1-OE2 2.85Å; R253-E257 WeakPolarHBondContact O-CB 3.43Å; R253-E257 VanDerWaalsContact O-CG 3.29Å; R253-E257 WeakPolarHBondContact O-CG 3.38Å; R253-E257 PolarHBondContact O-N 3.4Å
254	N	95.8	Very high	94.1	Very high	110 Å²	110	67.6 Å²	67.6	59%	0.588	33%	0.331	S	S	*	.	H	α-helix	trans	-65.4	-41.8	-178.4	-64.8	-22	0	0	0	111.8	F252 E257 E258	F252-N254 VanDerWaalsContact C-N 3.26Å; F252-N254 PolarHBondContact O-N 3.45Å; N254-E257 PolarHBondContact O-N 3.03Å; N254-E258 WeakPolarHBondContact O-CB 3.4Å; N254-E258 PolarHBondContact O-N 3.43Å
255	D	95.1	Very high	94.2	Very high	69 Å²	69	64 Å²	64	37%	0.369	32%	0.315	S	S	.	.	H	α-helix	trans	-66.6	-44.8	-179.3	-59.2	-31.8	0	0	0	110.4	L212 F252 E257 E258 L259	L212-D255 HydrophobicContact CD1-CB 3.9Å; L212-D255 HydrophobicContact CD2-CB 4.14Å; F252-D255 PolarHBondContact O-N 3.46Å; F252-D255 VanDerWaalsContact O-N 3.12Å; D255-E257 PolarHBondContact O-N 2.72Å; D255-E258 PolarHBondContact O-N 2.93Å; D255-L259 WeakPolarHBondContact O-CG 3.41Å; D255-L259 PolarHBondContact O-N 3.22Å
256	Y	96	Very high	94.4	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-63.5	-40.7	175	-73.6	-58.4	0	0	0	112.7	L212 Y215 L242 L245 E249 F252 E258 L259 A260	L212-Y256 HydrophobicContact CD1-CD1 3.86Å; L212-Y256 HydrophobicContact CD1-CD2 4.33Å; L212-Y256 HydrophobicContact CD1-CE1 3.58Å; L212-Y256 HydrophobicContact CD1-CE2 4.09Å; L212-Y256 HydrophobicContact CD1-CG 4.23Å; Y215-Y256 AromaticContact CD2-CE1 3.88Å; Y215-Y256 HydrophobicContact CD2-CE1 3.88Å; Y215-Y256 HydrophobicContact CG-CE1 4.31Å; L242-Y256 HydrophobicContact CD2-CD1 3.76Å; L242-Y256 HydrophobicContact CD2-CE1 4.28Å; L245-Y256 HydrophobicContact CB-CD1 4.41Å; L245-Y256 HydrophobicContact CB-CE1 4.42Å; L245-Y256 HydrophobicContact CB-CG 4.49Å; E249-Y256 HydrophobicContact CB-CE2 3.99Å; E249-Y256 HydrophobicContact CG-CE2 4.48Å; E249-Y256 WeakPolarHBondContact OE2-CE2 3.4Å; E249-Y256 PolarHBondContact OE2-OH 2.98Å; F252-Y256 HydrophobicContact CB-CD2 3.99Å; F252-Y256 HydrophobicContact CB-CE2 3.87Å; F252-Y256 WeakPolarHBondContact O-CD2 3.48Å; F252-Y256 PolarHBondContact O-N 3Å; F252-Y256 VanDerWaalsContact O-N 3.13Å; Y256-E258 VanDerWaalsContact C-N 3.31Å; Y256-E258 PolarHBondContact O-N 2.78Å; Y256-L259 PolarHBondContact O-N 2.93Å; Y256-A260 VanDerWaalsContact O-CB 3.3Å; Y256-A260 WeakPolarHBondContact O-CB 3.34Å; Y256-A260 PolarHBondContact O-N 3.23Å
257	E	95.5	Very high	94.5	Very high	82 Å²	82	63.3 Å²	63.3	38%	0.383	31%	0.311	S	S	.	.	H	α-helix	trans	-63.5	-36.5	175.4	-77.8	179.6	-163.3	0	0	111.8	R253 N254 D255 K261	R253-E257 HydrophobicContact CG-CG 4.38Å; R253-E257 VanDerWaalsContact CG-OE1 3.28Å; R253-E257 WeakPolarHBondContact CG-OE1 3.39Å; R253-E257 IonicContact CZ-OE1 2.74Å; R253-E257 IonicContact NH1-OE1 3.53Å; R253-E257 PolarHBondContact NH1-OE1 3.44Å; R253-E257 IonicContact NH1-OE2 2.85Å; R253-E257 WeakPolarHBondContact O-CB 3.43Å; R253-E257 VanDerWaalsContact O-CG 3.29Å; R253-E257 WeakPolarHBondContact O-CG 3.38Å; R253-E257 PolarHBondContact O-N 3.4Å; N254-E257 PolarHBondContact O-N 3.03Å; D255-E257 PolarHBondContact O-N 2.72Å; E257-K261 WeakPolarHBondContact O-CB 3.3Å; E257-K261 PolarHBondContact O-N 2.89Å
258	E	96.3	Very high	94.6	Very high	137 Å²	137	60 Å²	60	64%	0.64	29%	0.291	S	S	*	.	H	α-helix	trans	-67.7	-46.7	175.1	-175.1	167.5	-164	0	0	112.1	N254 D255 Y256 A260 K261 Q262	N254-E258 WeakPolarHBondContact O-CB 3.4Å; N254-E258 PolarHBondContact O-N 3.43Å; D255-E258 PolarHBondContact O-N 2.93Å; Y256-E258 VanDerWaalsContact C-N 3.31Å; Y256-E258 PolarHBondContact O-N 2.78Å; E258-A260 VanDerWaalsContact C-N 3.32Å; E258-A260 PolarHBondContact O-N 2.93Å; E258-K261 CarbonylContact O-C 3.59Å; E258-K261 WeakPolarHBondContact O-CB 3.39Å; E258-K261 PolarHBondContact O-N 3.33Å; E258-K261 VanDerWaalsContact O-N 3.13Å; E258-Q262 PolarHBondContact O-N 3.29Å
259	L	96.3	Very high	94.8	Very high	13 Å²	13	57.7 Å²	57.7	7%	0.068	28%	0.276	C	S	.	.	H	α-helix	trans	-62	-40.2	175	-65.7	176.8	0	0	0	111.9	L212 R216 A219 L242 D255 Y256 K261 Q262 C263	L212-L259 HydrophobicContact CD1-CD1 4.42Å; R216-L259 HydrophobicContact CB-CD1 4Å; R216-L259 HydrophobicContact CB-CD2 4.04Å; R216-L259 HydrophobicContact CG-CD2 3.86Å; A219-L259 HydrophobicContact CB-CB 4.3Å; A219-L259 HydrophobicContact CB-CD2 4.32Å; L242-L259 HydrophobicContact CD1-CB 3.82Å; L242-L259 HydrophobicContact CD2-CB 4.42Å; L242-L259 HydrophobicContact CD2-CD1 4.5Å; D255-L259 WeakPolarHBondContact O-CG 3.41Å; D255-L259 PolarHBondContact O-N 3.22Å; Y256-L259 PolarHBondContact O-N 2.93Å; L259-K261 VanDerWaalsContact C-N 3.3Å; L259-K261 PolarHBondContact O-N 2.98Å; L259-Q262 WeakPolarHBondContact O-CB 3.24Å; L259-Q262 PolarHBondContact O-N 3.05Å; L259-C263 PolarHBondContact O-N 3.48Å; L259-C263 PolarHBondContact O-SG 3.34Å; L259-C263 VanDerWaalsContact O-SG 3.35Å
260	A	96.8	Very high	95	Very high	4 Å²	4	56.9 Å²	56.9	3%	0.033	27%	0.272	C	S	.	.	H	α-helix	trans	-61.9	-41.5	174.9	0	0	0	0	0	110.7	L242 Y256 E258 C263 K264	L242-A260 HydrophobicContact CB-CB 3.86Å; L242-A260 HydrophobicContact CD1-CB 4.44Å; Y256-A260 VanDerWaalsContact O-CB 3.3Å; Y256-A260 WeakPolarHBondContact O-CB 3.34Å; Y256-A260 PolarHBondContact O-N 3.23Å; E258-A260 VanDerWaalsContact C-N 3.32Å; E258-A260 PolarHBondContact O-N 2.93Å; A260-C263 PolarHBondContact O-N 3.44Å; A260-K264 VanDerWaalsContact O-CG 3.28Å; A260-K264 WeakPolarHBondContact O-CG 3.27Å; A260-K264 PolarHBondContact O-N 2.96Å; A260-K264 VanDerWaalsContact O-N 3.11Å
261	K	95.4	Very high	95.2	Very high	120 Å²	120	52.4 Å²	52.4	52%	0.522	25%	0.245	S	C	.	.	H	α-helix	trans	-65.6	-39	175.4	-172.8	-178.9	178.1	-174.6	0	112	E257 E258 L259 C263 K264 M265	E257-K261 WeakPolarHBondContact O-CB 3.3Å; E257-K261 PolarHBondContact O-N 2.89Å; E258-K261 CarbonylContact O-C 3.59Å; E258-K261 WeakPolarHBondContact O-CB 3.39Å; E258-K261 PolarHBondContact O-N 3.33Å; E258-K261 VanDerWaalsContact O-N 3.13Å; L259-K261 VanDerWaalsContact C-N 3.3Å; L259-K261 PolarHBondContact O-N 2.98Å; K261-C263 VanDerWaalsContact C-N 3.34Å; K261-C263 PolarHBondContact O-N 3.45Å; K261-K264 PolarHBondContact O-N 3.48Å; K261-M265 HydrophobicContact CG-CG 4.47Å; K261-M265 WeakPolarHBondContact O-CB 3.5Å; K261-M265 WeakPolarHBondContact O-CG 3.34Å; K261-M265 PolarHBondContact O-N 2.91Å
262	Q	96.1	Very high	95.4	Very high	69 Å²	69	46.7 Å²	46.7	32%	0.322	23%	0.225	S	C	.	.	H	α-helix	trans	-57.8	-45.9	174.3	-173.9	-179.2	9.2	0	0	111.3	E258 L259 K264 M265 F266	E258-Q262 PolarHBondContact O-N 3.29Å; L259-Q262 WeakPolarHBondContact O-CB 3.24Å; L259-Q262 PolarHBondContact O-N 3.05Å; Q262-K264 PolarHBondContact O-N 3.01Å; Q262-M265 PolarHBondContact O-N 2.92Å; Q262-F266 WeakPolarHBondContact O-CB 3.1Å; Q262-F266 PolarHBondContact O-N 3.29Å
263	C	96.4	Very high	95.5	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.9	-41.5	176	-65.7	0	0	0	0	112.5	L259 A260 K261 F266 A267	L259-C263 PolarHBondContact O-N 3.48Å; L259-C263 PolarHBondContact O-SG 3.34Å; L259-C263 VanDerWaalsContact O-SG 3.35Å; A260-C263 PolarHBondContact O-N 3.44Å; K261-C263 VanDerWaalsContact C-N 3.34Å; K261-C263 PolarHBondContact O-N 3.45Å; C263-F266 PolarHBondContact O-N 2.94Å; C263-A267 PolarHBondContact O-N 2.9Å
264	K	95.6	Very high	95.4	Very high	37 Å²	37	41.7 Å²	41.7	16%	0.161	21%	0.209	C	C	.	.	H	α-helix	trans	-63.9	-44.1	177.1	-68	178.8	-179.7	-178.3	0	112.1	A260 K261 Q262 A267 K268 E318	A260-K264 VanDerWaalsContact O-CG 3.28Å; A260-K264 WeakPolarHBondContact O-CG 3.27Å; A260-K264 PolarHBondContact O-N 2.96Å; A260-K264 VanDerWaalsContact O-N 3.11Å; K261-K264 PolarHBondContact O-N 3.48Å; Q262-K264 PolarHBondContact O-N 3.01Å; K264-A267 PolarHBondContact O-N 3.45Å; K264-K268 PolarHBondContact O-N 3.18Å; K264-K268 VanDerWaalsContact O-N 3.11Å; K264-E318 WeakPolarHBondContact CB-OE2 3.35Å
265	M	95.6	Very high	95.2	Very high	57 Å²	57	45.6 Å²	45.6	28%	0.281	22%	0.215	S	C	.	.	H	α-helix	trans	-65.3	-40.3	176.8	-77	-64.6	-58.2	0	0	111.4	K261 Q262 K268 D269 E318	K261-M265 HydrophobicContact CG-CG 4.47Å; K261-M265 WeakPolarHBondContact O-CB 3.5Å; K261-M265 WeakPolarHBondContact O-CG 3.34Å; K261-M265 PolarHBondContact O-N 2.91Å; Q262-M265 PolarHBondContact O-N 2.92Å; M265-K268 HydrophobicContact CE-CD 4.24Å; M265-K268 PolarHBondContact O-N 3.34Å; M265-K268 HydrophobicContact SD-CD 4.02Å; M265-D269 WeakPolarHBondContact O-CB 3.36Å; M265-D269 VanDerWaalsContact O-CG 3.26Å; M265-D269 PolarHBondContact O-N 2.63Å; M265-E318 VanDerWaalsContact CG-OE2 3.27Å; M265-E318 WeakPolarHBondContact CG-OE2 3.49Å; M265-E318 PolarHBondContact N-OE2 2.99Å; M265-E318 VanDerWaalsContact SD-CD 3.55Å
266	F	95.9	Very high	95	Very high	4 Å²	4	46.7 Å²	46.7	2%	0.018	22%	0.221	C	C	.	.	H	α-helix	trans	-58.6	-49.9	174.1	168.9	-113.5	0	0	0	111.9	P221 I224 M225 P231 A235 Q262 C263 K268 D269 L270 Y754	P221-F266 HydrophobicContact CB-CD2 3.59Å; P221-F266 HydrophobicContact CB-CE2 3.94Å; P221-F266 HydrophobicContact CB-CG 4.13Å; P221-F266 HydrophobicContact CG-CB 4.25Å; P221-F266 HydrophobicContact CG-CD2 4.15Å; P221-F266 HydrophobicContact CG-CG 4.32Å; I224-F266 HydrophobicContact CB-CE1 4.24Å; I224-F266 HydrophobicContact CD1-CD1 4.41Å; I224-F266 HydrophobicContact CD1-CE1 4.47Å; I224-F266 HydrophobicContact CG2-CE1 3.78Å; I224-F266 HydrophobicContact CG2-CZ 4.36Å; M225-F266 HydrophobicContact CG-CE2 3.89Å; M225-F266 HydrophobicContact CG-CZ 3.64Å; M225-F266 HydrophobicContact SD-CE2 3.97Å; M225-F266 HydrophobicContact SD-CZ 4.31Å; P231-F266 HydrophobicContact CB-CE1 4.07Å; P231-F266 HydrophobicContact CB-CZ 4.11Å; A235-F266 HydrophobicContact CB-CD1 3.94Å; A235-F266 HydrophobicContact CB-CE1 4.38Å; Q262-F266 WeakPolarHBondContact O-CB 3.1Å; Q262-F266 PolarHBondContact O-N 3.29Å; C263-F266 PolarHBondContact O-N 2.94Å; F266-K268 VanDerWaalsContact C-N 3.33Å; F266-K268 PolarHBondContact O-N 2.61Å; F266-D269 PolarHBondContact O-N 3.35Å; F266-L270 HydrophobicContact CZ-CD2 4.21Å; F266-L270 WeakPolarHBondContact O-CB 3.5Å; F266-L270 PolarHBondContact O-N 3.32Å; F266-Y754 HydrophobicContact CD2-CE1 4.21Å; F266-Y754 HydrophobicContact CD2-CE2 4.36Å; F266-Y754 AromaticContact CD2-CZ 3.84Å; F266-Y754 HydrophobicContact CE2-CD1 4.46Å; F266-Y754 AromaticContact CE2-CE1 3.98Å; F266-Y754 HydrophobicContact CE2-CE1 3.98Å
267	A	96	Very high	94.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.1	-41.2	179.5	0	0	0	0	0	112.5	A235 F236 C263 K264 L271 F319	A235-A267 HydrophobicContact CB-CB 4.13Å; F236-A267 HydrophobicContact CD1-CB 4.2Å; F236-A267 HydrophobicContact CE1-CB 3.7Å; C263-A267 PolarHBondContact O-N 2.9Å; K264-A267 PolarHBondContact O-N 3.45Å; A267-L271 PolarHBondContact O-N 3.32Å; A267-L271 VanDerWaalsContact O-N 3.16Å; A267-F319 HydrophobicContact CB-CD2 4.16Å
268	K	95.4	Very high	94.2	Very high	59 Å²	59	56.3 Å²	56.3	26%	0.257	27%	0.266	S	S	.	.	H	α-helix	trans	-62.5	-50.1	173.3	172.1	-145.9	165.1	-144	0	111	K264 M265 F266 L270 L271 A272 E318 Q322	K264-K268 PolarHBondContact O-N 3.18Å; K264-K268 VanDerWaalsContact O-N 3.11Å; M265-K268 HydrophobicContact CE-CD 4.24Å; M265-K268 PolarHBondContact O-N 3.34Å; M265-K268 HydrophobicContact SD-CD 4.02Å; F266-K268 VanDerWaalsContact C-N 3.33Å; F266-K268 PolarHBondContact O-N 2.61Å; K268-L270 VanDerWaalsContact C-N 3.28Å; K268-L270 PolarHBondContact O-N 3.2Å; K268-L271 PolarHBondContact O-N 3.26Å; K268-A272 PolarHBondContact O-N 3.4Å; K268-E318 HydrophobicContact CB-CB 4.38Å; K268-E318 HydrophobicContact CD-CB 4.27Å; K268-Q322 HydrophobicContact CG-CB 4.48Å; K268-Q322 PolarHBondContact O-NE2 2.83Å; K268-Q322 PolarHBondContact O-OE1 3.17Å
269	D	95.1	Very high	94	Very high	35 Å²	35	50.8 Å²	50.8	19%	0.187	24%	0.241	C	C	.	.	H	α-helix	trans	-69.1	-29.4	-175.2	-70.4	-10.4	0	0	0	111.9	M265 F266 A272 Y754	M265-D269 WeakPolarHBondContact O-CB 3.36Å; M265-D269 VanDerWaalsContact O-CG 3.26Å; M265-D269 PolarHBondContact O-N 2.63Å; F266-D269 PolarHBondContact O-N 3.35Å; D269-A272 WeakPolarHBondContact O-CB 3.13Å; D269-A272 PolarHBondContact O-N 3.37Å; D269-Y754 HydrophobicContact CB-CD2 4.48Å; D269-Y754 HydrophobicContact CB-CE2 3.84Å
270	L	94.6	Very high	93.8	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66.1	-45.3	170.7	-172.2	63	0	0	0	111.7	P231 I232 F266 K268 A272 Q273 M747 L750 V751 Y754	P231-L270 HydrophobicContact CB-CD2 4.25Å; P231-L270 HydrophobicContact CG-CD2 3.79Å; I232-L270 HydrophobicContact CD1-CD2 4.36Å; I232-L270 HydrophobicContact CG1-CD2 3.75Å; F266-L270 HydrophobicContact CZ-CD2 4.21Å; F266-L270 WeakPolarHBondContact O-CB 3.5Å; F266-L270 PolarHBondContact O-N 3.32Å; K268-L270 VanDerWaalsContact C-N 3.28Å; K268-L270 PolarHBondContact O-N 3.2Å; L270-A272 PolarHBondContact O-N 2.87Å; L270-Q273 WeakPolarHBondContact O-CB 3.42Å; L270-Q273 PolarHBondContact O-N 3.37Å; L270-Q273 VanDerWaalsContact O-N 3.17Å; L270-M747 HydrophobicContact CD2-SD 4.03Å; L270-L750 HydrophobicContact CD1-CB 4.14Å; L270-V751 HydrophobicContact CD1-CG2 4.28Å; L270-Y754 HydrophobicContact CD1-CG 4.21Å
271	L	94.3	Very high	93.4	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.3	-23.4	174.4	-169	76.9	0	0	0	112.1	A267 K268 Q273 A274 L280 I283 F319 C325	A267-L271 PolarHBondContact O-N 3.32Å; A267-L271 VanDerWaalsContact O-N 3.16Å; K268-L271 PolarHBondContact O-N 3.26Å; L271-Q273 PolarHBondContact O-N 3.16Å; L271-A274 WeakPolarHBondContact O-CB 3.23Å; L271-A274 PolarHBondContact O-N 3.41Å; L271-L280 HydrophobicContact CD1-CD1 3.52Å; L271-L280 HydrophobicContact CD2-CD1 4.3Å; L271-L280 HydrophobicContact CG-CD1 4.04Å; L271-I283 HydrophobicContact CD1-CD1 4.29Å; L271-I283 HydrophobicContact CD1-CG2 3.95Å; L271-F319 HydrophobicContact CB-CD2 4.24Å; L271-F319 HydrophobicContact CB-CE2 3.82Å; L271-F319 HydrophobicContact CD1-CE2 3.95Å; L271-F319 HydrophobicContact CD1-CZ 3.91Å; L271-F319 HydrophobicContact CD2-CD1 4.44Å; L271-F319 HydrophobicContact CD2-CD2 4.01Å; L271-F319 HydrophobicContact CD2-CE1 4.08Å; L271-F319 HydrophobicContact CD2-CE2 3.63Å; L271-F319 HydrophobicContact CD2-CG 4.41Å; L271-F319 HydrophobicContact CD2-CZ 3.66Å; L271-F319 HydrophobicContact CG-CE2 4Å; L271-F319 HydrophobicContact CG-CZ 4.25Å; L271-C325 HydrophobicContact CD2-CB 3.97Å
272	A	94.1	Very high	93.1	Very high	40 Å²	40	49.9 Å²	49.9	33%	0.331	24%	0.24	S	C	.	.	H	α-helix	trans	-64.3	-27.4	177.2	0	0	0	0	0	112.4	K268 D269 L270 A274 N324	K268-A272 PolarHBondContact O-N 3.4Å; D269-A272 WeakPolarHBondContact O-CB 3.13Å; D269-A272 PolarHBondContact O-N 3.37Å; L270-A272 PolarHBondContact O-N 2.87Å; A272-A274 PolarHBondContact O-N 3.14Å; A272-N324 PolarHBondContact O-ND2 2.88Å
273	Q	94.5	Very high	92.8	Very high	30 Å²	30	46.7 Å²	46.7	14%	0.14	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-7.5	-176.8	-54.8	-58.3	-25.8	0	0	113.3	L270 L271 R275 L750 R753 Y754 S757	L270-Q273 WeakPolarHBondContact O-CB 3.42Å; L270-Q273 PolarHBondContact O-N 3.37Å; L270-Q273 VanDerWaalsContact O-N 3.17Å; L271-Q273 PolarHBondContact O-N 3.16Å; Q273-R275 PolarHBondContact O-N 3.41Å; Q273-L750 VanDerWaalsContact C-CD2 3.47Å; Q273-L750 HydrophobicContact CB-CD2 3.83Å; Q273-R753 HydrophobicContact CB-CB 4.08Å; Q273-R753 HydrophobicContact CG-CB 4.48Å; Q273-R753 PolarHBondContact O-NH1 3.4Å; Q273-Y754 HydrophobicContact CG-CD2 4.38Å; Q273-S757 PolarHBondContact NE2-OG 3.11Å
274	A	93.2	Very high	92.5	Very high	10 Å²	10	46.7 Å²	46.7	8%	0.083	23%	0.225	C	C	.	.			trans	-68.1	121.9	172.9	0	0	0	0	0	109.5	L271 A272 I283 N324 L750	L271-A274 WeakPolarHBondContact O-CB 3.23Å; L271-A274 PolarHBondContact O-N 3.41Å; A272-A274 PolarHBondContact O-N 3.14Å; A274-I283 HydrophobicContact CB-CD1 4.44Å; A274-N324 PolarHBondContact O-ND2 3.39Å; A274-L750 HydrophobicContact CB-CD2 4.06Å; A274-L750 VanDerWaalsContact N-CD2 3.35Å
275	R	90.1	Very high	92.1	Very high	191 Å²	191	45.6 Å²	45.6	72%	0.721	22%	0.221	S	C	*	.			trans	-97.3	-26.9	-177.2	-68.2	-176.2	178.7	179.9	0.1	112.5	Q273 E279	Q273-R275 PolarHBondContact O-N 3.41Å; R275-E279 PolarHBondContact N-OE2 3.14Å
276	N	91.3	Very high	91.6	Very high	93 Å²	93	43.9 Å²	43.9	50%	0.497	21%	0.212	S	C	.	.	S	Bend	trans	-115.9	145.7	-172.5	-62.8	-17.5	0	0	0	111.4	R278 E279 L280	N276-R278 PolarHBondContact O-N 3.49Å; N276-E279 HydrophobicContact CB-CB 4.4Å; N276-E279 HydrophobicContact CB-CG 4.1Å; N276-E279 PolarHBondContact O-N 3.44Å; N276-L280 PolarHBondContact O-N 3.44Å; N276-L280 VanDerWaalsContact O-N 3.14Å
277	S	87.9	Confident	90.8	Very high	83 Å²	83	45.8 Å²	45.8	58%	0.58	22%	0.224	S	C	*	.	H	α-helix	trans	-60.7	-31.3	173	53.7	0	0	0	0	112.8	L280 E281	S277-L280 PolarHBondContact O-N 2.69Å; S277-E281 WeakPolarHBondContact O-CB 3.26Å; S277-E281 PolarHBondContact O-N 3.39Å
278	R	88.3	Confident	89.3	Confident	200 Å²	200	48.6 Å²	48.6	76%	0.755	24%	0.244	S	C	*	.	H	α-helix	trans	-67.7	-41.7	175	-64.9	-178.9	-175.5	161.6	0.8	112.8	N276 L280 E281 V282	N276-R278 PolarHBondContact O-N 3.49Å; R278-L280 VanDerWaalsContact C-N 3.29Å; R278-L280 PolarHBondContact O-N 3.06Å; R278-E281 PolarHBondContact O-N 3.33Å; R278-V282 WeakPolarHBondContact O-CG2 3.39Å; R278-V282 PolarHBondContact O-N 2.8Å; R278-V282 VanDerWaalsContact O-N 3.09Å
279	E	91.6	Very high	87.6	Confident	22 Å²	22	48.7 Å²	48.7	10%	0.103	25%	0.252	C	S	.	.	H	α-helix	trans	-59.8	-47.5	174.5	-71.3	175.5	174.3	0	0	109	R275 N276 E281 V282 I283 I746 R753	R275-E279 PolarHBondContact N-OE2 3.14Å; N276-E279 HydrophobicContact CB-CB 4.4Å; N276-E279 HydrophobicContact CB-CG 4.1Å; N276-E279 PolarHBondContact O-N 3.44Å; E279-E281 PolarHBondContact O-N 2.71Å; E279-V282 PolarHBondContact O-N 3.41Å; E279-I283 WeakPolarHBondContact O-CD1 3.18Å; E279-I283 VanDerWaalsContact O-CG1 3.22Å; E279-I283 WeakPolarHBondContact O-CG1 3.44Å; E279-I283 PolarHBondContact O-N 3.23Å; E279-I283 VanDerWaalsContact O-N 3.11Å; E279-I746 HydrophobicContact CB-CG2 4.13Å; E279-I746 HydrophobicContact CG-CG2 4.25Å; E279-R753 IonicContact OE1-CZ 3.5Å; E279-R753 IonicContact OE1-NH1 3Å; E279-R753 PolarHBondContact OE1-NH1 3.3Å; E279-R753 VanDerWaalsContact OE1-NH1 3.16Å; E279-R753 IonicContact OE1-NH2 3.56Å; E279-R753 PolarHBondContact OE1-NH2 3.1Å; E279-R753 IonicContact OE2-CZ 3.15Å; E279-R753 IonicContact OE2-NH1 2.89Å; E279-R753 PolarHBondContact OE2-NH1 3.08Å
280	L	91	Very high	85.6	Confident	8 Å²	8	53.3 Å²	53.3	4%	0.042	28%	0.277	C	S	.	.	H	α-helix	trans	-63.6	-39.8	179.2	-173.4	59	0	0	0	112.9	L271 N276 S277 R278 I283 L284 N324 F328	L271-L280 HydrophobicContact CD1-CD1 3.52Å; L271-L280 HydrophobicContact CD2-CD1 4.3Å; L271-L280 HydrophobicContact CG-CD1 4.04Å; N276-L280 PolarHBondContact O-N 3.44Å; N276-L280 VanDerWaalsContact O-N 3.14Å; S277-L280 PolarHBondContact O-N 2.69Å; R278-L280 VanDerWaalsContact C-N 3.29Å; R278-L280 PolarHBondContact O-N 3.06Å; L280-I283 PolarHBondContact O-N 2.9Å; L280-L284 HydrophobicContact CD1-CD1 3.77Å; L280-L284 HydrophobicContact CD1-CD2 4.44Å; L280-L284 HydrophobicContact CD1-CG 3.88Å; L280-L284 HydrophobicContact CD2-CD1 4.42Å; L280-L284 HydrophobicContact CG-CD1 3.73Å; L280-L284 HydrophobicContact CG-CG 4.22Å; L280-L284 WeakPolarHBondContact O-CB 3.31Å; L280-L284 VanDerWaalsContact O-CG 3.29Å; L280-L284 WeakPolarHBondContact O-CG 3.43Å; L280-L284 PolarHBondContact O-N 3.4Å; L280-N324 HydrophobicContact CD2-CB 4.38Å; L280-N324 WeakPolarHBondContact CD2-O 3.43Å; L280-F328 HydrophobicContact CD2-CB 3.46Å; L280-F328 VanDerWaalsContact CD2-CB 3.46Å; L280-F328 HydrophobicContact CD2-CD2 4.25Å; L280-F328 HydrophobicContact CD2-CG 3.87Å; L280-F328 HydrophobicContact CG-CB 4.36Å; L280-F328 HydrophobicContact CG-CG 4.28Å
281	E	88.7	Confident	83.4	Confident	74 Å²	74	59.1 Å²	59.1	35%	0.346	31%	0.308	S	S	.	.	H	α-helix	trans	-60.8	-45.1	175.8	-177.3	179.6	178.8	0	0	111.9	S277 R278 E279 I283 N285 M303 F328	S277-E281 WeakPolarHBondContact O-CB 3.26Å; S277-E281 PolarHBondContact O-N 3.39Å; R278-E281 PolarHBondContact O-N 3.33Å; E279-E281 PolarHBondContact O-N 2.71Å; E281-I283 VanDerWaalsContact C-N 3.32Å; E281-I283 PolarHBondContact O-N 2.95Å; E281-N285 VanDerWaalsContact CG-ND2 3.33Å; E281-N285 WeakPolarHBondContact CG-ND2 3.49Å; E281-N285 WeakPolarHBondContact O-CB 3.32Å; E281-N285 PolarHBondContact O-N 3Å; E281-N285 PolarHBondContact O-ND2 2.89Å; E281-M303 HydrophobicContact CG-CE 4.23Å; E281-F328 HydrophobicContact CB-CE2 3.96Å; E281-F328 HydrophobicContact CB-CZ 3.96Å; E281-F328 HydrophobicContact CG-CZ 4.21Å
282	V	88.9	Confident	81	Confident	36 Å²	36	68.4 Å²	68.4	22%	0.218	35%	0.351	C	S	.	.	H	α-helix	trans	-62.8	-41.6	177.8	174.9	0	0	0	0	110.6	R278 E279 H286 Y743 I746	R278-V282 WeakPolarHBondContact O-CG2 3.39Å; R278-V282 PolarHBondContact O-N 2.8Å; R278-V282 VanDerWaalsContact O-N 3.09Å; E279-V282 PolarHBondContact O-N 3.41Å; V282-H286 WeakPolarHBondContact O-CB 3.32Å; V282-H286 PolarHBondContact O-N 3.13Å; V282-H286 VanDerWaalsContact O-N 3.17Å; V282-Y743 HydrophobicContact CG1-CD2 4.19Å; V282-I746 HydrophobicContact CB-CD1 3.74Å; V282-I746 HydrophobicContact CG1-CD1 3.75Å; V282-I746 HydrophobicContact CG2-CD1 3.91Å
283	I	91.1	Very high	78.9	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.005	35%	0.347	C	S	.	.	H	α-helix	trans	-65.8	-50.8	179	-60.9	157.9	0	0	0	111.5	I232 L271 A274 E279 L280 E281 N285 H286 R307 Y743 I746 L750	I232-I283 HydrophobicContact CD1-CG2 3.78Å; L271-I283 HydrophobicContact CD1-CD1 4.29Å; L271-I283 HydrophobicContact CD1-CG2 3.95Å; A274-I283 HydrophobicContact CB-CD1 4.44Å; E279-I283 WeakPolarHBondContact O-CD1 3.18Å; E279-I283 VanDerWaalsContact O-CG1 3.22Å; E279-I283 WeakPolarHBondContact O-CG1 3.44Å; E279-I283 PolarHBondContact O-N 3.23Å; E279-I283 VanDerWaalsContact O-N 3.11Å; L280-I283 PolarHBondContact O-N 2.9Å; E281-I283 VanDerWaalsContact C-N 3.32Å; E281-I283 PolarHBondContact O-N 2.95Å; I283-N285 VanDerWaalsContact C-N 3.27Å; I283-N285 PolarHBondContact O-N 3.34Å; I283-H286 PolarHBondContact O-N 3.43Å; I283-R307 VanDerWaalsContact O-CB 3.3Å; I283-R307 WeakPolarHBondContact O-CB 3.35Å; I283-Y743 HydrophobicContact CG1-CE2 4.47Å; I283-I746 HydrophobicContact CD1-CG2 4.31Å; I283-I746 HydrophobicContact CG1-CG2 4.28Å; I283-L750 HydrophobicContact CD1-CD1 3.45Å; I283-L750 VanDerWaalsContact CD1-CD1 3.45Å; I283-L750 HydrophobicContact CG1-CD1 4.19Å
284	L	89.5	Confident	76.7	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-70.7	-23.8	-175	-65.9	178	0	0	0	112.9	L280 L305 S306 R307 L308 F319 F328	L280-L284 HydrophobicContact CD1-CD1 3.77Å; L280-L284 HydrophobicContact CD1-CD2 4.44Å; L280-L284 HydrophobicContact CD1-CG 3.88Å; L280-L284 HydrophobicContact CD2-CD1 4.42Å; L280-L284 HydrophobicContact CG-CD1 3.73Å; L280-L284 HydrophobicContact CG-CG 4.22Å; L280-L284 WeakPolarHBondContact O-CB 3.31Å; L280-L284 VanDerWaalsContact O-CG 3.29Å; L280-L284 WeakPolarHBondContact O-CG 3.43Å; L280-L284 PolarHBondContact O-N 3.4Å; L284-L305 HydrophobicContact CB-CD2 4.05Å; L284-L305 CarbonylContact O-C 3.52Å; L284-L305 VanDerWaalsContact O-C 3.27Å; L284-L305 WeakPolarHBondContact O-CA 3.47Å; L284-S306 PolarHBondContact O-N 3.04Å; L284-R307 WeakPolarHBondContact O-CB 3.3Å; L284-R307 PolarHBondContact O-N 2.97Å; L284-L308 HydrophobicContact CD2-CB 4.42Å; L284-L308 HydrophobicContact CD2-CD1 4.48Å; L284-F319 HydrophobicContact CD2-CE1 3.98Å; L284-F319 HydrophobicContact CD2-CZ 4.13Å; L284-F328 HydrophobicContact CD1-CD1 3.47Å; L284-F328 VanDerWaalsContact CD1-CD1 3.47Å; L284-F328 HydrophobicContact CD1-CE1 3.58Å; L284-F328 HydrophobicContact CD1-CG 4.32Å
285	N	86.8	Confident	74.6	Confident	14 Å²	14	76.9 Å²	76.9	8%	0.075	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	4.6	176.8	-68.8	-38.4	0	0	0	113.9	E281 I283 L305 S306 R739	E281-N285 VanDerWaalsContact CG-ND2 3.33Å; E281-N285 WeakPolarHBondContact CG-ND2 3.49Å; E281-N285 WeakPolarHBondContact O-CB 3.32Å; E281-N285 PolarHBondContact O-N 3Å; E281-N285 PolarHBondContact O-ND2 2.89Å; I283-N285 VanDerWaalsContact C-N 3.27Å; I283-N285 PolarHBondContact O-N 3.34Å; N285-L305 VanDerWaalsContact OD1-CA 3.25Å; N285-L305 WeakPolarHBondContact OD1-CA 3.39Å; N285-L305 PolarHBondContact OD1-N 2.86Å; N285-S306 VanDerWaalsContact C-OG 3.31Å; N285-S306 PolarHBondContact O-OG 3.21Å; N285-R739 PolarHBondContact O-NH2 3.08Å; N285-R739 VanDerWaalsContact O-NH2 3.14Å
286	H	84.8	Confident	72.5	Confident	21 Å²	21	72.8 Å²	72.8	10%	0.097	37%	0.372	C	S	.	.			trans	-73.7	142.2	178.7	-174	59.2	0	0	0	111.5	D230 V282 I283 S306 R307 D740 Y743	D230-H286 IonicContact OD2-CD2 3.87Å; V282-H286 WeakPolarHBondContact O-CB 3.32Å; V282-H286 PolarHBondContact O-N 3.13Å; V282-H286 VanDerWaalsContact O-N 3.17Å; I283-H286 PolarHBondContact O-N 3.43Å; H286-S306 PolarHBondContact O-OG 2.96Å; H286-R307 PolarHBondContact CD2-NH2 3.27Å; H286-D740 IonicContact CE1-OD1 2.64Å; H286-D740 PolarHBondContact CE1-OD1 3.48Å; H286-D740 IonicContact ND1-OD1 2.92Å; H286-Y743 HydrophobicContact CB-CD2 3.59Å; H286-Y743 HydrophobicContact CB-CE2 3.6Å; H286-Y743 HydrophobicContact CB-CG 4.29Å; H286-Y743 AromaticContact CD2-CD1 3.71Å; H286-Y743 AromaticContact CD2-CD2 3.83Å; H286-Y743 AromaticContact CD2-CE1 3.49Å; H286-Y743 VanDerWaalsContact CD2-CE1 3.49Å; H286-Y743 WeakPolarHBondContact CD2-CE1 3.22Å; H286-Y743 AromaticContact CD2-CE2 3.62Å; H286-Y743 AromaticContact CD2-CG 3.87Å; H286-Y743 AromaticContact CD2-CZ 3.43Å; H286-Y743 VanDerWaalsContact CD2-CZ 3.43Å; H286-Y743 AromaticContact CE1-CD1 3.9Å; H286-Y743 AromaticContact CE1-CG 3.97Å; H286-Y743 AromaticContact CG-CD2 3.52Å; H286-Y743 AromaticContact CG-CE2 3.65Å; H286-Y743 AromaticContact CG-CG 3.73Å; H286-Y743 AromaticContact CG-CZ 3.97Å; H286-Y743 AromaticContact ND1-CD2 3.99Å; H286-Y743 AromaticContact ND1-CG 3.77Å; H286-Y743 AromaticContact NE2-CD1 3.66Å; H286-Y743 AromaticContact NE2-CE1 3.7Å
287	T	79.6	Confident	70.3	Confident	44 Å²	44	69.1 Å²	69.1	27%	0.27	36%	0.356	S	S	.	.			trans	-127.7	118.4	179.6	49.2	0	0	0	0	108.6	S306	T287-S306 WeakPolarHBondContact CG2-OG 3.47Å
288	S	64.3	Low	68.4	Low	60 Å²	60	67.1 Å²	67.1	42%	0.42	34%	0.339	S	S	.	.			trans	-83.4	-24.9	175	48.9	0	0	0	0	112.7	L233	L233-S288 WeakPolarHBondContact CD2-OG 3.34Å
289	S	59.4	Low	66.1	Low	60 Å²	60	63.5 Å²	63.5	42%	0.42	33%	0.334	S	S	.	.			trans	-77.1	139.2	-177.2	55.3	0	0	0	0	113.2	D291	S289-D291 PolarHBondContact O-N 2.82Å
290	D	53.1	Low	64	Low	133 Å²	133	66.9 Å²	66.9	71%	0.711	35%	0.349	S	S	*	.			trans	-78.4	4.2	172.7	-98.3	-10.6	0	0	0	113.6	K736	D290-K736 IonicContact OD1-NZ 3.4Å; D290-K736 PolarHBondContact OD1-NZ 3.41Å
291	D	48.1	Very low	61.9	Low	122 Å²	122	76.3 Å²	76.3	65%	0.652	39%	0.393	S	S	*	.	S	Bend	trans	-53.1	151.8	178.1	-87.9	-25.7	0	0	0	111.4	S289 V293	S289-D291 PolarHBondContact O-N 2.82Å; D291-V293 PolarHBondContact O-N 3.45Å
292	H	45	Very low	60.3	Low	195 Å²	195	77.5 Å²	77.5	90%	0.903	39%	0.394	S	S	*	.			trans	-57.4	75.8	-178.6	-73.2	-57.2	0	0	0	112.3	D294	H292-D294 PolarHBondContact O-N 3.01Å; H292-D294 VanDerWaalsContact O-N 3.1Å
293	V	49.3	Very low	59.2	Low	42 Å²	42	78.8 Å²	78.8	26%	0.255	40%	0.399	S	S	.	.			trans	-59.4	119.3	166.4	-179.5	0	0	0	0	105.2	D291 K295 L298	D291-V293 PolarHBondContact O-N 3.45Å; V293-K295 PolarHBondContact O-N 3.47Å; V293-L298 HydrophobicContact CB-CD1 4.31Å; V293-L298 HydrophobicContact CG1-CD1 3.75Å; V293-L298 HydrophobicContact CG1-CG 4.31Å
294	D	48.3	Very low	58.1	Low	129 Å²	129	82.2 Å²	82.2	69%	0.69	42%	0.417	S	S	*	.			trans	-46.4	118.3	173.4	-94.2	-37.7	0	0	0	108.1	H292 R296 G297	H292-D294 PolarHBondContact O-N 3.01Å; H292-D294 VanDerWaalsContact O-N 3.1Å; D294-R296 PolarHBondContact O-N 3.5Å; D294-G297 PolarHBondContact O-N 3.39Å
295	K	48.8	Very low	57.7	Low	87 Å²	87	82.2 Å²	82.2	38%	0.378	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	-18.6	-179.6	-67.6	-176	173.8	-168.5	0	113.2	V293 S728	V293-K295 PolarHBondContact O-N 3.47Å; K295-S728 PolarHBondContact NZ-OG 3.31Å
296	R	45.9	Very low	57.6	Low	105 Å²	105	82.9 Å²	82.9	40%	0.396	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-35.1	176.4	-63.8	-177.8	-152.9	-173.6	6.3	113.9	D294 L298 L299 E300	D294-R296 PolarHBondContact O-N 3.5Å; R296-L298 PolarHBondContact O-N 3.41Å; R296-L299 PolarHBondContact O-N 2.83Å; R296-E300 PolarHBondContact O-N 2.92Å
297	G	47.1	Very low	57.8	Low	15 Å²	15	82 Å²	82	16%	0.155	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-14.6	-176.4	0	0	0	0	0	114.6	D294 E300	D294-G297 PolarHBondContact O-N 3.39Å; G297-E300 CarbonylContact C-O 3.27Å
298	L	46.7	Very low	58.3	Low	42 Å²	42	79.9 Å²	79.9	22%	0.22	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-21.3	174	-88.6	152.7	0	0	0	113.5	V293 R296	V293-L298 HydrophobicContact CB-CD1 4.31Å; V293-L298 HydrophobicContact CG1-CD1 3.75Å; V293-L298 HydrophobicContact CG1-CG 4.31Å; R296-L298 PolarHBondContact O-N 3.41Å
299	L	40.2	Very low	59.5	Low	124 Å²	124	80.2 Å²	80.2	65%	0.649	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-30.5	179.2	-91.9	163.5	0	0	0	112.4	R296	R296-L299 PolarHBondContact O-N 2.83Å
300	E	46.5	Very low	61	Low	93 Å²	93	79.4 Å²	79.4	44%	0.435	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	129.2	161.4	-69.7	170.6	147.6	0	0	106.3	R296 G297 R302	R296-E300 PolarHBondContact O-N 2.92Å; G297-E300 CarbonylContact C-O 3.27Å; E300-R302 HydrophobicContact CB-CG 3.82Å; E300-R302 VanDerWaalsContact CD-NH2 3.29Å; E300-R302 PolarHBondContact O-N 2.6Å; E300-R302 IonicContact OE1-NH2 3.06Å; E300-R302 PolarHBondContact OE1-NH2 3.27Å; E300-R302 IonicContact OE2-CZ 3.59Å; E300-R302 IonicContact OE2-NE 3.09Å; E300-R302 PolarHBondContact OE2-NE 2.85Å; E300-R302 IonicContact OE2-NH2 2.63Å; E300-R302 PolarHBondContact OE2-NH2 3.12Å
301	E	47.8	Very low	62.8	Low	206 Å²	206	73 Å²	73	96%	0.963	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	61	173.9	-68.6	177	155	0	0	111.1
302	R	55.7	Low	64.8	Low	98 Å²	98	68.3 Å²	68.3	37%	0.37	33%	0.331	S	S	.	.			trans	-90.4	124.1	-178.8	-67.1	-162	-163.9	-130.7	-3.3	109.4	E300 N304 D686	E300-R302 HydrophobicContact CB-CG 3.82Å; E300-R302 VanDerWaalsContact CD-NH2 3.29Å; E300-R302 PolarHBondContact O-N 2.6Å; E300-R302 IonicContact OE1-NH2 3.06Å; E300-R302 PolarHBondContact OE1-NH2 3.27Å; E300-R302 IonicContact OE2-CZ 3.59Å; E300-R302 IonicContact OE2-NE 3.09Å; E300-R302 PolarHBondContact OE2-NE 2.85Å; E300-R302 IonicContact OE2-NH2 2.63Å; E300-R302 PolarHBondContact OE2-NH2 3.12Å; R302-N304 PolarHBondContact O-N 3.1Å; R302-D686 IonicContact CZ-OD2 2.66Å; R302-D686 IonicContact NH1-OD2 3.82Å; R302-D686 PolarHBondContact NH1-OD2 3.31Å
303	M	64.6	Low	66.9	Low	64 Å²	64	66.1 Å²	66.1	32%	0.315	32%	0.319	S	S	.	.			trans	-74.6	85.1	175.5	-58.9	173.2	80.1	0	0	109.9	E281 L305 F328 V332	E281-M303 HydrophobicContact CG-CE 4.23Å; M303-L305 PolarHBondContact O-N 3.08Å; M303-F328 HydrophobicContact CE-CE1 3.87Å; M303-F328 HydrophobicContact CE-CE2 3.82Å; M303-F328 HydrophobicContact CE-CZ 3.15Å; M303-V332 HydrophobicContact CE-CG2 3.49Å; M303-V332 VanDerWaalsContact CE-CG2 3.49Å; M303-V332 HydrophobicContact SD-CG2 4.07Å
304	N	67.7	Low	69	Low	73 Å²	73	67.6 Å²	67.6	39%	0.39	32%	0.32	S	S	.	.			trans	-75.9	-8.8	179.4	-73.6	-13.9	0	0	0	113.6	R302 S306 K309	R302-N304 PolarHBondContact O-N 3.1Å; N304-S306 PolarHBondContact O-N 3.21Å; N304-S306 VanDerWaalsContact O-N 3.1Å; N304-K309 VanDerWaalsContact O-CE 3.27Å; N304-K309 WeakPolarHBondContact O-CE 3.31Å
305	L	82.6	Confident	71	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	30%	0.3	C	S	.	.			trans	45.1	43.1	177.2	-61.4	170.8	0	0	0	112.9	L284 N285 M303 R307 L308 K309 F328 L329 L681 F684	L284-L305 HydrophobicContact CB-CD2 4.05Å; L284-L305 CarbonylContact O-C 3.52Å; L284-L305 VanDerWaalsContact O-C 3.27Å; L284-L305 WeakPolarHBondContact O-CA 3.47Å; N285-L305 VanDerWaalsContact OD1-CA 3.25Å; N285-L305 WeakPolarHBondContact OD1-CA 3.39Å; N285-L305 PolarHBondContact OD1-N 2.86Å; M303-L305 PolarHBondContact O-N 3.08Å; L305-R307 PolarHBondContact O-N 3.35Å; L305-L308 HydrophobicContact CB-CB 4.2Å; L305-L308 HydrophobicContact CB-CD2 4.5Å; L305-L308 HydrophobicContact CD1-CD2 4.44Å; L305-L308 WeakPolarHBondContact O-CB 3.39Å; L305-L308 PolarHBondContact O-N 3.39Å; L305-L308 VanDerWaalsContact O-N 3.16Å; L305-K309 PolarHBondContact O-N 2.8Å; L305-F328 HydrophobicContact CD2-CE1 3.69Å; L305-F328 HydrophobicContact CD2-CZ 4.41Å; L305-L329 HydrophobicContact CD1-CD2 4.35Å; L305-L681 HydrophobicContact CB-CD1 4.27Å; L305-L681 HydrophobicContact CD1-CD1 4.31Å; L305-F684 HydrophobicContact CD1-CD2 3.56Å; L305-F684 HydrophobicContact CD1-CE2 3.69Å
306	S	83.6	Confident	73.2	Confident	28 Å²	28	59.6 Å²	59.6	20%	0.196	28%	0.282	C	S	.	.	H	α-helix	trans	-59	-44.1	-173.2	47.2	0	0	0	0	113.2	L284 N285 H286 T287 N304 L308 K309 L310	L284-S306 PolarHBondContact O-N 3.04Å; N285-S306 VanDerWaalsContact C-OG 3.31Å; N285-S306 PolarHBondContact O-OG 3.21Å; H286-S306 PolarHBondContact O-OG 2.96Å; T287-S306 WeakPolarHBondContact CG2-OG 3.47Å; N304-S306 PolarHBondContact O-N 3.21Å; N304-S306 VanDerWaalsContact O-N 3.1Å; S306-L308 VanDerWaalsContact C-N 3.29Å; S306-L308 PolarHBondContact O-N 3.49Å; S306-K309 WeakPolarHBondContact O-CB 3.27Å; S306-K309 PolarHBondContact O-N 2.83Å; S306-L310 WeakPolarHBondContact O-CB 3.42Å; S306-L310 PolarHBondContact O-N 2.85Å
307	R	89.7	Confident	75.5	Confident	1 Å²	1	57.6 Å²	57.6	0%	0.004	28%	0.276	C	S	.	.	H	α-helix	trans	-67.1	-34.4	179.2	-176.8	56.5	56.9	118.7	1.5	111.3	D230 I283 L284 H286 L305 L310 A311	D230-R307 VanDerWaalsContact CG-NH1 3.31Å; D230-R307 IonicContact OD1-NH1 3.91Å; D230-R307 PolarHBondContact OD1-NH1 3.41Å; D230-R307 VanDerWaalsContact OD1-NH1 3.1Å; D230-R307 IonicContact OD2-CZ 3.19Å; D230-R307 IonicContact OD2-NH1 3.18Å; D230-R307 PolarHBondContact OD2-NH1 3.36Å; D230-R307 IonicContact OD2-NH2 3.13Å; D230-R307 PolarHBondContact OD2-NH2 3.41Å; I283-R307 VanDerWaalsContact O-CB 3.3Å; I283-R307 WeakPolarHBondContact O-CB 3.35Å; L284-R307 WeakPolarHBondContact O-CB 3.3Å; L284-R307 PolarHBondContact O-N 2.97Å; H286-R307 PolarHBondContact CD2-NH2 3.27Å; L305-R307 PolarHBondContact O-N 3.35Å; R307-L310 WeakPolarHBondContact O-CB 3.48Å; R307-L310 PolarHBondContact O-N 3.23Å; R307-A311 WeakPolarHBondContact O-CB 3.39Å; R307-A311 PolarHBondContact O-N 3.01Å
308	L	90.4	Very high	77.7	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-69.1	-40.9	174.8	-173.9	70.5	0	0	0	112	L284 L305 S306 L310 A311 I312 V320 L329	L284-L308 HydrophobicContact CD2-CB 4.42Å; L284-L308 HydrophobicContact CD2-CD1 4.48Å; L305-L308 HydrophobicContact CB-CB 4.2Å; L305-L308 HydrophobicContact CB-CD2 4.5Å; L305-L308 HydrophobicContact CD1-CD2 4.44Å; L305-L308 WeakPolarHBondContact O-CB 3.39Å; L305-L308 PolarHBondContact O-N 3.39Å; L305-L308 VanDerWaalsContact O-N 3.16Å; S306-L308 VanDerWaalsContact C-N 3.29Å; S306-L308 PolarHBondContact O-N 3.49Å; L308-L310 VanDerWaalsContact C-N 3.26Å; L308-L310 PolarHBondContact O-N 3.48Å; L308-A311 WeakPolarHBondContact O-CB 3.46Å; L308-A311 PolarHBondContact O-N 3.32Å; L308-I312 HydrophobicContact CG-CD1 4.46Å; L308-I312 WeakPolarHBondContact O-CG1 3.37Å; L308-I312 PolarHBondContact O-N 3.27Å; L308-V320 HydrophobicContact CD1-CG1 4.38Å; L308-V320 HydrophobicContact CD1-CG2 3.9Å; L308-L329 HydrophobicContact CD2-CD1 4.13Å; L308-L329 HydrophobicContact CD2-CD2 3.62Å; L308-L329 HydrophobicContact CD2-CG 4.28Å
309	K	88.8	Confident	80	Confident	66 Å²	66	56.2 Å²	56.2	29%	0.287	26%	0.264	S	S	.	.	H	α-helix	trans	-57.3	-44.1	171.7	-72.6	177.4	-174.7	-169.9	0	110.8	N304 L305 S306 I312 K313 L681 D685	N304-K309 VanDerWaalsContact O-CE 3.27Å; N304-K309 WeakPolarHBondContact O-CE 3.31Å; L305-K309 PolarHBondContact O-N 2.8Å; S306-K309 WeakPolarHBondContact O-CB 3.27Å; S306-K309 PolarHBondContact O-N 2.83Å; K309-I312 PolarHBondContact O-N 2.81Å; K309-K313 PolarHBondContact O-N 3.42Å; K309-L681 HydrophobicContact CB-CD2 4.35Å; K309-L681 HydrophobicContact CG-CD1 4.08Å; K309-L681 HydrophobicContact CG-CD2 3.49Å; K309-L681 VanDerWaalsContact CG-CD2 3.49Å; K309-L681 HydrophobicContact CG-CG 4.01Å; K309-D685 IonicContact NZ-OD1 3.95Å; K309-D685 PolarHBondContact NZ-OD1 2.91Å; K309-D685 IonicContact NZ-OD2 2.7Å; K309-D685 PolarHBondContact NZ-OD2 3.46Å
310	L	90	Very high	82.7	Confident	43 Å²	43	50.3 Å²	50.3	23%	0.225	23%	0.233	C	C	.	.	H	α-helix	trans	-63.8	-42.2	176.3	-167.5	64.6	0	0	0	112.2	L233 S306 R307 L308 I312 K313 Y314	L233-L310 HydrophobicContact CD1-CD2 3.47Å; L233-L310 VanDerWaalsContact CD1-CD2 3.47Å; S306-L310 WeakPolarHBondContact O-CB 3.42Å; S306-L310 PolarHBondContact O-N 2.85Å; R307-L310 WeakPolarHBondContact O-CB 3.48Å; R307-L310 PolarHBondContact O-N 3.23Å; L308-L310 VanDerWaalsContact C-N 3.26Å; L308-L310 PolarHBondContact O-N 3.48Å; L310-I312 VanDerWaalsContact C-N 3.28Å; L310-I312 PolarHBondContact O-N 2.94Å; L310-K313 WeakPolarHBondContact O-CB 3.04Å; L310-K313 PolarHBondContact O-N 3.07Å; L310-K313 VanDerWaalsContact O-N 3.14Å; L310-Y314 HydrophobicContact CD1-CD2 3.97Å; L310-Y314 HydrophobicContact CD1-CE2 3.55Å; L310-Y314 HydrophobicContact CD2-CE2 4.32Å; L310-Y314 HydrophobicContact CG-CD2 3.84Å; L310-Y314 HydrophobicContact CG-CE2 3.75Å; L310-Y314 WeakPolarHBondContact O-CD2 3.37Å; L310-Y314 PolarHBondContact O-N 3.14Å
311	A	92.6	Very high	85	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.2	-38.1	175.2	0	0	0	0	0	112	F236 R307 L308 N315 Q316 F319 V320	F236-A311 HydrophobicContact CE2-CB 3.68Å; F236-A311 HydrophobicContact CZ-CB 3.79Å; R307-A311 WeakPolarHBondContact O-CB 3.39Å; R307-A311 PolarHBondContact O-N 3.01Å; L308-A311 WeakPolarHBondContact O-CB 3.46Å; L308-A311 PolarHBondContact O-N 3.32Å; A311-N315 PolarHBondContact O-N 3.5Å; A311-Q316 HydrophobicContact CB-CB 4.09Å; A311-Q316 HydrophobicContact CB-CG 4.42Å; A311-Q316 VanDerWaalsContact O-CB 3.24Å; A311-Q316 WeakPolarHBondContact O-CB 3.35Å; A311-Q316 WeakPolarHBondContact O-CG 3.16Å; A311-Q316 PolarHBondContact O-N 2.88Å; A311-F319 HydrophobicContact CB-CD1 3.81Å; A311-F319 HydrophobicContact CB-CE1 4.08Å; A311-V320 HydrophobicContact CB-CG2 4.28Å
312	I	90.4	Very high	87.2	Confident	22 Å²	22	37.3 Å²	37.3	11%	0.113	18%	0.175	C	C	.	.	H	α-helix	trans	-67.9	-41.7	174.5	-70.2	162.2	0	0	0	111	L308 K309 L310 Y314 N315 V320 F674 K678 L681	L308-I312 HydrophobicContact CG-CD1 4.46Å; L308-I312 WeakPolarHBondContact O-CG1 3.37Å; L308-I312 PolarHBondContact O-N 3.27Å; K309-I312 PolarHBondContact O-N 2.81Å; L310-I312 VanDerWaalsContact C-N 3.28Å; L310-I312 PolarHBondContact O-N 2.94Å; I312-Y314 VanDerWaalsContact C-N 3.34Å; I312-Y314 PolarHBondContact O-N 3.3Å; I312-N315 WeakPolarHBondContact O-CA 3.49Å; I312-N315 PolarHBondContact O-N 2.98Å; I312-V320 HydrophobicContact CG1-CG2 4.28Å; I312-F674 HydrophobicContact CB-CE2 4.38Å; I312-F674 HydrophobicContact CB-CZ 4.38Å; I312-F674 HydrophobicContact CG1-CE2 3.97Å; I312-F674 HydrophobicContact CG1-CZ 4.34Å; I312-F674 HydrophobicContact CG2-CZ 4.06Å; I312-K678 HydrophobicContact CG2-CD 4.16Å; I312-K678 HydrophobicContact CG2-CG 4.12Å; I312-L681 HydrophobicContact CD1-CD2 3.35Å
313	K	88.8	Confident	89	Confident	150 Å²	150	36.8 Å²	36.8	65%	0.652	19%	0.186	S	C	*	.	H	α-helix	trans	-59	-43.5	175.8	-172.8	175.1	-178.3	174.8	0	112	K309 L310 N315	K309-K313 PolarHBondContact O-N 3.42Å; L310-K313 WeakPolarHBondContact O-CB 3.04Å; L310-K313 PolarHBondContact O-N 3.07Å; L310-K313 VanDerWaalsContact O-N 3.14Å; K313-N315 PolarHBondContact O-N 2.85Å
314	Y	92.1	Very high	90.3	Very high	72 Å²	72	36 Å²	36	28%	0.282	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	11.4	174.3	-71.6	-68.8	0	0	0	114.3	F236 A240 L310 I312 Q316	F236-Y314 HydrophobicContact CB-CD2 3.89Å; F236-Y314 HydrophobicContact CB-CE2 4.47Å; F236-Y314 HydrophobicContact CB-CG 4.13Å; A240-Y314 HydrophobicContact CB-CD1 3.56Å; A240-Y314 HydrophobicContact CB-CE1 3.98Å; L310-Y314 HydrophobicContact CD1-CD2 3.97Å; L310-Y314 HydrophobicContact CD1-CE2 3.55Å; L310-Y314 HydrophobicContact CD2-CE2 4.32Å; L310-Y314 HydrophobicContact CG-CD2 3.84Å; L310-Y314 HydrophobicContact CG-CE2 3.75Å; L310-Y314 WeakPolarHBondContact O-CD2 3.37Å; L310-Y314 PolarHBondContact O-N 3.14Å; I312-Y314 VanDerWaalsContact C-N 3.34Å; I312-Y314 PolarHBondContact O-N 3.3Å; Y314-Q316 VanDerWaalsContact C-N 3.29Å; Y314-Q316 PolarHBondContact O-N 3.39Å; Y314-Q316 PolarHBondContact O-NE2 3.1Å
315	N	91.6	Very high	91.5	Very high	48 Å²	48	32.5 Å²	32.5	26%	0.257	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	43.4	177.7	-158.1	-4.8	0	0	0	113.7	A311 I312 K313 K317	A311-N315 PolarHBondContact O-N 3.5Å; I312-N315 WeakPolarHBondContact O-CA 3.49Å; I312-N315 PolarHBondContact O-N 2.98Å; K313-N315 PolarHBondContact O-N 2.85Å; N315-K317 VanDerWaalsContact C-N 3.3Å; N315-K317 PolarHBondContact O-N 3.11Å; N315-K317 VanDerWaalsContact OD1-CE 3.27Å; N315-K317 WeakPolarHBondContact OD1-CE 3.39Å; N315-K317 WeakPolarHBondContact OD1-CG 3.47Å
316	Q	94.8	Very high	92	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.167	C	C	.	.			trans	-82.3	68	-178	-60.9	-65.1	-33.3	0	0	111.6	F236 S239 A311 Y314 E318 F319 V320	F236-Q316 HydrophobicContact CB-CG 4.47Å; F236-Q316 HydrophobicContact CD1-CB 4.43Å; F236-Q316 VanDerWaalsContact CD1-CD 3.45Å; F236-Q316 HydrophobicContact CD1-CG 3.48Å; F236-Q316 VanDerWaalsContact CD1-CG 3.48Å; F236-Q316 HydrophobicContact CD2-CG 4.42Å; F236-Q316 HydrophobicContact CE1-CB 4.13Å; F236-Q316 HydrophobicContact CE1-CG 3.65Å; F236-Q316 HydrophobicContact CG-CG 3.89Å; F236-Q316 HydrophobicContact CZ-CG 4.21Å; S239-Q316 PolarHBondContact OG-NE2 2.92Å; A311-Q316 HydrophobicContact CB-CB 4.09Å; A311-Q316 HydrophobicContact CB-CG 4.42Å; A311-Q316 VanDerWaalsContact O-CB 3.24Å; A311-Q316 WeakPolarHBondContact O-CB 3.35Å; A311-Q316 WeakPolarHBondContact O-CG 3.16Å; A311-Q316 PolarHBondContact O-N 2.88Å; Y314-Q316 VanDerWaalsContact C-N 3.29Å; Y314-Q316 PolarHBondContact O-N 3.39Å; Y314-Q316 PolarHBondContact O-NE2 3.1Å; Q316-E318 VanDerWaalsContact C-N 3.32Å; Q316-E318 PolarHBondContact O-N 3.38Å; Q316-F319 HydrophobicContact CB-CB 4.07Å; Q316-F319 PolarHBondContact O-N 3.17Å; Q316-V320 WeakPolarHBondContact O-CG2 3.4Å; Q316-V320 PolarHBondContact O-N 3.16Å
317	K	93.6	Very high	92.4	Very high	64 Å²	64	37.9 Å²	37.9	28%	0.278	19%	0.187	S	C	.	.	H	α-helix	trans	-56.7	-42.7	-174.8	-62.3	178.6	176.7	-178.6	0	113.1	N315 A321 E671 F674	N315-K317 VanDerWaalsContact C-N 3.3Å; N315-K317 PolarHBondContact O-N 3.11Å; N315-K317 VanDerWaalsContact OD1-CE 3.27Å; N315-K317 WeakPolarHBondContact OD1-CE 3.39Å; N315-K317 WeakPolarHBondContact OD1-CG 3.47Å; K317-A321 WeakPolarHBondContact O-CB 3.5Å; K317-A321 PolarHBondContact O-N 3.32Å; K317-E671 HydrophobicContact CD-CG 4.3Å; K317-E671 IonicContact NZ-OE1 3.99Å; K317-E671 PolarHBondContact NZ-OE1 3.42Å; K317-F674 HydrophobicContact CB-CD2 4.37Å; K317-F674 HydrophobicContact CB-CG 4.45Å; K317-F674 HydrophobicContact CG-CB 4.42Å; K317-F674 HydrophobicContact CG-CD1 4.24Å; K317-F674 HydrophobicContact CG-CD2 4.11Å; K317-F674 HydrophobicContact CG-CE2 4.43Å; K317-F674 HydrophobicContact CG-CG 4Å
318	E	93.9	Very high	92.4	Very high	28 Å²	28	38.4 Å²	38.4	13%	0.131	19%	0.189	C	C	.	.	H	α-helix	trans	-69.8	-41.3	-175.4	-64.4	-176.2	153.8	0	0	113	K264 M265 K268 Q316 A321 Q322	K264-E318 WeakPolarHBondContact CB-OE2 3.35Å; M265-E318 VanDerWaalsContact CG-OE2 3.27Å; M265-E318 WeakPolarHBondContact CG-OE2 3.49Å; M265-E318 PolarHBondContact N-OE2 2.99Å; M265-E318 VanDerWaalsContact SD-CD 3.55Å; K268-E318 HydrophobicContact CB-CB 4.38Å; K268-E318 HydrophobicContact CD-CB 4.27Å; Q316-E318 VanDerWaalsContact C-N 3.32Å; Q316-E318 PolarHBondContact O-N 3.38Å; E318-A321 PolarHBondContact O-N 3.47Å; E318-Q322 PolarHBondContact O-N 3.09Å
319	F	95.5	Very high	92.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61	-46	175.4	-179.4	-91.1	0	0	0	111.6	I232 F236 A267 L271 L284 A311 Q316 Q322	I232-F319 HydrophobicContact CG2-CE2 3.99Å; I232-F319 HydrophobicContact CG2-CZ 4.36Å; F236-F319 HydrophobicContact CE1-CB 4.36Å; F236-F319 HydrophobicContact CE1-CD2 4.02Å; F236-F319 HydrophobicContact CE1-CE2 4.44Å; F236-F319 HydrophobicContact CE1-CG 4.09Å; F236-F319 HydrophobicContact CZ-CB 4.5Å; F236-F319 AromaticContact CZ-CD1 3.91Å; F236-F319 HydrophobicContact CZ-CD1 3.91Å; F236-F319 AromaticContact CZ-CD2 3.84Å; F236-F319 HydrophobicContact CZ-CD2 3.84Å; F236-F319 HydrophobicContact CZ-CE1 4Å; F236-F319 AromaticContact CZ-CE2 3.91Å; F236-F319 HydrophobicContact CZ-CE2 3.91Å; F236-F319 AromaticContact CZ-CG 3.83Å; F236-F319 HydrophobicContact CZ-CG 3.83Å; F236-F319 HydrophobicContact CZ-CZ 4Å; A267-F319 HydrophobicContact CB-CD2 4.16Å; L271-F319 HydrophobicContact CB-CD2 4.24Å; L271-F319 HydrophobicContact CB-CE2 3.82Å; L271-F319 HydrophobicContact CD1-CE2 3.95Å; L271-F319 HydrophobicContact CD1-CZ 3.91Å; L271-F319 HydrophobicContact CD2-CD1 4.44Å; L271-F319 HydrophobicContact CD2-CD2 4.01Å; L271-F319 HydrophobicContact CD2-CE1 4.08Å; L271-F319 HydrophobicContact CD2-CE2 3.63Å; L271-F319 HydrophobicContact CD2-CG 4.41Å; L271-F319 HydrophobicContact CD2-CZ 3.66Å; L271-F319 HydrophobicContact CG-CE2 4Å; L271-F319 HydrophobicContact CG-CZ 4.25Å; L284-F319 HydrophobicContact CD2-CE1 3.98Å; L284-F319 HydrophobicContact CD2-CZ 4.13Å; A311-F319 HydrophobicContact CB-CD1 3.81Å; A311-F319 HydrophobicContact CB-CE1 4.08Å; Q316-F319 HydrophobicContact CB-CB 4.07Å; Q316-F319 PolarHBondContact O-N 3.17Å; F319-Q322 VanDerWaalsContact O-CB 3.28Å; F319-Q322 WeakPolarHBondContact O-CB 3.35Å
320	V	95.3	Very high	92.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-71.7	-38.4	-179.6	178.9	0	0	0	0	111.5	L308 A311 I312 Q316 Q322 Q326 F674 A677	L308-V320 HydrophobicContact CD1-CG1 4.38Å; L308-V320 HydrophobicContact CD1-CG2 3.9Å; A311-V320 HydrophobicContact CB-CG2 4.28Å; I312-V320 HydrophobicContact CG1-CG2 4.28Å; Q316-V320 WeakPolarHBondContact O-CG2 3.4Å; Q316-V320 PolarHBondContact O-N 3.16Å; V320-Q322 PolarHBondContact O-N 2.89Å; V320-Q326 PolarHBondContact O-NE2 3.1Å; V320-F674 HydrophobicContact CB-CD2 3.96Å; V320-F674 HydrophobicContact CG1-CD2 4.23Å; V320-F674 HydrophobicContact CG2-CD2 4.03Å; V320-F674 HydrophobicContact CG2-CE2 4.19Å; V320-A677 HydrophobicContact CG1-CB 3.45Å; V320-A677 VanDerWaalsContact CG1-CB 3.45Å
321	A	94.4	Very high	92.3	Very high	14 Å²	14	38.7 Å²	38.7	12%	0.116	20%	0.197	C	C	.	.	H	α-helix	trans	-71.9	-8.6	-178.4	0	0	0	0	0	114	K317 E318 K670 K673	K317-A321 WeakPolarHBondContact O-CB 3.5Å; K317-A321 PolarHBondContact O-N 3.32Å; E318-A321 PolarHBondContact O-N 3.47Å; A321-K670 HydrophobicContact CB-CB 4.16Å; A321-K673 HydrophobicContact CB-CB 4.14Å; A321-K673 HydrophobicContact CB-CD 4.35Å
322	Q	95.1	Very high	92.1	Very high	12 Å²	12	40 Å²	40	6%	0.056	21%	0.205	C	C	.	.			trans	-58.1	140.3	180	-175.2	156.2	17.6	0	0	113.7	K268 E318 F319 V320 N324 C325 Q326	K268-Q322 HydrophobicContact CG-CB 4.48Å; K268-Q322 PolarHBondContact O-NE2 2.83Å; K268-Q322 PolarHBondContact O-OE1 3.17Å; E318-Q322 PolarHBondContact O-N 3.09Å; F319-Q322 VanDerWaalsContact O-CB 3.28Å; F319-Q322 WeakPolarHBondContact O-CB 3.35Å; V320-Q322 PolarHBondContact O-N 2.89Å; Q322-N324 PolarHBondContact O-N 3.16Å; Q322-C325 HydrophobicContact CB-CB 4.26Å; Q322-C325 PolarHBondContact O-N 2.65Å; Q322-Q326 WeakPolarHBondContact O-CB 3.28Å; Q322-Q326 VanDerWaalsContact O-CG 3.3Å; Q322-Q326 WeakPolarHBondContact O-CG 3.37Å; Q322-Q326 PolarHBondContact O-N 3.33Å
323	S	93.1	Very high	92	Very high	86 Å²	86	39.2 Å²	39.2	60%	0.601	20%	0.2	S	C	*	.	H	α-helix	trans	-53.9	-49.9	-176.7	48.8	0	0	0	0	113.4	C325 Q326 Q327	S323-C325 PolarHBondContact O-N 3.31Å; S323-Q326 PolarHBondContact O-N 3.24Å; S323-Q327 WeakPolarHBondContact O-CB 3.39Å; S323-Q327 PolarHBondContact O-N 2.74Å
324	N	93.1	Very high	91.9	Very high	47 Å²	47	33.6 Å²	33.6	25%	0.251	18%	0.176	S	C	.	.	H	α-helix	trans	-61.5	-45	-179.2	-64.3	-8	0	0	0	111.5	A272 A274 L280 Q322 Q327 F328	A272-N324 PolarHBondContact O-ND2 2.88Å; A274-N324 PolarHBondContact O-ND2 3.39Å; L280-N324 HydrophobicContact CD2-CB 4.38Å; L280-N324 WeakPolarHBondContact CD2-O 3.43Å; Q322-N324 PolarHBondContact O-N 3.16Å; N324-Q327 PolarHBondContact O-N 3.36Å; N324-F328 WeakPolarHBondContact O-CB 3.3Å; N324-F328 PolarHBondContact O-N 3.1Å
325	C	92.6	Very high	91.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62	-46.6	176.6	-172.9	0	0	0	0	111.5	L271 Q322 S323 Q327 F328 L329	L271-C325 HydrophobicContact CD2-CB 3.97Å; Q322-C325 HydrophobicContact CB-CB 4.26Å; Q322-C325 PolarHBondContact O-N 2.65Å; S323-C325 PolarHBondContact O-N 3.31Å; C325-Q327 PolarHBondContact O-N 3.01Å; C325-F328 PolarHBondContact O-N 2.99Å; C325-L329 WeakPolarHBondContact O-CB 3.4Å; C325-L329 WeakPolarHBondContact O-CG 3.42Å; C325-L329 PolarHBondContact O-N 3.21Å
326	Q	93	Very high	90.9	Very high	10 Å²	10	36 Å²	36	5%	0.047	20%	0.198	C	C	.	.	H	α-helix	trans	-65.7	-37.7	178.7	-70	-68.6	-36.8	0	0	112.5	V320 Q322 S323 L329 N330 K673	V320-Q326 PolarHBondContact O-NE2 3.1Å; Q322-Q326 WeakPolarHBondContact O-CB 3.28Å; Q322-Q326 VanDerWaalsContact O-CG 3.3Å; Q322-Q326 WeakPolarHBondContact O-CG 3.37Å; Q322-Q326 PolarHBondContact O-N 3.33Å; S323-Q326 PolarHBondContact O-N 3.24Å; Q326-L329 PolarHBondContact O-N 3.47Å; Q326-N330 WeakPolarHBondContact O-CB 3.32Å; Q326-N330 PolarHBondContact O-N 3.26Å; Q326-N330 PolarHBondContact O-ND2 3Å; Q326-K673 HydrophobicContact CG-CD 4.44Å; Q326-K673 PolarHBondContact NE2-O 2.86Å
327	Q	91	Very high	90.1	Very high	131 Å²	131	38.7 Å²	38.7	61%	0.612	21%	0.211	S	C	*	.	H	α-helix	trans	-64.4	-42.7	175.2	-178.2	174.1	-8.7	0	0	111.1	S323 N324 C325 N330 T331	S323-Q327 WeakPolarHBondContact O-CB 3.39Å; S323-Q327 PolarHBondContact O-N 2.74Å; N324-Q327 PolarHBondContact O-N 3.36Å; C325-Q327 PolarHBondContact O-N 3.01Å; Q327-N330 WeakPolarHBondContact O-CB 3.47Å; Q327-N330 PolarHBondContact O-N 3.47Å; Q327-T331 PolarHBondContact O-N 3.35Å; Q327-T331 VanDerWaalsContact O-N 3.08Å
328	F	90.5	Very high	89.4	Confident	12 Å²	12	38.3 Å²	38.3	5%	0.053	22%	0.221	C	C	.	.	H	α-helix	trans	-63.9	-46.1	175.1	178	-98.9	0	0	0	112.1	L280 E281 L284 M303 L305 N324 C325 N330 T331 V332	L280-F328 HydrophobicContact CD2-CB 3.46Å; L280-F328 VanDerWaalsContact CD2-CB 3.46Å; L280-F328 HydrophobicContact CD2-CD2 4.25Å; L280-F328 HydrophobicContact CD2-CG 3.87Å; L280-F328 HydrophobicContact CG-CB 4.36Å; L280-F328 HydrophobicContact CG-CG 4.28Å; E281-F328 HydrophobicContact CB-CE2 3.96Å; E281-F328 HydrophobicContact CB-CZ 3.96Å; E281-F328 HydrophobicContact CG-CZ 4.21Å; L284-F328 HydrophobicContact CD1-CD1 3.47Å; L284-F328 VanDerWaalsContact CD1-CD1 3.47Å; L284-F328 HydrophobicContact CD1-CE1 3.58Å; L284-F328 HydrophobicContact CD1-CG 4.32Å; M303-F328 HydrophobicContact CE-CE1 3.87Å; M303-F328 HydrophobicContact CE-CE2 3.82Å; M303-F328 HydrophobicContact CE-CZ 3.15Å; L305-F328 HydrophobicContact CD2-CE1 3.69Å; L305-F328 HydrophobicContact CD2-CZ 4.41Å; N324-F328 WeakPolarHBondContact O-CB 3.3Å; N324-F328 PolarHBondContact O-N 3.1Å; C325-F328 PolarHBondContact O-N 2.99Å; F328-N330 VanDerWaalsContact C-N 3.27Å; F328-N330 PolarHBondContact O-N 2.88Å; F328-T331 WeakPolarHBondContact CA-OG1 3.5Å; F328-T331 WeakPolarHBondContact O-CA 3.41Å; F328-T331 PolarHBondContact O-N 3.27Å; F328-T331 PolarHBondContact O-OG1 3.01Å; F328-V332 HydrophobicContact CD1-CG2 4.36Å; F328-V332 HydrophobicContact CE1-CG2 4.09Å; F328-V332 HydrophobicContact CZ-CG2 4.25Å; F328-V332 PolarHBondContact O-N 3.03Å
329	L	90.1	Very high	88.7	Confident	1 Å²	1	41 Å²	41	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-57.6	-39.7	174.3	-77.4	172.8	0	0	0	112.6	L305 L308 C325 Q326 T331 V332 W333 A677 W680 F684	L305-L329 HydrophobicContact CD1-CD2 4.35Å; L308-L329 HydrophobicContact CD2-CD1 4.13Å; L308-L329 HydrophobicContact CD2-CD2 3.62Å; L308-L329 HydrophobicContact CD2-CG 4.28Å; C325-L329 WeakPolarHBondContact O-CB 3.4Å; C325-L329 WeakPolarHBondContact O-CG 3.42Å; C325-L329 PolarHBondContact O-N 3.21Å; Q326-L329 PolarHBondContact O-N 3.47Å; L329-T331 VanDerWaalsContact C-N 3.34Å; L329-T331 PolarHBondContact O-N 2.99Å; L329-V332 PolarHBondContact O-N 3.12Å; L329-W333 VanDerWaalsContact O-CB 3.23Å; L329-W333 WeakPolarHBondContact O-CB 3.19Å; L329-W333 PolarHBondContact O-N 3.36Å; L329-A677 HydrophobicContact CD1-CB 3.93Å; L329-W680 HydrophobicContact CB-CE3 4.14Å; L329-W680 HydrophobicContact CB-CZ3 4.06Å; L329-F684 HydrophobicContact CD2-CE2 3.73Å; L329-F684 HydrophobicContact CD2-CZ 4.27Å
330	N	89.1	Confident	88.1	Confident	40 Å²	40	43 Å²	43	21%	0.214	25%	0.25	C	S	.	.	H	α-helix	trans	-61.3	-41.2	173.2	-83.3	-66.7	0	0	0	112.2	Q326 Q327 F328 W333 F334 W680	Q326-N330 WeakPolarHBondContact O-CB 3.32Å; Q326-N330 PolarHBondContact O-N 3.26Å; Q326-N330 PolarHBondContact O-ND2 3Å; Q327-N330 WeakPolarHBondContact O-CB 3.47Å; Q327-N330 PolarHBondContact O-N 3.47Å; F328-N330 VanDerWaalsContact C-N 3.27Å; F328-N330 PolarHBondContact O-N 2.88Å; N330-W333 PolarHBondContact O-N 3.44Å; N330-F334 VanDerWaalsContact O-CD2 3.25Å; N330-F334 WeakPolarHBondContact O-CD2 3.3Å; N330-F334 PolarHBondContact O-N 3.08Å; N330-F334 VanDerWaalsContact O-N 3.15Å; N330-W680 VanDerWaalsContact OD1-CH2 3.27Å; N330-W680 WeakPolarHBondContact OD1-CH2 3.4Å
331	T	88.3	Confident	87.4	Confident	76 Å²	76	50 Å²	50	47%	0.466	28%	0.276	S	S	.	.	H	α-helix	trans	-64.4	-40.5	177.3	54.9	0	0	0	0	112.3	Q327 F328 L329 G335	Q327-T331 PolarHBondContact O-N 3.35Å; Q327-T331 VanDerWaalsContact O-N 3.08Å; F328-T331 WeakPolarHBondContact CA-OG1 3.5Å; F328-T331 WeakPolarHBondContact O-CA 3.41Å; F328-T331 PolarHBondContact O-N 3.27Å; F328-T331 PolarHBondContact O-OG1 3.01Å; L329-T331 VanDerWaalsContact C-N 3.34Å; L329-T331 PolarHBondContact O-N 2.99Å; T331-G335 PolarHBondContact O-N 3.45Å
332	V	87.1	Confident	86.9	Confident	28 Å²	28	59.6 Å²	59.6	17%	0.17	31%	0.31	C	S	.	.	H	α-helix	trans	-68.8	-39	175.7	179.5	0	0	0	0	111.4	M303 F328 L329 F684	M303-V332 HydrophobicContact CE-CG2 3.49Å; M303-V332 VanDerWaalsContact CE-CG2 3.49Å; M303-V332 HydrophobicContact SD-CG2 4.07Å; F328-V332 HydrophobicContact CD1-CG2 4.36Å; F328-V332 HydrophobicContact CE1-CG2 4.09Å; F328-V332 HydrophobicContact CZ-CG2 4.25Å; F328-V332 PolarHBondContact O-N 3.03Å; L329-V332 PolarHBondContact O-N 3.12Å; V332-F684 HydrophobicContact CB-CZ 4.27Å; V332-F684 HydrophobicContact CG1-CD1 4.43Å; V332-F684 HydrophobicContact CG1-CE1 4Å; V332-F684 HydrophobicContact CG1-CE2 4.18Å; V332-F684 HydrophobicContact CG1-CZ 3.87Å
333	W	88.6	Confident	86.6	Confident	5 Å²	5	62.7 Å²	62.7	2%	0.019	32%	0.323	C	S	.	.	H	α-helix	trans	-62.3	-46.1	-179.3	-179.7	-102.6	0	0	0	113.1	L329 N330 P381 F382 F385 W680 Y683 F684	L329-W333 VanDerWaalsContact O-CB 3.23Å; L329-W333 WeakPolarHBondContact O-CB 3.19Å; L329-W333 PolarHBondContact O-N 3.36Å; N330-W333 PolarHBondContact O-N 3.44Å; W333-P381 HydrophobicContact CE3-CB 3.95Å; W333-P381 HydrophobicContact CE3-CG 4.16Å; W333-P381 HydrophobicContact CZ3-CB 3.95Å; W333-P381 WeakPolarHBondContact O-CG 3.24Å; W333-F382 HydrophobicContact CZ2-CB 4.42Å; W333-F382 HydrophobicContact CZ2-CD2 4.26Å; W333-F382 AromaticContact NE1-CD2 3.41Å; W333-F382 AromaticContact NE1-CG 3.98Å; W333-F382 WeakPolarHBondContact O-CB 3.37Å; W333-F382 PolarHBondContact O-N 2.87Å; W333-F385 HydrophobicContact CH2-CB 3.64Å; W333-F385 HydrophobicContact CH2-CG 4.06Å; W333-F385 HydrophobicContact CZ2-CB 3.87Å; W333-F385 HydrophobicContact CZ2-CD1 4.3Å; W333-F385 HydrophobicContact CZ2-CG 4.11Å; W333-W680 HydrophobicContact CB-CD2 4.45Å; W333-W680 HydrophobicContact CB-CE3 4.08Å; W333-W680 HydrophobicContact CB-CZ3 4.15Å; W333-W680 AromaticContact CD2-CD2 3.82Å; W333-W680 HydrophobicContact CD2-CD2 3.82Å; W333-W680 AromaticContact CD2-CE2 3.9Å; W333-W680 HydrophobicContact CD2-CE3 4.34Å; W333-W680 AromaticContact CD2-CG 3.93Å; W333-W680 HydrophobicContact CD2-CG 3.93Å; W333-W680 HydrophobicContact CD2-CZ2 4.49Å; W333-W680 AromaticContact CD2-NE1 4Å; W333-W680 AromaticContact CE2-NE1 3.85Å; W333-W680 HydrophobicContact CE3-CB 3.63Å; W333-W680 AromaticContact CE3-CD1 3.66Å; W333-W680 AromaticContact CE3-CD2 3.75Å; W333-W680 HydrophobicContact CE3-CD2 3.75Å; W333-W680 HydrophobicContact CE3-CE3 4.37Å; W333-W680 AromaticContact CE3-CG 3.4Å; W333-W680 HydrophobicContact CE3-CG 3.4Å; W333-W680 HydrophobicContact CG-CD2 4.13Å; W333-W680 HydrophobicContact CG-CE3 4.23Å; W333-W680 HydrophobicContact CG-CH2 4.46Å; W333-W680 HydrophobicContact CG-CZ2 4.33Å; W333-W680 HydrophobicContact CG-CZ3 4.4Å; W333-W680 AromaticContact CH2-CD1 3.56Å; W333-W680 HydrophobicContact CH2-CG 4.13Å; W333-W680 AromaticContact CH2-NE1 3.99Å; W333-W680 AromaticContact CZ2-CD1 3.92Å; W333-W680 AromaticContact CZ2-NE1 3.85Å; W333-W680 HydrophobicContact CZ3-CB 3.67Å; W333-W680 AromaticContact CZ3-CD1 3.45Å; W333-W680 VanDerWaalsContact CZ3-CD1 3.45Å; W333-W680 HydrophobicContact CZ3-CD2 4.32Å; W333-W680 AromaticContact CZ3-CG 3.54Å; W333-W680 HydrophobicContact CZ3-CG 3.54Å; W333-Y683 HydrophobicContact CH2-CD2 4.25Å; W333-Y683 HydrophobicContact CZ3-CD2 4.39Å; W333-F684 HydrophobicContact CB-CE1 4.5Å; W333-F684 AromaticContact CE3-CE1 3.67Å; W333-F684 HydrophobicContact CE3-CE1 3.67Å; W333-F684 HydrophobicContact CE3-CZ 4.2Å; W333-F684 HydrophobicContact CZ3-CE1 4.35Å
334	F	86.8	Confident	86.5	Confident	31 Å²	31	66.3 Å²	66.3	14%	0.136	33%	0.33	C	S	.	.	H	α-helix	trans	-83.9	-28.2	179.9	-67.8	-67.9	0	0	0	112.9	N330 E336 M337 Y340 F382	N330-F334 VanDerWaalsContact O-CD2 3.25Å; N330-F334 WeakPolarHBondContact O-CD2 3.3Å; N330-F334 PolarHBondContact O-N 3.08Å; N330-F334 VanDerWaalsContact O-N 3.15Å; F334-E336 PolarHBondContact O-N 3.36Å; F334-M337 WeakPolarHBondContact O-CA 3.45Å; F334-M337 WeakPolarHBondContact O-CB 3.49Å; F334-M337 PolarHBondContact O-N 2.95Å; F334-Y340 HydrophobicContact CD1-CD1 4.17Å; F334-Y340 AromaticContact CE1-CD1 3.76Å; F334-Y340 HydrophobicContact CE1-CD1 3.76Å; F334-Y340 HydrophobicContact CE1-CE1 4.11Å; F334-F382 HydrophobicContact CD1-CB 4.5Å; F334-F382 HydrophobicContact CD1-CD1 4.41Å; F334-F382 HydrophobicContact CD1-CD2 4.49Å; F334-F382 HydrophobicContact CD1-CG 4.22Å; F334-F382 HydrophobicContact CE1-CD2 4.06Å; F334-F382 HydrophobicContact CE1-CE2 4.18Å; F334-F382 HydrophobicContact CE1-CG 4.24Å; F334-F382 HydrophobicContact CE1-CZ 4.47Å
335	G	83.9	Confident	86.2	Confident	37 Å²	37	69.3 Å²	69.3	38%	0.381	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	48.2	-125.9	178	0	0	0	0	0	112.6	T331 M337 A338	T331-G335 PolarHBondContact O-N 3.45Å; G335-M337 PolarHBondContact O-N 2.99Å; G335-A338 PolarHBondContact O-N 3.16Å
336	E	79.1	Confident	86.1	Confident	133 Å²	133	74.6 Å²	74.6	62%	0.621	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-63.6	-19.2	177.4	-62.1	-174.7	169.6	0	0	113.8	F334 A338	F334-E336 PolarHBondContact O-N 3.36Å; E336-A338 PolarHBondContact O-N 3.45Å
337	M	78.8	Confident	86	Confident	57 Å²	57	78.6 Å²	78.6	28%	0.281	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-87.3	22.8	177.5	-64.8	-63	176.6	0	0	113.3	F334 G335 S339 Y340 I377	F334-M337 WeakPolarHBondContact O-CA 3.45Å; F334-M337 WeakPolarHBondContact O-CB 3.49Å; F334-M337 PolarHBondContact O-N 2.95Å; G335-M337 PolarHBondContact O-N 2.99Å; M337-S339 PolarHBondContact O-N 3.33Å; M337-S339 VanDerWaalsContact O-N 3.07Å; M337-Y340 WeakPolarHBondContact O-CB 3.45Å; M337-Y340 PolarHBondContact O-N 2.74Å; M337-I377 HydrophobicContact CE-CB 4.06Å; M337-I377 HydrophobicContact CE-CD1 3.95Å; M337-I377 HydrophobicContact CE-CG1 3.7Å; M337-I377 HydrophobicContact CE-CG2 3.3Å
338	A	77.6	Confident	85.9	Confident	57 Å²	57	74.9 Å²	74.9	47%	0.471	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-53.6	-31.8	178.6	0	0	0	0	0	113.7	G335 E336 Y340 R341	G335-A338 PolarHBondContact O-N 3.16Å; E336-A338 PolarHBondContact O-N 3.45Å; A338-Y340 PolarHBondContact O-N 3.1Å; A338-R341 PolarHBondContact O-N 3.31Å
339	S	80.3	Confident	85.8	Confident	84 Å²	84	80.3 Å²	80.3	59%	0.587	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-61.7	-25.2	176	-62.5	0	0	0	0	113.5	M337 R341 R342	M337-S339 PolarHBondContact O-N 3.33Å; M337-S339 VanDerWaalsContact O-N 3.07Å; S339-R341 PolarHBondContact O-N 3.41Å; S339-R342 PolarHBondContact O-N 2.82Å
340	Y	82.6	Confident	85.8	Confident	42 Å²	42	82.1 Å²	82.1	17%	0.165	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-57.2	-37.3	176.4	174.2	-101.4	0	0	0	112.2	F334 M337 A338 R342 K343 K348 T351 V352 F382	F334-Y340 HydrophobicContact CD1-CD1 4.17Å; F334-Y340 AromaticContact CE1-CD1 3.76Å; F334-Y340 HydrophobicContact CE1-CD1 3.76Å; F334-Y340 HydrophobicContact CE1-CE1 4.11Å; M337-Y340 WeakPolarHBondContact O-CB 3.45Å; M337-Y340 PolarHBondContact O-N 2.74Å; A338-Y340 PolarHBondContact O-N 3.1Å; Y340-R342 VanDerWaalsContact C-N 3.26Å; Y340-R342 PolarHBondContact O-N 3.04Å; Y340-K343 WeakPolarHBondContact O-CB 3.34Å; Y340-K343 PolarHBondContact O-N 2.91Å; Y340-K348 HydrophobicContact CD2-CG 4.31Å; Y340-K348 HydrophobicContact CE1-CG 4.42Å; Y340-K348 HydrophobicContact CE2-CB 3.84Å; Y340-K348 HydrophobicContact CE2-CG 3.8Å; Y340-K348 WeakPolarHBondContact O-CE 3.32Å; Y340-T351 VanDerWaalsContact CE2-OG1 3.27Å; Y340-T351 WeakPolarHBondContact CE2-OG1 3.3Å; Y340-V352 HydrophobicContact CE2-CG2 4.14Å; Y340-V352 VanDerWaalsContact OH-CG2 3.23Å; Y340-V352 WeakPolarHBondContact OH-CG2 3.34Å; Y340-F382 HydrophobicContact CD1-CE1 4.08Å; Y340-F382 AromaticContact CD1-CZ 3.98Å; Y340-F382 HydrophobicContact CD1-CZ 3.98Å; Y340-F382 HydrophobicContact CD2-CE1 4.45Å; Y340-F382 HydrophobicContact CE1-CE1 4.06Å; Y340-F382 HydrophobicContact CE1-CE2 4.23Å; Y340-F382 AromaticContact CE1-CZ 3.5Å; Y340-F382 HydrophobicContact CE1-CZ 3.5Å; Y340-F382 HydrophobicContact CE2-CE1 4.42Å; Y340-F382 HydrophobicContact CE2-CZ 4.23Å; Y340-F382 HydrophobicContact CG-CE1 4.28Å; Y340-F382 AromaticContact CZ-CZ 3.66Å
341	R	80.8	Confident	85.8	Confident	146 Å²	146	81.6 Å²	81.6	55%	0.551	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-62.4	-32.7	-177.5	-168.2	175.1	71.8	-170.3	2.9	112.9	A338 S339 K348	A338-R341 PolarHBondContact O-N 3.31Å; S339-R341 PolarHBondContact O-N 3.41Å; R341-K348 VanDerWaalsContact O-CE 3.29Å; R341-K348 WeakPolarHBondContact O-CE 3.34Å; R341-K348 PolarHBondContact O-NZ 3.4Å
342	R	84.6	Confident	85.9	Confident	216 Å²	216	79.8 Å²	79.8	82%	0.815	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-81.3	-13.8	-177.2	-60.4	-176.7	-171.2	172	2.2	113.5	S339 Y340	S339-R342 PolarHBondContact O-N 2.82Å; Y340-R342 VanDerWaalsContact C-N 3.26Å; Y340-R342 PolarHBondContact O-N 3.04Å
343	K	87.4	Confident	86	Confident	78 Å²	78	84 Å²	84	34%	0.339	44%	0.443	S	S	.	.	S	Bend	trans	-69.8	152.2	-178.8	-67.1	-178.6	174.2	-173.8	0	112.1	Y340 L347 K348	Y340-K343 WeakPolarHBondContact O-CB 3.34Å; Y340-K343 PolarHBondContact O-N 2.91Å; K343-L347 HydrophobicContact CB-CB 4.44Å; K343-L347 HydrophobicContact CB-CD2 4.11Å; K343-L347 HydrophobicContact CD-CD2 3.7Å; K343-L347 HydrophobicContact CD-CG 4.05Å; K343-L347 HydrophobicContact CG-CD2 3.88Å; K343-K348 HydrophobicContact CB-CG 3.92Å; K343-K348 WeakPolarHBondContact O-CD 3.42Å; K343-K348 WeakPolarHBondContact O-CE 3.35Å; K343-K348 PolarHBondContact O-NZ 3.43Å
344	H	90.8	Very high	86.1	Confident	162 Å²	162	86.4 Å²	86.4	75%	0.75	46%	0.46	S	S	*	.			trans	-63.4	153.2	170.1	-67.4	-77.2	0	0	0	111.5	C346 L347 K348	H344-C346 VanDerWaalsContact C-N 3.31Å; H344-C346 PolarHBondContact O-N 3.35Å; H344-L347 PolarHBondContact O-N 3.46Å; H344-L347 VanDerWaalsContact O-N 3.12Å; H344-K348 WeakPolarHBondContact O-CG 3.42Å; H344-K348 PolarHBondContact O-N 3.4Å
345	T	87.6	Confident	86.3	Confident	109 Å²	109	86.9 Å²	86.9	67%	0.669	46%	0.464	S	S	*	.	H	α-helix	trans	-56.8	-39.5	-175.8	-50.8	0	0	0	0	113.4	K348 M349	T345-K348 WeakPolarHBondContact O-CB 3.44Å; T345-K348 PolarHBondContact O-N 3.05Å; T345-M349 PolarHBondContact O-N 2.88Å
346	C	90.9	Very high	86.7	Confident	111 Å²	111	86.3 Å²	86.3	75%	0.75	46%	0.456	S	S	*	.	H	α-helix	trans	-62.9	-47.8	176.2	-177.7	0	0	0	0	111.7	H344 K348 M349 G350	H344-C346 VanDerWaalsContact C-N 3.31Å; H344-C346 PolarHBondContact O-N 3.35Å; C346-K348 VanDerWaalsContact C-N 3.31Å; C346-K348 PolarHBondContact O-N 2.94Å; C346-M349 PolarHBondContact O-N 3.44Å; C346-G350 PolarHBondContact O-N 3.04Å
347	L	89.6	Confident	87.2	Confident	94 Å²	94	86.5 Å²	86.5	49%	0.492	46%	0.46	S	S	.	.	H	α-helix	trans	-65.7	-35	177.6	-169.7	67.6	0	0	0	111.8	K343 H344 G350 T351	K343-L347 HydrophobicContact CB-CB 4.44Å; K343-L347 HydrophobicContact CB-CD2 4.11Å; K343-L347 HydrophobicContact CD-CD2 3.7Å; K343-L347 HydrophobicContact CD-CG 4.05Å; K343-L347 HydrophobicContact CG-CD2 3.88Å; H344-L347 PolarHBondContact O-N 3.46Å; H344-L347 VanDerWaalsContact O-N 3.12Å; L347-G350 PolarHBondContact O-N 3.25Å; L347-T351 WeakPolarHBondContact O-CG2 3.45Å; L347-T351 PolarHBondContact O-N 3.31Å; L347-T351 PolarHBondContact O-OG1 3.02Å; L347-T351 VanDerWaalsContact O-OG1 3.1Å
348	K	89.3	Confident	87.8	Confident	53 Å²	53	87.5 Å²	87.5	23%	0.23	47%	0.467	C	S	.	.	H	α-helix	trans	-59.8	-52.6	172.1	-76.4	172	169.1	151.1	0	110.8	Y340 R341 K343 H344 T345 C346 G350 T351 V352	Y340-K348 HydrophobicContact CD2-CG 4.31Å; Y340-K348 HydrophobicContact CE1-CG 4.42Å; Y340-K348 HydrophobicContact CE2-CB 3.84Å; Y340-K348 HydrophobicContact CE2-CG 3.8Å; Y340-K348 WeakPolarHBondContact O-CE 3.32Å; R341-K348 VanDerWaalsContact O-CE 3.29Å; R341-K348 WeakPolarHBondContact O-CE 3.34Å; R341-K348 PolarHBondContact O-NZ 3.4Å; K343-K348 HydrophobicContact CB-CG 3.92Å; K343-K348 WeakPolarHBondContact O-CD 3.42Å; K343-K348 WeakPolarHBondContact O-CE 3.35Å; K343-K348 PolarHBondContact O-NZ 3.43Å; H344-K348 WeakPolarHBondContact O-CG 3.42Å; H344-K348 PolarHBondContact O-N 3.4Å; T345-K348 WeakPolarHBondContact O-CB 3.44Å; T345-K348 PolarHBondContact O-N 3.05Å; C346-K348 VanDerWaalsContact C-N 3.31Å; C346-K348 PolarHBondContact O-N 2.94Å; K348-G350 VanDerWaalsContact C-N 3.32Å; K348-G350 PolarHBondContact O-N 3.06Å; K348-T351 PolarHBondContact O-N 3.44Å; K348-T351 VanDerWaalsContact O-N 3.17Å; K348-T351 PolarHBondContact O-OG1 3.42Å; K348-V352 WeakPolarHBondContact O-CG2 3.45Å; K348-V352 PolarHBondContact O-N 2.95Å
349	M	88.8	Confident	88.5	Confident	126 Å²	126	85.8 Å²	85.8	62%	0.621	45%	0.448	S	S	*	.	H	α-helix	trans	-58.5	-45.5	177.9	-167.3	64.2	71.9	0	0	111.2	T345 C346 T351 V352 L353	T345-M349 PolarHBondContact O-N 2.88Å; C346-M349 PolarHBondContact O-N 3.44Å; M349-T351 VanDerWaalsContact C-N 3.35Å; M349-T351 PolarHBondContact O-N 3.24Å; M349-V352 PolarHBondContact O-N 3.49Å; M349-L353 WeakPolarHBondContact O-CB 3.34Å; M349-L353 PolarHBondContact O-N 3.36Å
350	G	90.9	Very high	88.9	Confident	39 Å²	39	84.1 Å²	84.1	40%	0.402	44%	0.435	S	S	.	.	H	α-helix	trans	-58.6	-42.3	175.9	0	0	0	0	0	113.1	C346 L347 K348 L353 S354	C346-G350 PolarHBondContact O-N 3.04Å; L347-G350 PolarHBondContact O-N 3.25Å; K348-G350 VanDerWaalsContact C-N 3.32Å; K348-G350 PolarHBondContact O-N 3.06Å; G350-L353 PolarHBondContact O-N 2.96Å; G350-S354 WeakPolarHBondContact O-CB 3.28Å; G350-S354 PolarHBondContact O-N 3.47Å; G350-S354 PolarHBondContact O-OG 3.26Å
351	T	88	Confident	89.2	Confident	29 Å²	29	87.1 Å²	87.1	18%	0.178	45%	0.454	C	S	.	.	H	α-helix	trans	-69.9	-34.5	176.6	51.9	0	0	0	0	113.8	Y340 L347 K348 M349 S354 L355	Y340-T351 VanDerWaalsContact CE2-OG1 3.27Å; Y340-T351 WeakPolarHBondContact CE2-OG1 3.3Å; L347-T351 WeakPolarHBondContact O-CG2 3.45Å; L347-T351 PolarHBondContact O-N 3.31Å; L347-T351 PolarHBondContact O-OG1 3.02Å; L347-T351 VanDerWaalsContact O-OG1 3.1Å; K348-T351 PolarHBondContact O-N 3.44Å; K348-T351 VanDerWaalsContact O-N 3.17Å; K348-T351 PolarHBondContact O-OG1 3.42Å; M349-T351 VanDerWaalsContact C-N 3.35Å; M349-T351 PolarHBondContact O-N 3.24Å; T351-S354 PolarHBondContact O-OG 3.03Å; T351-S354 VanDerWaalsContact O-OG 3.08Å; T351-L355 WeakPolarHBondContact O-CB 3.37Å; T351-L355 VanDerWaalsContact O-CG 3.3Å; T351-L355 WeakPolarHBondContact O-CG 3.32Å; T351-L355 PolarHBondContact O-N 3.06Å; T351-L355 VanDerWaalsContact O-N 3.11Å
352	V	89.8	Confident	89.5	Confident	38 Å²	38	81.6 Å²	81.6	23%	0.23	44%	0.435	C	S	.	.	H	α-helix	trans	-69.5	-43.7	174.7	173	0	0	0	0	110	Y340 K348 M349 L355 A356 F382 I386	Y340-V352 HydrophobicContact CE2-CG2 4.14Å; Y340-V352 VanDerWaalsContact OH-CG2 3.23Å; Y340-V352 WeakPolarHBondContact OH-CG2 3.34Å; K348-V352 WeakPolarHBondContact O-CG2 3.45Å; K348-V352 PolarHBondContact O-N 2.95Å; M349-V352 PolarHBondContact O-N 3.49Å; V352-L355 PolarHBondContact O-N 3.4Å; V352-A356 VanDerWaalsContact O-CB 3.25Å; V352-A356 WeakPolarHBondContact O-CB 3.45Å; V352-A356 PolarHBondContact O-N 3.32Å; V352-F382 HydrophobicContact CG2-CZ 4.3Å; V352-I386 HydrophobicContact CG1-CD1 4.18Å; V352-I386 HydrophobicContact CG1-CG1 4.45Å; V352-I386 HydrophobicContact CG1-CG2 4.43Å; V352-I386 HydrophobicContact CG2-CD1 4.02Å
353	L	90.9	Very high	89.5	Confident	117 Å²	117	71.4 Å²	71.4	61%	0.613	40%	0.397	S	S	*	.	H	α-helix	trans	-63.2	-41.7	178	-176.3	63.1	0	0	0	111.7	M349 G350 A356 L357	M349-L353 WeakPolarHBondContact O-CB 3.34Å; M349-L353 PolarHBondContact O-N 3.36Å; G350-L353 PolarHBondContact O-N 2.96Å; L353-A356 PolarHBondContact O-N 3.26Å; L353-L357 WeakPolarHBondContact O-CB 3.23Å; L353-L357 PolarHBondContact O-N 3.38Å
354	S	90.5	Very high	89.5	Confident	55 Å²	55	71.6 Å²	71.6	39%	0.385	40%	0.4	S	S	.	.	H	α-helix	trans	-67	-42.1	177.3	68.2	0	0	0	0	112.4	G350 T351 A356 L357 L358	G350-S354 WeakPolarHBondContact O-CB 3.28Å; G350-S354 PolarHBondContact O-N 3.47Å; G350-S354 PolarHBondContact O-OG 3.26Å; T351-S354 PolarHBondContact O-OG 3.03Å; T351-S354 VanDerWaalsContact O-OG 3.08Å; S354-A356 VanDerWaalsContact C-N 3.33Å; S354-L357 PolarHBondContact O-N 3.13Å; S354-L358 WeakPolarHBondContact O-CB 3.37Å; S354-L358 WeakPolarHBondContact O-CD1 3.38Å; S354-L358 VanDerWaalsContact O-CG 3.3Å; S354-L358 WeakPolarHBondContact O-CG 3.21Å; S354-L358 PolarHBondContact O-N 3.36Å
355	L	90.9	Very high	89.2	Confident	41 Å²	41	66.8 Å²	66.8	22%	0.215	38%	0.384	C	S	.	.	H	α-helix	trans	-62.9	-40.2	173	-76.5	170	0	0	0	112	T351 V352 W359 L362 I386	T351-L355 WeakPolarHBondContact O-CB 3.37Å; T351-L355 VanDerWaalsContact O-CG 3.3Å; T351-L355 WeakPolarHBondContact O-CG 3.32Å; T351-L355 PolarHBondContact O-N 3.06Å; T351-L355 VanDerWaalsContact O-N 3.11Å; V352-L355 PolarHBondContact O-N 3.4Å; L355-W359 PolarHBondContact O-N 2.83Å; L355-L362 HydrophobicContact CD2-CD1 3.92Å; L355-I386 HydrophobicContact CB-CG2 4.14Å; L355-I386 HydrophobicContact CD1-CD1 4.37Å
356	A	90.6	Very high	89	Confident	26 Å²	26	62.7 Å²	62.7	22%	0.215	36%	0.357	C	S	.	.	H	α-helix	trans	-64.7	-46.8	176.8	0	0	0	0	0	110.7	V352 L353 S354 L358 W359 I386 A390	V352-A356 VanDerWaalsContact O-CB 3.25Å; V352-A356 WeakPolarHBondContact O-CB 3.45Å; V352-A356 PolarHBondContact O-N 3.32Å; L353-A356 PolarHBondContact O-N 3.26Å; S354-A356 VanDerWaalsContact C-N 3.33Å; A356-L358 VanDerWaalsContact C-N 3.32Å; A356-L358 PolarHBondContact O-N 2.85Å; A356-W359 WeakPolarHBondContact O-CB 3.45Å; A356-W359 PolarHBondContact O-N 2.92Å; A356-I386 HydrophobicContact CB-CG2 4.37Å; A356-A390 HydrophobicContact CB-CB 3.86Å
357	L	90.8	Very high	88.5	Confident	136 Å²	136	59.4 Å²	59.4	71%	0.712	33%	0.332	S	S	*	.	H	α-helix	trans	-66.3	-34.7	179.6	-167.3	121.9	0	0	0	112.6	L353 S354 W359	L353-L357 WeakPolarHBondContact O-CB 3.23Å; L353-L357 PolarHBondContact O-N 3.38Å; S354-L357 PolarHBondContact O-N 3.13Å; L357-W359 VanDerWaalsContact C-N 3.29Å; L357-W359 PolarHBondContact O-N 3.15Å
358	L	91.1	Very high	88.1	Confident	79 Å²	79	60.8 Å²	60.8	41%	0.414	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	7	179.4	-66.3	166	0	0	0	113.7	S354 A356 L361 L362	S354-L358 WeakPolarHBondContact O-CB 3.37Å; S354-L358 WeakPolarHBondContact O-CD1 3.38Å; S354-L358 VanDerWaalsContact O-CG 3.3Å; S354-L358 WeakPolarHBondContact O-CG 3.21Å; S354-L358 PolarHBondContact O-N 3.36Å; A356-L358 VanDerWaalsContact C-N 3.32Å; A356-L358 PolarHBondContact O-N 2.85Å; L358-L361 HydrophobicContact CD2-CD1 3.85Å; L358-L361 PolarHBondContact O-N 2.95Å; L358-L362 HydrophobicContact CB-CD1 4.16Å; L358-L362 HydrophobicContact CB-CG 4.32Å; L358-L362 VanDerWaalsContact O-CG 3.28Å; L358-L362 WeakPolarHBondContact O-CG 3.3Å; L358-L362 PolarHBondContact O-N 3.44Å
359	W	91.8	Very high	87.8	Confident	20 Å²	20	62.4 Å²	62.4	8%	0.076	35%	0.353	C	S	.	.	H	α-helix	trans	-53.5	-40.9	-176.8	86.1	-99.8	0	0	0	115.4	L355 A356 L357 L362 S363 I387 A390 T394 W428 P691 L694	L355-W359 PolarHBondContact O-N 2.83Å; A356-W359 WeakPolarHBondContact O-CB 3.45Å; A356-W359 PolarHBondContact O-N 2.92Å; L357-W359 VanDerWaalsContact C-N 3.29Å; L357-W359 PolarHBondContact O-N 3.15Å; W359-L362 PolarHBondContact O-N 3.12Å; W359-S363 WeakPolarHBondContact O-CB 3.43Å; W359-S363 PolarHBondContact O-N 3.19Å; W359-S363 PolarHBondContact O-OG 2.9Å; W359-I387 HydrophobicContact CB-CG1 4.47Å; W359-I387 HydrophobicContact CB-CG2 4.3Å; W359-I387 HydrophobicContact CE3-CG2 4.46Å; W359-A390 HydrophobicContact CB-CB 4Å; W359-A390 HydrophobicContact CG-CB 3.95Å; W359-T394 HydrophobicContact CZ2-CG2 4.45Å; W359-T394 WeakPolarHBondContact CZ2-OG1 3.34Å; W359-T394 VanDerWaalsContact NE1-CG2 3.32Å; W359-W428 HydrophobicContact CH2-CZ2 4.16Å; W359-W428 HydrophobicContact CZ2-CZ2 4.17Å; W359-P691 HydrophobicContact CE3-CG 4.03Å; W359-P691 HydrophobicContact CZ3-CG 3.92Å; W359-L694 HydrophobicContact CZ3-CD1 4.39Å
360	P	89.8	Confident	87.1	Confident	49 Å²	49	58.1 Å²	58.1	32%	0.318	33%	0.334	S	S	.	.	H	α-helix	trans	-71.2	-38	-177.2	28	-32.9	0	0	0	111.3	S363 I364	P360-S363 WeakPolarHBondContact CA-OG 3.34Å; P360-S363 PolarHBondContact O-OG 3.34Å; P360-I364 WeakPolarHBondContact O-CD1 3.47Å; P360-I364 VanDerWaalsContact O-CG1 3.26Å; P360-I364 WeakPolarHBondContact O-CG1 3.46Å; P360-I364 PolarHBondContact O-N 2.67Å; P360-I364 VanDerWaalsContact O-N 3.11Å
361	L	88.7	Confident	86.4	Confident	106 Å²	106	67 Å²	67	56%	0.555	36%	0.356	S	S	*	.	H	α-helix	trans	-65.5	-44.7	176.2	-66.6	172.4	0	0	0	111	L358 S363 I364 C365	L358-L361 HydrophobicContact CD2-CD1 3.85Å; L358-L361 PolarHBondContact O-N 2.95Å; L361-S363 PolarHBondContact O-N 3.43Å; L361-I364 PolarHBondContact O-N 3.36Å; L361-C365 WeakPolarHBondContact O-CB 3.22Å; L361-C365 PolarHBondContact O-N 2.97Å; L361-C365 PolarHBondContact O-SG 2.89Å
362	L	86.7	Confident	86.3	Confident	30 Å²	30	67.3 Å²	67.3	16%	0.157	36%	0.359	C	S	.	.	H	α-helix	trans	-61.7	-44	179.2	-69.9	172.4	0	0	0	111.9	L355 L358 W359 C365 Y366 V374 I378 I387	L355-L362 HydrophobicContact CD2-CD1 3.92Å; L358-L362 HydrophobicContact CB-CD1 4.16Å; L358-L362 HydrophobicContact CB-CG 4.32Å; L358-L362 VanDerWaalsContact O-CG 3.28Å; L358-L362 WeakPolarHBondContact O-CG 3.3Å; L358-L362 PolarHBondContact O-N 3.44Å; W359-L362 PolarHBondContact O-N 3.12Å; L362-C365 WeakPolarHBondContact O-CB 3.47Å; L362-C365 PolarHBondContact O-N 3.18Å; L362-Y366 PolarHBondContact O-N 3.09Å; L362-V374 HydrophobicContact CD2-CG1 3.8Å; L362-I378 HydrophobicContact CB-CD1 3.89Å; L362-I378 HydrophobicContact CD2-CD1 4.41Å; L362-I378 WeakPolarHBondContact O-CD1 3.12Å; L362-I387 HydrophobicContact CB-CD1 4.33Å; L362-I387 HydrophobicContact CD1-CD1 4.48Å
363	S	85.4	Confident	86	Confident	2 Å²	2	75.7 Å²	75.7	1%	0.014	39%	0.387	C	S	.	.	H	α-helix	trans	-67.8	-37.5	179.6	46.4	0	0	0	0	113	W359 P360 L361 Y366 L367 L694	W359-S363 WeakPolarHBondContact O-CB 3.43Å; W359-S363 PolarHBondContact O-N 3.19Å; W359-S363 PolarHBondContact O-OG 2.9Å; P360-S363 WeakPolarHBondContact CA-OG 3.34Å; P360-S363 PolarHBondContact O-OG 3.34Å; L361-S363 PolarHBondContact O-N 3.43Å; S363-Y366 PolarHBondContact O-N 3.26Å; S363-L367 PolarHBondContact O-N 3.03Å; S363-L367 VanDerWaalsContact O-N 3.16Å; S363-L694 WeakPolarHBondContact OG-CD1 3.45Å
364	I	85.7	Confident	85.6	Confident	81 Å²	81	72.9 Å²	72.9	42%	0.415	37%	0.374	S	S	.	.	H	α-helix	trans	-65.4	-44.1	171.9	-66.6	165.9	0	0	0	111.1	P360 L361 Y366 L367 L368 L694	P360-I364 WeakPolarHBondContact O-CD1 3.47Å; P360-I364 VanDerWaalsContact O-CG1 3.26Å; P360-I364 WeakPolarHBondContact O-CG1 3.46Å; P360-I364 PolarHBondContact O-N 2.67Å; P360-I364 VanDerWaalsContact O-N 3.11Å; L361-I364 PolarHBondContact O-N 3.36Å; I364-Y366 VanDerWaalsContact C-N 3.28Å; I364-Y366 PolarHBondContact O-N 3.36Å; I364-L367 WeakPolarHBondContact O-CB 3.5Å; I364-L367 PolarHBondContact O-N 2.76Å; I364-L367 VanDerWaalsContact O-N 3.08Å; I364-L368 HydrophobicContact CG2-CD1 3.94Å; I364-L368 HydrophobicContact CG2-CG 4.41Å; I364-L368 PolarHBondContact O-N 3.23Å; I364-L694 HydrophobicContact CG1-CD1 4.36Å
365	C	84.9	Confident	85	Confident	61 Å²	61	70.3 Å²	70.3	41%	0.412	36%	0.356	S	S	.	.	H	α-helix	trans	-58.3	-39.5	176	-75.5	0	0	0	0	112.4	L361 L362 V369	L361-C365 WeakPolarHBondContact O-CB 3.22Å; L361-C365 PolarHBondContact O-N 2.97Å; L361-C365 PolarHBondContact O-SG 2.89Å; L362-C365 WeakPolarHBondContact O-CB 3.47Å; L362-C365 PolarHBondContact O-N 3.18Å; C365-V369 PolarHBondContact O-N 2.83Å
366	Y	83.3	Confident	84.5	Confident	24 Å²	24	73.2 Å²	73.2	9%	0.094	37%	0.369	C	S	.	.	H	α-helix	trans	-64.9	-38.5	175.1	-176.7	-93.3	0	0	0	112.5	L362 S363 I364 P370 I378 T689 L690	L362-Y366 PolarHBondContact O-N 3.09Å; S363-Y366 PolarHBondContact O-N 3.26Å; I364-Y366 VanDerWaalsContact C-N 3.28Å; I364-Y366 PolarHBondContact O-N 3.36Å; Y366-P370 WeakPolarHBondContact O-CB 3.48Å; Y366-I378 HydrophobicContact CD2-CB 4.09Å; Y366-I378 HydrophobicContact CD2-CG2 3.85Å; Y366-I378 HydrophobicContact CE2-CG2 4.46Å; Y366-I378 HydrophobicContact CG-CG2 4.19Å; Y366-T689 VanDerWaalsContact CE1-OG1 3.32Å; Y366-T689 WeakPolarHBondContact CE1-OG1 3.4Å; Y366-L690 HydrophobicContact CD1-CD2 3.9Å; Y366-L690 HydrophobicContact CD1-CG 4.27Å
367	L	81.3	Confident	84.2	Confident	41 Å²	41	74.5 Å²	74.5	22%	0.215	37%	0.372	C	S	.	.	H	α-helix	trans	-66	-42.6	178.8	-169.9	153.6	0	0	0	111.5	S363 I364 L690 L697	S363-L367 PolarHBondContact O-N 3.03Å; S363-L367 VanDerWaalsContact O-N 3.16Å; I364-L367 WeakPolarHBondContact O-CB 3.5Å; I364-L367 PolarHBondContact O-N 2.76Å; I364-L367 VanDerWaalsContact O-N 3.08Å; L367-L690 HydrophobicContact CD1-CD1 4.49Å; L367-L697 HydrophobicContact CD1-CB 3.92Å; L367-L697 HydrophobicContact CD1-CD1 3.85Å
368	L	82	Confident	83.8	Confident	124 Å²	124	68.3 Å²	68.3	65%	0.649	34%	0.339	S	S	*	.	H	α-helix	trans	-77	-49.4	-178.1	-65.8	173.7	0	0	0	113	I364	I364-L368 HydrophobicContact CG2-CD1 3.94Å; I364-L368 HydrophobicContact CG2-CG 4.41Å; I364-L368 PolarHBondContact O-N 3.23Å
369	V	81.9	Confident	83.3	Confident	86 Å²	86	67.9 Å²	67.9	52%	0.521	34%	0.335	S	S	.	.			trans	-134.1	80.6	-173.9	-169.3	0	0	0	0	111	C365 R371 S372	C365-V369 PolarHBondContact O-N 2.83Å; V369-R371 VanDerWaalsContact C-N 3.26Å; V369-R371 PolarHBondContact O-N 2.76Å; V369-S372 WeakPolarHBondContact O-CB 3.48Å; V369-S372 PolarHBondContact O-N 3.14Å; V369-S372 PolarHBondContact O-OG 3.17Å
370	P	75.1	Confident	83	Confident	36 Å²	36	67.4 Å²	67.4	23%	0.234	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-12.8	-174	28.3	-36.1	0	0	0	114.3	Y366	Y366-P370 WeakPolarHBondContact O-CB 3.48Å
371	R	76.3	Confident	82.9	Confident	227 Å²	227	65.8 Å²	65.8	86%	0.857	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	2	177.6	-75	-173	171.5	162.7	-2.6	113.6	V369	V369-R371 VanDerWaalsContact C-N 3.26Å; V369-R371 PolarHBondContact O-N 2.76Å
372	S	85.2	Confident	82.9	Confident	35 Å²	35	61.7 Å²	61.7	25%	0.245	30%	0.301	C	S	.	.	S	Bend	trans	-70	163.4	176	64.4	0	0	0	0	111.7	V369 V374 G375 Q376	V369-S372 WeakPolarHBondContact O-CB 3.48Å; V369-S372 PolarHBondContact O-N 3.14Å; V369-S372 PolarHBondContact O-OG 3.17Å; S372-V374 PolarHBondContact O-N 3.23Å; S372-G375 WeakPolarHBondContact O-CA 3.45Å; S372-G375 PolarHBondContact O-N 2.81Å; S372-G375 PolarHBondContact OG-N 3.1Å; S372-Q376 PolarHBondContact O-N 2.89Å
373	R	82.9	Confident	83	Confident	213 Å²	213	60.3 Å²	60.3	80%	0.804	29%	0.294	S	S	*	.	H	α-helix	trans	-56	-39.4	171.3	-69.7	-172.9	177.2	-180	-0.3	111.8	G375 Q376 I377	R373-G375 VanDerWaalsContact C-N 3.32Å; R373-G375 PolarHBondContact O-N 3.32Å; R373-Q376 PolarHBondContact O-N 3.32Å; R373-I377 WeakPolarHBondContact O-CG1 3.45Å; R373-I377 PolarHBondContact O-N 2.92Å
374	V	82	Confident	83.1	Confident	58 Å²	58	60.4 Å²	60.4	35%	0.352	30%	0.295	S	S	.	.	H	α-helix	trans	-63.9	-39.1	174.9	-179.8	0	0	0	0	111	L362 S372 Q376 I377 I378	L362-V374 HydrophobicContact CD2-CG1 3.8Å; S372-V374 PolarHBondContact O-N 3.23Å; V374-Q376 PolarHBondContact O-N 2.91Å; V374-I377 PolarHBondContact O-N 3.41Å; V374-I378 HydrophobicContact CG1-CD1 3.93Å; V374-I378 WeakPolarHBondContact O-CG1 3.33Å; V374-I378 PolarHBondContact O-N 3Å
375	G	78.8	Confident	83.3	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-63	-38.6	174.6	0	0	0	0	0	113.6	S372 R373 I378 H379	S372-G375 WeakPolarHBondContact O-CA 3.45Å; S372-G375 PolarHBondContact O-N 2.81Å; S372-G375 PolarHBondContact OG-N 3.1Å; R373-G375 VanDerWaalsContact C-N 3.32Å; R373-G375 PolarHBondContact O-N 3.32Å; G375-I378 PolarHBondContact O-N 3.28Å; G375-H379 PolarHBondContact O-N 3.36Å
376	Q	80.8	Confident	83.6	Confident	102 Å²	102	55.2 Å²	55.2	48%	0.477	26%	0.262	S	S	.	.	H	α-helix	trans	-66.3	-41.6	173.6	-70.3	174.1	-28.8	0	0	111.6	S372 R373 V374 I378 H379 T380	S372-Q376 PolarHBondContact O-N 2.89Å; R373-Q376 PolarHBondContact O-N 3.32Å; V374-Q376 PolarHBondContact O-N 2.91Å; Q376-I378 PolarHBondContact O-N 2.95Å; Q376-H379 VanDerWaalsContact O-CB 3.23Å; Q376-H379 WeakPolarHBondContact O-CB 3.44Å; Q376-H379 PolarHBondContact O-N 3.43Å; Q376-H379 VanDerWaalsContact O-N 3.13Å; Q376-T380 PolarHBondContact O-N 3Å
377	I	83.6	Confident	84	Confident	54 Å²	54	54.3 Å²	54.3	28%	0.277	26%	0.259	S	S	.	.	H	α-helix	trans	-61	-45.4	174.9	-69.1	168.9	0	0	0	111.3	M337 R373 V374 H379 T380 V383	M337-I377 HydrophobicContact CE-CB 4.06Å; M337-I377 HydrophobicContact CE-CD1 3.95Å; M337-I377 HydrophobicContact CE-CG1 3.7Å; M337-I377 HydrophobicContact CE-CG2 3.3Å; R373-I377 WeakPolarHBondContact O-CG1 3.45Å; R373-I377 PolarHBondContact O-N 2.92Å; V374-I377 PolarHBondContact O-N 3.41Å; I377-H379 PolarHBondContact O-N 3.39Å; I377-T380 WeakPolarHBondContact O-CB 3.31Å; I377-T380 WeakPolarHBondContact O-CG2 3.41Å; I377-T380 PolarHBondContact O-N 2.88Å; I377-T380 VanDerWaalsContact O-N 3.07Å; I377-T380 PolarHBondContact O-OG1 3.05Å; I377-V383 HydrophobicContact CG2-CG2 4.17Å
378	I	82.6	Confident	84.4	Confident	5 Å²	5	53.7 Å²	53.7	3%	0.026	26%	0.255	C	S	.	.	H	α-helix	trans	-66.6	-26.2	177.6	-66.8	166.5	0	0	0	111.6	L362 Y366 V374 G375 Q376 T380 V383 K384 I387	L362-I378 HydrophobicContact CB-CD1 3.89Å; L362-I378 HydrophobicContact CD2-CD1 4.41Å; L362-I378 WeakPolarHBondContact O-CD1 3.12Å; Y366-I378 HydrophobicContact CD2-CB 4.09Å; Y366-I378 HydrophobicContact CD2-CG2 3.85Å; Y366-I378 HydrophobicContact CE2-CG2 4.46Å; Y366-I378 HydrophobicContact CG-CG2 4.19Å; V374-I378 HydrophobicContact CG1-CD1 3.93Å; V374-I378 WeakPolarHBondContact O-CG1 3.33Å; V374-I378 PolarHBondContact O-N 3Å; G375-I378 PolarHBondContact O-N 3.28Å; Q376-I378 PolarHBondContact O-N 2.95Å; I378-T380 PolarHBondContact O-N 3.29Å; I378-V383 HydrophobicContact CG1-CG1 4.35Å; I378-K384 WeakPolarHBondContact O-CG 3.33Å; I378-I387 HydrophobicContact CG1-CD1 4.13Å; I378-I387 HydrophobicContact CG2-CD1 4.16Å
379	H	80	Confident	84.8	Confident	70 Å²	70	49.2 Å²	49.2	32%	0.324	23%	0.234	S	C	.	.	H	α-helix	trans	-66.2	-20.2	174.4	-158.6	-79.2	0	0	0	112.6	G375 Q376 I377 K384 D686	G375-H379 PolarHBondContact O-N 3.36Å; Q376-H379 VanDerWaalsContact O-CB 3.23Å; Q376-H379 WeakPolarHBondContact O-CB 3.44Å; Q376-H379 PolarHBondContact O-N 3.43Å; Q376-H379 VanDerWaalsContact O-N 3.13Å; I377-H379 PolarHBondContact O-N 3.39Å; H379-K384 WeakPolarHBondContact O-CE 3.44Å; H379-K384 PolarHBondContact O-NZ 2.9Å; H379-D686 IonicContact CD2-OD1 3.32Å; H379-D686 IonicContact CE1-OD1 3.81Å; H379-D686 PolarHBondContact CE1-OD1 3.26Å; H379-D686 IonicContact CE1-OD2 3.55Å; H379-D686 IonicContact ND1-OD1 2.63Å; H379-D686 IonicContact NE2-OD1 2.58Å; H379-D686 PolarHBondContact NE2-OD1 2.98Å; H379-D686 VanDerWaalsContact NE2-OD1 3.09Å; H379-D686 IonicContact NE2-OD2 3.1Å
380	T	85.7	Confident	85.3	Confident	11 Å²	11	45.6 Å²	45.6	7%	0.067	21%	0.213	C	C	.	.	S	Bend	trans	-67.7	134.2	175.6	68.7	0	0	0	0	111	Q376 I377 I378 F382 V383 K384	Q376-T380 PolarHBondContact O-N 3Å; I377-T380 WeakPolarHBondContact O-CB 3.31Å; I377-T380 WeakPolarHBondContact O-CG2 3.41Å; I377-T380 PolarHBondContact O-N 2.88Å; I377-T380 VanDerWaalsContact O-N 3.07Å; I377-T380 PolarHBondContact O-OG1 3.05Å; I378-T380 PolarHBondContact O-N 3.29Å; T380-F382 VanDerWaalsContact C-N 3.32Å; T380-F382 PolarHBondContact O-N 3.43Å; T380-V383 PolarHBondContact O-N 3.21Å; T380-V383 VanDerWaalsContact O-N 3.13Å; T380-V383 WeakPolarHBondContact OG1-CB 3.35Å; T380-V383 VanDerWaalsContact OG1-CG2 3.24Å; T380-V383 WeakPolarHBondContact OG1-CG2 3.39Å; T380-K384 PolarHBondContact O-N 3.25Å
381	P	88.2	Confident	86.2	Confident	14 Å²	14	44 Å²	44	9%	0.091	20%	0.203	C	C	.	.	H	α-helix	trans	-67.6	-32	-170.1	25.8	-33.6	0	0	0	113.1	W333 V383 K384 F385 F684	W333-P381 HydrophobicContact CE3-CB 3.95Å; W333-P381 HydrophobicContact CE3-CG 4.16Å; W333-P381 HydrophobicContact CZ3-CB 3.95Å; W333-P381 WeakPolarHBondContact O-CG 3.24Å; P381-V383 VanDerWaalsContact C-N 3.35Å; P381-V383 PolarHBondContact O-N 3.16Å; P381-K384 PolarHBondContact O-N 2.8Å; P381-F385 PolarHBondContact O-N 3.25Å; P381-F684 HydrophobicContact CB-CD1 3.53Å; P381-F684 HydrophobicContact CB-CE1 3.74Å; P381-F684 HydrophobicContact CG-CD1 3.6Å; P381-F684 HydrophobicContact CG-CE1 3.48Å; P381-F684 VanDerWaalsContact CG-CE1 3.48Å
382	F	88.3	Confident	86.9	Confident	20 Å²	20	34 Å²	34	9%	0.088	17%	0.165	C	C	.	.	H	α-helix	trans	-57.7	-44.8	171.5	175.7	-116.3	0	0	0	112.8	W333 F334 Y340 V352 T380 F385 I386	W333-F382 HydrophobicContact CZ2-CB 4.42Å; W333-F382 HydrophobicContact CZ2-CD2 4.26Å; W333-F382 AromaticContact NE1-CD2 3.41Å; W333-F382 AromaticContact NE1-CG 3.98Å; W333-F382 WeakPolarHBondContact O-CB 3.37Å; W333-F382 PolarHBondContact O-N 2.87Å; F334-F382 HydrophobicContact CD1-CB 4.5Å; F334-F382 HydrophobicContact CD1-CD1 4.41Å; F334-F382 HydrophobicContact CD1-CD2 4.49Å; F334-F382 HydrophobicContact CD1-CG 4.22Å; F334-F382 HydrophobicContact CE1-CD2 4.06Å; F334-F382 HydrophobicContact CE1-CE2 4.18Å; F334-F382 HydrophobicContact CE1-CG 4.24Å; F334-F382 HydrophobicContact CE1-CZ 4.47Å; Y340-F382 HydrophobicContact CD1-CE1 4.08Å; Y340-F382 AromaticContact CD1-CZ 3.98Å; Y340-F382 HydrophobicContact CD1-CZ 3.98Å; Y340-F382 HydrophobicContact CD2-CE1 4.45Å; Y340-F382 HydrophobicContact CE1-CE1 4.06Å; Y340-F382 HydrophobicContact CE1-CE2 4.23Å; Y340-F382 AromaticContact CE1-CZ 3.5Å; Y340-F382 HydrophobicContact CE1-CZ 3.5Å; Y340-F382 HydrophobicContact CE2-CE1 4.42Å; Y340-F382 HydrophobicContact CE2-CZ 4.23Å; Y340-F382 HydrophobicContact CG-CE1 4.28Å; Y340-F382 AromaticContact CZ-CZ 3.66Å; V352-F382 HydrophobicContact CG2-CZ 4.3Å; T380-F382 VanDerWaalsContact C-N 3.32Å; T380-F382 PolarHBondContact O-N 3.43Å; F382-F385 PolarHBondContact O-N 2.95Å; F382-I386 HydrophobicContact CD1-CD1 4.17Å; F382-I386 HydrophobicContact CD2-CD1 4.26Å; F382-I386 HydrophobicContact CE1-CD1 3.62Å; F382-I386 HydrophobicContact CE2-CD1 3.73Å; F382-I386 HydrophobicContact CE2-CG1 4.4Å; F382-I386 HydrophobicContact CG-CD1 4.48Å; F382-I386 HydrophobicContact CZ-CD1 3.39Å; F382-I386 HydrophobicContact CZ-CG1 4.49Å; F382-I386 WeakPolarHBondContact O-CG1 3.42Å; F382-I386 PolarHBondContact O-N 3.23Å
383	V	88.8	Confident	87.3	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.006	18%	0.178	C	C	.	.	H	α-helix	trans	-71.6	-40	179.2	176.3	0	0	0	0	110.7	I377 I378 T380 P381 F385 I386 I387	I377-V383 HydrophobicContact CG2-CG2 4.17Å; I378-V383 HydrophobicContact CG1-CG1 4.35Å; T380-V383 PolarHBondContact O-N 3.21Å; T380-V383 VanDerWaalsContact O-N 3.13Å; T380-V383 WeakPolarHBondContact OG1-CB 3.35Å; T380-V383 VanDerWaalsContact OG1-CG2 3.24Å; T380-V383 WeakPolarHBondContact OG1-CG2 3.39Å; P381-V383 VanDerWaalsContact C-N 3.35Å; P381-V383 PolarHBondContact O-N 3.16Å; V383-F385 VanDerWaalsContact C-N 3.3Å; V383-F385 PolarHBondContact O-N 3.25Å; V383-I386 PolarHBondContact O-N 3.17Å; V383-I387 HydrophobicContact CG1-CD1 3.61Å; V383-I387 HydrophobicContact CG1-CG1 4.24Å; V383-I387 WeakPolarHBondContact O-CG1 3.42Å; V383-I387 PolarHBondContact O-N 2.76Å
384	K	88.9	Confident	87.8	Confident	5 Å²	5	29.7 Å²	29.7	2%	0.022	15%	0.151	C	C	.	.	H	α-helix	trans	-52.6	-49.5	171.9	-66.6	179	-179	168.1	0	110.6	I378 H379 T380 P381 I386 I387 H388 Y683 D686	I378-K384 WeakPolarHBondContact O-CG 3.33Å; H379-K384 WeakPolarHBondContact O-CE 3.44Å; H379-K384 PolarHBondContact O-NZ 2.9Å; T380-K384 PolarHBondContact O-N 3.25Å; P381-K384 PolarHBondContact O-N 2.8Å; K384-I386 PolarHBondContact O-N 3.4Å; K384-I387 PolarHBondContact O-N 3.42Å; K384-H388 PolarHBondContact O-CD2 3.11Å; K384-H388 PolarHBondContact O-N 3.36Å; K384-Y683 HydrophobicContact CB-CD1 4.2Å; K384-D686 IonicContact NZ-OD1 3.24Å; K384-D686 PolarHBondContact NZ-OD1 3.3Å
385	F	89.8	Confident	88.4	Confident	22 Å²	22	27 Å²	27	10%	0.096	14%	0.135	C	C	.	.	H	α-helix	trans	-59.1	-45.3	179.4	171.8	-101	0	0	0	113.1	W333 P381 F382 V383 H388 S389 M522 T525 L679 Y683	W333-F385 HydrophobicContact CH2-CB 3.64Å; W333-F385 HydrophobicContact CH2-CG 4.06Å; W333-F385 HydrophobicContact CZ2-CB 3.87Å; W333-F385 HydrophobicContact CZ2-CD1 4.3Å; W333-F385 HydrophobicContact CZ2-CG 4.11Å; P381-F385 PolarHBondContact O-N 3.25Å; F382-F385 PolarHBondContact O-N 2.95Å; V383-F385 VanDerWaalsContact C-N 3.3Å; V383-F385 PolarHBondContact O-N 3.25Å; F385-H388 PolarHBondContact O-N 3.38Å; F385-S389 WeakPolarHBondContact O-CB 3.28Å; F385-S389 PolarHBondContact O-N 3.45Å; F385-S389 PolarHBondContact O-OG 3.14Å; F385-M522 HydrophobicContact CE2-SD 3.76Å; F385-M522 HydrophobicContact CZ-SD 3.94Å; F385-T525 HydrophobicContact CE1-CG2 3.97Å; F385-T525 HydrophobicContact CZ-CG2 4.08Å; F385-T525 VanDerWaalsContact CZ-OG1 3.28Å; F385-T525 WeakPolarHBondContact CZ-OG1 3.45Å; F385-L679 HydrophobicContact CE2-CD2 4.28Å; F385-Y683 HydrophobicContact CB-CD1 4.48Å; F385-Y683 HydrophobicContact CB-CD2 4.44Å; F385-Y683 HydrophobicContact CB-CE1 4.45Å; F385-Y683 HydrophobicContact CB-CE2 4.42Å; F385-Y683 HydrophobicContact CB-CG 4.48Å; F385-Y683 HydrophobicContact CD2-CD2 4.31Å; F385-Y683 AromaticContact CD2-CE2 3.62Å; F385-Y683 HydrophobicContact CD2-CE2 3.62Å; F385-Y683 AromaticContact CD2-CZ 3.73Å; F385-Y683 HydrophobicContact CE2-CE2 4.44Å; F385-Y683 HydrophobicContact CG-CE2 4.5Å
386	I	90.6	Very high	89.1	Confident	11 Å²	11	27 Å²	27	6%	0.056	14%	0.135	C	C	.	.	H	α-helix	trans	-63.6	-44.6	178.4	-68.8	169.7	0	0	0	110.7	V352 L355 A356 F382 V383 K384 S389 A390	V352-I386 HydrophobicContact CG1-CD1 4.18Å; V352-I386 HydrophobicContact CG1-CG1 4.45Å; V352-I386 HydrophobicContact CG1-CG2 4.43Å; V352-I386 HydrophobicContact CG2-CD1 4.02Å; L355-I386 HydrophobicContact CB-CG2 4.14Å; L355-I386 HydrophobicContact CD1-CD1 4.37Å; A356-I386 HydrophobicContact CB-CG2 4.37Å; F382-I386 HydrophobicContact CD1-CD1 4.17Å; F382-I386 HydrophobicContact CD2-CD1 4.26Å; F382-I386 HydrophobicContact CE1-CD1 3.62Å; F382-I386 HydrophobicContact CE2-CD1 3.73Å; F382-I386 HydrophobicContact CE2-CG1 4.4Å; F382-I386 HydrophobicContact CG-CD1 4.48Å; F382-I386 HydrophobicContact CZ-CD1 3.39Å; F382-I386 HydrophobicContact CZ-CG1 4.49Å; F382-I386 WeakPolarHBondContact O-CG1 3.42Å; F382-I386 PolarHBondContact O-N 3.23Å; V383-I386 PolarHBondContact O-N 3.17Å; K384-I386 PolarHBondContact O-N 3.4Å; I386-S389 PolarHBondContact O-N 2.88Å; I386-A390 VanDerWaalsContact O-CB 3.25Å; I386-A390 WeakPolarHBondContact O-CB 3.37Å; I386-A390 PolarHBondContact O-N 3.37Å
387	I	90.6	Very high	89.6	Confident	4 Å²	4	26.5 Å²	26.5	2%	0.021	14%	0.135	C	C	.	.	H	α-helix	trans	-65	-42.8	-179.1	-69.2	168.4	0	0	0	111.3	W359 L362 I378 V383 K384 A390 S391 P691	W359-I387 HydrophobicContact CB-CG1 4.47Å; W359-I387 HydrophobicContact CB-CG2 4.3Å; W359-I387 HydrophobicContact CE3-CG2 4.46Å; L362-I387 HydrophobicContact CB-CD1 4.33Å; L362-I387 HydrophobicContact CD1-CD1 4.48Å; I378-I387 HydrophobicContact CG1-CD1 4.13Å; I378-I387 HydrophobicContact CG2-CD1 4.16Å; V383-I387 HydrophobicContact CG1-CD1 3.61Å; V383-I387 HydrophobicContact CG1-CG1 4.24Å; V383-I387 WeakPolarHBondContact O-CG1 3.42Å; V383-I387 PolarHBondContact O-N 2.76Å; K384-I387 PolarHBondContact O-N 3.42Å; I387-A390 PolarHBondContact O-N 2.88Å; I387-S391 PolarHBondContact O-N 3.07Å; I387-P691 HydrophobicContact CG2-CB 4.27Å; I387-P691 HydrophobicContact CG2-CG 3.6Å
388	H	89.4	Confident	90	Very high	29 Å²	29	25 Å²	25	13%	0.134	13%	0.128	C	C	.	.	H	α-helix	trans	-62.2	-42.1	173.9	-83.5	-78.5	0	0	0	112.1	K384 F385 Y392 Y683 C688 L690 P691	K384-H388 PolarHBondContact O-CD2 3.11Å; K384-H388 PolarHBondContact O-N 3.36Å; F385-H388 PolarHBondContact O-N 3.38Å; H388-Y392 PolarHBondContact O-N 3.38Å; H388-Y392 VanDerWaalsContact O-N 3.12Å; H388-Y683 HydrophobicContact CB-CE1 4.16Å; H388-Y683 AromaticContact CD2-CE1 3.76Å; H388-C688 PolarHBondContact NE2-O 3.18Å; H388-L690 PolarHBondContact CE1-O 3.48Å; H388-P691 VanDerWaalsContact CE1-CA 3.45Å; H388-P691 WeakPolarHBondContact CE1-CA 3.43Å; H388-P691 WeakPolarHBondContact ND1-CA 3.41Å
389	S	90.7	Very high	90.5	Very high	29 Å²	29	24.9 Å²	24.9	20%	0.203	13%	0.127	C	C	.	.	H	α-helix	trans	-67.7	-41	178.1	-57.2	0	0	0	0	112.2	F385 I386 Y392 F393	F385-S389 WeakPolarHBondContact O-CB 3.28Å; F385-S389 PolarHBondContact O-N 3.45Å; F385-S389 PolarHBondContact O-OG 3.14Å; I386-S389 PolarHBondContact O-N 2.88Å; S389-Y392 PolarHBondContact O-N 2.82Å; S389-F393 PolarHBondContact O-N 3.49Å
390	A	92.8	Very high	91	Very high	11 Å²	11	25.2 Å²	25.2	9%	0.091	13%	0.131	C	C	.	.	H	α-helix	trans	-64.9	-43.2	177.8	0	0	0	0	0	111.5	A356 W359 I386 I387 Y392 F393 T394	A356-A390 HydrophobicContact CB-CB 3.86Å; W359-A390 HydrophobicContact CB-CB 4Å; W359-A390 HydrophobicContact CG-CB 3.95Å; I386-A390 VanDerWaalsContact O-CB 3.25Å; I386-A390 WeakPolarHBondContact O-CB 3.37Å; I386-A390 PolarHBondContact O-N 3.37Å; I387-A390 PolarHBondContact O-N 2.88Å; A390-Y392 VanDerWaalsContact C-N 3.34Å; A390-Y392 PolarHBondContact O-N 2.96Å; A390-F393 PolarHBondContact O-N 3.01Å; A390-T394 PolarHBondContact O-N 3.43Å; A390-T394 PolarHBondContact O-OG1 3.24Å
391	S	93.3	Very high	91.2	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.014	15%	0.149	C	C	.	.	H	α-helix	trans	-58.9	-45.7	173.2	169.2	0	0	0	0	111.8	I387 F393 T394 F395 W428 P692	I387-S391 PolarHBondContact O-N 3.07Å; S391-F393 VanDerWaalsContact C-N 3.31Å; S391-F393 PolarHBondContact O-N 3Å; S391-T394 WeakPolarHBondContact CA-OG1 3.41Å; S391-T394 PolarHBondContact O-N 3.21Å; S391-T394 VanDerWaalsContact O-N 3.16Å; S391-T394 PolarHBondContact O-OG1 3.22Å; S391-F395 PolarHBondContact O-N 3.11Å; S391-W428 PolarHBondContact OG-NE1 3Å; S391-P692 WeakPolarHBondContact CB-O 3.34Å; S391-P692 PolarHBondContact OG-O 3.35Å
392	Y	92.7	Very high	91.2	Very high	17 Å²	17	28.6 Å²	28.6	7%	0.067	15%	0.147	C	C	.	.	H	α-helix	trans	-62.4	-39.8	177.8	-170.8	-106.8	0	0	0	112.3	H388 S389 A390 T394 F395 L396 M432 S515 R518 L519	H388-Y392 PolarHBondContact O-N 3.38Å; H388-Y392 VanDerWaalsContact O-N 3.12Å; S389-Y392 PolarHBondContact O-N 2.82Å; A390-Y392 VanDerWaalsContact C-N 3.34Å; A390-Y392 PolarHBondContact O-N 2.96Å; Y392-T394 PolarHBondContact O-N 3.43Å; Y392-F395 HydrophobicContact CD2-CD1 4.25Å; Y392-F395 AromaticContact CE2-CD1 3.94Å; Y392-F395 HydrophobicContact CE2-CD1 3.94Å; Y392-F395 HydrophobicContact CE2-CE1 4.37Å; Y392-F395 WeakPolarHBondContact O-CB 3.29Å; Y392-F395 PolarHBondContact O-N 3.47Å; Y392-L396 HydrophobicContact CD1-CD1 4.24Å; Y392-L396 HydrophobicContact CD1-CG 4.49Å; Y392-L396 HydrophobicContact CE1-CD1 3.86Å; Y392-L396 HydrophobicContact CE1-CD2 4.3Å; Y392-L396 HydrophobicContact CE1-CG 4.12Å; Y392-L396 PolarHBondContact O-N 3.19Å; Y392-L396 VanDerWaalsContact O-N 3.1Å; Y392-M432 HydrophobicContact CD2-SD 4.45Å; Y392-M432 HydrophobicContact CE2-SD 4.29Å; Y392-S515 VanDerWaalsContact OH-C 3.28Å; Y392-S515 WeakPolarHBondContact OH-CA 3.4Å; Y392-S515 PolarHBondContact OH-O 3.08Å; Y392-R518 HydrophobicContact CE1-CB 4.26Å; Y392-R518 VanDerWaalsContact CZ-CD 3.48Å; Y392-R518 WeakPolarHBondContact OH-CB 3.4Å; Y392-R518 VanDerWaalsContact OH-CD 3.26Å; Y392-R518 WeakPolarHBondContact OH-CD 3.21Å; Y392-L519 HydrophobicContact CD1-CD2 3.85Å; Y392-L519 HydrophobicContact CE1-CD2 3.82Å; Y392-L519 HydrophobicContact CE1-CG 4.34Å
393	F	93.1	Very high	91.1	Very high	116 Å²	116	30 Å²	30	51%	0.509	16%	0.159	S	C	.	.	H	α-helix	trans	-63.2	-40.9	174.3	-170	-101.9	0	0	0	112	S389 A390 S391 F395 L396 L397	S389-F393 PolarHBondContact O-N 3.49Å; A390-F393 PolarHBondContact O-N 3.01Å; S391-F393 VanDerWaalsContact C-N 3.31Å; S391-F393 PolarHBondContact O-N 3Å; F393-F395 VanDerWaalsContact C-N 3.3Å; F393-F395 PolarHBondContact O-N 3.38Å; F393-L396 PolarHBondContact O-N 3.14Å; F393-L397 HydrophobicContact CD1-CD1 3.91Å; F393-L397 HydrophobicContact CD1-CG 4.23Å; F393-L397 HydrophobicContact CE1-CD1 3.68Å; F393-L397 HydrophobicContact CE1-CD2 4.29Å; F393-L397 HydrophobicContact CE1-CG 4Å; F393-L397 HydrophobicContact CZ-CD2 4.45Å; F393-L397 WeakPolarHBondContact O-CG 3.47Å; F393-L397 PolarHBondContact O-N 3.27Å
394	T	92.9	Very high	90.9	Very high	41 Å²	41	35 Å²	35	25%	0.252	19%	0.185	S	C	.	.	H	α-helix	trans	-64.7	-32.6	173.6	55.8	0	0	0	0	113.3	W359 A390 S391 Y392 L397 L398	W359-T394 HydrophobicContact CZ2-CG2 4.45Å; W359-T394 WeakPolarHBondContact CZ2-OG1 3.34Å; W359-T394 VanDerWaalsContact NE1-CG2 3.32Å; A390-T394 PolarHBondContact O-N 3.43Å; A390-T394 PolarHBondContact O-OG1 3.24Å; S391-T394 WeakPolarHBondContact CA-OG1 3.41Å; S391-T394 PolarHBondContact O-N 3.21Å; S391-T394 VanDerWaalsContact O-N 3.16Å; S391-T394 PolarHBondContact O-OG1 3.22Å; Y392-T394 PolarHBondContact O-N 3.43Å; T394-L397 PolarHBondContact O-N 3.24Å; T394-L398 WeakPolarHBondContact O-CB 3.49Å; T394-L398 PolarHBondContact O-N 2.9Å
395	F	94	Very high	90.7	Very high	1 Å²	1	37 Å²	37	0%	0.004	20%	0.198	C	C	.	.	H	α-helix	trans	-62.7	-43.1	172	168.9	-105	0	0	0	111.7	S391 Y392 F393 L398 L399 L425 W428 I429 M432 Y464	S391-F395 PolarHBondContact O-N 3.11Å; Y392-F395 HydrophobicContact CD2-CD1 4.25Å; Y392-F395 AromaticContact CE2-CD1 3.94Å; Y392-F395 HydrophobicContact CE2-CD1 3.94Å; Y392-F395 HydrophobicContact CE2-CE1 4.37Å; Y392-F395 WeakPolarHBondContact O-CB 3.29Å; Y392-F395 PolarHBondContact O-N 3.47Å; F393-F395 VanDerWaalsContact C-N 3.3Å; F393-F395 PolarHBondContact O-N 3.38Å; F395-L398 WeakPolarHBondContact O-CB 3.33Å; F395-L398 PolarHBondContact O-N 3.03Å; F395-L399 HydrophobicContact CD1-CD1 4.09Å; F395-L399 HydrophobicContact CE1-CD1 3.49Å; F395-L399 VanDerWaalsContact CE1-CD1 3.49Å; F395-L399 HydrophobicContact CE1-CG 4.24Å; F395-L399 HydrophobicContact CE2-CD1 4.3Å; F395-L399 HydrophobicContact CE2-CD2 4.33Å; F395-L399 HydrophobicContact CE2-CG 4.21Å; F395-L399 HydrophobicContact CZ-CD1 3.61Å; F395-L399 HydrophobicContact CZ-CD2 4.17Å; F395-L399 HydrophobicContact CZ-CG 4Å; F395-L399 WeakPolarHBondContact O-CG 2.94Å; F395-L399 PolarHBondContact O-N 2.88Å; F395-L425 HydrophobicContact CD2-CD2 4.18Å; F395-L425 HydrophobicContact CE2-CD2 3.89Å; F395-W428 HydrophobicContact CB-CG 4.43Å; F395-W428 HydrophobicContact CD2-CB 3.75Å; F395-W428 AromaticContact CD2-CG 3.96Å; F395-W428 HydrophobicContact CD2-CG 3.96Å; F395-W428 HydrophobicContact CE2-CB 4.19Å; F395-I429 HydrophobicContact CE2-CG1 4.34Å; F395-M432 HydrophobicContact CD1-CE 4.29Å; F395-M432 HydrophobicContact CD2-CE 4.31Å; F395-M432 HydrophobicContact CE1-CE 3.8Å; F395-M432 HydrophobicContact CE1-SD 4.45Å; F395-M432 HydrophobicContact CE2-CE 3.82Å; F395-M432 HydrophobicContact CZ-CE 3.54Å; F395-Y464 HydrophobicContact CE1-CE2 4.36Å; F395-Y464 HydrophobicContact CZ-CE2 4.03Å
396	L	93.4	Very high	90.1	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.016	20%	0.198	C	C	.	.	H	α-helix	trans	-64.8	-40.6	175.5	-63.7	177.8	0	0	0	112.5	Y392 F393 L398 L399 N400 S515 Y516 L519	Y392-L396 HydrophobicContact CD1-CD1 4.24Å; Y392-L396 HydrophobicContact CD1-CG 4.49Å; Y392-L396 HydrophobicContact CE1-CD1 3.86Å; Y392-L396 HydrophobicContact CE1-CD2 4.3Å; Y392-L396 HydrophobicContact CE1-CG 4.12Å; Y392-L396 PolarHBondContact O-N 3.19Å; Y392-L396 VanDerWaalsContact O-N 3.1Å; F393-L396 PolarHBondContact O-N 3.14Å; L396-L398 VanDerWaalsContact C-N 3.3Å; L396-L398 PolarHBondContact O-N 3.31Å; L396-L399 HydrophobicContact CD2-CD1 4.21Å; L396-L399 WeakPolarHBondContact O-CB 3.43Å; L396-L399 PolarHBondContact O-N 3.43Å; L396-N400 PolarHBondContact O-N 2.85Å; L396-N400 PolarHBondContact O-ND2 3.37Å; L396-S515 WeakPolarHBondContact CD2-OG 3.37Å; L396-Y516 HydrophobicContact CB-CE1 4.25Å; L396-Y516 HydrophobicContact CD1-CD1 4.13Å; L396-Y516 HydrophobicContact CD1-CE1 4.05Å; L396-Y516 HydrophobicContact CD2-CD1 4.43Å; L396-Y516 HydrophobicContact CD2-CE1 4.34Å; L396-Y516 HydrophobicContact CG-CE1 4.46Å; L396-L519 HydrophobicContact CD1-CD1 3.56Å; L396-L519 HydrophobicContact CD1-CD2 3.78Å; L396-L519 HydrophobicContact CD1-CG 3.74Å
397	L	92.5	Very high	89.3	Confident	90 Å²	90	41.7 Å²	41.7	47%	0.471	22%	0.222	S	C	.	.	H	α-helix	trans	-61.6	-40.6	173.4	-69.3	177.8	0	0	0	111.7	F393 T394 L399 N400 L401	F393-L397 HydrophobicContact CD1-CD1 3.91Å; F393-L397 HydrophobicContact CD1-CG 4.23Å; F393-L397 HydrophobicContact CE1-CD1 3.68Å; F393-L397 HydrophobicContact CE1-CD2 4.29Å; F393-L397 HydrophobicContact CE1-CG 4Å; F393-L397 HydrophobicContact CZ-CD2 4.45Å; F393-L397 WeakPolarHBondContact O-CG 3.47Å; F393-L397 PolarHBondContact O-N 3.27Å; T394-L397 PolarHBondContact O-N 3.24Å; L397-L399 VanDerWaalsContact C-N 3.33Å; L397-L399 PolarHBondContact O-N 3.23Å; L397-N400 PolarHBondContact O-N 3.11Å; L397-L401 PolarHBondContact O-N 3.41Å
398	L	92.4	Very high	88.4	Confident	23 Å²	23	49.2 Å²	49.2	12%	0.12	26%	0.257	C	S	.	.	H	α-helix	trans	-64.3	-36.8	175.7	-172.6	65.1	0	0	0	111.8	T394 F395 L396 L401 Y402 I421 L424 L425 W428	T394-L398 WeakPolarHBondContact O-CB 3.49Å; T394-L398 PolarHBondContact O-N 2.9Å; F395-L398 WeakPolarHBondContact O-CB 3.33Å; F395-L398 PolarHBondContact O-N 3.03Å; L396-L398 VanDerWaalsContact C-N 3.3Å; L396-L398 PolarHBondContact O-N 3.31Å; L398-L401 HydrophobicContact CD1-CD2 4.5Å; L398-L401 PolarHBondContact O-N 2.95Å; L398-Y402 VanDerWaalsContact O-CB 3.3Å; L398-Y402 WeakPolarHBondContact O-CB 3.25Å; L398-Y402 PolarHBondContact O-N 3.46Å; L398-I421 HydrophobicContact CD1-CG2 4.04Å; L398-L424 HydrophobicContact CD2-CB 4.01Å; L398-L425 HydrophobicContact CB-CD2 4.31Å; L398-L425 HydrophobicContact CD2-CD2 3.67Å; L398-L425 HydrophobicContact CD2-CG 3.97Å; L398-L425 HydrophobicContact CG-CD2 3.78Å; L398-L425 HydrophobicContact CG-CG 4.13Å; L398-W428 HydrophobicContact CD2-CE3 3.99Å; L398-W428 HydrophobicContact CD2-CZ3 4.04Å
399	L	92.1	Very high	87	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-65.2	-38.6	173.4	-72.9	173.9	0	0	0	112.8	F395 L396 L397 Y402 S403 L425 Y464 F508	F395-L399 HydrophobicContact CD1-CD1 4.09Å; F395-L399 HydrophobicContact CE1-CD1 3.49Å; F395-L399 VanDerWaalsContact CE1-CD1 3.49Å; F395-L399 HydrophobicContact CE1-CG 4.24Å; F395-L399 HydrophobicContact CE2-CD1 4.3Å; F395-L399 HydrophobicContact CE2-CD2 4.33Å; F395-L399 HydrophobicContact CE2-CG 4.21Å; F395-L399 HydrophobicContact CZ-CD1 3.61Å; F395-L399 HydrophobicContact CZ-CD2 4.17Å; F395-L399 HydrophobicContact CZ-CG 4Å; F395-L399 WeakPolarHBondContact O-CG 2.94Å; F395-L399 PolarHBondContact O-N 2.88Å; L396-L399 HydrophobicContact CD2-CD1 4.21Å; L396-L399 WeakPolarHBondContact O-CB 3.43Å; L396-L399 PolarHBondContact O-N 3.43Å; L397-L399 VanDerWaalsContact C-N 3.33Å; L397-L399 PolarHBondContact O-N 3.23Å; L399-Y402 PolarHBondContact O-N 3.34Å; L399-S403 PolarHBondContact O-N 3.13Å; L399-S403 PolarHBondContact O-OG 2.98Å; L399-L425 HydrophobicContact CD2-CD1 4.31Å; L399-L425 HydrophobicContact CD2-CD2 3.69Å; L399-L425 HydrophobicContact CG-CD2 4.15Å; L399-Y464 VanDerWaalsContact CD1-OH 3.28Å; L399-Y464 WeakPolarHBondContact CD1-OH 3.4Å; L399-Y464 HydrophobicContact CD2-CE1 4.36Å; L399-F508 HydrophobicContact CD2-CE2 3.96Å; L399-F508 HydrophobicContact CD2-CZ 3.85Å
400	N	90.5	Very high	85.7	Confident	78 Å²	78	51 Å²	51	42%	0.417	28%	0.279	S	S	.	.	H	α-helix	trans	-65.1	-45.5	174	-70.2	-32.3	0	0	0	111.2	L396 L397 Y402 S403 L404 Y516	L396-N400 PolarHBondContact O-N 2.85Å; L396-N400 PolarHBondContact O-ND2 3.37Å; L397-N400 PolarHBondContact O-N 3.11Å; N400-Y402 VanDerWaalsContact C-N 3.29Å; N400-Y402 PolarHBondContact O-N 2.82Å; N400-S403 PolarHBondContact O-N 2.97Å; N400-L404 PolarHBondContact O-N 2.94Å; N400-Y516 PolarHBondContact ND2-OH 2.84Å; N400-Y516 PolarHBondContact OD1-OH 3.08Å
401	L	90.3	Very high	84.5	Confident	84 Å²	84	54.5 Å²	54.5	44%	0.44	29%	0.292	S	S	.	.	H	α-helix	trans	-60	-43.4	176.5	-177.9	63.3	0	0	0	111	L397 L398 S403 L404 V405	L397-L401 PolarHBondContact O-N 3.41Å; L398-L401 HydrophobicContact CD1-CD2 4.5Å; L398-L401 PolarHBondContact O-N 2.95Å; L401-S403 VanDerWaalsContact C-N 3.34Å; L401-S403 PolarHBondContact O-N 3.36Å; L401-L404 PolarHBondContact O-N 2.85Å; L401-V405 HydrophobicContact CD1-CG2 4.4Å; L401-V405 WeakPolarHBondContact O-CG2 3.22Å; L401-V405 PolarHBondContact O-N 2.74Å
402	Y	88.8	Confident	83.3	Confident	11 Å²	11	60 Å²	60	4%	0.043	32%	0.322	C	S	.	.	H	α-helix	trans	-58.3	-45.1	174.9	178.1	-95.6	0	0	0	112.2	L398 L399 N400 L404 V405 Y406 I421 D422 L425 R471 F508	L398-Y402 VanDerWaalsContact O-CB 3.3Å; L398-Y402 WeakPolarHBondContact O-CB 3.25Å; L398-Y402 PolarHBondContact O-N 3.46Å; L399-Y402 PolarHBondContact O-N 3.34Å; N400-Y402 VanDerWaalsContact C-N 3.29Å; N400-Y402 PolarHBondContact O-N 2.82Å; Y402-L404 VanDerWaalsContact C-N 3.3Å; Y402-L404 PolarHBondContact O-N 3.39Å; Y402-V405 PolarHBondContact O-N 3.29Å; Y402-Y406 HydrophobicContact CE1-CD2 4.49Å; Y402-Y406 HydrophobicContact CE1-CG 4.3Å; Y402-Y406 AromaticContact CZ-CD2 3.92Å; Y402-Y406 WeakPolarHBondContact O-CB 3.33Å; Y402-Y406 PolarHBondContact O-N 3.05Å; Y402-Y406 WeakPolarHBondContact OH-CD2 3.32Å; Y402-I421 HydrophobicContact CD2-CB 4.44Å; Y402-I421 HydrophobicContact CD2-CG2 3.8Å; Y402-I421 HydrophobicContact CG-CG2 4.41Å; Y402-D422 WeakPolarHBondContact CE2-OD1 3.38Å; Y402-L425 HydrophobicContact CD1-CD1 4.27Å; Y402-L425 HydrophobicContact CD2-CD1 3.69Å; Y402-L425 HydrophobicContact CE2-CD1 4.47Å; Y402-L425 HydrophobicContact CG-CD1 3.59Å; Y402-R471 PolarHBondContact OH-NH1 3.44Å; Y402-R471 PolarHBondContact OH-NH2 2.73Å; Y402-F508 AromaticContact CD1-CE1 3.6Å; Y402-F508 HydrophobicContact CD1-CE1 3.6Å; Y402-F508 HydrophobicContact CD1-CE2 4.48Å; Y402-F508 AromaticContact CD1-CZ 3.42Å; Y402-F508 HydrophobicContact CD1-CZ 3.42Å; Y402-F508 VanDerWaalsContact CD1-CZ 3.42Å; Y402-F508 HydrophobicContact CE1-CD1 4.45Å; Y402-F508 AromaticContact CE1-CE1 3.62Å; Y402-F508 HydrophobicContact CE1-CE1 3.62Å; Y402-F508 AromaticContact CE1-CZ 3.67Å; Y402-F508 HydrophobicContact CE1-CZ 3.67Å; Y402-F508 HydrophobicContact CG-CZ 4.47Å
403	S	86.3	Confident	82.3	Confident	51 Å²	51	63 Å²	63	36%	0.357	34%	0.337	S	S	.	.	H	α-helix	trans	-64	-35.5	179.6	-57.5	0	0	0	0	112.1	L399 N400 L401 N407	L399-S403 PolarHBondContact O-N 3.13Å; L399-S403 PolarHBondContact O-OG 2.98Å; N400-S403 PolarHBondContact O-N 2.97Å; L401-S403 VanDerWaalsContact C-N 3.34Å; L401-S403 PolarHBondContact O-N 3.36Å; S403-N407 VanDerWaalsContact O-CB 3.3Å; S403-N407 WeakPolarHBondContact O-CB 3.01Å; S403-N407 PolarHBondContact O-N 3.39Å
404	L	84.6	Confident	81.1	Confident	104 Å²	104	59.3 Å²	59.3	55%	0.545	32%	0.322	S	S	.	.	H	α-helix	trans	-66.2	-53	174.8	-171.1	72	0	0	0	111.4	N400 L401 Y402 Y406 N407 E408	N400-L404 PolarHBondContact O-N 2.94Å; L401-L404 PolarHBondContact O-N 2.85Å; Y402-L404 VanDerWaalsContact C-N 3.3Å; Y402-L404 PolarHBondContact O-N 3.39Å; L404-Y406 PolarHBondContact O-N 2.66Å; L404-N407 PolarHBondContact O-N 2.88Å; L404-E408 PolarHBondContact O-N 3.2Å
405	V	83.4	Confident	80.1	Confident	47 Å²	47	58.3 Å²	58.3	29%	0.285	32%	0.32	S	S	.	.	H	α-helix	trans	-64.3	-39.4	-177.8	174.4	0	0	0	0	111.9	L401 Y402 N407 I421	L401-V405 HydrophobicContact CD1-CG2 4.4Å; L401-V405 WeakPolarHBondContact O-CG2 3.22Å; L401-V405 PolarHBondContact O-N 2.74Å; Y402-V405 PolarHBondContact O-N 3.29Å; V405-N407 VanDerWaalsContact C-N 3.34Å; V405-N407 PolarHBondContact O-N 3.28Å; V405-I421 HydrophobicContact CB-CD1 4.2Å; V405-I421 HydrophobicContact CG1-CD1 4.18Å; V405-I421 HydrophobicContact CG2-CD1 3.87Å
406	Y	77.1	Confident	79.2	Confident	27 Å²	27	59.3 Å²	59.3	11%	0.106	33%	0.326	C	S	.	.	H	α-helix	trans	-65.4	-37.9	178.9	-174.2	-102	0	0	0	112.4	Y402 L404 K410 P416 E505	Y402-Y406 HydrophobicContact CE1-CD2 4.49Å; Y402-Y406 HydrophobicContact CE1-CG 4.3Å; Y402-Y406 AromaticContact CZ-CD2 3.92Å; Y402-Y406 WeakPolarHBondContact O-CB 3.33Å; Y402-Y406 PolarHBondContact O-N 3.05Å; Y402-Y406 WeakPolarHBondContact OH-CD2 3.32Å; L404-Y406 PolarHBondContact O-N 2.66Å; Y406-K410 HydrophobicContact CD2-CB 4.4Å; Y406-K410 PolarHBondContact O-N 3.02Å; Y406-P416 HydrophobicContact CE2-CG 4.48Å; Y406-E505 HydrophobicContact CE1-CG 4.27Å; Y406-E505 VanDerWaalsContact CE1-OE1 3.31Å; Y406-E505 WeakPolarHBondContact CE1-OE1 3.35Å; Y406-E505 PolarHBondContact OH-OE1 2.99Å
407	N	73.5	Confident	78.4	Confident	105 Å²	105	62.4 Å²	62.4	56%	0.561	35%	0.346	S	S	*	.	H	α-helix	trans	-74.4	-30.7	-175.2	-158.7	31	0	0	0	112.9	S403 L404 V405	S403-N407 VanDerWaalsContact O-CB 3.3Å; S403-N407 WeakPolarHBondContact O-CB 3.01Å; S403-N407 PolarHBondContact O-N 3.39Å; L404-N407 PolarHBondContact O-N 2.88Å; V405-N407 VanDerWaalsContact C-N 3.34Å; V405-N407 PolarHBondContact O-N 3.28Å
408	E	72.1	Confident	77.8	Confident	163 Å²	163	60.2 Å²	60.2	76%	0.762	34%	0.335	S	S	*	.	H	α-helix	trans	-75.3	-36.5	-178.1	-74.1	-176.3	167.9	0	0	113.9	L404	L404-E408 PolarHBondContact O-N 3.2Å
409	G	61.6	Low	77.3	Confident	64 Å²	64	62.6 Å²	62.6	66%	0.66	35%	0.345	S	S	*	.	H	α-helix	trans	-123.8	-17	-164.3	0	0	0	0	0	117.8
410	K	63.2	Low	77	Confident	32 Å²	32	69.5 Å²	69.5	14%	0.139	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-135.1	-3.4	-157.9	-65.3	-175.5	176.4	-174.4	0	116.4	Y406 N412 M413 P416 E419	Y406-K410 HydrophobicContact CD2-CB 4.4Å; Y406-K410 PolarHBondContact O-N 3.02Å; K410-N412 PolarHBondContact O-N 3.47Å; K410-M413 PolarHBondContact O-N 3.09Å; K410-P416 HydrophobicContact CB-CB 4.33Å; K410-P416 HydrophobicContact CD-CB 4.1Å; K410-E419 VanDerWaalsContact CE-OE1 3.27Å; K410-E419 WeakPolarHBondContact CE-OE1 3.39Å; K410-E419 VanDerWaalsContact NZ-CG 3.3Å; K410-E419 IonicContact NZ-OE1 2.61Å; K410-E419 PolarHBondContact NZ-OE1 3.29Å; K410-E419 IonicContact NZ-OE2 2.9Å; K410-E419 PolarHBondContact NZ-OE2 3.14Å
411	K	66.2	Low	76.9	Confident	83 Å²	83	67.2 Å²	67.2	36%	0.361	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-24.6	-177.7	-164.4	172.1	-177.8	176.4	0	113.8	R492	K411-R492 WeakPolarHBondContact O-CD 3.27Å; K411-R492 PolarHBondContact O-NH1 3.31Å
412	N	69.3	Low	76.7	Confident	118 Å²	118	63.8 Å²	63.8	63%	0.631	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	6.4	-173.9	-60.6	-18	0	0	0	114.3	K410	K410-N412 PolarHBondContact O-N 3.47Å
413	M	71.9	Confident	76.8	Confident	79 Å²	79	69.6 Å²	69.6	39%	0.389	37%	0.372	S	S	.	.			trans	-101.2	130.4	178.6	-70.2	-167.8	148.8	0	0	111.9	K410 G415 P416 W495	K410-M413 PolarHBondContact O-N 3.09Å; M413-G415 PolarHBondContact O-N 3.38Å; M413-G415 VanDerWaalsContact O-N 3.14Å; M413-P416 HydrophobicContact CB-CB 4.44Å; M413-W495 WeakPolarHBondContact O-CH2 3.45Å
414	M	67.5	Low	77	Confident	40 Å²	40	70.8 Å²	70.8	20%	0.197	37%	0.374	C	S	.	.	S	Bend	trans	-66.6	-11.3	178.8	-72.1	178.3	157.2	0	0	114.4	F478 P490 W495 H499	M414-F478 HydrophobicContact CB-CD1 4.48Å; M414-F478 HydrophobicContact CB-CG 4.32Å; M414-P490 HydrophobicContact CE-CB 3.77Å; M414-P490 HydrophobicContact CE-CG 3.54Å; M414-P490 HydrophobicContact SD-CG 4.36Å; M414-W495 HydrophobicContact CB-CZ2 4.33Å; M414-W495 HydrophobicContact CE-CD2 4.43Å; M414-W495 HydrophobicContact CE-CG 3.93Å; M414-W495 HydrophobicContact CG-CD2 4.24Å; M414-W495 VanDerWaalsContact CG-CE2 3.45Å; M414-W495 HydrophobicContact CG-CH2 4.46Å; M414-W495 HydrophobicContact CG-CZ2 3.57Å; M414-H499 PolarHBondContact O-CE1 3.46Å
415	G	72	Confident	77.3	Confident	19 Å²	19	65.8 Å²	65.8	20%	0.196	35%	0.348	C	S	.	.	S	Bend	trans	-167.4	76.3	177.5	0	0	0	0	0	111.9	M413	M413-G415 PolarHBondContact O-N 3.38Å; M413-G415 VanDerWaalsContact O-N 3.14Å
416	P	74.9	Confident	77.7	Confident	22 Å²	22	65.2 Å²	65.2	14%	0.143	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-64.2	143.6	-179.7	26.2	-32.7	0	0	0	111.1	Y406 K410 M413	Y406-P416 HydrophobicContact CE2-CG 4.48Å; K410-P416 HydrophobicContact CB-CB 4.33Å; K410-P416 HydrophobicContact CD-CB 4.1Å; M413-P416 HydrophobicContact CB-CB 4.44Å
417	P	76.5	Confident	78.4	Confident	68 Å²	68	67.7 Å²	67.7	44%	0.442	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-63.9	142.5	173.8	27.9	-33.8	0	0	0	110.6	E419	P417-E419 PolarHBondContact O-N 2.84Å
418	L	79.9	Confident	79.4	Confident	44 Å²	44	64.3 Å²	64.3	23%	0.23	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-62.9	127.8	176.1	-68.5	110.5	0	0	0	110.2	D422 Y423 I426	L418-D422 HydrophobicContact CB-CB 4.36Å; L418-D422 HydrophobicContact CD2-CB 4.18Å; L418-Y423 HydrophobicContact CB-CE2 3.9Å; L418-I426 HydrophobicContact CD2-CD1 3.83Å
419	E	81.1	Confident	80.4	Confident	73 Å²	73	56.9 Å²	56.9	34%	0.341	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-96.1	169.7	177.8	-102.2	175.6	-173.2	0	0	112.9	K410 P417 I421 D422 Y423	K410-E419 VanDerWaalsContact CE-OE1 3.27Å; K410-E419 WeakPolarHBondContact CE-OE1 3.39Å; K410-E419 VanDerWaalsContact NZ-CG 3.3Å; K410-E419 IonicContact NZ-OE1 2.61Å; K410-E419 PolarHBondContact NZ-OE1 3.29Å; K410-E419 IonicContact NZ-OE2 2.9Å; K410-E419 PolarHBondContact NZ-OE2 3.14Å; P417-E419 PolarHBondContact O-N 2.84Å; E419-I421 PolarHBondContact O-N 3.5Å; E419-I421 VanDerWaalsContact O-N 3.15Å; E419-D422 PolarHBondContact N-OD2 3.11Å; E419-D422 WeakPolarHBondContact O-CB 3.42Å; E419-D422 PolarHBondContact O-N 3.45Å; E419-Y423 WeakPolarHBondContact O-CD2 3.5Å; E419-Y423 PolarHBondContact O-N 3.2Å
420	M	86	Confident	81.8	Confident	147 Å²	147	58 Å²	58	72%	0.724	29%	0.292	S	S	*	.	H	α-helix	trans	-52.2	-36.9	173.4	-66	-62	-74.7	0	0	112.2	Y423 L424	M420-Y423 PolarHBondContact O-N 3.16Å; M420-L424 VanDerWaalsContact O-CG 3.28Å; M420-L424 WeakPolarHBondContact O-CG 3.46Å; M420-L424 PolarHBondContact O-N 2.64Å
421	I	88	Confident	83.2	Confident	30 Å²	30	56.5 Å²	56.5	15%	0.154	29%	0.286	C	S	.	.	H	α-helix	trans	-67	-39.9	177.7	-53.6	176.1	0	0	0	111.1	L398 Y402 V405 E419 L424 L425	L398-I421 HydrophobicContact CD1-CG2 4.04Å; Y402-I421 HydrophobicContact CD2-CB 4.44Å; Y402-I421 HydrophobicContact CD2-CG2 3.8Å; Y402-I421 HydrophobicContact CG-CG2 4.41Å; V405-I421 HydrophobicContact CB-CD1 4.2Å; V405-I421 HydrophobicContact CG1-CD1 4.18Å; V405-I421 HydrophobicContact CG2-CD1 3.87Å; E419-I421 PolarHBondContact O-N 3.5Å; E419-I421 VanDerWaalsContact O-N 3.15Å; I421-L424 PolarHBondContact O-N 2.95Å; I421-L425 HydrophobicContact CG2-CD1 4.36Å; I421-L425 WeakPolarHBondContact O-CG 3.29Å; I421-L425 PolarHBondContact O-N 2.92Å
422	D	87.3	Confident	84.4	Confident	13 Å²	13	52.9 Å²	52.9	7%	0.07	27%	0.27	C	S	.	.	H	α-helix	trans	-63.1	-44.6	175.4	-65.3	-63	0	0	0	110.8	Y402 L418 E419 L424 L425 I426 R471	Y402-D422 WeakPolarHBondContact CE2-OD1 3.38Å; L418-D422 HydrophobicContact CB-CB 4.36Å; L418-D422 HydrophobicContact CD2-CB 4.18Å; E419-D422 PolarHBondContact N-OD2 3.11Å; E419-D422 WeakPolarHBondContact O-CB 3.42Å; E419-D422 PolarHBondContact O-N 3.45Å; D422-L424 VanDerWaalsContact C-N 3.33Å; D422-L424 PolarHBondContact O-N 3.16Å; D422-L425 PolarHBondContact O-N 3.28Å; D422-I426 WeakPolarHBondContact O-CB 3.42Å; D422-I426 WeakPolarHBondContact O-CD1 3.19Å; D422-I426 WeakPolarHBondContact O-CG1 3.28Å; D422-I426 PolarHBondContact O-N 3Å; D422-R471 IonicContact OD1-NH1 3.38Å
423	Y	89.9	Confident	85.5	Confident	132 Å²	132	49.4 Å²	49.4	52%	0.518	25%	0.253	S	S	.	.	H	α-helix	trans	-62.5	-39.8	176.7	-70.2	-67.4	0	0	0	112.4	L418 E419 M420 L427	L418-Y423 HydrophobicContact CB-CE2 3.9Å; E419-Y423 WeakPolarHBondContact O-CD2 3.5Å; E419-Y423 PolarHBondContact O-N 3.2Å; M420-Y423 PolarHBondContact O-N 3.16Å; Y423-L427 WeakPolarHBondContact O-CB 3.33Å; Y423-L427 PolarHBondContact O-N 2.8Å
424	L	90.8	Very high	86.3	Confident	76 Å²	76	51.2 Å²	51.2	40%	0.398	26%	0.256	S	S	.	.	H	α-helix	trans	-61.2	-52.7	172.9	-70.8	168.3	0	0	0	110.1	L398 M420 I421 D422 I426 L427 W428	L398-L424 HydrophobicContact CD2-CB 4.01Å; M420-L424 VanDerWaalsContact O-CG 3.28Å; M420-L424 WeakPolarHBondContact O-CG 3.46Å; M420-L424 PolarHBondContact O-N 2.64Å; I421-L424 PolarHBondContact O-N 2.95Å; D422-L424 VanDerWaalsContact C-N 3.33Å; D422-L424 PolarHBondContact O-N 3.16Å; L424-I426 VanDerWaalsContact C-N 3.33Å; L424-I426 PolarHBondContact O-N 3.35Å; L424-L427 WeakPolarHBondContact O-CB 3.19Å; L424-L427 PolarHBondContact O-N 3.28Å; L424-W428 HydrophobicContact CB-CE3 4.46Å; L424-W428 HydrophobicContact CB-CZ3 4.16Å; L424-W428 HydrophobicContact CD2-CZ3 4.1Å; L424-W428 VanDerWaalsContact O-CE3 3.27Å; L424-W428 PolarHBondContact O-N 3.34Å
425	L	91.4	Very high	87.3	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-56.9	-44.8	178.9	-75.8	173	0	0	0	112.8	F395 L398 L399 Y402 I421 D422 L427 W428 I429 F468	F395-L425 HydrophobicContact CD2-CD2 4.18Å; F395-L425 HydrophobicContact CE2-CD2 3.89Å; L398-L425 HydrophobicContact CB-CD2 4.31Å; L398-L425 HydrophobicContact CD2-CD2 3.67Å; L398-L425 HydrophobicContact CD2-CG 3.97Å; L398-L425 HydrophobicContact CG-CD2 3.78Å; L398-L425 HydrophobicContact CG-CG 4.13Å; L399-L425 HydrophobicContact CD2-CD1 4.31Å; L399-L425 HydrophobicContact CD2-CD2 3.69Å; L399-L425 HydrophobicContact CG-CD2 4.15Å; Y402-L425 HydrophobicContact CD1-CD1 4.27Å; Y402-L425 HydrophobicContact CD2-CD1 3.69Å; Y402-L425 HydrophobicContact CE2-CD1 4.47Å; Y402-L425 HydrophobicContact CG-CD1 3.59Å; I421-L425 HydrophobicContact CG2-CD1 4.36Å; I421-L425 WeakPolarHBondContact O-CG 3.29Å; I421-L425 PolarHBondContact O-N 2.92Å; D422-L425 PolarHBondContact O-N 3.28Å; L425-L427 VanDerWaalsContact C-N 3.28Å; L425-L427 PolarHBondContact O-N 2.97Å; L425-W428 PolarHBondContact O-N 2.99Å; L425-W428 VanDerWaalsContact O-N 3.15Å; L425-I429 WeakPolarHBondContact O-CD1 3.49Å; L425-I429 VanDerWaalsContact O-CG1 3.3Å; L425-I429 WeakPolarHBondContact O-CG1 3.23Å; L425-I429 PolarHBondContact O-N 3.49Å; L425-F468 HydrophobicContact CB-CZ 3.95Å; L425-F468 HydrophobicContact CD1-CZ 4.26Å
426	I	91.8	Very high	88.1	Confident	35 Å²	35	50.6 Å²	50.6	18%	0.179	25%	0.251	C	S	.	.	H	α-helix	trans	-58	-43.1	176.1	-70	164.4	0	0	0	110.4	L418 D422 L424 W428 I429 I430 F468	L418-I426 HydrophobicContact CD2-CD1 3.83Å; D422-I426 WeakPolarHBondContact O-CB 3.42Å; D422-I426 WeakPolarHBondContact O-CD1 3.19Å; D422-I426 WeakPolarHBondContact O-CG1 3.28Å; D422-I426 PolarHBondContact O-N 3Å; L424-I426 VanDerWaalsContact C-N 3.33Å; L424-I426 PolarHBondContact O-N 3.35Å; I426-W428 PolarHBondContact O-N 3.38Å; I426-I429 PolarHBondContact O-N 3.4Å; I426-I430 HydrophobicContact CG2-CD1 3.66Å; I426-I430 HydrophobicContact CG2-CG1 4.27Å; I426-I430 WeakPolarHBondContact O-CB 3.27Å; I426-I430 VanDerWaalsContact O-CG1 3.27Å; I426-I430 WeakPolarHBondContact O-CG1 3.43Å; I426-I430 PolarHBondContact O-N 3.42Å; I426-F468 HydrophobicContact CD1-CD1 3.84Å; I426-F468 HydrophobicContact CD1-CE1 4.26Å; I426-F468 HydrophobicContact CG1-CD1 3.56Å; I426-F468 HydrophobicContact CG1-CE1 3.84Å; I426-F468 HydrophobicContact CG1-CG 3.96Å; I426-F468 HydrophobicContact CG1-CZ 4.48Å
427	L	91.8	Very high	88.7	Confident	79 Å²	79	52.9 Å²	52.9	41%	0.414	27%	0.265	S	S	.	.	H	α-helix	trans	-61	-42.1	177	-176.1	70.5	0	0	0	112.1	Y423 L424 L425 G431 P693	Y423-L427 WeakPolarHBondContact O-CB 3.33Å; Y423-L427 PolarHBondContact O-N 2.8Å; L424-L427 WeakPolarHBondContact O-CB 3.19Å; L424-L427 PolarHBondContact O-N 3.28Å; L425-L427 VanDerWaalsContact C-N 3.28Å; L425-L427 PolarHBondContact O-N 2.97Å; L427-G431 PolarHBondContact O-N 3.26Å; L427-P693 HydrophobicContact CD2-CB 3.87Å; L427-P693 HydrophobicContact CD2-CG 4.27Å; L427-P693 HydrophobicContact CG-CB 3.69Å
428	W	93.4	Very high	89.1	Confident	34 Å²	34	51.7 Å²	51.7	13%	0.129	25%	0.253	C	S	.	.	H	α-helix	trans	-64.3	-44.4	174.4	-100.5	-91.8	0	0	0	112.2	W359 S391 F395 L398 L424 L425 I426 G431 M432 P693	W359-W428 HydrophobicContact CH2-CZ2 4.16Å; W359-W428 HydrophobicContact CZ2-CZ2 4.17Å; S391-W428 PolarHBondContact OG-NE1 3Å; F395-W428 HydrophobicContact CB-CG 4.43Å; F395-W428 HydrophobicContact CD2-CB 3.75Å; F395-W428 AromaticContact CD2-CG 3.96Å; F395-W428 HydrophobicContact CD2-CG 3.96Å; F395-W428 HydrophobicContact CE2-CB 4.19Å; L398-W428 HydrophobicContact CD2-CE3 3.99Å; L398-W428 HydrophobicContact CD2-CZ3 4.04Å; L424-W428 HydrophobicContact CB-CE3 4.46Å; L424-W428 HydrophobicContact CB-CZ3 4.16Å; L424-W428 HydrophobicContact CD2-CZ3 4.1Å; L424-W428 VanDerWaalsContact O-CE3 3.27Å; L424-W428 PolarHBondContact O-N 3.34Å; L425-W428 PolarHBondContact O-N 2.99Å; L425-W428 VanDerWaalsContact O-N 3.15Å; I426-W428 PolarHBondContact O-N 3.38Å; W428-G431 CarbonylContact O-C 3.6Å; W428-G431 WeakPolarHBondContact O-CA 3.39Å; W428-G431 PolarHBondContact O-N 3.14Å; W428-G431 VanDerWaalsContact O-N 3.16Å; W428-M432 WeakPolarHBondContact O-CG 3.27Å; W428-M432 PolarHBondContact O-N 3.03Å; W428-P693 HydrophobicContact CD2-CB 4.21Å; W428-P693 HydrophobicContact CD2-CG 3.91Å; W428-P693 HydrophobicContact CE3-CB 4.44Å; W428-P693 HydrophobicContact CE3-CG 4.09Å; W428-P693 HydrophobicContact CG-CB 4.39Å; W428-P693 HydrophobicContact CG-CG 4.49Å; W428-P693 HydrophobicContact CH2-CG 4.18Å; W428-P693 HydrophobicContact CZ2-CG 3.99Å; W428-P693 HydrophobicContact CZ3-CG 4.23Å
429	I	93.5	Very high	89.3	Confident	6 Å²	6	51.8 Å²	51.8	3%	0.031	25%	0.25	C	C	.	.	H	α-helix	trans	-63.6	-45.2	-179.8	-68.1	159.2	0	0	0	110.6	F395 L425 I426 G431 M432 V433 Y464 F468	F395-I429 HydrophobicContact CE2-CG1 4.34Å; L425-I429 WeakPolarHBondContact O-CD1 3.49Å; L425-I429 VanDerWaalsContact O-CG1 3.3Å; L425-I429 WeakPolarHBondContact O-CG1 3.23Å; L425-I429 PolarHBondContact O-N 3.49Å; I426-I429 PolarHBondContact O-N 3.4Å; I429-G431 VanDerWaalsContact C-N 3.27Å; I429-G431 PolarHBondContact O-N 2.85Å; I429-M432 HydrophobicContact CG1-CE 4.13Å; I429-M432 PolarHBondContact O-N 3.37Å; I429-M432 VanDerWaalsContact O-N 3.14Å; I429-V433 HydrophobicContact CG2-CG2 4.29Å; I429-V433 VanDerWaalsContact O-CG2 3.31Å; I429-V433 WeakPolarHBondContact O-CG2 3.48Å; I429-V433 PolarHBondContact O-N 3.2Å; I429-Y464 HydrophobicContact CD1-CD1 4.25Å; I429-Y464 HydrophobicContact CD1-CG 4.16Å; I429-Y464 HydrophobicContact CG1-CG 4.37Å; I429-F468 HydrophobicContact CD1-CD2 3.51Å; I429-F468 HydrophobicContact CD1-CE2 3.13Å; I429-F468 HydrophobicContact CD1-CZ 4.03Å
430	I	92	Very high	89.6	Confident	88 Å²	88	51.4 Å²	51.4	45%	0.451	25%	0.25	S	C	.	.	H	α-helix	trans	-59.1	-42.1	173.9	-67.4	168.2	0	0	0	110.3	I426 M432 V433 W434 V696	I426-I430 HydrophobicContact CG2-CD1 3.66Å; I426-I430 HydrophobicContact CG2-CG1 4.27Å; I426-I430 WeakPolarHBondContact O-CB 3.27Å; I426-I430 VanDerWaalsContact O-CG1 3.27Å; I426-I430 WeakPolarHBondContact O-CG1 3.43Å; I426-I430 PolarHBondContact O-N 3.42Å; I430-M432 PolarHBondContact O-N 3.07Å; I430-V433 PolarHBondContact O-N 2.97Å; I430-W434 VanDerWaalsContact O-CB 3.24Å; I430-W434 WeakPolarHBondContact O-CB 3.39Å; I430-W434 PolarHBondContact O-N 2.98Å; I430-V696 HydrophobicContact CG2-CG2 4.04Å
431	G	91.6	Very high	89.6	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.9	-38.5	175.6	0	0	0	0	0	113.9	L427 W428 I429 S435	L427-G431 PolarHBondContact O-N 3.26Å; W428-G431 CarbonylContact O-C 3.6Å; W428-G431 WeakPolarHBondContact O-CA 3.39Å; W428-G431 PolarHBondContact O-N 3.14Å; W428-G431 VanDerWaalsContact O-N 3.16Å; I429-G431 VanDerWaalsContact C-N 3.27Å; I429-G431 PolarHBondContact O-N 2.85Å; G431-S435 PolarHBondContact O-N 2.98Å; G431-S435 VanDerWaalsContact O-N 3.12Å
432	M	91.6	Very high	89.1	Confident	8 Å²	8	57.5 Å²	57.5	4%	0.039	26%	0.263	C	S	.	.	H	α-helix	trans	-70.9	-45.9	175.5	-70.7	-169.6	-67.2	0	0	111.9	Y392 F395 W428 I429 I430 W434 S435 D436 M460 P692	Y392-M432 HydrophobicContact CD2-SD 4.45Å; Y392-M432 HydrophobicContact CE2-SD 4.29Å; F395-M432 HydrophobicContact CD1-CE 4.29Å; F395-M432 HydrophobicContact CD2-CE 4.31Å; F395-M432 HydrophobicContact CE1-CE 3.8Å; F395-M432 HydrophobicContact CE1-SD 4.45Å; F395-M432 HydrophobicContact CE2-CE 3.82Å; F395-M432 HydrophobicContact CZ-CE 3.54Å; W428-M432 WeakPolarHBondContact O-CG 3.27Å; W428-M432 PolarHBondContact O-N 3.03Å; I429-M432 HydrophobicContact CG1-CE 4.13Å; I429-M432 PolarHBondContact O-N 3.37Å; I429-M432 VanDerWaalsContact O-N 3.14Å; I430-M432 PolarHBondContact O-N 3.07Å; M432-W434 VanDerWaalsContact C-N 3.33Å; M432-W434 PolarHBondContact O-N 3.22Å; M432-S435 WeakPolarHBondContact O-CB 3.34Å; M432-S435 PolarHBondContact O-N 3.27Å; M432-S435 VanDerWaalsContact O-N 3.13Å; M432-D436 PolarHBondContact O-N 3.33Å; M432-M460 HydrophobicContact CE-CE 4.48Å; M432-M460 HydrophobicContact SD-CE 4.2Å; M432-P692 HydrophobicContact CG-CB 4.07Å; M432-P692 HydrophobicContact CG-CG 4.05Å
433	V	92.3	Very high	88.6	Confident	45 Å²	45	60.6 Å²	60.6	27%	0.273	28%	0.278	S	S	.	.	H	α-helix	trans	-59	-45.4	175.4	171.5	0	0	0	0	110.4	I429 I430 S435 D436 V437 N461	I429-V433 HydrophobicContact CG2-CG2 4.29Å; I429-V433 VanDerWaalsContact O-CG2 3.31Å; I429-V433 WeakPolarHBondContact O-CG2 3.48Å; I429-V433 PolarHBondContact O-N 3.2Å; I430-V433 PolarHBondContact O-N 2.97Å; V433-S435 VanDerWaalsContact C-N 3.29Å; V433-S435 PolarHBondContact O-N 3.28Å; V433-D436 PolarHBondContact O-N 3.25Å; V433-V437 HydrophobicContact CG1-CG2 4.26Å; V433-V437 VanDerWaalsContact O-CG2 3.29Å; V433-V437 WeakPolarHBondContact O-CG2 3.46Å; V433-V437 PolarHBondContact O-N 2.98Å; V433-N461 HydrophobicContact CG2-CB 4.09Å
434	W	89.9	Confident	88.4	Confident	116 Å²	116	55.8 Å²	55.8	44%	0.439	27%	0.268	S	S	.	.	H	α-helix	trans	-62.5	-35.8	177	-174.6	-124.7	0	0	0	112.8	I430 M432 K438	I430-W434 VanDerWaalsContact O-CB 3.24Å; I430-W434 WeakPolarHBondContact O-CB 3.39Å; I430-W434 PolarHBondContact O-N 2.98Å; M432-W434 VanDerWaalsContact C-N 3.33Å; M432-W434 PolarHBondContact O-N 3.22Å; W434-K438 WeakPolarHBondContact O-CB 3.47Å; W434-K438 WeakPolarHBondContact O-CG 3.38Å; W434-K438 PolarHBondContact O-N 3.43Å
435	S	87.2	Confident	88.2	Confident	30 Å²	30	57.4 Å²	57.4	21%	0.21	28%	0.277	C	S	.	.	H	α-helix	trans	-64.4	-43.5	173.6	-173.2	0	0	0	0	112	G431 M432 V433 K438 R439	G431-S435 PolarHBondContact O-N 2.98Å; G431-S435 VanDerWaalsContact O-N 3.12Å; M432-S435 WeakPolarHBondContact O-CB 3.34Å; M432-S435 PolarHBondContact O-N 3.27Å; M432-S435 VanDerWaalsContact O-N 3.13Å; V433-S435 VanDerWaalsContact C-N 3.29Å; V433-S435 PolarHBondContact O-N 3.28Å; S435-K438 PolarHBondContact O-N 3.31Å; S435-R439 PolarHBondContact O-N 2.85Å
436	D	88.9	Confident	87.9	Confident	16 Å²	16	65.3 Å²	65.3	9%	0.086	31%	0.314	C	S	.	.	H	α-helix	trans	-69.5	-39.8	179.1	-74.8	-0.9	0	0	0	111.4	M432 V433 R439 L440 N461	M432-D436 PolarHBondContact O-N 3.33Å; V433-D436 PolarHBondContact O-N 3.25Å; D436-R439 WeakPolarHBondContact O-CB 3.24Å; D436-R439 PolarHBondContact O-N 2.77Å; D436-L440 WeakPolarHBondContact O-CB 3.38Å; D436-L440 PolarHBondContact O-N 2.81Å; D436-N461 PolarHBondContact OD2-ND2 3.41Å
437	V	88.6	Confident	87.5	Confident	71 Å²	71	67.1 Å²	67.1	43%	0.43	32%	0.324	S	S	.	.	H	α-helix	trans	-61.5	-44.9	174.1	171.1	0	0	0	0	111.3	V433 R439 L440 W441	V433-V437 HydrophobicContact CG1-CG2 4.26Å; V433-V437 VanDerWaalsContact O-CG2 3.29Å; V433-V437 WeakPolarHBondContact O-CG2 3.46Å; V433-V437 PolarHBondContact O-N 2.98Å; V437-R439 VanDerWaalsContact C-N 3.3Å; V437-R439 PolarHBondContact O-N 3.24Å; V437-L440 PolarHBondContact O-N 3.31Å; V437-W441 WeakPolarHBondContact O-CB 3.49Å; V437-W441 PolarHBondContact O-N 3.34Å
438	K	84.8	Confident	87.2	Confident	43 Å²	43	63.6 Å²	63.6	19%	0.187	31%	0.305	C	S	.	.	H	α-helix	trans	-59.1	-43.4	174.3	-81.6	177.9	176.3	170.2	0	111.5	W434 S435 W441 Y442 N695	W434-K438 WeakPolarHBondContact O-CB 3.47Å; W434-K438 WeakPolarHBondContact O-CG 3.38Å; W434-K438 PolarHBondContact O-N 3.43Å; S435-K438 PolarHBondContact O-N 3.31Å; K438-W441 PolarHBondContact O-N 2.64Å; K438-Y442 HydrophobicContact CB-CE2 4.36Å; K438-Y442 WeakPolarHBondContact O-CD2 3.17Å; K438-Y442 PolarHBondContact O-N 2.8Å; K438-Y442 VanDerWaalsContact O-N 3.14Å; K438-N695 PolarHBondContact NZ-OD1 3.47Å
439	R	83.6	Confident	86.8	Confident	45 Å²	45	65.5 Å²	65.5	17%	0.17	32%	0.317	C	S	.	.	H	α-helix	trans	-63	-49	178.6	-179.8	174.4	-100.2	159.6	0.6	111.2	S435 D436 V437 W441 Y442 E443 F448 R453 N454	S435-R439 PolarHBondContact O-N 2.85Å; D436-R439 WeakPolarHBondContact O-CB 3.24Å; D436-R439 PolarHBondContact O-N 2.77Å; V437-R439 VanDerWaalsContact C-N 3.3Å; V437-R439 PolarHBondContact O-N 3.24Å; R439-W441 PolarHBondContact O-N 3.02Å; R439-Y442 PolarHBondContact O-N 3.26Å; R439-Y442 VanDerWaalsContact O-N 3.07Å; R439-E443 VanDerWaalsContact CD-OE2 3.23Å; R439-E443 WeakPolarHBondContact CD-OE2 3.37Å; R439-E443 HydrophobicContact CG-CG 4.12Å; R439-E443 WeakPolarHBondContact CG-OE1 3.48Å; R439-E443 WeakPolarHBondContact CG-OE2 3.29Å; R439-E443 IonicContact CZ-OE1 3.99Å; R439-E443 IonicContact NE-OE1 4Å; R439-E443 PolarHBondContact NE-OE1 3.15Å; R439-E443 IonicContact NE-OE2 2.84Å; R439-E443 PolarHBondContact O-N 2.88Å; R439-F448 HydrophobicContact CB-CE2 4.45Å; R439-F448 HydrophobicContact CG-CD2 3.97Å; R439-F448 HydrophobicContact CG-CE2 4.23Å; R439-R453 VanDerWaalsContact NH2-NH2 3.18Å; R439-N454 PolarHBondContact NH1-OD1 3.06Å
440	L	87.7	Confident	86.3	Confident	65 Å²	65	72 Å²	72	34%	0.34	35%	0.348	S	S	.	.	H	α-helix	trans	-55.9	-38.6	177	-176.1	66	0	0	0	111.6	D436 V437 G444 L445 F448	D436-L440 WeakPolarHBondContact O-CB 3.38Å; D436-L440 PolarHBondContact O-N 2.81Å; V437-L440 PolarHBondContact O-N 3.31Å; L440-G444 WeakPolarHBondContact O-CA 3.41Å; L440-G444 PolarHBondContact O-N 3.49Å; L440-L445 HydrophobicContact CD1-CB 4.27Å; L440-L445 HydrophobicContact CD1-CD1 3.78Å; L440-F448 HydrophobicContact CD1-CB 3.9Å; L440-F448 HydrophobicContact CD1-CD1 4.04Å; L440-F448 HydrophobicContact CD1-CG 3.91Å
441	W	85.7	Confident	86	Confident	197 Å²	197	70.4 Å²	70.4	75%	0.746	34%	0.338	S	S	*	.	H	α-helix	trans	-69.8	-31.8	177.8	-167.8	58	0	0	0	114	V437 K438 R439	V437-W441 WeakPolarHBondContact O-CB 3.49Å; V437-W441 PolarHBondContact O-N 3.34Å; K438-W441 PolarHBondContact O-N 2.64Å; R439-W441 PolarHBondContact O-N 3.02Å
442	Y	78.4	Confident	85.6	Confident	108 Å²	108	73.3 Å²	73.3	42%	0.424	36%	0.359	S	S	.	.	H	α-helix	trans	-90.1	-36.8	-179.3	-70	-54.5	0	0	0	114.5	K438 R439 K687	K438-Y442 HydrophobicContact CB-CE2 4.36Å; K438-Y442 WeakPolarHBondContact O-CD2 3.17Å; K438-Y442 PolarHBondContact O-N 2.8Å; K438-Y442 VanDerWaalsContact O-N 3.14Å; R439-Y442 PolarHBondContact O-N 3.26Å; R439-Y442 VanDerWaalsContact O-N 3.07Å; Y442-K687 HydrophobicContact CD1-CD 4.1Å; Y442-K687 HydrophobicContact CD2-CD 4.01Å; Y442-K687 HydrophobicContact CE1-CD 4.07Å; Y442-K687 HydrophobicContact CE2-CB 4.05Å; Y442-K687 HydrophobicContact CE2-CD 4Å; Y442-K687 HydrophobicContact CE2-CG 4.42Å; Y442-K687 HydrophobicContact CG-CD 4.08Å
443	E	76.4	Confident	85.3	Confident	79 Å²	79	74.4 Å²	74.4	37%	0.369	36%	0.362	S	S	.	.	H	α-helix	trans	-90.5	-29.7	-176.4	-68.1	172.1	-167.5	0	0	111.4	R439	R439-E443 VanDerWaalsContact CD-OE2 3.23Å; R439-E443 WeakPolarHBondContact CD-OE2 3.37Å; R439-E443 HydrophobicContact CG-CG 4.12Å; R439-E443 WeakPolarHBondContact CG-OE1 3.48Å; R439-E443 WeakPolarHBondContact CG-OE2 3.29Å; R439-E443 IonicContact CZ-OE1 3.99Å; R439-E443 IonicContact NE-OE1 4Å; R439-E443 PolarHBondContact NE-OE1 3.15Å; R439-E443 IonicContact NE-OE2 2.84Å; R439-E443 PolarHBondContact O-N 2.88Å
444	G	84.9	Confident	85.1	Confident	31 Å²	31	72.5 Å²	72.5	32%	0.32	35%	0.35	S	S	.	.			trans	91.2	167.1	-170.9	0	0	0	0	0	112.3	L440 F448	L440-G444 WeakPolarHBondContact O-CA 3.41Å; L440-G444 PolarHBondContact O-N 3.49Å; G444-F448 WeakPolarHBondContact O-CB 3.42Å; G444-F448 PolarHBondContact O-N 3Å
445	L	86.6	Confident	85.1	Confident	110 Å²	110	71.3 Å²	71.3	58%	0.576	35%	0.35	S	S	*	.	H	α-helix	trans	-72.3	-43.1	-173.3	-177.3	69	0	0	0	113.1	L440 F448 L449	L440-L445 HydrophobicContact CD1-CB 4.27Å; L440-L445 HydrophobicContact CD1-CD1 3.78Å; L445-F448 PolarHBondContact O-N 2.85Å; L445-L449 HydrophobicContact CD1-CD1 4Å; L445-L449 HydrophobicContact CD1-CG 4.27Å; L445-L449 HydrophobicContact CG-CD1 4.08Å; L445-L449 WeakPolarHBondContact O-CG 3.5Å; L445-L449 PolarHBondContact O-N 3.13Å
446	E	85.7	Confident	85.2	Confident	165 Å²	165	71.6 Å²	71.6	77%	0.771	35%	0.349	S	S	*	.	H	α-helix	trans	-64.7	-55.4	-176.4	-66.9	177.1	177.5	0	0	111	F448 L449 E450	E446-F448 PolarHBondContact O-N 2.74Å; E446-L449 PolarHBondContact O-N 2.68Å; E446-L449 VanDerWaalsContact O-N 3.14Å; E446-E450 PolarHBondContact O-N 2.84Å
447	D	82.2	Confident	85.3	Confident	73 Å²	73	70.9 Å²	70.9	39%	0.39	35%	0.345	S	S	.	.	H	α-helix	trans	-59.3	-34.3	176.8	-70.6	-0.9	0	0	0	112
448	F	86.2	Confident	85.4	Confident	5 Å²	5	72.9 Å²	72.9	2%	0.022	35%	0.348	C	S	.	.	H	α-helix	trans	-66.9	-44.4	177	179.2	-93.1	0	0	0	112	R439 L440 G444 L445 E446 N454 F458	R439-F448 HydrophobicContact CB-CE2 4.45Å; R439-F448 HydrophobicContact CG-CD2 3.97Å; R439-F448 HydrophobicContact CG-CE2 4.23Å; L440-F448 HydrophobicContact CD1-CB 3.9Å; L440-F448 HydrophobicContact CD1-CD1 4.04Å; L440-F448 HydrophobicContact CD1-CG 3.91Å; G444-F448 WeakPolarHBondContact O-CB 3.42Å; G444-F448 PolarHBondContact O-N 3Å; L445-F448 PolarHBondContact O-N 2.85Å; E446-F448 PolarHBondContact O-N 2.74Å; F448-N454 HydrophobicContact CD1-CB 4.37Å; F448-N454 HydrophobicContact CD2-CB 3.96Å; F448-N454 HydrophobicContact CE1-CB 4.14Å; F448-N454 HydrophobicContact CE2-CB 3.73Å; F448-N454 HydrophobicContact CG-CB 4.28Å; F448-N454 HydrophobicContact CZ-CB 3.83Å; F448-N454 WeakPolarHBondContact O-CB 3.2Å; F448-N454 PolarHBondContact O-ND2 3.09Å; F448-F458 HydrophobicContact CE1-CB 4.19Å; F448-F458 HydrophobicContact CZ-CB 4.41Å
449	L	85.2	Confident	85.9	Confident	75 Å²	75	74 Å²	74	39%	0.393	36%	0.358	S	S	.	.	H	α-helix	trans	-77.2	-23	-178.4	-72	177.7	0	0	0	113	L445 E446 E451 Q455	L445-L449 HydrophobicContact CD1-CD1 4Å; L445-L449 HydrophobicContact CD1-CG 4.27Å; L445-L449 HydrophobicContact CG-CD1 4.08Å; L445-L449 WeakPolarHBondContact O-CG 3.5Å; L445-L449 PolarHBondContact O-N 3.13Å; E446-L449 PolarHBondContact O-N 2.68Å; E446-L449 VanDerWaalsContact O-N 3.14Å; L449-E451 PolarHBondContact O-N 2.89Å; L449-Q455 WeakPolarHBondContact O-CG 3.34Å; L449-Q455 PolarHBondContact O-NE2 3.06Å
450	E	83.8	Confident	86.4	Confident	143 Å²	143	71.8 Å²	71.8	67%	0.668	35%	0.35	S	S	*	.	H	α-helix	trans	-63.9	-30.4	176	-162.8	-172.9	173.3	0	0	112	E446 S452	E446-E450 PolarHBondContact O-N 2.84Å; E450-S452 PolarHBondContact O-N 3.44Å
451	E	84.8	Confident	86.7	Confident	54 Å²	54	69 Å²	69	25%	0.252	34%	0.335	S	S	.	.			trans	-84.7	115.2	-177.9	-173.6	68.3	-148.1	0	0	112.5	L449 R453 N454 Q455 K678	L449-E451 PolarHBondContact O-N 2.89Å; E451-R453 HydrophobicContact CG-CB 4.13Å; E451-R453 PolarHBondContact O-N 2.69Å; E451-R453 VanDerWaalsContact O-N 3.14Å; E451-N454 HydrophobicContact CB-CB 4.2Å; E451-N454 WeakPolarHBondContact O-CB 3.3Å; E451-N454 PolarHBondContact O-N 3.16Å; E451-Q455 PolarHBondContact O-N 3.05Å; E451-Q455 VanDerWaalsContact O-N 3.09Å; E451-K678 WeakPolarHBondContact OE2-CE 3.01Å; E451-K678 IonicContact OE2-NZ 3.58Å; E451-K678 PolarHBondContact OE2-NZ 3.44Å
452	S	83.2	Confident	87.1	Confident	61 Å²	61	62.3 Å²	62.3	43%	0.427	32%	0.319	S	S	.	.	H	α-helix	trans	-58	-31.8	-179	62.1	0	0	0	0	114.2	E450 N454 Q455 L456	E450-S452 PolarHBondContact O-N 3.44Å; S452-N454 VanDerWaalsContact C-N 3.34Å; S452-N454 PolarHBondContact O-N 3.02Å; S452-Q455 PolarHBondContact O-N 3Å; S452-L456 PolarHBondContact O-N 3.27Å
453	R	85.5	Confident	87.9	Confident	31 Å²	31	58.4 Å²	58.4	12%	0.117	31%	0.305	C	S	.	.	H	α-helix	trans	-63.6	-39.8	174.9	-170.9	-176	88.5	121.4	-2.1	112.4	R439 E451 S457 F521	R439-R453 VanDerWaalsContact NH2-NH2 3.18Å; E451-R453 HydrophobicContact CG-CB 4.13Å; E451-R453 PolarHBondContact O-N 2.69Å; E451-R453 VanDerWaalsContact O-N 3.14Å; R453-S457 WeakPolarHBondContact O-CB 3.41Å; R453-S457 PolarHBondContact O-N 3.23Å; R453-S457 VanDerWaalsContact O-N 3.09Å; R453-S457 PolarHBondContact O-OG 2.86Å; R453-F521 HydrophobicContact CB-CD1 4.36Å; R453-F521 HydrophobicContact CB-CD2 4.34Å; R453-F521 HydrophobicContact CB-CE1 4.38Å; R453-F521 HydrophobicContact CB-CE2 4.32Å; R453-F521 HydrophobicContact CB-CG 4.36Å; R453-F521 HydrophobicContact CB-CZ 4.36Å; R453-F521 HydrophobicContact CG-CB 4.33Å; R453-F521 HydrophobicContact CG-CD1 4.49Å; R453-F521 HydrophobicContact CG-CD2 3.9Å; R453-F521 HydrophobicContact CG-CE2 4.28Å; R453-F521 HydrophobicContact CG-CG 4.01Å
454	N	88.1	Confident	88.8	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.021	29%	0.288	C	S	.	.	H	α-helix	trans	-72.5	-41.4	179.3	-70.9	-13.7	0	0	0	109.8	R439 F448 E451 S452 L456 S457 F458	R439-N454 PolarHBondContact NH1-OD1 3.06Å; F448-N454 HydrophobicContact CD1-CB 4.37Å; F448-N454 HydrophobicContact CD2-CB 3.96Å; F448-N454 HydrophobicContact CE1-CB 4.14Å; F448-N454 HydrophobicContact CE2-CB 3.73Å; F448-N454 HydrophobicContact CG-CB 4.28Å; F448-N454 HydrophobicContact CZ-CB 3.83Å; F448-N454 WeakPolarHBondContact O-CB 3.2Å; F448-N454 PolarHBondContact O-ND2 3.09Å; E451-N454 HydrophobicContact CB-CB 4.2Å; E451-N454 WeakPolarHBondContact O-CB 3.3Å; E451-N454 PolarHBondContact O-N 3.16Å; S452-N454 VanDerWaalsContact C-N 3.34Å; S452-N454 PolarHBondContact O-N 3.02Å; N454-L456 PolarHBondContact O-N 3.28Å; N454-S457 PolarHBondContact O-N 2.63Å; N454-F458 WeakPolarHBondContact O-CB 3.42Å; N454-F458 PolarHBondContact O-N 2.86Å
455	Q	89.2	Confident	89.2	Confident	92 Å²	92	57.9 Å²	57.9	43%	0.43	30%	0.297	S	S	.	.	H	α-helix	trans	-55.3	-50.1	172.5	-64.1	178.4	-11.5	0	0	111.9	L449 E451 S452 S457 F458 V459	L449-Q455 WeakPolarHBondContact O-CG 3.34Å; L449-Q455 PolarHBondContact O-NE2 3.06Å; E451-Q455 PolarHBondContact O-N 3.05Å; E451-Q455 VanDerWaalsContact O-N 3.09Å; S452-Q455 PolarHBondContact O-N 3Å; Q455-S457 VanDerWaalsContact C-N 3.33Å; Q455-S457 PolarHBondContact O-N 2.87Å; Q455-F458 PolarHBondContact O-N 3.17Å; Q455-V459 WeakPolarHBondContact O-CG2 3.44Å; Q455-V459 PolarHBondContact O-N 3.2Å
456	L	90.5	Very high	89.6	Confident	36 Å²	36	54.2 Å²	54.2	19%	0.188	28%	0.283	C	S	.	.	H	α-helix	trans	-60.4	-43.8	177.5	-174	76	0	0	0	111.3	S452 N454 F458 V459 M460 L514 R518 F521	S452-L456 PolarHBondContact O-N 3.27Å; N454-L456 PolarHBondContact O-N 3.28Å; L456-F458 VanDerWaalsContact C-N 3.34Å; L456-F458 PolarHBondContact O-N 2.99Å; L456-V459 PolarHBondContact O-N 3.12Å; L456-M460 WeakPolarHBondContact O-CB 3.17Å; L456-M460 PolarHBondContact O-N 3.4Å; L456-L514 HydrophobicContact CD1-CB 4.3Å; L456-L514 HydrophobicContact CD1-CD2 3.94Å; L456-R518 HydrophobicContact CD2-CB 4.04Å; L456-R518 HydrophobicContact CD2-CG 4.38Å; L456-F521 HydrophobicContact CB-CE2 4.12Å; L456-F521 HydrophobicContact CD2-CD2 4.22Å; L456-F521 HydrophobicContact CD2-CE2 3.54Å; L456-F521 HydrophobicContact CG-CE2 4.44Å
457	S	89.7	Confident	89.9	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.007	25%	0.246	C	C	.	.	H	α-helix	trans	-64	-40	-179.5	-56.7	0	0	0	0	111.5	R453 N454 Q455 N461 R518	R453-S457 WeakPolarHBondContact O-CB 3.41Å; R453-S457 PolarHBondContact O-N 3.23Å; R453-S457 VanDerWaalsContact O-N 3.09Å; R453-S457 PolarHBondContact O-OG 2.86Å; N454-S457 PolarHBondContact O-N 2.63Å; Q455-S457 VanDerWaalsContact C-N 3.33Å; Q455-S457 PolarHBondContact O-N 2.87Å; S457-N461 VanDerWaalsContact O-CB 3.24Å; S457-N461 WeakPolarHBondContact O-CB 3.45Å; S457-N461 PolarHBondContact O-N 3.27Å; S457-N461 PolarHBondContact O-ND2 3.5Å; S457-R518 PolarHBondContact OG-NE 3.43Å; S457-R518 PolarHBondContact OG-NH2 3.04Å; S457-R518 VanDerWaalsContact OG-NH2 3.11Å
458	F	92.4	Very high	90.3	Very high	112 Å²	112	43.5 Å²	43.5	49%	0.491	23%	0.23	S	C	.	.	H	α-helix	trans	-63.8	-48.3	176.9	179.2	-101.7	0	0	0	112.2	F448 N454 Q455 L456 N461 S462	F448-F458 HydrophobicContact CE1-CB 4.19Å; F448-F458 HydrophobicContact CZ-CB 4.41Å; N454-F458 WeakPolarHBondContact O-CB 3.42Å; N454-F458 PolarHBondContact O-N 2.86Å; Q455-F458 PolarHBondContact O-N 3.17Å; L456-F458 VanDerWaalsContact C-N 3.34Å; L456-F458 PolarHBondContact O-N 2.99Å; F458-N461 PolarHBondContact O-N 3.37Å; F458-S462 WeakPolarHBondContact O-CB 3.45Å; F458-S462 PolarHBondContact O-N 3.13Å; F458-S462 PolarHBondContact O-OG 3.44Å
459	V	93.8	Very high	90.6	Very high	66 Å²	66	46.4 Å²	46.4	40%	0.4	25%	0.249	S	C	.	.	H	α-helix	trans	-63.6	-44.2	177.3	175	0	0	0	0	111	Q455 L456 S462 L463 L514	Q455-V459 WeakPolarHBondContact O-CG2 3.44Å; Q455-V459 PolarHBondContact O-N 3.2Å; L456-V459 PolarHBondContact O-N 3.12Å; V459-S462 PolarHBondContact O-N 2.96Å; V459-S462 PolarHBondContact O-OG 3.28Å; V459-L463 HydrophobicContact CG1-CD1 3.93Å; V459-L463 WeakPolarHBondContact O-CD1 3.47Å; V459-L463 WeakPolarHBondContact O-CG 3.41Å; V459-L463 PolarHBondContact O-N 3.5Å; V459-L463 VanDerWaalsContact O-N 3.12Å; V459-L514 HydrophobicContact CG1-CD1 3.88Å
460	M	94.4	Very high	90.9	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.6	-47.9	177.1	-179.9	-162.1	73.7	0	0	111.5	M432 L456 L463 Y464 L514	M432-M460 HydrophobicContact CE-CE 4.48Å; M432-M460 HydrophobicContact SD-CE 4.2Å; L456-M460 WeakPolarHBondContact O-CB 3.17Å; L456-M460 PolarHBondContact O-N 3.4Å; M460-L463 PolarHBondContact O-N 3.3Å; M460-Y464 HydrophobicContact CG-CD2 3.85Å; M460-Y464 HydrophobicContact CG-CE2 3.55Å; M460-Y464 VanDerWaalsContact O-CD2 3.26Å; M460-Y464 WeakPolarHBondContact O-CD2 3.5Å; M460-Y464 PolarHBondContact O-N 2.9Å; M460-Y464 HydrophobicContact SD-CE2 4.1Å; M460-L514 HydrophobicContact CB-CB 4.3Å; M460-L514 HydrophobicContact CG-CB 4.37Å
461	N	93.4	Very high	91.1	Very high	6 Å²	6	39.2 Å²	39.2	3%	0.032	21%	0.213	C	C	.	.	H	α-helix	trans	-67.3	-36.4	-178.5	-75.4	-23.9	0	0	0	112.5	V433 D436 S457 F458 Y464 L465	V433-N461 HydrophobicContact CG2-CB 4.09Å; D436-N461 PolarHBondContact OD2-ND2 3.41Å; S457-N461 VanDerWaalsContact O-CB 3.24Å; S457-N461 WeakPolarHBondContact O-CB 3.45Å; S457-N461 PolarHBondContact O-N 3.27Å; S457-N461 PolarHBondContact O-ND2 3.5Å; F458-N461 PolarHBondContact O-N 3.37Å; N461-Y464 PolarHBondContact O-N 3.47Å; N461-L465 WeakPolarHBondContact O-CB 3.44Å; N461-L465 PolarHBondContact O-N 3.24Å
462	S	94.9	Very high	91.3	Very high	57 Å²	57	40.9 Å²	40.9	40%	0.399	22%	0.223	S	C	.	.	H	α-helix	trans	-66.7	-39.5	176	67.2	0	0	0	0	112.1	F458 V459 L465 A466	F458-S462 WeakPolarHBondContact O-CB 3.45Å; F458-S462 PolarHBondContact O-N 3.13Å; F458-S462 PolarHBondContact O-OG 3.44Å; V459-S462 PolarHBondContact O-N 2.96Å; V459-S462 PolarHBondContact O-OG 3.28Å; S462-L465 PolarHBondContact O-N 3.41Å; S462-A466 WeakPolarHBondContact O-CB 3.17Å; S462-A466 PolarHBondContact O-N 2.83Å
463	L	95.3	Very high	91.5	Very high	26 Å²	26	41.9 Å²	41.9	14%	0.136	23%	0.226	C	C	.	.	H	α-helix	trans	-65.6	-40.8	174.7	-68.4	163.4	0	0	0	112.5	V459 M460 A466 T467 L507 F510 A511 L514	V459-L463 HydrophobicContact CG1-CD1 3.93Å; V459-L463 WeakPolarHBondContact O-CD1 3.47Å; V459-L463 WeakPolarHBondContact O-CG 3.41Å; V459-L463 PolarHBondContact O-N 3.5Å; V459-L463 VanDerWaalsContact O-N 3.12Å; M460-L463 PolarHBondContact O-N 3.3Å; L463-A466 PolarHBondContact O-N 3.28Å; L463-T467 WeakPolarHBondContact O-CB 3.47Å; L463-T467 PolarHBondContact O-N 3.35Å; L463-T467 PolarHBondContact O-OG1 3.39Å; L463-L507 HydrophobicContact CD2-CD2 3.79Å; L463-F510 HydrophobicContact CD1-CD1 3.42Å; L463-F510 VanDerWaalsContact CD1-CD1 3.42Å; L463-F510 HydrophobicContact CD1-CE1 3.76Å; L463-F510 HydrophobicContact CD2-CD1 4.32Å; L463-A511 HydrophobicContact CB-CB 3.89Å; L463-L514 HydrophobicContact CD1-CD1 3.65Å
464	Y	94.4	Very high	91.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.2	-44.2	173.4	-80.8	-52.3	0	0	0	111.6	F395 L399 I429 M460 N461 A466 T467 F468 F508 A511 N512 S515	F395-Y464 HydrophobicContact CE1-CE2 4.36Å; F395-Y464 HydrophobicContact CZ-CE2 4.03Å; L399-Y464 VanDerWaalsContact CD1-OH 3.28Å; L399-Y464 WeakPolarHBondContact CD1-OH 3.4Å; L399-Y464 HydrophobicContact CD2-CE1 4.36Å; I429-Y464 HydrophobicContact CD1-CD1 4.25Å; I429-Y464 HydrophobicContact CD1-CG 4.16Å; I429-Y464 HydrophobicContact CG1-CG 4.37Å; M460-Y464 HydrophobicContact CG-CD2 3.85Å; M460-Y464 HydrophobicContact CG-CE2 3.55Å; M460-Y464 VanDerWaalsContact O-CD2 3.26Å; M460-Y464 WeakPolarHBondContact O-CD2 3.5Å; M460-Y464 PolarHBondContact O-N 2.9Å; M460-Y464 HydrophobicContact SD-CE2 4.1Å; N461-Y464 PolarHBondContact O-N 3.47Å; Y464-A466 VanDerWaalsContact C-N 3.35Å; Y464-A466 PolarHBondContact O-N 2.94Å; Y464-T467 WeakPolarHBondContact O-CB 3.44Å; Y464-T467 PolarHBondContact O-N 3.18Å; Y464-F468 VanDerWaalsContact O-CD2 3.32Å; Y464-F468 WeakPolarHBondContact O-CD2 3.33Å; Y464-F468 PolarHBondContact O-N 3.36Å; Y464-F508 HydrophobicContact CD1-CD2 4.23Å; Y464-F508 HydrophobicContact CD1-CE2 4.34Å; Y464-F508 AromaticContact CE1-CD2 3.96Å; Y464-F508 HydrophobicContact CE1-CD2 3.96Å; Y464-F508 AromaticContact CE1-CE2 3.86Å; Y464-F508 HydrophobicContact CE1-CE2 3.86Å; Y464-A511 HydrophobicContact CD1-CB 3.76Å; Y464-A511 HydrophobicContact CD2-CB 4.2Å; Y464-A511 HydrophobicContact CE1-CB 3.54Å; Y464-A511 HydrophobicContact CE2-CB 4.02Å; Y464-A511 HydrophobicContact CG-CB 4.06Å; Y464-A511 PolarHBondContact OH-O 3.24Å; Y464-N512 WeakPolarHBondContact OH-CA 3.45Å; Y464-N512 PolarHBondContact OH-N 3.29Å; Y464-N512 PolarHBondContact OH-OD1 3.35Å; Y464-S515 WeakPolarHBondContact OH-CB 3.34Å; Y464-S515 PolarHBondContact OH-OG 3.47Å
465	L	94.3	Very high	91.4	Very high	98 Å²	98	42.6 Å²	42.6	51%	0.513	23%	0.231	S	C	.	.	H	α-helix	trans	-61.3	-43.5	176.5	-173	65.7	0	0	0	111.6	N461 S462 T467 F468 T469	N461-L465 WeakPolarHBondContact O-CB 3.44Å; N461-L465 PolarHBondContact O-N 3.24Å; S462-L465 PolarHBondContact O-N 3.41Å; L465-T467 VanDerWaalsContact C-N 3.34Å; L465-T467 PolarHBondContact O-N 3.37Å; L465-F468 PolarHBondContact O-N 2.7Å; L465-T469 HydrophobicContact CD1-CG2 4.44Å; L465-T469 HydrophobicContact CG-CG2 4.49Å; L465-T469 WeakPolarHBondContact O-CB 3.49Å; L465-T469 VanDerWaalsContact O-CG2 3.24Å; L465-T469 WeakPolarHBondContact O-CG2 3.32Å; L465-T469 PolarHBondContact O-N 2.77Å; L465-T469 PolarHBondContact O-OG1 3.23Å
466	A	94.8	Very high	91.2	Very high	34 Å²	34	42.1 Å²	42.1	28%	0.281	24%	0.237	S	C	.	.	H	α-helix	trans	-61.1	-41.6	175.1	0	0	0	0	0	112.1	S462 L463 Y464 T469 L470 L507	S462-A466 WeakPolarHBondContact O-CB 3.17Å; S462-A466 PolarHBondContact O-N 2.83Å; L463-A466 PolarHBondContact O-N 3.28Å; Y464-A466 VanDerWaalsContact C-N 3.35Å; Y464-A466 PolarHBondContact O-N 2.94Å; A466-T469 VanDerWaalsContact CA-OG1 3.32Å; A466-T469 WeakPolarHBondContact CA-OG1 3.23Å; A466-T469 PolarHBondContact O-OG1 2.95Å; A466-L470 WeakPolarHBondContact O-CB 3.4Å; A466-L470 VanDerWaalsContact O-CG 3.29Å; A466-L470 WeakPolarHBondContact O-CG 3.17Å; A466-L470 PolarHBondContact O-N 2.9Å; A466-L507 HydrophobicContact CB-CD1 4.1Å
467	T	92.9	Very high	90.9	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.9	-52.1	178.1	-61.3	0	0	0	0	111.8	L463 Y464 L465 L470 R471 A504 F508	L463-T467 WeakPolarHBondContact O-CB 3.47Å; L463-T467 PolarHBondContact O-N 3.35Å; L463-T467 PolarHBondContact O-OG1 3.39Å; Y464-T467 WeakPolarHBondContact O-CB 3.44Å; Y464-T467 PolarHBondContact O-N 3.18Å; L465-T467 VanDerWaalsContact C-N 3.34Å; L465-T467 PolarHBondContact O-N 3.37Å; T467-L470 PolarHBondContact O-N 3.27Å; T467-R471 WeakPolarHBondContact O-CG 3.3Å; T467-R471 PolarHBondContact O-N 3.41Å; T467-A504 HydrophobicContact CG2-CB 4.29Å; T467-A504 WeakPolarHBondContact CG2-O 3.37Å; T467-F508 HydrophobicContact CG2-CB 3.68Å; T467-F508 HydrophobicContact CG2-CD2 3.9Å; T467-F508 HydrophobicContact CG2-CG 4.15Å; T467-F508 PolarHBondContact OG1-N 3.01Å
468	F	90.5	Very high	90.4	Very high	12 Å²	12	49.1 Å²	49.1	5%	0.053	27%	0.266	C	S	.	.	H	α-helix	trans	-72.1	-33	-176.5	-78.3	-78.7	0	0	0	112.4	L425 I426 I429 Y464 L465 R471 I472	L425-F468 HydrophobicContact CB-CZ 3.95Å; L425-F468 HydrophobicContact CD1-CZ 4.26Å; I426-F468 HydrophobicContact CD1-CD1 3.84Å; I426-F468 HydrophobicContact CD1-CE1 4.26Å; I426-F468 HydrophobicContact CG1-CD1 3.56Å; I426-F468 HydrophobicContact CG1-CE1 3.84Å; I426-F468 HydrophobicContact CG1-CG 3.96Å; I426-F468 HydrophobicContact CG1-CZ 4.48Å; I429-F468 HydrophobicContact CD1-CD2 3.51Å; I429-F468 HydrophobicContact CD1-CE2 3.13Å; I429-F468 HydrophobicContact CD1-CZ 4.03Å; Y464-F468 VanDerWaalsContact O-CD2 3.32Å; Y464-F468 WeakPolarHBondContact O-CD2 3.33Å; Y464-F468 PolarHBondContact O-N 3.36Å; L465-F468 PolarHBondContact O-N 2.7Å; F468-R471 PolarHBondContact O-N 3.31Å; F468-I472 VanDerWaalsContact O-CG1 3.26Å; F468-I472 WeakPolarHBondContact O-CG1 3.14Å; F468-I472 PolarHBondContact O-N 3.48Å
469	T	91.6	Very high	89.4	Confident	67 Å²	67	49.8 Å²	49.8	41%	0.411	27%	0.269	S	S	.	.	H	α-helix	trans	-64.4	-45.9	172.7	49.5	0	0	0	0	111.6	L465 A466 R471 I472 V473	L465-T469 HydrophobicContact CD1-CG2 4.44Å; L465-T469 HydrophobicContact CG-CG2 4.49Å; L465-T469 WeakPolarHBondContact O-CB 3.49Å; L465-T469 VanDerWaalsContact O-CG2 3.24Å; L465-T469 WeakPolarHBondContact O-CG2 3.32Å; L465-T469 PolarHBondContact O-N 2.77Å; L465-T469 PolarHBondContact O-OG1 3.23Å; A466-T469 VanDerWaalsContact CA-OG1 3.32Å; A466-T469 WeakPolarHBondContact CA-OG1 3.23Å; A466-T469 PolarHBondContact O-OG1 2.95Å; T469-R471 VanDerWaalsContact C-N 3.29Å; T469-R471 PolarHBondContact O-N 3.48Å; T469-I472 PolarHBondContact O-N 2.86Å; T469-V473 VanDerWaalsContact O-CG2 3.3Å; T469-V473 WeakPolarHBondContact O-CG2 3.38Å; T469-V473 PolarHBondContact O-N 3.42Å
470	L	91.1	Very high	88	Confident	46 Å²	46	52 Å²	52	24%	0.241	28%	0.278	C	S	.	.	H	α-helix	trans	-60.3	-37.5	174.7	-74.7	172.9	0	0	0	112.5	A466 T467 V473 A474 P500 V503 A504 L507	A466-L470 WeakPolarHBondContact O-CB 3.4Å; A466-L470 VanDerWaalsContact O-CG 3.29Å; A466-L470 WeakPolarHBondContact O-CG 3.17Å; A466-L470 PolarHBondContact O-N 2.9Å; T467-L470 PolarHBondContact O-N 3.27Å; L470-V473 PolarHBondContact O-N 3.43Å; L470-A474 WeakPolarHBondContact O-CB 3.5Å; L470-A474 PolarHBondContact O-N 3.09Å; L470-P500 HydrophobicContact CD2-CB 4.34Å; L470-V503 HydrophobicContact CD1-CB 4.3Å; L470-V503 HydrophobicContact CD1-CG1 3.87Å; L470-A504 HydrophobicContact CB-CB 3.91Å; L470-A504 HydrophobicContact CD1-CB 4.35Å; L470-L507 HydrophobicContact CD1-CD1 3.93Å
471	R	88	Confident	86.4	Confident	21 Å²	21	56 Å²	56	8%	0.079	31%	0.306	C	S	.	.	H	α-helix	trans	-66.7	-41.5	175.1	-76.1	174.3	167.3	-158	-10.1	113.1	Y402 D422 T467 F468 T469 V473 A474 H475 I501 A504	Y402-R471 PolarHBondContact OH-NH1 3.44Å; Y402-R471 PolarHBondContact OH-NH2 2.73Å; D422-R471 IonicContact OD1-NH1 3.38Å; T467-R471 WeakPolarHBondContact O-CG 3.3Å; T467-R471 PolarHBondContact O-N 3.41Å; F468-R471 PolarHBondContact O-N 3.31Å; T469-R471 VanDerWaalsContact C-N 3.29Å; T469-R471 PolarHBondContact O-N 3.48Å; R471-V473 VanDerWaalsContact C-N 3.34Å; R471-A474 PolarHBondContact O-N 2.95Å; R471-H475 WeakPolarHBondContact O-CB 3.49Å; R471-H475 PolarHBondContact O-N 3.3Å; R471-I501 HydrophobicContact CG-CD1 3.91Å; R471-A504 HydrophobicContact CG-CB 4.03Å
472	I	88.4	Confident	84.7	Confident	88 Å²	88	61.7 Å²	61.7	45%	0.451	33%	0.33	S	S	.	.	H	α-helix	trans	-63.7	-42.8	174.8	-68.2	164.3	0	0	0	110.2	F468 T469 H475 S476	F468-I472 VanDerWaalsContact O-CG1 3.26Å; F468-I472 WeakPolarHBondContact O-CG1 3.14Å; F468-I472 PolarHBondContact O-N 3.48Å; T469-I472 PolarHBondContact O-N 2.86Å; I472-H475 PolarHBondContact O-N 3.04Å; I472-S476 WeakPolarHBondContact O-CB 3.23Å; I472-S476 PolarHBondContact O-N 3.49Å
473	V	89.3	Confident	82.8	Confident	83 Å²	83	64.8 Å²	64.8	50%	0.503	34%	0.342	S	S	.	.	H	α-helix	trans	-62.2	-46.3	176	170.7	0	0	0	0	111.1	T469 L470 R471 S476 K477	T469-V473 VanDerWaalsContact O-CG2 3.3Å; T469-V473 WeakPolarHBondContact O-CG2 3.38Å; T469-V473 PolarHBondContact O-N 3.42Å; L470-V473 PolarHBondContact O-N 3.43Å; R471-V473 VanDerWaalsContact C-N 3.34Å; V473-S476 PolarHBondContact O-N 2.96Å; V473-K477 WeakPolarHBondContact O-CB 3.49Å; V473-K477 PolarHBondContact O-N 3.14Å
474	A	86.6	Confident	80.9	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-60.1	-47.9	176.5	0	0	0	0	0	111.1	L470 R471 S476 K477 F478 P500	L470-A474 WeakPolarHBondContact O-CB 3.5Å; L470-A474 PolarHBondContact O-N 3.09Å; R471-A474 PolarHBondContact O-N 2.95Å; A474-S476 PolarHBondContact O-N 3.5Å; A474-K477 PolarHBondContact O-N 3.3Å; A474-F478 HydrophobicContact CB-CD2 4.47Å; A474-F478 WeakPolarHBondContact O-CB 3.44Å; A474-F478 WeakPolarHBondContact O-CD2 3.42Å; A474-F478 PolarHBondContact O-N 2.87Å; A474-P500 HydrophobicContact CB-CB 4.38Å; A474-P500 HydrophobicContact CB-CG 4.07Å
475	H	84.9	Confident	78.9	Confident	49 Å²	49	75.9 Å²	75.9	23%	0.227	41%	0.407	C	S	.	.	H	α-helix	trans	-58.5	-47	175.4	-179.9	-87.8	0	0	0	111.5	R471 I472 K477 K479	R471-H475 WeakPolarHBondContact O-CB 3.49Å; R471-H475 PolarHBondContact O-N 3.3Å; I472-H475 PolarHBondContact O-N 3.04Å; H475-K477 PolarHBondContact O-N 3.2Å; H475-K479 WeakPolarHBondContact O-CB 3.45Å; H475-K479 PolarHBondContact O-N 3.46Å
476	S	84.6	Confident	76.7	Confident	82 Å²	82	78.6 Å²	78.6	57%	0.573	42%	0.421	S	S	*	.	H	α-helix	trans	-63.2	-39	-180	-169.9	0	0	0	0	113.2	I472 V473 A474	I472-S476 WeakPolarHBondContact O-CB 3.23Å; I472-S476 PolarHBondContact O-N 3.49Å; V473-S476 PolarHBondContact O-N 2.96Å; A474-S476 PolarHBondContact O-N 3.5Å
477	K	84	Confident	74.7	Confident	142 Å²	142	82.6 Å²	82.6	62%	0.617	44%	0.443	S	S	*	.	H	α-helix	trans	-74.5	-43.5	-177.6	-170.7	178.2	179.7	-177.3	0	111.9	V473 A474 H475	V473-K477 WeakPolarHBondContact O-CB 3.49Å; V473-K477 PolarHBondContact O-N 3.14Å; A474-K477 PolarHBondContact O-N 3.3Å; H475-K477 PolarHBondContact O-N 3.2Å
478	F	78.8	Confident	73	Confident	43 Å²	43	87.7 Å²	87.7	19%	0.189	48%	0.478	C	S	.	.	H	α-helix	trans	-93.2	-5.5	-175.1	-63.8	-72.3	0	0	0	114	M414 A474 N480 C481 H499 P500	M414-F478 HydrophobicContact CB-CD1 4.48Å; M414-F478 HydrophobicContact CB-CG 4.32Å; A474-F478 HydrophobicContact CB-CD2 4.47Å; A474-F478 WeakPolarHBondContact O-CB 3.44Å; A474-F478 WeakPolarHBondContact O-CD2 3.42Å; A474-F478 PolarHBondContact O-N 2.87Å; F478-N480 VanDerWaalsContact C-N 3.28Å; F478-N480 PolarHBondContact O-N 3.45Å; F478-C481 PolarHBondContact O-N 3.15Å; F478-H499 AromaticContact CE2-CE1 3.74Å; F478-H499 AromaticContact CE2-NE2 3.26Å; F478-H499 VanDerWaalsContact CE2-NE2 3.26Å; F478-H499 WeakPolarHBondContact CE2-NE2 3.4Å; F478-H499 AromaticContact CZ-NE2 3.29Å; F478-H499 VanDerWaalsContact CZ-NE2 3.29Å; F478-H499 WeakPolarHBondContact CZ-NE2 3.27Å; F478-P500 HydrophobicContact CE2-CG 4.31Å
479	K	72.2	Confident	71.6	Confident	126 Å²	126	92.5 Å²	92.5	55%	0.548	51%	0.509	S	S	.	.	S	Bend	trans	-59.2	-38.8	171.3	179	178	-176.5	-174.1	0	112	H475	H475-K479 WeakPolarHBondContact O-CB 3.45Å; H475-K479 PolarHBondContact O-N 3.46Å
480	N	64.8	Low	70.3	Confident	111 Å²	111	92 Å²	92	59%	0.594	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-75.8	-32.7	-179.4	-66.4	-9.9	0	0	0	112.2	F478 K482 N483	F478-N480 VanDerWaalsContact C-N 3.28Å; F478-N480 PolarHBondContact O-N 3.45Å; N480-K482 PolarHBondContact O-N 2.69Å; N480-K482 VanDerWaalsContact O-N 3.16Å; N480-N483 PolarHBondContact O-N 2.7Å; N480-N483 VanDerWaalsContact O-N 3.15Å
481	C	60.7	Low	69.3	Low	85 Å²	85	96.1 Å²	96.1	57%	0.574	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-66.6	-13	176.2	-62.6	0	0	0	0	113.9	F478	F478-C481 PolarHBondContact O-N 3.15Å
482	K	57.3	Low	68.8	Low	126 Å²	126	98.1 Å²	98.1	55%	0.548	53%	0.532	S	S	.	.	G	3₁₀ helix	trans	-84.9	-14.5	176.9	-141.7	174.2	-173.2	175.8	0	113	N480	N480-K482 PolarHBondContact O-N 2.69Å; N480-K482 VanDerWaalsContact O-N 3.16Å
483	N	54.5	Low	68.3	Low	122 Å²	122	102.6 Å²	102.6	65%	0.652	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-17.5	-178.6	-69.4	-6.4	0	0	0	112.9	N480 T485	N480-N483 PolarHBondContact O-N 2.7Å; N480-N483 VanDerWaalsContact O-N 3.15Å; N483-T485 PolarHBondContact O-N 3.03Å
484	D	54.8	Low	67.8	Low	133 Å²	133	104.1 Å²	104.1	71%	0.711	55%	0.554	S	S	*	*	S	Bend	trans	-84.8	105.7	170.1	-73.2	-27.1	0	0	0	108.5	D486	D484-D486 VanDerWaalsContact C-N 3.3Å; D484-D486 PolarHBondContact O-N 3.43Å; D484-D486 VanDerWaalsContact O-N 3.15Å
485	T	52.1	Low	67.7	Low	126 Å²	126	105 Å²	105	77%	0.773	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	7.9	-163.2	37.5	0	0	0	0	117.1	N483	N483-T485 PolarHBondContact O-N 3.03Å
486	D	48.1	Very low	67.7	Low	154 Å²	154	107.9 Å²	107.9	82%	0.824	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.7	23.5	-167.6	-77.5	-25.1	0	0	0	116.4	D484	D484-D486 VanDerWaalsContact C-N 3.3Å; D484-D486 PolarHBondContact O-N 3.43Å; D484-D486 VanDerWaalsContact O-N 3.15Å
487	T	54.5	Low	67.6	Low	119 Å²	119	107.6 Å²	107.6	73%	0.73	58%	0.577	S	S	*	*	S	Bend	trans	-133.7	116.1	171	-36.8	0	0	0	0	111.3	T489	T487-T489 PolarHBondContact O-N 3.3Å
488	S	57.3	Low	67.7	Low	107 Å²	107	108.9 Å²	108.9	75%	0.748	58%	0.583	S	S	*	*			trans	-43.2	115.4	168.6	48.7	0	0	0	0	109.5	P490	S488-P490 WeakPolarHBondContact O-CD 3.5Å; S488-P490 VanDerWaalsContact O-N 3.15Å
489	T	59.7	Low	68.1	Low	112 Å²	112	107.4 Å²	107.4	69%	0.687	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-53.7	122.7	174.9	41.6	0	0	0	0	108.6	T487 E491	T487-T489 PolarHBondContact O-N 3.3Å; T489-E491 PolarHBondContact O-N 3.27Å
490	P	65.4	Low	68.9	Low	57 Å²	57	102.9 Å²	102.9	37%	0.37	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-57.8	137.6	-176	-19.4	27.7	0	0	0	110.6	M414 S488 D494 W495	M414-P490 HydrophobicContact CE-CB 3.77Å; M414-P490 HydrophobicContact CE-CG 3.54Å; M414-P490 HydrophobicContact SD-CG 4.36Å; S488-P490 WeakPolarHBondContact O-CD 3.5Å; S488-P490 VanDerWaalsContact O-N 3.15Å; P490-D494 HydrophobicContact CB-CB 4.19Å; P490-W495 PolarHBondContact O-NE1 3.29Å; P490-W495 VanDerWaalsContact O-NE1 3.08Å
491	E	69.9	Low	70	Confident	133 Å²	133	97.7 Å²	97.7	62%	0.621	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-58.7	152.2	174	-67.6	-168.9	177.2	0	0	109.7	T489 K493 D494 W495	T489-E491 PolarHBondContact O-N 3.27Å; E491-K493 PolarHBondContact O-N 3.42Å; E491-D494 PolarHBondContact O-N 3.48Å; E491-W495 VanDerWaalsContact O-CD1 3.22Å; E491-W495 PolarHBondContact O-NE1 3.24Å
492	R	77.3	Confident	71.3	Confident	63 Å²	63	95.9 Å²	95.9	24%	0.238	52%	0.516	C	S	.	.	G	3₁₀ helix	trans	-53.3	-26	-176.3	-179.9	175.8	169.3	123	-0.5	114.2	K411 D494 W495 E505	K411-R492 WeakPolarHBondContact O-CD 3.27Å; K411-R492 PolarHBondContact O-NH1 3.31Å; R492-D494 VanDerWaalsContact C-N 3.29Å; R492-W495 HydrophobicContact CB-CD2 4.46Å; R492-W495 HydrophobicContact CB-CZ2 4.34Å; R492-W495 HydrophobicContact CG-CD2 4.28Å; R492-W495 HydrophobicContact CG-CE3 4.05Å; R492-W495 HydrophobicContact CG-CH2 4.34Å; R492-W495 HydrophobicContact CG-CZ3 4.05Å; R492-E505 IonicContact CZ-OE1 3.9Å; R492-E505 IonicContact CZ-OE2 3.36Å; R492-E505 IonicContact NH1-OE1 2.98Å; R492-E505 PolarHBondContact NH1-OE1 3.48Å; R492-E505 IonicContact NH1-OE2 3.18Å; R492-E505 PolarHBondContact NH1-OE2 3.06Å; R492-E505 IonicContact NH2-OE1 3.92Å; R492-E505 IonicContact NH2-OE2 2.68Å; R492-E505 PolarHBondContact NH2-OE2 3.28Å
493	K	77.3	Confident	72.9	Confident	182 Å²	182	92.5 Å²	92.5	79%	0.791	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-68.8	-28.2	178.7	-63.4	175.1	-177.3	169.4	0	112.8	E491 W495	E491-K493 PolarHBondContact O-N 3.42Å; K493-W495 VanDerWaalsContact C-N 3.31Å
494	D	79.9	Confident	74.6	Confident	115 Å²	115	86.7 Å²	86.7	62%	0.615	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-93.9	6.9	-175.1	-52.7	-35.2	0	0	0	112.1	P490 E491 R492	P490-D494 HydrophobicContact CB-CB 4.19Å; E491-D494 PolarHBondContact O-N 3.48Å; R492-D494 VanDerWaalsContact C-N 3.29Å
495	W	84.3	Confident	76.3	Confident	18 Å²	18	81.9 Å²	81.9	7%	0.068	45%	0.449	C	S	.	.	S	Bend	trans	-73.6	141.8	177.6	-66.2	7.9	0	0	0	109.9	M413 M414 P490 E491 R492 K493 H499 I501 L502	M413-W495 WeakPolarHBondContact O-CH2 3.45Å; M414-W495 HydrophobicContact CB-CZ2 4.33Å; M414-W495 HydrophobicContact CE-CD2 4.43Å; M414-W495 HydrophobicContact CE-CG 3.93Å; M414-W495 HydrophobicContact CG-CD2 4.24Å; M414-W495 VanDerWaalsContact CG-CE2 3.45Å; M414-W495 HydrophobicContact CG-CH2 4.46Å; M414-W495 HydrophobicContact CG-CZ2 3.57Å; P490-W495 PolarHBondContact O-NE1 3.29Å; P490-W495 VanDerWaalsContact O-NE1 3.08Å; E491-W495 VanDerWaalsContact O-CD1 3.22Å; E491-W495 PolarHBondContact O-NE1 3.24Å; R492-W495 HydrophobicContact CB-CD2 4.46Å; R492-W495 HydrophobicContact CB-CZ2 4.34Å; R492-W495 HydrophobicContact CG-CD2 4.28Å; R492-W495 HydrophobicContact CG-CE3 4.05Å; R492-W495 HydrophobicContact CG-CH2 4.34Å; R492-W495 HydrophobicContact CG-CZ3 4.05Å; K493-W495 VanDerWaalsContact C-N 3.31Å; W495-H499 HydrophobicContact CB-CB 4.44Å; W495-I501 HydrophobicContact CE3-CG2 3.71Å; W495-I501 HydrophobicContact CH2-CG2 4.06Å; W495-I501 HydrophobicContact CZ3-CG2 3.23Å; W495-L502 HydrophobicContact CB-CD1 4.26Å; W495-L502 HydrophobicContact CE3-CD1 4.4Å; W495-L502 HydrophobicContact CE3-CD2 3.99Å; W495-L502 HydrophobicContact CE3-CG 4.06Å; W495-L502 HydrophobicContact CZ3-CD2 4.3Å
496	D	84.4	Confident	78.1	Confident	110 Å²	110	78 Å²	78	59%	0.588	43%	0.433	S	S	*	.			trans	-55.3	141.4	171.8	-178	26.2	0	0	0	110.8	F498 H499	D496-F498 PolarHBondContact O-N 3.48Å; D496-F498 VanDerWaalsContact O-N 3.13Å; D496-H499 WeakPolarHBondContact O-CB 3.31Å; D496-H499 PolarHBondContact O-N 3.15Å
497	A	82.8	Confident	80.3	Confident	76 Å²	76	73 Å²	73	63%	0.628	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-30.5	-175.5	0	0	0	0	0	112.4
498	F	86.3	Confident	82.1	Confident	169 Å²	169	68 Å²	68	74%	0.741	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	20	177.8	-61.6	-75.2	0	0	0	113.5	D496	D496-F498 PolarHBondContact O-N 3.48Å; D496-F498 VanDerWaalsContact O-N 3.13Å
499	H	87.3	Confident	83.8	Confident	12 Å²	12	65.5 Å²	65.5	6%	0.056	36%	0.36	C	S	.	.			trans	-54.9	131.4	176.6	-171.4	-79.9	0	0	0	110.4	M414 F478 W495 D496 I501 L502 V503	M414-H499 PolarHBondContact O-CE1 3.46Å; F478-H499 AromaticContact CE2-CE1 3.74Å; F478-H499 AromaticContact CE2-NE2 3.26Å; F478-H499 VanDerWaalsContact CE2-NE2 3.26Å; F478-H499 WeakPolarHBondContact CE2-NE2 3.4Å; F478-H499 AromaticContact CZ-NE2 3.29Å; F478-H499 VanDerWaalsContact CZ-NE2 3.29Å; F478-H499 WeakPolarHBondContact CZ-NE2 3.27Å; W495-H499 HydrophobicContact CB-CB 4.44Å; D496-H499 WeakPolarHBondContact O-CB 3.31Å; D496-H499 PolarHBondContact O-N 3.15Å; H499-I501 WeakPolarHBondContact ND1-CG2 3.28Å; H499-I501 PolarHBondContact ND1-N 3.3Å; H499-I501 PolarHBondContact O-N 3.21Å; H499-L502 HydrophobicContact CB-CD1 4.07Å; H499-L502 HydrophobicContact CB-CG 4.23Å; H499-L502 WeakPolarHBondContact O-CB 3.34Å; H499-L502 PolarHBondContact O-N 3.33Å; H499-V503 PolarHBondContact O-N 3.4Å
500	P	88.3	Confident	85.4	Confident	31 Å²	31	65.4 Å²	65.4	20%	0.201	35%	0.351	C	S	.	.	H	α-helix	trans	-58.2	-29.6	-170	20.8	-34	0	0	0	113.6	L470 A474 F478 A504	L470-P500 HydrophobicContact CD2-CB 4.34Å; A474-P500 HydrophobicContact CB-CB 4.38Å; A474-P500 HydrophobicContact CB-CG 4.07Å; F478-P500 HydrophobicContact CE2-CG 4.31Å; P500-A504 VanDerWaalsContact O-CB 3.23Å; P500-A504 WeakPolarHBondContact O-CB 3.46Å; P500-A504 PolarHBondContact O-N 3.42Å
501	I	87.9	Confident	86.8	Confident	2 Å²	2	62.7 Å²	62.7	1%	0.01	33%	0.333	C	S	.	.	H	α-helix	trans	-69.7	-36.4	175.1	-154.2	63.6	0	0	0	113.1	R471 W495 H499 A504 E505	R471-I501 HydrophobicContact CG-CD1 3.91Å; W495-I501 HydrophobicContact CE3-CG2 3.71Å; W495-I501 HydrophobicContact CH2-CG2 4.06Å; W495-I501 HydrophobicContact CZ3-CG2 3.23Å; H499-I501 WeakPolarHBondContact ND1-CG2 3.28Å; H499-I501 PolarHBondContact ND1-N 3.3Å; H499-I501 PolarHBondContact O-N 3.21Å; I501-A504 PolarHBondContact O-N 3.46Å; I501-E505 WeakPolarHBondContact O-CB 3.24Å; I501-E505 WeakPolarHBondContact O-CG 3.24Å; I501-E505 PolarHBondContact O-N 3.39Å
502	L	88.3	Confident	87.9	Confident	46 Å²	46	57.4 Å²	57.4	24%	0.241	31%	0.309	C	S	.	.	H	α-helix	trans	-70.7	-42.6	179.6	-66.1	175.7	0	0	0	109.7	W495 H499 A504 E505 G506	W495-L502 HydrophobicContact CB-CD1 4.26Å; W495-L502 HydrophobicContact CE3-CD1 4.4Å; W495-L502 HydrophobicContact CE3-CD2 3.99Å; W495-L502 HydrophobicContact CE3-CG 4.06Å; W495-L502 HydrophobicContact CZ3-CD2 4.3Å; H499-L502 HydrophobicContact CB-CD1 4.07Å; H499-L502 HydrophobicContact CB-CG 4.23Å; H499-L502 WeakPolarHBondContact O-CB 3.34Å; H499-L502 PolarHBondContact O-N 3.33Å; L502-A504 VanDerWaalsContact C-N 3.34Å; L502-E505 PolarHBondContact O-N 2.85Å; L502-G506 PolarHBondContact O-N 3.02Å
503	V	91.3	Very high	88.7	Confident	56 Å²	56	58.4 Å²	58.4	34%	0.339	32%	0.322	S	S	.	.	H	α-helix	trans	-61.1	-45.1	172.4	-178.2	0	0	0	0	110.3	L470 H499 E505 G506 L507	L470-V503 HydrophobicContact CD1-CB 4.3Å; L470-V503 HydrophobicContact CD1-CG1 3.87Å; H499-V503 PolarHBondContact O-N 3.4Å; V503-E505 PolarHBondContact O-N 2.92Å; V503-G506 PolarHBondContact O-N 3.33Å; V503-L507 HydrophobicContact CG1-CD1 4.08Å; V503-L507 HydrophobicContact CG1-CG 4.39Å; V503-L507 WeakPolarHBondContact O-CG 3.27Å; V503-L507 PolarHBondContact O-N 3.12Å
504	A	90.3	Very high	89.4	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-61.9	-42.3	176.6	0	0	0	0	0	112.5	T467 L470 R471 P500 I501 L502 L507 F508	T467-A504 HydrophobicContact CG2-CB 4.29Å; T467-A504 WeakPolarHBondContact CG2-O 3.37Å; L470-A504 HydrophobicContact CB-CB 3.91Å; L470-A504 HydrophobicContact CD1-CB 4.35Å; R471-A504 HydrophobicContact CG-CB 4.03Å; P500-A504 VanDerWaalsContact O-CB 3.23Å; P500-A504 WeakPolarHBondContact O-CB 3.46Å; P500-A504 PolarHBondContact O-N 3.42Å; I501-A504 PolarHBondContact O-N 3.46Å; L502-A504 VanDerWaalsContact C-N 3.34Å; A504-L507 PolarHBondContact O-N 3.27Å; A504-F508 WeakPolarHBondContact O-CB 3.46Å; A504-F508 PolarHBondContact O-N 2.96Å
505	E	89.2	Confident	90.1	Very high	32 Å²	32	45 Å²	45	15%	0.15	26%	0.259	C	S	.	.	H	α-helix	trans	-62.3	-41.5	175.3	-76.4	179.2	-178.1	0	0	112.1	Y406 R492 I501 L502 V503 F508 A509	Y406-E505 HydrophobicContact CE1-CG 4.27Å; Y406-E505 VanDerWaalsContact CE1-OE1 3.31Å; Y406-E505 WeakPolarHBondContact CE1-OE1 3.35Å; Y406-E505 PolarHBondContact OH-OE1 2.99Å; R492-E505 IonicContact CZ-OE1 3.9Å; R492-E505 IonicContact CZ-OE2 3.36Å; R492-E505 IonicContact NH1-OE1 2.98Å; R492-E505 PolarHBondContact NH1-OE1 3.48Å; R492-E505 IonicContact NH1-OE2 3.18Å; R492-E505 PolarHBondContact NH1-OE2 3.06Å; R492-E505 IonicContact NH2-OE1 3.92Å; R492-E505 IonicContact NH2-OE2 2.68Å; R492-E505 PolarHBondContact NH2-OE2 3.28Å; I501-E505 WeakPolarHBondContact O-CB 3.24Å; I501-E505 WeakPolarHBondContact O-CG 3.24Å; I501-E505 PolarHBondContact O-N 3.39Å; L502-E505 PolarHBondContact O-N 2.85Å; V503-E505 PolarHBondContact O-N 2.92Å; E505-F508 PolarHBondContact O-N 3.31Å; E505-A509 WeakPolarHBondContact O-CB 3.45Å; E505-A509 PolarHBondContact O-N 3.25Å
506	G	91.6	Very high	90.4	Very high	43 Å²	43	48.3 Å²	48.3	44%	0.443	27%	0.272	S	S	.	.	H	α-helix	trans	-63	-48.3	175.8	0	0	0	0	0	112.6	L502 V503 F508 A509 F510	L502-G506 PolarHBondContact O-N 3.02Å; V503-G506 PolarHBondContact O-N 3.33Å; G506-F508 VanDerWaalsContact C-N 3.32Å; G506-F508 PolarHBondContact O-N 3.47Å; G506-A509 PolarHBondContact O-N 3.17Å; G506-F510 PolarHBondContact O-N 3.05Å; G506-F510 VanDerWaalsContact O-N 3.11Å
507	L	93.8	Very high	90.7	Very high	49 Å²	49	46.7 Å²	46.7	26%	0.257	26%	0.263	S	S	.	.	H	α-helix	trans	-63.5	-38.2	175.7	-66.3	176.5	0	0	0	111.8	L463 A466 L470 V503 A504 F510 A511	L463-L507 HydrophobicContact CD2-CD2 3.79Å; A466-L507 HydrophobicContact CB-CD1 4.1Å; L470-L507 HydrophobicContact CD1-CD1 3.93Å; V503-L507 HydrophobicContact CG1-CD1 4.08Å; V503-L507 HydrophobicContact CG1-CG 4.39Å; V503-L507 WeakPolarHBondContact O-CG 3.27Å; V503-L507 PolarHBondContact O-N 3.12Å; A504-L507 PolarHBondContact O-N 3.27Å; L507-F510 PolarHBondContact O-N 3.43Å; L507-A511 WeakPolarHBondContact O-CB 3.2Å; L507-A511 PolarHBondContact O-N 2.98Å
508	F	92.1	Very high	91.1	Very high	14 Å²	14	44.6 Å²	44.6	6%	0.061	24%	0.238	C	C	.	.	H	α-helix	trans	-63.8	-45.1	176.7	-173.2	-115.5	0	0	0	112	L399 Y402 Y464 T467 A504 E505 G506 F510 A511 N512	L399-F508 HydrophobicContact CD2-CE2 3.96Å; L399-F508 HydrophobicContact CD2-CZ 3.85Å; Y402-F508 AromaticContact CD1-CE1 3.6Å; Y402-F508 HydrophobicContact CD1-CE1 3.6Å; Y402-F508 HydrophobicContact CD1-CE2 4.48Å; Y402-F508 AromaticContact CD1-CZ 3.42Å; Y402-F508 HydrophobicContact CD1-CZ 3.42Å; Y402-F508 VanDerWaalsContact CD1-CZ 3.42Å; Y402-F508 HydrophobicContact CE1-CD1 4.45Å; Y402-F508 AromaticContact CE1-CE1 3.62Å; Y402-F508 HydrophobicContact CE1-CE1 3.62Å; Y402-F508 AromaticContact CE1-CZ 3.67Å; Y402-F508 HydrophobicContact CE1-CZ 3.67Å; Y402-F508 HydrophobicContact CG-CZ 4.47Å; Y464-F508 HydrophobicContact CD1-CD2 4.23Å; Y464-F508 HydrophobicContact CD1-CE2 4.34Å; Y464-F508 AromaticContact CE1-CD2 3.96Å; Y464-F508 HydrophobicContact CE1-CD2 3.96Å; Y464-F508 AromaticContact CE1-CE2 3.86Å; Y464-F508 HydrophobicContact CE1-CE2 3.86Å; T467-F508 HydrophobicContact CG2-CB 3.68Å; T467-F508 HydrophobicContact CG2-CD2 3.9Å; T467-F508 HydrophobicContact CG2-CG 4.15Å; T467-F508 PolarHBondContact OG1-N 3.01Å; A504-F508 WeakPolarHBondContact O-CB 3.46Å; A504-F508 PolarHBondContact O-N 2.96Å; E505-F508 PolarHBondContact O-N 3.31Å; G506-F508 VanDerWaalsContact C-N 3.32Å; G506-F508 PolarHBondContact O-N 3.47Å; F508-F510 VanDerWaalsContact C-N 3.32Å; F508-F510 PolarHBondContact O-N 3.16Å; F508-A511 PolarHBondContact O-N 3.02Å; F508-N512 WeakPolarHBondContact CD1-ND2 3.48Å; F508-N512 WeakPolarHBondContact CE1-ND2 3.49Å; F508-N512 WeakPolarHBondContact CZ-ND2 3.24Å; F508-N512 WeakPolarHBondContact O-CB 3.38Å; F508-N512 PolarHBondContact O-N 3.32Å; F508-N512 PolarHBondContact O-ND2 3.4Å; F508-N512 PolarHBondContact O-OD1 3.01Å
509	A	92.6	Very high	91.2	Very high	55 Å²	55	39 Å²	39	46%	0.455	22%	0.216	S	C	.	.	H	α-helix	trans	-60.6	-44.6	177.4	0	0	0	0	0	111	E505 G506 N512 V513	E505-A509 WeakPolarHBondContact O-CB 3.45Å; E505-A509 PolarHBondContact O-N 3.25Å; G506-A509 PolarHBondContact O-N 3.17Å; A509-N512 PolarHBondContact O-N 3.29Å; A509-V513 PolarHBondContact O-N 3.29Å; A509-V513 VanDerWaalsContact O-N 3.13Å
510	F	93.9	Very high	91.2	Very high	111 Å²	111	43.2 Å²	43.2	49%	0.487	23%	0.234	S	C	.	.	H	α-helix	trans	-64.3	-44.3	176.5	-170.1	-112.2	0	0	0	112	L463 G506 L507 F508 N512 V513 L514	L463-F510 HydrophobicContact CD1-CD1 3.42Å; L463-F510 VanDerWaalsContact CD1-CD1 3.42Å; L463-F510 HydrophobicContact CD1-CE1 3.76Å; L463-F510 HydrophobicContact CD2-CD1 4.32Å; G506-F510 PolarHBondContact O-N 3.05Å; G506-F510 VanDerWaalsContact O-N 3.11Å; L507-F510 PolarHBondContact O-N 3.43Å; F508-F510 VanDerWaalsContact C-N 3.32Å; F508-F510 PolarHBondContact O-N 3.16Å; F510-N512 VanDerWaalsContact C-N 3.3Å; F510-N512 PolarHBondContact O-N 3.11Å; F510-V513 PolarHBondContact O-N 3.46Å; F510-L514 HydrophobicContact CD1-CD1 4.14Å; F510-L514 HydrophobicContact CE1-CD1 3.7Å; F510-L514 HydrophobicContact CE1-CG 4.21Å; F510-L514 HydrophobicContact CZ-CD1 4.24Å; F510-L514 HydrophobicContact CZ-CD2 4.23Å; F510-L514 HydrophobicContact CZ-CG 4.38Å; F510-L514 WeakPolarHBondContact O-CG 3.32Å; F510-L514 PolarHBondContact O-N 2.62Å; F510-L514 VanDerWaalsContact O-N 3.1Å
511	A	93.8	Very high	91.1	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.2	-40.3	175.3	0	0	0	0	0	112.2	L463 Y464 L507 F508 L514 S515	L463-A511 HydrophobicContact CB-CB 3.89Å; Y464-A511 HydrophobicContact CD1-CB 3.76Å; Y464-A511 HydrophobicContact CD2-CB 4.2Å; Y464-A511 HydrophobicContact CE1-CB 3.54Å; Y464-A511 HydrophobicContact CE2-CB 4.02Å; Y464-A511 HydrophobicContact CG-CB 4.06Å; Y464-A511 PolarHBondContact OH-O 3.24Å; L507-A511 WeakPolarHBondContact O-CB 3.2Å; L507-A511 PolarHBondContact O-N 2.98Å; F508-A511 PolarHBondContact O-N 3.02Å; A511-L514 PolarHBondContact O-N 3.05Å; A511-S515 WeakPolarHBondContact O-CB 3.36Å; A511-S515 PolarHBondContact O-N 2.95Å
512	N	93	Very high	91	Very high	21 Å²	21	46 Å²	46	11%	0.112	25%	0.245	C	C	.	.	H	α-helix	trans	-62.8	-42.9	176.8	-71.2	-15.5	0	0	0	112	Y464 F508 A509 F510 L514 S515 Y516	Y464-N512 WeakPolarHBondContact OH-CA 3.45Å; Y464-N512 PolarHBondContact OH-N 3.29Å; Y464-N512 PolarHBondContact OH-OD1 3.35Å; F508-N512 WeakPolarHBondContact CD1-ND2 3.48Å; F508-N512 WeakPolarHBondContact CE1-ND2 3.49Å; F508-N512 WeakPolarHBondContact CZ-ND2 3.24Å; F508-N512 WeakPolarHBondContact O-CB 3.38Å; F508-N512 PolarHBondContact O-N 3.32Å; F508-N512 PolarHBondContact O-ND2 3.4Å; F508-N512 PolarHBondContact O-OD1 3.01Å; A509-N512 PolarHBondContact O-N 3.29Å; F510-N512 VanDerWaalsContact C-N 3.3Å; F510-N512 PolarHBondContact O-N 3.11Å; N512-L514 PolarHBondContact O-N 3.05Å; N512-S515 WeakPolarHBondContact O-CB 3.39Å; N512-S515 PolarHBondContact O-N 3.24Å; N512-S515 PolarHBondContact O-OG 3.39Å; N512-Y516 WeakPolarHBondContact O-CD2 3.3Å; N512-Y516 PolarHBondContact O-N 3.49Å; N512-Y516 VanDerWaalsContact O-N 3.13Å
513	V	94.5	Very high	91.1	Very high	84 Å²	84	48.9 Å²	48.9	51%	0.509	25%	0.253	S	S	.	.	H	α-helix	trans	-59	-49.2	174.4	174	0	0	0	0	110.5	A509 F510 S515 Y516 L517	A509-V513 PolarHBondContact O-N 3.29Å; A509-V513 VanDerWaalsContact O-N 3.13Å; F510-V513 PolarHBondContact O-N 3.46Å; V513-S515 VanDerWaalsContact C-N 3.25Å; V513-S515 PolarHBondContact O-N 2.83Å; V513-Y516 PolarHBondContact O-N 3.48Å; V513-Y516 VanDerWaalsContact O-N 3.17Å; V513-L517 HydrophobicContact CG1-CD1 4.29Å; V513-L517 HydrophobicContact CG1-CG 4.44Å; V513-L517 WeakPolarHBondContact O-CG 3.29Å; V513-L517 PolarHBondContact O-N 3.01Å
514	L	93.1	Very high	90.9	Very high	16 Å²	16	46.8 Å²	46.8	8%	0.084	24%	0.241	C	C	.	.	H	α-helix	trans	-61.5	-34.5	178.2	-61.7	-175.9	0	0	0	112.3	L456 V459 M460 L463 F510 A511 N512 Y516 L517 R518	L456-L514 HydrophobicContact CD1-CB 4.3Å; L456-L514 HydrophobicContact CD1-CD2 3.94Å; V459-L514 HydrophobicContact CG1-CD1 3.88Å; M460-L514 HydrophobicContact CB-CB 4.3Å; M460-L514 HydrophobicContact CG-CB 4.37Å; L463-L514 HydrophobicContact CD1-CD1 3.65Å; F510-L514 HydrophobicContact CD1-CD1 4.14Å; F510-L514 HydrophobicContact CE1-CD1 3.7Å; F510-L514 HydrophobicContact CE1-CG 4.21Å; F510-L514 HydrophobicContact CZ-CD1 4.24Å; F510-L514 HydrophobicContact CZ-CD2 4.23Å; F510-L514 HydrophobicContact CZ-CG 4.38Å; F510-L514 WeakPolarHBondContact O-CG 3.32Å; F510-L514 PolarHBondContact O-N 2.62Å; F510-L514 VanDerWaalsContact O-N 3.1Å; A511-L514 PolarHBondContact O-N 3.05Å; N512-L514 PolarHBondContact O-N 3.05Å; L514-Y516 PolarHBondContact O-N 3.33Å; L514-L517 HydrophobicContact CD2-CD1 4.18Å; L514-L517 PolarHBondContact O-N 3.05Å; L514-R518 PolarHBondContact O-N 3.33Å
515	S	92.7	Very high	90.8	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.1	-39.3	176.6	81.7	0	0	0	0	112.4	Y392 L396 Y464 A511 N512 V513 R518	Y392-S515 VanDerWaalsContact OH-C 3.28Å; Y392-S515 WeakPolarHBondContact OH-CA 3.4Å; Y392-S515 PolarHBondContact OH-O 3.08Å; L396-S515 WeakPolarHBondContact CD2-OG 3.37Å; Y464-S515 WeakPolarHBondContact OH-CB 3.34Å; Y464-S515 PolarHBondContact OH-OG 3.47Å; A511-S515 WeakPolarHBondContact O-CB 3.36Å; A511-S515 PolarHBondContact O-N 2.95Å; N512-S515 WeakPolarHBondContact O-CB 3.39Å; N512-S515 PolarHBondContact O-N 3.24Å; N512-S515 PolarHBondContact O-OG 3.39Å; V513-S515 VanDerWaalsContact C-N 3.25Å; V513-S515 PolarHBondContact O-N 2.83Å; S515-R518 VanDerWaalsContact O-CB 3.32Å; S515-R518 WeakPolarHBondContact O-CB 3.35Å; S515-R518 PolarHBondContact O-N 3.47Å
516	Y	92.3	Very high	90.7	Very high	88 Å²	88	49.5 Å²	49.5	35%	0.345	26%	0.261	S	S	.	.	H	α-helix	trans	-70.9	-40.6	173.1	-81.7	-73.6	0	0	0	112.2	L396 N400 N512 V513 L514 R518 L519	L396-Y516 HydrophobicContact CB-CE1 4.25Å; L396-Y516 HydrophobicContact CD1-CD1 4.13Å; L396-Y516 HydrophobicContact CD1-CE1 4.05Å; L396-Y516 HydrophobicContact CD2-CD1 4.43Å; L396-Y516 HydrophobicContact CD2-CE1 4.34Å; L396-Y516 HydrophobicContact CG-CE1 4.46Å; N400-Y516 PolarHBondContact ND2-OH 2.84Å; N400-Y516 PolarHBondContact OD1-OH 3.08Å; N512-Y516 WeakPolarHBondContact O-CD2 3.3Å; N512-Y516 PolarHBondContact O-N 3.49Å; N512-Y516 VanDerWaalsContact O-N 3.13Å; V513-Y516 PolarHBondContact O-N 3.48Å; V513-Y516 VanDerWaalsContact O-N 3.17Å; L514-Y516 PolarHBondContact O-N 3.33Å; Y516-R518 PolarHBondContact O-N 2.86Å; Y516-R518 VanDerWaalsContact O-N 3.16Å; Y516-L519 HydrophobicContact CD1-CD1 4.23Å; Y516-L519 VanDerWaalsContact O-CB 3.31Å; Y516-L519 WeakPolarHBondContact O-CB 3.39Å; Y516-L519 PolarHBondContact O-N 2.98Å
517	L	91.1	Very high	90.5	Very high	76 Å²	76	51.4 Å²	51.4	40%	0.398	27%	0.267	S	S	.	.	H	α-helix	trans	-58.5	-29.1	176	-69.4	-178.9	0	0	0	112.2	V513 L514 L519 F520	V513-L517 HydrophobicContact CG1-CD1 4.29Å; V513-L517 HydrophobicContact CG1-CG 4.44Å; V513-L517 WeakPolarHBondContact O-CG 3.29Å; V513-L517 PolarHBondContact O-N 3.01Å; L514-L517 HydrophobicContact CD2-CD1 4.18Å; L514-L517 PolarHBondContact O-N 3.05Å; L517-L519 PolarHBondContact O-N 3.29Å; L517-F520 HydrophobicContact CD2-CD2 3.93Å; L517-F520 HydrophobicContact CD2-CE2 3.63Å; L517-F520 WeakPolarHBondContact O-CB 3.41Å; L517-F520 WeakPolarHBondContact O-CD2 3.26Å; L517-F520 PolarHBondContact O-N 2.96Å; L517-F520 VanDerWaalsContact O-N 3.09Å
518	R	90.3	Very high	90.2	Very high	31 Å²	31	55.6 Å²	55.6	12%	0.117	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-58.9	-27.6	174.9	-161.7	-174.4	-170.4	-169.8	6.2	113.3	Y392 L456 S457 L514 S515 Y516 F520 F521	Y392-R518 HydrophobicContact CE1-CB 4.26Å; Y392-R518 VanDerWaalsContact CZ-CD 3.48Å; Y392-R518 WeakPolarHBondContact OH-CB 3.4Å; Y392-R518 VanDerWaalsContact OH-CD 3.26Å; Y392-R518 WeakPolarHBondContact OH-CD 3.21Å; L456-R518 HydrophobicContact CD2-CB 4.04Å; L456-R518 HydrophobicContact CD2-CG 4.38Å; S457-R518 PolarHBondContact OG-NE 3.43Å; S457-R518 PolarHBondContact OG-NH2 3.04Å; S457-R518 VanDerWaalsContact OG-NH2 3.11Å; L514-R518 PolarHBondContact O-N 3.33Å; S515-R518 VanDerWaalsContact O-CB 3.32Å; S515-R518 WeakPolarHBondContact O-CB 3.35Å; S515-R518 PolarHBondContact O-N 3.47Å; Y516-R518 PolarHBondContact O-N 2.86Å; Y516-R518 VanDerWaalsContact O-N 3.16Å; R518-F520 PolarHBondContact O-N 3.28Å; R518-F521 HydrophobicContact CG-CD2 4.37Å; R518-F521 WeakPolarHBondContact O-CB 3.43Å; R518-F521 PolarHBondContact O-N 2.84Å; R518-F521 VanDerWaalsContact O-N 3.14Å
519	L	88.8	Confident	90.1	Very high	51 Å²	51	58.6 Å²	58.6	27%	0.267	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-62.8	-27.6	177.3	-68.2	179.4	0	0	0	112.6	Y392 L396 Y516 L517 F521 M522	Y392-L519 HydrophobicContact CD1-CD2 3.85Å; Y392-L519 HydrophobicContact CE1-CD2 3.82Å; Y392-L519 HydrophobicContact CE1-CG 4.34Å; L396-L519 HydrophobicContact CD1-CD1 3.56Å; L396-L519 HydrophobicContact CD1-CD2 3.78Å; L396-L519 HydrophobicContact CD1-CG 3.74Å; Y516-L519 HydrophobicContact CD1-CD1 4.23Å; Y516-L519 VanDerWaalsContact O-CB 3.31Å; Y516-L519 WeakPolarHBondContact O-CB 3.39Å; Y516-L519 PolarHBondContact O-N 2.98Å; L517-L519 PolarHBondContact O-N 3.29Å; L519-F521 PolarHBondContact O-N 3.37Å; L519-M522 WeakPolarHBondContact O-CB 3.26Å; L519-M522 PolarHBondContact O-N 3.16Å
520	F	87.6	Confident	90.1	Very high	102 Å²	102	56 Å²	56	45%	0.447	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-56.1	-35.9	174.9	-76.4	-71.7	0	0	0	111.4	L517 R518 M522 Y523 Q533	L517-F520 HydrophobicContact CD2-CD2 3.93Å; L517-F520 HydrophobicContact CD2-CE2 3.63Å; L517-F520 WeakPolarHBondContact O-CB 3.41Å; L517-F520 WeakPolarHBondContact O-CD2 3.26Å; L517-F520 PolarHBondContact O-N 2.96Å; L517-F520 VanDerWaalsContact O-N 3.09Å; R518-F520 PolarHBondContact O-N 3.28Å; F520-M522 PolarHBondContact O-N 3.46Å; F520-Y523 AromaticContact CD1-CD2 3.94Å; F520-Y523 HydrophobicContact CD1-CD2 3.94Å; F520-Y523 AromaticContact CD1-CE2 3.7Å; F520-Y523 HydrophobicContact CD1-CE2 3.7Å; F520-Y523 HydrophobicContact CE1-CE2 4Å; F520-Y523 VanDerWaalsContact O-CB 3.31Å; F520-Y523 WeakPolarHBondContact O-CB 3.2Å; F520-Y523 PolarHBondContact O-N 3.44Å; F520-Q533 PolarHBondContact O-NE2 3.45Å; F520-Q533 PolarHBondContact O-OE1 3.41Å
521	F	85.4	Confident	90	Very high	46 Å²	46	51.1 Å²	51.1	20%	0.202	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-65.2	-19.9	177.6	-65.3	-62.2	0	0	0	114.2	R453 L456 R518 L519 Y523 T524	R453-F521 HydrophobicContact CB-CD1 4.36Å; R453-F521 HydrophobicContact CB-CD2 4.34Å; R453-F521 HydrophobicContact CB-CE1 4.38Å; R453-F521 HydrophobicContact CB-CE2 4.32Å; R453-F521 HydrophobicContact CB-CG 4.36Å; R453-F521 HydrophobicContact CB-CZ 4.36Å; R453-F521 HydrophobicContact CG-CB 4.33Å; R453-F521 HydrophobicContact CG-CD1 4.49Å; R453-F521 HydrophobicContact CG-CD2 3.9Å; R453-F521 HydrophobicContact CG-CE2 4.28Å; R453-F521 HydrophobicContact CG-CG 4.01Å; L456-F521 HydrophobicContact CB-CE2 4.12Å; L456-F521 HydrophobicContact CD2-CD2 4.22Å; L456-F521 HydrophobicContact CD2-CE2 3.54Å; L456-F521 HydrophobicContact CG-CE2 4.44Å; R518-F521 HydrophobicContact CG-CD2 4.37Å; R518-F521 WeakPolarHBondContact O-CB 3.43Å; R518-F521 PolarHBondContact O-N 2.84Å; R518-F521 VanDerWaalsContact O-N 3.14Å; L519-F521 PolarHBondContact O-N 3.37Å; F521-Y523 VanDerWaalsContact C-N 3.3Å; F521-T524 WeakPolarHBondContact O-CG2 3.45Å; F521-T524 PolarHBondContact O-OG1 2.88Å
522	M	86.3	Confident	89.7	Confident	45 Å²	45	56 Å²	56	22%	0.222	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-75.1	-21.2	174.8	-65.2	-62.2	160	0	0	112.5	F385 L519 F520 T524 T525	F385-M522 HydrophobicContact CE2-SD 3.76Å; F385-M522 HydrophobicContact CZ-SD 3.94Å; L519-M522 WeakPolarHBondContact O-CB 3.26Å; L519-M522 PolarHBondContact O-N 3.16Å; F520-M522 PolarHBondContact O-N 3.46Å; M522-T524 PolarHBondContact O-N 2.87Å; M522-T525 PolarHBondContact O-N 2.64Å; M522-T525 VanDerWaalsContact O-N 3.13Å; M522-T525 PolarHBondContact O-OG1 2.86Å
523	Y	88.9	Confident	89.5	Confident	106 Å²	106	56.3 Å²	56.3	42%	0.416	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-62.6	-24.2	176.9	-66.1	-11.4	0	0	0	112.8	F520 F521 T525 S526 L529 G530	F520-Y523 AromaticContact CD1-CD2 3.94Å; F520-Y523 HydrophobicContact CD1-CD2 3.94Å; F520-Y523 AromaticContact CD1-CE2 3.7Å; F520-Y523 HydrophobicContact CD1-CE2 3.7Å; F520-Y523 HydrophobicContact CE1-CE2 4Å; F520-Y523 VanDerWaalsContact O-CB 3.31Å; F520-Y523 WeakPolarHBondContact O-CB 3.2Å; F520-Y523 PolarHBondContact O-N 3.44Å; F521-Y523 VanDerWaalsContact C-N 3.3Å; Y523-T525 PolarHBondContact O-N 2.93Å; Y523-S526 WeakPolarHBondContact O-CB 3.48Å; Y523-S526 PolarHBondContact O-N 2.8Å; Y523-L529 HydrophobicContact CD1-CD1 4.29Å; Y523-L529 HydrophobicContact CG-CB 4.38Å; Y523-L529 HydrophobicContact CG-CD1 4.31Å; Y523-G530 WeakPolarHBondContact O-CA 3.31Å; Y523-G530 PolarHBondContact O-N 2.79Å
524	T	88.4	Confident	89.3	Confident	13 Å²	13	53.8 Å²	53.8	8%	0.08	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-52.9	-26.2	172.5	59.3	0	0	0	0	113.8	F521 M522 S526 I534 W672	F521-T524 WeakPolarHBondContact O-CG2 3.45Å; F521-T524 PolarHBondContact O-OG1 2.88Å; M522-T524 PolarHBondContact O-N 2.87Å; T524-S526 VanDerWaalsContact C-N 3.34Å; T524-I534 HydrophobicContact CG2-CD1 4Å; T524-W672 PolarHBondContact O-NE1 3.14Å
525	T	87.1	Confident	89	Confident	44 Å²	44	53.1 Å²	53.1	27%	0.27	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-75.7	-25	179.4	-54.2	0	0	0	0	112.3	F385 M522 Y523 L679	F385-T525 HydrophobicContact CE1-CG2 3.97Å; F385-T525 HydrophobicContact CZ-CG2 4.08Å; F385-T525 VanDerWaalsContact CZ-OG1 3.28Å; F385-T525 WeakPolarHBondContact CZ-OG1 3.45Å; M522-T525 PolarHBondContact O-N 2.64Å; M522-T525 VanDerWaalsContact O-N 3.13Å; M522-T525 PolarHBondContact O-OG1 2.86Å; Y523-T525 PolarHBondContact O-N 2.93Å; T525-L679 WeakPolarHBondContact OG1-CD2 3.36Å
526	S	87.6	Confident	88.8	Confident	45 Å²	45	58.4 Å²	58.4	32%	0.315	30%	0.295	S	S	.	.	S	Bend	trans	-77.4	139.6	177.8	-179.3	0	0	0	0	111	Y523 T524 I528 L529 G530 W672	Y523-S526 WeakPolarHBondContact O-CB 3.48Å; Y523-S526 PolarHBondContact O-N 2.8Å; T524-S526 VanDerWaalsContact C-N 3.34Å; S526-I528 VanDerWaalsContact C-N 3.27Å; S526-I528 PolarHBondContact O-N 2.98Å; S526-I528 PolarHBondContact OG-N 3.25Å; S526-L529 PolarHBondContact OG-N 3.11Å; S526-G530 WeakPolarHBondContact O-CA 3.33Å; S526-G530 PolarHBondContact O-N 3.31Å; S526-G530 VanDerWaalsContact O-N 3.08Å; S526-W672 PolarHBondContact O-NE1 3.26Å
527	S	87.5	Confident	88.5	Confident	82 Å²	82	55.9 Å²	55.9	57%	0.573	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-17.2	173.8	58.6	0	0	0	0	114.1	W672	S527-W672 VanDerWaalsContact CA-CZ2 3.43Å
528	I	87.8	Confident	88.3	Confident	138 Å²	138	54.6 Å²	54.6	71%	0.708	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-49.4	-178.5	-59.1	171.7	0	0	0	109.9	S526	S526-I528 VanDerWaalsContact C-N 3.27Å; S526-I528 PolarHBondContact O-N 2.98Å; S526-I528 PolarHBondContact OG-N 3.25Å
529	L	89.6	Confident	88.3	Confident	76 Å²	76	54.8 Å²	54.8	40%	0.398	29%	0.291	S	S	.	.	H	α-helix	trans	-84.3	-21.2	-176.2	-60.6	174.6	0	0	0	113.1	Y523 S526 Q533	Y523-L529 HydrophobicContact CD1-CD1 4.29Å; Y523-L529 HydrophobicContact CG-CB 4.38Å; Y523-L529 HydrophobicContact CG-CD1 4.31Å; S526-L529 PolarHBondContact OG-N 3.11Å; L529-Q533 WeakPolarHBondContact O-CB 3.36Å; L529-Q533 PolarHBondContact O-N 3.28Å
530	G	91.5	Very high	88.1	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-63.1	-54.3	-176	0	0	0	0	0	113.9	Y523 S526 L532 Q533 I534 W672	Y523-G530 WeakPolarHBondContact O-CA 3.31Å; Y523-G530 PolarHBondContact O-N 2.79Å; S526-G530 WeakPolarHBondContact O-CA 3.33Å; S526-G530 PolarHBondContact O-N 3.31Å; S526-G530 VanDerWaalsContact O-N 3.08Å; G530-L532 VanDerWaalsContact C-N 3.31Å; G530-L532 PolarHBondContact O-N 2.94Å; G530-Q533 PolarHBondContact O-N 2.97Å; G530-I534 WeakPolarHBondContact O-CG1 3.47Å; G530-I534 PolarHBondContact O-N 2.82Å; G530-W672 VanDerWaalsContact C-CD1 3.47Å
531	P	91.9	Very high	88	Confident	9 Å²	9	58.9 Å²	58.9	6%	0.058	31%	0.313	C	S	.	.	H	α-helix	trans	-56.6	-43.3	177.6	-25.5	34.3	0	0	0	112.9	Q533 I534 S535 E668 W672	P531-Q533 VanDerWaalsContact C-N 3.34Å; P531-Q533 PolarHBondContact O-N 2.91Å; P531-I534 PolarHBondContact O-N 3.49Å; P531-S535 PolarHBondContact O-N 3.45Å; P531-S535 PolarHBondContact O-OG 3.36Å; P531-E668 HydrophobicContact CB-CB 4.32Å; P531-E668 HydrophobicContact CB-CG 4.13Å; P531-W672 HydrophobicContact CB-CB 4.31Å; P531-W672 HydrophobicContact CG-CB 3.98Å; P531-W672 HydrophobicContact CG-CD2 3.88Å; P531-W672 HydrophobicContact CG-CE3 4.13Å; P531-W672 HydrophobicContact CG-CG 3.77Å
532	L	87.9	Confident	88	Confident	104 Å²	104	60.7 Å²	60.7	55%	0.545	32%	0.322	S	S	.	.	H	α-helix	trans	-60.9	-40.6	177.4	-176	66.4	0	0	0	112.6	G530 S535 M536	G530-L532 VanDerWaalsContact C-N 3.31Å; G530-L532 PolarHBondContact O-N 2.94Å; L532-S535 PolarHBondContact O-OG 3Å; L532-M536 WeakPolarHBondContact O-CB 3.46Å; L532-M536 PolarHBondContact O-N 3.45Å; L532-M536 VanDerWaalsContact O-N 3.11Å
533	Q	89.8	Confident	88.2	Confident	27 Å²	27	61.9 Å²	61.9	13%	0.126	33%	0.326	C	S	.	.	H	α-helix	trans	-69	-41.6	179	-171.7	-141.2	-32.7	0	0	111.8	F520 L529 G530 P531 M536 G537	F520-Q533 PolarHBondContact O-NE2 3.45Å; F520-Q533 PolarHBondContact O-OE1 3.41Å; L529-Q533 WeakPolarHBondContact O-CB 3.36Å; L529-Q533 PolarHBondContact O-N 3.28Å; G530-Q533 PolarHBondContact O-N 2.97Å; P531-Q533 VanDerWaalsContact C-N 3.34Å; P531-Q533 PolarHBondContact O-N 2.91Å; Q533-M536 PolarHBondContact O-N 2.78Å; Q533-G537 PolarHBondContact O-N 2.9Å
534	I	89.1	Confident	88.1	Confident	31 Å²	31	58.5 Å²	58.5	16%	0.159	32%	0.324	C	S	.	.	H	α-helix	trans	-66.6	-43.1	179.7	-65	-62.6	0	0	0	110.8	T524 G530 P531 M536 G537 Q538 E671 A675	T524-I534 HydrophobicContact CG2-CD1 4Å; G530-I534 WeakPolarHBondContact O-CG1 3.47Å; G530-I534 PolarHBondContact O-N 2.82Å; P531-I534 PolarHBondContact O-N 3.49Å; I534-M536 VanDerWaalsContact C-N 3.34Å; I534-M536 PolarHBondContact O-N 3.47Å; I534-G537 PolarHBondContact O-N 3.35Å; I534-Q538 PolarHBondContact O-N 2.96Å; I534-Q538 VanDerWaalsContact O-N 3.17Å; I534-E671 HydrophobicContact CG2-CB 4.14Å; I534-A675 HydrophobicContact CD1-CB 3.75Å; I534-A675 HydrophobicContact CG1-CB 4.31Å
535	S	88.2	Confident	88	Confident	2 Å²	2	64.6 Å²	64.6	1%	0.014	35%	0.349	C	S	.	.	H	α-helix	trans	-63.5	-40.1	176.6	59.7	0	0	0	0	111.9	P531 L532 G537 Q538 M539	P531-S535 PolarHBondContact O-N 3.45Å; P531-S535 PolarHBondContact O-OG 3.36Å; L532-S535 PolarHBondContact O-OG 3Å; S535-G537 PolarHBondContact O-N 3.38Å; S535-Q538 PolarHBondContact O-N 3.46Å; S535-M539 WeakPolarHBondContact O-CG 3.32Å; S535-M539 PolarHBondContact O-N 2.82Å
536	M	86.9	Confident	88	Confident	110 Å²	110	64.3 Å²	64.3	54%	0.542	34%	0.344	S	S	.	.	H	α-helix	trans	-58.7	-43.9	172.6	-175.3	-178.1	175.9	0	0	112.8	L532 Q533 I534 Q538 M539 L540	L532-M536 WeakPolarHBondContact O-CB 3.46Å; L532-M536 PolarHBondContact O-N 3.45Å; L532-M536 VanDerWaalsContact O-N 3.11Å; Q533-M536 PolarHBondContact O-N 2.78Å; I534-M536 VanDerWaalsContact C-N 3.34Å; I534-M536 PolarHBondContact O-N 3.47Å; M536-Q538 VanDerWaalsContact C-N 3.33Å; M536-Q538 PolarHBondContact O-N 2.89Å; M536-M539 HydrophobicContact CB-CE 4.39Å; M536-M539 PolarHBondContact O-N 3.33Å; M536-L540 WeakPolarHBondContact O-CG 3.42Å; M536-L540 PolarHBondContact O-N 3.05Å; M536-L540 VanDerWaalsContact O-N 3.08Å
537	G	86.7	Confident	88	Confident	36 Å²	36	65.3 Å²	65.3	37%	0.371	35%	0.346	S	S	.	.	H	α-helix	trans	-61.6	-38.5	178.6	0	0	0	0	0	113.4	Q533 I534 S535 L540	Q533-G537 PolarHBondContact O-N 2.9Å; I534-G537 PolarHBondContact O-N 3.35Å; S535-G537 PolarHBondContact O-N 3.38Å; G537-L540 PolarHBondContact O-N 3.12Å
538	Q	87	Confident	88.1	Confident	48 Å²	48	63.4 Å²	63.4	22%	0.224	34%	0.339	C	S	.	.	H	α-helix	trans	-74.7	-38.6	177.5	-69.3	-177.5	1.2	0	0	112.8	I534 S535 M536 L540 Q541 E542 I664 E671	I534-Q538 PolarHBondContact O-N 2.96Å; I534-Q538 VanDerWaalsContact O-N 3.17Å; S535-Q538 PolarHBondContact O-N 3.46Å; M536-Q538 VanDerWaalsContact C-N 3.33Å; M536-Q538 PolarHBondContact O-N 2.89Å; Q538-L540 PolarHBondContact O-N 2.9Å; Q538-Q541 WeakPolarHBondContact O-CB 3.4Å; Q538-Q541 PolarHBondContact O-N 3.45Å; Q538-E542 PolarHBondContact O-N 3.09Å; Q538-I664 HydrophobicContact CB-CD1 3.81Å; Q538-E671 VanDerWaalsContact CD-OE2 3.22Å; Q538-E671 PolarHBondContact NE2-OE1 3.01Å; Q538-E671 VanDerWaalsContact NE2-OE1 3.15Å; Q538-E671 PolarHBondContact NE2-OE2 3.06Å; Q538-E671 PolarHBondContact OE1-OE2 3.43Å
539	M	89.5	Confident	88.1	Confident	36 Å²	36	61.1 Å²	61.1	18%	0.177	33%	0.327	C	S	.	.	H	α-helix	trans	-59.1	-35.6	172.9	-72.3	-171	-65	0	0	111.9	S535 M536 Q541 E542 F543 L657 F661 I664	S535-M539 WeakPolarHBondContact O-CG 3.32Å; S535-M539 PolarHBondContact O-N 2.82Å; M536-M539 HydrophobicContact CB-CE 4.39Å; M536-M539 PolarHBondContact O-N 3.33Å; M539-Q541 VanDerWaalsContact C-N 3.29Å; M539-Q541 PolarHBondContact O-N 3.39Å; M539-E542 PolarHBondContact O-N 3.47Å; M539-F543 WeakPolarHBondContact O-CB 3.31Å; M539-F543 PolarHBondContact O-N 3.17Å; M539-L657 HydrophobicContact CB-CD2 4.42Å; M539-F661 HydrophobicContact CE-CD2 3.88Å; M539-F661 HydrophobicContact SD-CB 3.62Å; M539-F661 HydrophobicContact SD-CD2 3.66Å; M539-F661 HydrophobicContact SD-CG 4.09Å; M539-I664 HydrophobicContact CG-CD1 3.79Å
540	L	86.1	Confident	88.2	Confident	99 Å²	99	58.5 Å²	58.5	52%	0.518	31%	0.313	S	S	.	.	H	α-helix	trans	-63.1	-31.2	175.5	-79.3	166.2	0	0	0	113.2	M536 G537 Q538 F543 G544	M536-L540 WeakPolarHBondContact O-CG 3.42Å; M536-L540 PolarHBondContact O-N 3.05Å; M536-L540 VanDerWaalsContact O-N 3.08Å; G537-L540 PolarHBondContact O-N 3.12Å; Q538-L540 PolarHBondContact O-N 2.9Å; L540-F543 HydrophobicContact CD2-CD1 4.48Å; L540-F543 WeakPolarHBondContact O-CB 3.47Å; L540-F543 PolarHBondContact O-N 3.19Å; L540-G544 PolarHBondContact O-N 3.22Å
541	Q	85.3	Confident	88.1	Confident	140 Å²	140	61.7 Å²	61.7	65%	0.654	33%	0.33	S	S	*	.	H	α-helix	trans	-69.2	-41.2	176	-65.7	-179.5	-16.3	0	0	111.6	Q538 M539 G544 K545	Q538-Q541 WeakPolarHBondContact O-CB 3.4Å; Q538-Q541 PolarHBondContact O-N 3.45Å; M539-Q541 VanDerWaalsContact C-N 3.29Å; M539-Q541 PolarHBondContact O-N 3.39Å; Q541-G544 PolarHBondContact O-N 3.04Å; Q541-K545 PolarHBondContact O-N 3.01Å
542	E	85.7	Confident	88.2	Confident	83 Å²	83	67.1 Å²	67.1	39%	0.388	36%	0.358	S	S	.	.	H	α-helix	trans	-68.5	-37.3	173.6	-65.2	-56.3	148.5	0	0	111.9	Q538 M539 G544 K545 F546	Q538-E542 PolarHBondContact O-N 3.09Å; M539-E542 PolarHBondContact O-N 3.47Å; E542-G544 VanDerWaalsContact C-N 3.26Å; E542-G544 PolarHBondContact O-N 3.2Å; E542-K545 PolarHBondContact O-N 3.29Å; E542-K545 IonicContact OE1-NZ 3.6Å; E542-K545 PolarHBondContact OE1-NZ 2.99Å; E542-K545 WeakPolarHBondContact OE2-CD 3.24Å; E542-K545 IonicContact OE2-NZ 3.27Å; E542-K545 PolarHBondContact OE2-NZ 3.07Å; E542-F546 PolarHBondContact O-N 3.3Å
543	F	88.9	Confident	88.4	Confident	70 Å²	70	63.3 Å²	63.3	31%	0.307	34%	0.339	S	S	.	.	H	α-helix	trans	-57.3	-39.4	170.9	173.7	-100.4	0	0	0	111.8	M539 L540 K545 F546 L547 L653 L657	M539-F543 WeakPolarHBondContact O-CB 3.31Å; M539-F543 PolarHBondContact O-N 3.17Å; L540-F543 HydrophobicContact CD2-CD1 4.48Å; L540-F543 WeakPolarHBondContact O-CB 3.47Å; L540-F543 PolarHBondContact O-N 3.19Å; F543-K545 VanDerWaalsContact C-N 3.34Å; F543-K545 PolarHBondContact O-N 3.38Å; F543-F546 CarbonylContact O-C 3.6Å; F543-F546 WeakPolarHBondContact O-CB 3.37Å; F543-F546 PolarHBondContact O-N 3.41Å; F543-F546 VanDerWaalsContact O-N 3.15Å; F543-L547 HydrophobicContact CE1-CB 4.48Å; F543-L547 HydrophobicContact CE1-CD1 4.44Å; F543-L547 HydrophobicContact CZ-CD1 4.29Å; F543-L547 PolarHBondContact O-N 3.32Å; F543-L653 HydrophobicContact CD2-CD1 3.56Å; F543-L653 HydrophobicContact CD2-CD2 4.18Å; F543-L653 HydrophobicContact CD2-CG 4.46Å; F543-L653 HydrophobicContact CE2-CD1 3.95Å; F543-L653 HydrophobicContact CE2-CD2 3.77Å; F543-L657 HydrophobicContact CB-CD2 4.46Å
544	G	86.8	Confident	88.4	Confident	36 Å²	36	62.3 Å²	62.3	37%	0.371	33%	0.334	S	S	.	.	H	α-helix	trans	-59.2	-39.6	176.8	0	0	0	0	0	113.6	L540 Q541 E542 F546 L547 G548	L540-G544 PolarHBondContact O-N 3.22Å; Q541-G544 PolarHBondContact O-N 3.04Å; E542-G544 VanDerWaalsContact C-N 3.26Å; E542-G544 PolarHBondContact O-N 3.2Å; G544-F546 VanDerWaalsContact C-N 3.33Å; G544-F546 PolarHBondContact O-N 3.42Å; G544-L547 WeakPolarHBondContact O-CB 3.46Å; G544-L547 PolarHBondContact O-N 3.12Å; G544-G548 PolarHBondContact O-N 3.08Å
545	K	86.3	Confident	88.6	Confident	141 Å²	141	65.1 Å²	65.1	61%	0.613	35%	0.345	S	S	*	.	H	α-helix	trans	-63.7	-40.5	175.4	-60	178	-165.8	158.3	0	111.3	Q541 E542 F543 G548	Q541-K545 PolarHBondContact O-N 3.01Å; E542-K545 PolarHBondContact O-N 3.29Å; E542-K545 IonicContact OE1-NZ 3.6Å; E542-K545 PolarHBondContact OE1-NZ 2.99Å; E542-K545 WeakPolarHBondContact OE2-CD 3.24Å; E542-K545 IonicContact OE2-NZ 3.27Å; E542-K545 PolarHBondContact OE2-NZ 3.07Å; F543-K545 VanDerWaalsContact C-N 3.34Å; F543-K545 PolarHBondContact O-N 3.38Å; K545-G548 PolarHBondContact O-N 2.84Å
546	F	87.9	Confident	88.9	Confident	38 Å²	38	68.7 Å²	68.7	17%	0.167	37%	0.37	C	S	.	.	H	α-helix	trans	-68.9	-37.5	175.8	-175.9	-91.7	0	0	0	112.6	E542 F543 G544 G548 L549 F550 L649 L652 L653	E542-F546 PolarHBondContact O-N 3.3Å; F543-F546 CarbonylContact O-C 3.6Å; F543-F546 WeakPolarHBondContact O-CB 3.37Å; F543-F546 PolarHBondContact O-N 3.41Å; F543-F546 VanDerWaalsContact O-N 3.15Å; G544-F546 VanDerWaalsContact C-N 3.33Å; G544-F546 PolarHBondContact O-N 3.42Å; F546-G548 PolarHBondContact O-N 2.95Å; F546-L549 WeakPolarHBondContact O-CB 3.29Å; F546-L549 PolarHBondContact O-N 3.2Å; F546-F550 PolarHBondContact O-N 2.97Å; F546-L649 HydrophobicContact CE1-CB 4.48Å; F546-L649 HydrophobicContact CE2-CD2 4.4Å; F546-L649 HydrophobicContact CZ-CB 3.9Å; F546-L649 HydrophobicContact CZ-CD2 4.02Å; F546-L649 HydrophobicContact CZ-CG 4.47Å; F546-L649 VanDerWaalsContact CZ-O 3.24Å; F546-L649 WeakPolarHBondContact CZ-O 3.49Å; F546-L652 HydrophobicContact CE2-CB 4.41Å; F546-L653 HydrophobicContact CB-CD1 4.3Å; F546-L653 HydrophobicContact CD1-CB 4.18Å; F546-L653 HydrophobicContact CD1-CD1 3.49Å; F546-L653 VanDerWaalsContact CD1-CD1 3.49Å; F546-L653 HydrophobicContact CD1-CG 4.24Å; F546-L653 HydrophobicContact CE1-CB 3.71Å; F546-L653 HydrophobicContact CE1-CD1 3.93Å; F546-L653 HydrophobicContact CE1-CD2 4.37Å; F546-L653 HydrophobicContact CE1-CG 4.19Å; F546-L653 HydrophobicContact CG-CD1 3.88Å; F546-L653 HydrophobicContact CZ-CB 3.9Å
547	L	88.3	Confident	89.1	Confident	66 Å²	66	65.3 Å²	65.3	35%	0.346	35%	0.353	S	S	.	.	H	α-helix	trans	-57.1	-34.9	175.9	-174.2	69.8	0	0	0	111.4	F543 G544 L549 F550 L551	F543-L547 HydrophobicContact CE1-CB 4.48Å; F543-L547 HydrophobicContact CE1-CD1 4.44Å; F543-L547 HydrophobicContact CZ-CD1 4.29Å; F543-L547 PolarHBondContact O-N 3.32Å; G544-L547 WeakPolarHBondContact O-CB 3.46Å; G544-L547 PolarHBondContact O-N 3.12Å; L547-L549 PolarHBondContact O-N 3.49Å; L547-F550 HydrophobicContact CD1-CD1 3.86Å; L547-F550 WeakPolarHBondContact O-CB 3.32Å; L547-F550 PolarHBondContact O-N 3.44Å; L547-L551 HydrophobicContact CG-CD1 4.39Å; L547-L551 HydrophobicContact CG-CG 4.44Å; L547-L551 WeakPolarHBondContact O-CG 3.37Å; L547-L551 PolarHBondContact O-N 3.36Å
548	G	89.1	Confident	89.2	Confident	42 Å²	42	63.6 Å²	63.6	43%	0.433	34%	0.335	S	S	.	.	H	α-helix	trans	-59.7	-42.7	173.3	0	0	0	0	0	113.5	G544 K545 F546 L551 L552	G544-G548 PolarHBondContact O-N 3.08Å; K545-G548 PolarHBondContact O-N 2.84Å; F546-G548 PolarHBondContact O-N 2.95Å; G548-L551 PolarHBondContact O-N 3.46Å; G548-L552 PolarHBondContact O-N 3.41Å; G548-L552 VanDerWaalsContact O-N 3.12Å
549	L	88.4	Confident	89.4	Confident	89 Å²	89	65.8 Å²	65.8	47%	0.466	35%	0.347	S	S	.	.	H	α-helix	trans	-66.3	-39.4	175.3	-176.8	143.1	0	0	0	111.4	F546 L547 L552 V553 L649	F546-L549 WeakPolarHBondContact O-CB 3.29Å; F546-L549 PolarHBondContact O-N 3.2Å; L547-L549 PolarHBondContact O-N 3.49Å; L549-L552 PolarHBondContact O-N 3.13Å; L549-V553 PolarHBondContact O-N 3.34Å; L549-L649 HydrophobicContact CD2-CD1 4.22Å; L549-L649 HydrophobicContact CD2-CD2 3.35Å; L549-L649 HydrophobicContact CD2-CG 4.44Å
550	F	90	Very high	89.4	Confident	22 Å²	22	65.3 Å²	65.3	10%	0.096	35%	0.352	C	S	.	.	H	α-helix	trans	-62.5	-44.7	173.9	166.8	-99.6	0	0	0	112.4	F546 L547 L552 V553 L554 I610 V645 L649	F546-F550 PolarHBondContact O-N 2.97Å; L547-F550 HydrophobicContact CD1-CD1 3.86Å; L547-F550 WeakPolarHBondContact O-CB 3.32Å; L547-F550 PolarHBondContact O-N 3.44Å; F550-L552 VanDerWaalsContact C-N 3.32Å; F550-L552 PolarHBondContact O-N 3.23Å; F550-V553 PolarHBondContact O-N 3.06Å; F550-L554 HydrophobicContact CE1-CD2 4.19Å; F550-L554 HydrophobicContact CZ-CB 4.28Å; F550-L554 HydrophobicContact CZ-CD1 4.35Å; F550-L554 HydrophobicContact CZ-CD2 4.26Å; F550-L554 PolarHBondContact O-N 2.99Å; F550-I610 HydrophobicContact CD2-CD1 4.47Å; F550-I610 HydrophobicContact CE1-CD1 4.31Å; F550-I610 HydrophobicContact CE2-CD1 3.26Å; F550-I610 HydrophobicContact CE2-CG1 4.49Å; F550-I610 HydrophobicContact CZ-CD1 3.16Å; F550-V645 HydrophobicContact CD2-CG1 4.07Å; F550-V645 HydrophobicContact CE2-CG1 3.65Å; F550-V645 HydrophobicContact CE2-CG2 4.41Å; F550-L649 HydrophobicContact CD2-CD1 4.3Å
551	L	91.3	Very high	89.3	Confident	66 Å²	66	60.7 Å²	60.7	35%	0.346	33%	0.327	S	S	.	.	H	α-helix	trans	-63.2	-36.8	178.5	-72.5	174.3	0	0	0	112.3	L547 G548 L554 F555	L547-L551 HydrophobicContact CG-CD1 4.39Å; L547-L551 HydrophobicContact CG-CG 4.44Å; L547-L551 WeakPolarHBondContact O-CG 3.37Å; L547-L551 PolarHBondContact O-N 3.36Å; G548-L551 PolarHBondContact O-N 3.46Å; L551-L554 HydrophobicContact CD2-CD2 4.21Å; L551-L554 PolarHBondContact O-N 2.9Å; L551-F555 HydrophobicContact CB-CE2 4.3Å; L551-F555 WeakPolarHBondContact O-CD2 3.48Å; L551-F555 WeakPolarHBondContact O-CG 3.32Å; L551-F555 PolarHBondContact O-N 3.39Å
552	L	92.1	Very high	89.3	Confident	124 Å²	124	55.1 Å²	55.1	65%	0.649	30%	0.303	S	S	*	.	H	α-helix	trans	-59.1	-47.9	174.1	-173.2	163.6	0	0	0	111	G548 L549 F550 F555 S556	G548-L552 PolarHBondContact O-N 3.41Å; G548-L552 VanDerWaalsContact O-N 3.12Å; L549-L552 PolarHBondContact O-N 3.13Å; F550-L552 VanDerWaalsContact C-N 3.32Å; F550-L552 PolarHBondContact O-N 3.23Å; L552-F555 PolarHBondContact O-N 3.05Å; L552-S556 PolarHBondContact O-N 3.47Å
553	V	92.3	Very high	89.3	Confident	24 Å²	24	58.7 Å²	58.7	15%	0.145	32%	0.32	C	S	.	.	H	α-helix	trans	-61.2	-50.1	176	173.8	0	0	0	0	110.1	L549 F550 F555 S556 F557 V644 V645 L649	L549-V553 PolarHBondContact O-N 3.34Å; F550-V553 PolarHBondContact O-N 3.06Å; V553-F555 VanDerWaalsContact C-N 3.33Å; V553-F555 PolarHBondContact O-N 3.4Å; V553-S556 PolarHBondContact O-N 2.9Å; V553-F557 HydrophobicContact CG1-CD2 3.66Å; V553-F557 HydrophobicContact CG1-CE2 3.69Å; V553-F557 VanDerWaalsContact O-CD2 3.29Å; V553-F557 WeakPolarHBondContact O-CD2 3.46Å; V553-F557 PolarHBondContact O-N 3.35Å; V553-V644 HydrophobicContact CG1-CG1 4.14Å; V553-V645 HydrophobicContact CG1-CG2 3.84Å; V553-L649 HydrophobicContact CB-CD1 4.43Å; V553-L649 HydrophobicContact CG1-CD1 4.48Å; V553-L649 HydrophobicContact CG2-CD1 4.25Å
554	L	91.4	Very high	88.9	Confident	5 Å²	5	56.9 Å²	56.9	3%	0.026	31%	0.313	C	S	.	.	H	α-helix	trans	-53.3	-48.4	179	-176.3	68.5	0	0	0	111.9	F550 L551 F557 T558 L606 Y641	F550-L554 HydrophobicContact CE1-CD2 4.19Å; F550-L554 HydrophobicContact CZ-CB 4.28Å; F550-L554 HydrophobicContact CZ-CD1 4.35Å; F550-L554 HydrophobicContact CZ-CD2 4.26Å; F550-L554 PolarHBondContact O-N 2.99Å; L551-L554 HydrophobicContact CD2-CD2 4.21Å; L551-L554 PolarHBondContact O-N 2.9Å; L554-F557 PolarHBondContact O-N 3.47Å; L554-T558 WeakPolarHBondContact O-CB 3.17Å; L554-T558 PolarHBondContact O-N 3.37Å; L554-T558 PolarHBondContact O-OG1 3.42Å; L554-L606 HydrophobicContact CD1-CB 3.53Å; L554-L606 HydrophobicContact CD1-CD1 4.31Å; L554-Y641 HydrophobicContact CD1-CE2 4.32Å
555	F	92.8	Very high	88.4	Confident	91 Å²	91	56 Å²	56	40%	0.399	30%	0.299	S	S	.	.	H	α-helix	trans	-66.7	-40.3	179.6	-67.8	-42.5	0	0	0	112.9	L551 L552 V553 F557 T558 I559 F599	L551-F555 HydrophobicContact CB-CE2 4.3Å; L551-F555 WeakPolarHBondContact O-CD2 3.48Å; L551-F555 WeakPolarHBondContact O-CG 3.32Å; L551-F555 PolarHBondContact O-N 3.39Å; L552-F555 PolarHBondContact O-N 3.05Å; V553-F555 VanDerWaalsContact C-N 3.33Å; V553-F555 PolarHBondContact O-N 3.4Å; F555-F557 PolarHBondContact O-N 2.82Å; F555-T558 PolarHBondContact O-N 2.81Å; F555-I559 VanDerWaalsContact O-CG1 3.3Å; F555-I559 WeakPolarHBondContact O-CG1 3.35Å; F555-I559 PolarHBondContact O-N 2.86Å; F555-F599 AromaticContact CD1-CZ 3.86Å; F555-F599 HydrophobicContact CD1-CZ 3.86Å; F555-F599 HydrophobicContact CE1-CZ 4.22Å
556	S	93.6	Very high	87.7	Confident	77 Å²	77	50.7 Å²	50.7	54%	0.538	28%	0.284	S	S	.	.	H	α-helix	trans	-58.3	-46.4	176.4	-175.4	0	0	0	0	111.9	L552 V553 G560	L552-S556 PolarHBondContact O-N 3.47Å; V553-S556 PolarHBondContact O-N 2.9Å; S556-G560 PolarHBondContact O-N 3.23Å; S556-G560 VanDerWaalsContact O-N 3.16Å
557	F	91.1	Very high	86.4	Confident	39 Å²	39	56.7 Å²	56.7	17%	0.171	31%	0.31	C	S	.	.	H	α-helix	trans	-72.7	-33.7	178.4	-78.1	-84.7	0	0	0	112.4	V553 L554 F555 G560 L561 L606 I637 Y641	V553-F557 HydrophobicContact CG1-CD2 3.66Å; V553-F557 HydrophobicContact CG1-CE2 3.69Å; V553-F557 VanDerWaalsContact O-CD2 3.29Å; V553-F557 WeakPolarHBondContact O-CD2 3.46Å; V553-F557 PolarHBondContact O-N 3.35Å; L554-F557 PolarHBondContact O-N 3.47Å; F555-F557 PolarHBondContact O-N 2.82Å; F557-G560 PolarHBondContact O-N 3.4Å; F557-L561 PolarHBondContact O-N 2.82Å; F557-L606 HydrophobicContact CB-CD1 4.07Å; F557-I637 HydrophobicContact CD1-CG2 3.82Å; F557-I637 HydrophobicContact CE1-CG2 4.3Å; F557-Y641 HydrophobicContact CB-CD2 3.89Å; F557-Y641 HydrophobicContact CB-CE2 4.5Å; F557-Y641 HydrophobicContact CD1-CD2 4.26Å; F557-Y641 AromaticContact CD2-CD2 3.84Å; F557-Y641 HydrophobicContact CD2-CD2 3.84Å; F557-Y641 HydrophobicContact CE2-CD2 4.46Å; F557-Y641 AromaticContact CG-CD2 3.74Å; F557-Y641 HydrophobicContact CG-CD2 3.74Å; F557-Y641 HydrophobicContact CG-CG 4.42Å
558	T	90.2	Very high	84.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-60.6	-45.8	174.4	-58.1	0	0	0	0	111.1	L554 F555 L561 T562 F599 T602 C603 L606	L554-T558 WeakPolarHBondContact O-CB 3.17Å; L554-T558 PolarHBondContact O-N 3.37Å; L554-T558 PolarHBondContact O-OG1 3.42Å; F555-T558 PolarHBondContact O-N 2.81Å; T558-L561 PolarHBondContact O-N 2.88Å; T558-T562 WeakPolarHBondContact O-CB 3.41Å; T558-T562 WeakPolarHBondContact O-CG2 3.47Å; T558-T562 PolarHBondContact O-N 2.82Å; T558-T562 PolarHBondContact O-OG1 2.95Å; T558-F599 HydrophobicContact CG2-CD2 3.56Å; T558-F599 HydrophobicContact CG2-CE2 3.52Å; T558-F599 HydrophobicContact CG2-CG 4.21Å; T558-F599 HydrophobicContact CG2-CZ 4.15Å; T558-F599 WeakPolarHBondContact CG2-O 3.35Å; T558-T602 HydrophobicContact CG2-CG2 3.77Å; T558-C603 HydrophobicContact CG2-CB 4.09Å; T558-L606 WeakPolarHBondContact OG1-CD1 3.48Å
559	I	90.8	Very high	83.2	Confident	93 Å²	93	58.3 Å²	58.3	48%	0.477	30%	0.302	S	S	.	.	H	α-helix	trans	-63.6	-43.8	176.6	-65.2	166.2	0	0	0	110.5	F555 L561 T562 Q563 F599	F555-I559 VanDerWaalsContact O-CG1 3.3Å; F555-I559 WeakPolarHBondContact O-CG1 3.35Å; F555-I559 PolarHBondContact O-N 2.86Å; I559-L561 PolarHBondContact O-N 3.01Å; I559-T562 WeakPolarHBondContact CA-OG1 3.43Å; I559-T562 PolarHBondContact O-OG1 3.48Å; I559-Q563 WeakPolarHBondContact O-CB 3.47Å; I559-Q563 PolarHBondContact O-N 2.88Å; I559-F599 HydrophobicContact CG1-CE2 4.04Å
560	G	89.2	Confident	81.3	Confident	27 Å²	27	57.3 Å²	57.3	28%	0.278	31%	0.306	S	S	.	.	H	α-helix	trans	-59.6	-45	178	0	0	0	0	0	113.5	S556 F557 L564	S556-G560 PolarHBondContact O-N 3.23Å; S556-G560 VanDerWaalsContact O-N 3.16Å; F557-G560 PolarHBondContact O-N 3.4Å; G560-L564 PolarHBondContact O-N 2.64Å
561	L	84	Confident	79.3	Confident	1 Å²	1	64.1 Å²	64.1	1%	0.005	34%	0.336	C	S	.	.	H	α-helix	trans	-74	-40.9	-180	-71.5	177	0	0	0	113	F557 T558 I559 Q563 L564 Y565 F596 T602 L606 I637 I638	F557-L561 PolarHBondContact O-N 2.82Å; T558-L561 PolarHBondContact O-N 2.88Å; I559-L561 PolarHBondContact O-N 3.01Å; L561-Q563 VanDerWaalsContact C-N 3.29Å; L561-Q563 PolarHBondContact O-N 3.42Å; L561-L564 PolarHBondContact O-N 3.26Å; L561-L564 VanDerWaalsContact O-N 3.16Å; L561-Y565 HydrophobicContact CD2-CE2 4.18Å; L561-Y565 WeakPolarHBondContact O-CD2 3.31Å; L561-Y565 PolarHBondContact O-N 3.5Å; L561-F596 HydrophobicContact CD1-CD1 4.4Å; L561-F596 HydrophobicContact CD1-CE1 4.15Å; L561-T602 HydrophobicContact CB-CG2 3.84Å; L561-T602 HydrophobicContact CD1-CG2 4.38Å; L561-L606 HydrophobicContact CD1-CD1 4.13Å; L561-L606 HydrophobicContact CD1-CD2 3.76Å; L561-L606 HydrophobicContact CD1-CG 4.19Å; L561-I637 HydrophobicContact CD2-CB 4.03Å; L561-I637 HydrophobicContact CD2-CG2 3.65Å; L561-I637 HydrophobicContact CG-CG2 3.9Å; L561-I638 HydrophobicContact CD1-CD1 4.48Å; L561-I638 HydrophobicContact CD1-CG1 3.92Å; L561-I638 HydrophobicContact CD2-CD1 4.47Å; L561-I638 HydrophobicContact CD2-CG1 4.08Å
562	T	85	Confident	77.3	Confident	24 Å²	24	66 Å²	66	15%	0.147	34%	0.343	C	S	.	.	H	α-helix	trans	-62.2	-36.1	173.8	41.9	0	0	0	0	112.6	T558 I559 L564 G566 F599 T602	T558-T562 WeakPolarHBondContact O-CB 3.41Å; T558-T562 WeakPolarHBondContact O-CG2 3.47Å; T558-T562 PolarHBondContact O-N 2.82Å; T558-T562 PolarHBondContact O-OG1 2.95Å; I559-T562 WeakPolarHBondContact CA-OG1 3.43Å; I559-T562 PolarHBondContact O-OG1 3.48Å; T562-L564 VanDerWaalsContact C-N 3.33Å; T562-G566 WeakPolarHBondContact O-CA 3.34Å; T562-G566 PolarHBondContact O-N 2.91Å; T562-F599 HydrophobicContact CG2-CB 4.28Å; T562-T602 HydrophobicContact CG2-CG2 4.21Å; T562-T602 WeakPolarHBondContact CG2-OG1 3.47Å
563	Q	85.2	Confident	75.2	Confident	157 Å²	157	65.5 Å²	65.5	73%	0.734	35%	0.345	S	S	*	.	H	α-helix	trans	-68.4	-34.8	175	-173.7	174.2	-3.4	0	0	112.2	I559 L561	I559-Q563 WeakPolarHBondContact O-CB 3.47Å; I559-Q563 PolarHBondContact O-N 2.88Å; L561-Q563 VanDerWaalsContact C-N 3.29Å; L561-Q563 PolarHBondContact O-N 3.42Å
564	L	81.3	Confident	73	Confident	33 Å²	33	73.6 Å²	73.6	17%	0.173	38%	0.379	C	S	.	.	H	α-helix	trans	-69.4	-44.2	180	-171.3	65.4	0	0	0	112.2	G560 L561 T562 R630 V633 G634 I637	G560-L564 PolarHBondContact O-N 2.64Å; L561-L564 PolarHBondContact O-N 3.26Å; L561-L564 VanDerWaalsContact O-N 3.16Å; T562-L564 VanDerWaalsContact C-N 3.33Å; L564-R630 HydrophobicContact CD1-CG 3.93Å; L564-R630 HydrophobicContact CG-CG 4.05Å; L564-R630 PolarHBondContact O-NE 2.89Å; L564-R630 PolarHBondContact O-NH2 3.47Å; L564-V633 HydrophobicContact CD1-CG1 4.26Å; L564-V633 HydrophobicContact CD2-CG1 4.2Å; L564-G634 VanDerWaalsContact CD2-CA 3.43Å; L564-I637 HydrophobicContact CD2-CD1 4.24Å
565	Y	76.7	Confident	70.9	Confident	17 Å²	17	76.5 Å²	76.5	7%	0.067	41%	0.409	C	S	.	.	H	α-helix	trans	-105.4	-14.6	-172.4	-66.9	-68.6	0	0	0	115	L561 K567 D568 F596 H597 R630	L561-Y565 HydrophobicContact CD2-CE2 4.18Å; L561-Y565 WeakPolarHBondContact O-CD2 3.31Å; L561-Y565 PolarHBondContact O-N 3.5Å; Y565-K567 VanDerWaalsContact C-N 3.28Å; Y565-K567 PolarHBondContact O-N 3.34Å; Y565-D568 PolarHBondContact O-N 3.47Å; Y565-F596 HydrophobicContact CD2-CB 3.79Å; Y565-F596 HydrophobicContact CD2-CD2 4.21Å; Y565-F596 HydrophobicContact CD2-CG 4.2Å; Y565-F596 HydrophobicContact CE2-CD2 4.27Å; Y565-F596 HydrophobicContact CG-CB 4.04Å; Y565-H597 PolarHBondContact O-ND1 2.95Å; Y565-R630 HydrophobicContact CE1-CG 4.46Å
566	G	71.1	Confident	68.6	Low	29 Å²	29	79.4 Å²	79.4	30%	0.299	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-66.7	-19.8	-173.2	0	0	0	0	0	115.6	T562 D568	T562-G566 WeakPolarHBondContact O-CA 3.34Å; T562-G566 PolarHBondContact O-N 2.91Å; G566-D568 VanDerWaalsContact C-N 3.33Å; G566-D568 PolarHBondContact O-N 3.07Å
567	K	59.8	Low	66.3	Low	164 Å²	164	80.9 Å²	80.9	71%	0.713	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-72.9	-21.5	179.3	-83.3	-174.8	176.7	176.5	0	114	Y565 Y569	Y565-K567 VanDerWaalsContact C-N 3.28Å; Y565-K567 PolarHBondContact O-N 3.34Å; K567-Y569 VanDerWaalsContact C-N 3.33Å; K567-Y569 PolarHBondContact O-N 2.76Å
568	D	57.4	Low	64	Low	37 Å²	37	86.3 Å²	86.3	20%	0.198	47%	0.465	C	S	.	.	G	3₁₀ helix	trans	-82.7	-12.9	-172	-59.8	-34.4	0	0	0	112.3	Y565 G566 A570 K571 R630	Y565-D568 PolarHBondContact O-N 3.47Å; G566-D568 VanDerWaalsContact C-N 3.33Å; G566-D568 PolarHBondContact O-N 3.07Å; D568-A570 VanDerWaalsContact C-N 3.3Å; D568-A570 PolarHBondContact O-N 3.02Å; D568-K571 PolarHBondContact O-N 3.16Å; D568-R630 IonicContact OD1-CZ 3.73Å; D568-R630 IonicContact OD1-NH1 3.59Å; D568-R630 PolarHBondContact OD1-NH1 3.41Å; D568-R630 IonicContact OD1-NH2 3.92Å; D568-R630 IonicContact OD2-CZ 3.92Å; D568-R630 IonicContact OD2-NH1 3.99Å; D568-R630 PolarHBondContact OD2-NH1 2.69Å; D568-R630 VanDerWaalsContact OD2-NH1 3.1Å; D568-R630 IonicContact OD2-NH2 2.8Å
569	Y	52.7	Low	61.9	Low	105 Å²	105	94.1 Å²	94.1	41%	0.412	50%	0.502	S	S	.	.	H	α-helix	trans	-66.2	-28.6	176.2	-150.4	-100.8	0	0	0	113	K567 T573 E584 H597	K567-Y569 VanDerWaalsContact C-N 3.33Å; K567-Y569 PolarHBondContact O-N 2.76Å; Y569-T573 PolarHBondContact O-OG1 3.23Å; Y569-E584 PolarHBondContact OH-OE2 2.96Å; Y569-H597 HydrophobicContact CD2-CB 3.48Å; Y569-H597 VanDerWaalsContact CD2-CB 3.48Å; Y569-H597 AromaticContact CD2-CG 3.65Å; Y569-H597 AromaticContact CD2-ND1 3.66Å; Y569-H597 HydrophobicContact CE2-CB 4.18Å; Y569-H597 HydrophobicContact CG-CB 4.16Å; Y569-H597 PolarHBondContact N-ND1 3.3Å
570	A	49.3	Very low	59.8	Low	68 Å²	68	95.3 Å²	95.3	56%	0.562	51%	0.514	S	S	*	.	H	α-helix	trans	-82.3	-14.3	-178.2	0	0	0	0	0	114.1	D568	D568-A570 VanDerWaalsContact C-N 3.3Å; D568-A570 PolarHBondContact O-N 3.02Å
571	K	47.8	Very low	58.2	Low	166 Å²	166	98.7 Å²	98.7	72%	0.722	52%	0.52	S	S	*	.	H	α-helix	trans	-94.2	-35.8	-179.7	-83.1	-176.8	177.7	177	0	112.7	D568 T573 K574	D568-K571 PolarHBondContact O-N 3.16Å; K571-T573 VanDerWaalsContact C-N 3.32Å; K571-T573 PolarHBondContact O-N 3.17Å; K571-K574 PolarHBondContact O-N 3.22Å
572	E	50.2	Low	56.9	Low	106 Å²	106	105.8 Å²	105.8	50%	0.495	56%	0.558	S	S	.	*	H	α-helix	trans	-68.4	-30.2	177.9	-68.3	-159.9	172.9	0	0	112.9	K574 G575 K581	E572-K574 PolarHBondContact O-N 3.49Å; E572-G575 PolarHBondContact O-N 2.96Å; E572-K581 IonicContact OE2-NZ 3.35Å; E572-K581 PolarHBondContact OE2-NZ 3.3Å
573	T	47.8	Very low	55.9	Low	112 Å²	112	108 Å²	108	69%	0.687	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-15.2	178.6	13.3	0	0	0	0	114.5	Y569 K571	Y569-T573 PolarHBondContact O-OG1 3.23Å; K571-T573 VanDerWaalsContact C-N 3.32Å; K571-T573 PolarHBondContact O-N 3.17Å
574	K	45.1	Very low	54.8	Low	195 Å²	195	106.3 Å²	106.3	85%	0.848	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	-5.5	178.8	-71.4	-171.8	178	-177.3	0	114.1	K571 E572	K571-K574 PolarHBondContact O-N 3.22Å; E572-K574 PolarHBondContact O-N 3.49Å
575	G	47.9	Very low	54	Low	65 Å²	65	105.9 Å²	105.9	67%	0.67	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119	-16.2	-167.2	0	0	0	0	0	117.6	E572	E572-G575 PolarHBondContact O-N 2.96Å
576	Q	43.9	Very low	53.4	Low	153 Å²	153	106.7 Å²	106.7	72%	0.715	58%	0.575	S	S	*	*			trans	-138	89.6	-179.4	-83.6	177.9	-16.7	0	0	111.5
577	S	45.5	Very low	53.1	Low	107 Å²	107	112.9 Å²	112.9	75%	0.748	59%	0.594	S	S	*	*			trans	-72.9	126.2	152	53	0	0	0	0	108.7
578	N	42.8	Very low	53.5	Low	154 Å²	154	105.7 Å²	105.7	82%	0.824	56%	0.564	S	S	*	*	S	Bend	trans	100	37.2	162.5	-50.8	-12.5	0	0	0	119.2
579	Q	46.4	Very low	53.7	Low	164 Å²	164	114 Å²	114	77%	0.766	60%	0.602	S	S	*	*			trans	-130.1	112.4	143.8	-75.2	-175.9	-6.1	0	0	108.1	K581	Q579-K581 VanDerWaalsContact C-N 3.34Å; Q579-K581 PolarHBondContact O-N 3.21Å
580	T	47.3	Very low	54	Low	118 Å²	118	117.2 Å²	117.2	72%	0.724	62%	0.621	S	S	*	*			trans	-62.9	99.8	166.3	45.3	0	0	0	0	106.8	D582	T580-D582 WeakPolarHBondContact CB-OD1 3.45Å; T580-D582 PolarHBondContact O-N 2.96Å; T580-D582 PolarHBondContact OG1-OD1 3.04Å
581	K	54.4	Low	54.4	Low	97 Å²	97	116.7 Å²	116.7	42%	0.422	61%	0.607	S	S	.	*			trans	-67.3	91.4	164.5	-74.1	-178.4	-179.9	173.1	0	105.5	E572 Q579 C583 D594	E572-K581 IonicContact OE2-NZ 3.35Å; E572-K581 PolarHBondContact OE2-NZ 3.3Å; Q579-K581 VanDerWaalsContact C-N 3.34Å; Q579-K581 PolarHBondContact O-N 3.21Å; K581-C583 PolarHBondContact O-N 3.48Å; K581-D594 IonicContact NZ-OD2 3.49Å; K581-D594 PolarHBondContact NZ-OD2 3.03Å
582	D	57	Low	54.8	Low	150 Å²	150	110.7 Å²	110.7	80%	0.802	59%	0.585	S	S	*	*	S	Bend	trans	-64.3	-6	-173.4	-72.7	-17.7	0	0	0	113.9	T580	T580-D582 WeakPolarHBondContact CB-OD1 3.45Å; T580-D582 PolarHBondContact O-N 2.96Å; T580-D582 PolarHBondContact OG1-OD1 3.04Å
583	C	63.6	Low	55.1	Low	71 Å²	71	107.3 Å²	107.3	48%	0.48	57%	0.571	S	S	.	*			trans	-147	117.8	176.9	-169.5	0	0	0	0	110.1	K581 C588	K581-C583 PolarHBondContact O-N 3.48Å; C583-C588 VanDerWaalsContact CA-SG 3.53Å; C583-C588 HydrophobicContact CB-CB 3.81Å; C583-C588 WeakPolarHBondContact CB-SG 3.46Å; C583-C588 PolarHBondContact O-SG 3.29Å; C583-C588 WeakPolarHBondContact SG-CA 3.07Å; C583-C588 WeakPolarHBondContact SG-CB 3.33Å; C583-C588 CovalentContact SG-SG 2.03Å; C583-C588 PolarHBondContact SG-SG 3Å
584	E	63.4	Low	55.7	Low	121 Å²	121	102.9 Å²	102.9	57%	0.565	54%	0.543	S	S	*	.			trans	-111.1	133.9	170.1	-65.6	-174.2	178.8	0	0	110.2	Y569 C588	Y569-E584 PolarHBondContact OH-OE2 2.96Å; E584-C588 PolarHBondContact N-SG 3.5Å; E584-C588 VanDerWaalsContact N-SG 3.42Å
585	G	63.5	Low	56.8	Low	25 Å²	25	93.8 Å²	93.8	26%	0.258	50%	0.504	S	S	.	.	S	Bend	trans	119	-177.2	173.7	0	0	0	0	0	115.7	F587 C588	G585-F587 VanDerWaalsContact C-N 3.25Å; G585-F587 PolarHBondContact O-N 3Å; G585-C588 WeakPolarHBondContact O-CB 3.36Å; G585-C588 PolarHBondContact O-N 2.85Å; G585-C588 PolarHBondContact O-SG 3.02Å
586	I	64.9	Low	58.1	Low	33 Å²	33	91.4 Å²	91.4	17%	0.169	48%	0.475	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-23.9	-170.3	-62.3	141	0	0	0	113	C588 A595 A605	I586-C588 VanDerWaalsContact C-N 3.32Å; I586-A595 HydrophobicContact CG1-CB 3.8Å; I586-A605 HydrophobicContact CD1-CB 3.61Å; I586-A605 HydrophobicContact CG1-CB 4.1Å
587	F	64.5	Low	59.5	Low	160 Å²	160	85.2 Å²	85.2	70%	0.702	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	3.7	-176.4	-60.2	-72.4	0	0	0	113.6	G585 W608	G585-F587 VanDerWaalsContact C-N 3.25Å; G585-F587 PolarHBondContact O-N 3Å; F587-W608 AromaticContact CZ-NE1 3.55Å
588	C	67.1	Low	61.2	Low	12 Å²	12	83.4 Å²	83.4	8%	0.081	43%	0.431	C	S	.	.	S	Bend	trans	-79.5	142.2	178.7	-59.5	0	0	0	0	111.4	C583 E584 G585 I586 Q590	C583-C588 VanDerWaalsContact CA-SG 3.53Å; C583-C588 HydrophobicContact CB-CB 3.81Å; C583-C588 WeakPolarHBondContact CB-SG 3.46Å; C583-C588 PolarHBondContact O-SG 3.29Å; C583-C588 WeakPolarHBondContact SG-CA 3.07Å; C583-C588 WeakPolarHBondContact SG-CB 3.33Å; C583-C588 CovalentContact SG-SG 2.03Å; C583-C588 PolarHBondContact SG-SG 3Å; E584-C588 PolarHBondContact N-SG 3.5Å; E584-C588 VanDerWaalsContact N-SG 3.42Å; G585-C588 WeakPolarHBondContact O-CB 3.36Å; G585-C588 PolarHBondContact O-N 2.85Å; G585-C588 PolarHBondContact O-SG 3.02Å; I586-C588 VanDerWaalsContact C-N 3.32Å; C588-Q590 PolarHBondContact O-N 3.33Å
589	Q	63.3	Low	63.3	Low	211 Å²	211	80.3 Å²	80.3	99%	0.986	41%	0.411	S	S	*	.	S	Bend	trans	-61	-30.9	179.7	-171.5	172.8	-5.3	0	0	112.2
590	Q	58.6	Low	65.1	Low	173 Å²	173	77.6 Å²	77.6	81%	0.808	40%	0.399	S	S	*	.	S	Bend	trans	-107.9	101.7	169.7	-168	168.2	-5.1	0	0	108.4	C588 S592	C588-Q590 PolarHBondContact O-N 3.33Å; Q590-S592 PolarHBondContact O-N 3.08Å
591	Q	57.5	Low	66.7	Low	58 Å²	58	72.7 Å²	72.7	27%	0.271	37%	0.372	S	S	.	.			trans	-82.9	99.2	-175.3	-162.7	167	1.8	0	0	109.7
592	S	55.2	Low	68.1	Low	39 Å²	39	68.1 Å²	68.1	27%	0.273	35%	0.352	S	S	.	.			trans	-81.2	167.4	172.9	57.7	0	0	0	0	111.5	Q590 D594	Q590-S592 PolarHBondContact O-N 3.08Å; S592-D594 WeakPolarHBondContact CB-OD2 3.49Å; S592-D594 PolarHBondContact O-N 3.34Å; S592-D594 PolarHBondContact OG-OD2 3.41Å
593	N	56.3	Low	69.6	Low	35 Å²	35	62.1 Å²	62.1	19%	0.187	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-64.1	-2.8	177.3	-75.7	11.5	0	0	0	114.2	A595 F596 H597 V620 I623	N593-A595 PolarHBondContact O-N 3Å; N593-F596 PolarHBondContact O-N 3.05Å; N593-H597 PolarHBondContact O-CD2 3.49Å; N593-H597 PolarHBondContact O-NE2 3.33Å; N593-V620 PolarHBondContact ND2-O 3.06Å; N593-V620 WeakPolarHBondContact OD1-CA 3.47Å; N593-V620 WeakPolarHBondContact OD1-CG1 3.3Å; N593-V620 PolarHBondContact OD1-O 3.12Å; N593-I623 HydrophobicContact CB-CD1 4.36Å; N593-I623 WeakPolarHBondContact ND2-CD1 3.28Å; N593-I623 WeakPolarHBondContact ND2-CG1 3.14Å
594	D	61	Low	70.5	Confident	19 Å²	19	64.7 Å²	64.7	10%	0.102	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-62.2	-13.9	-177.1	-62.2	-37.7	0	0	0	113.8	K581 S592 F596 H597	K581-D594 IonicContact NZ-OD2 3.49Å; K581-D594 PolarHBondContact NZ-OD2 3.03Å; S592-D594 WeakPolarHBondContact CB-OD2 3.49Å; S592-D594 PolarHBondContact O-N 3.34Å; S592-D594 PolarHBondContact OG-OD2 3.41Å; D594-F596 VanDerWaalsContact C-N 3.29Å; D594-F596 PolarHBondContact O-N 3.16Å; D594-H597 WeakPolarHBondContact CA-CD2 3.24Å; D594-H597 IonicContact OD1-NE2 3.8Å
595	A	67.9	Low	71.3	Confident	5 Å²	5	59.4 Å²	59.4	4%	0.041	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-63.1	-27.2	-179.8	0	0	0	0	0	114.7	I586 N593 G601 T602	I586-A595 HydrophobicContact CG1-CB 3.8Å; N593-A595 PolarHBondContact O-N 3Å; A595-G601 CarbonylContact O-C 3.18Å; A595-T602 PolarHBondContact O-N 3.05Å
596	F	75.5	Confident	72.4	Confident	14 Å²	14	58.3 Å²	58.3	6%	0.061	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-103.2	5	-174	-62.4	-54.9	0	0	0	115.1	L561 Y565 N593 D594 T602 A605 V620 I638	L561-F596 HydrophobicContact CD1-CD1 4.4Å; L561-F596 HydrophobicContact CD1-CE1 4.15Å; Y565-F596 HydrophobicContact CD2-CB 3.79Å; Y565-F596 HydrophobicContact CD2-CD2 4.21Å; Y565-F596 HydrophobicContact CD2-CG 4.2Å; Y565-F596 HydrophobicContact CE2-CD2 4.27Å; Y565-F596 HydrophobicContact CG-CB 4.04Å; N593-F596 PolarHBondContact O-N 3.05Å; D594-F596 VanDerWaalsContact C-N 3.29Å; D594-F596 PolarHBondContact O-N 3.16Å; F596-T602 WeakPolarHBondContact CA-OG1 3.5Å; F596-T602 HydrophobicContact CD1-CG2 3.98Å; F596-T602 PolarHBondContact O-OG1 3.13Å; F596-A605 HydrophobicContact CD1-CB 4.32Å; F596-A605 HydrophobicContact CE1-CB 3.71Å; F596-A605 HydrophobicContact CZ-CB 4.43Å; F596-V620 HydrophobicContact CD2-CG1 3.78Å; F596-V620 HydrophobicContact CE2-CB 4.29Å; F596-V620 HydrophobicContact CE2-CG1 3.49Å; F596-V620 VanDerWaalsContact CE2-CG1 3.49Å; F596-I638 HydrophobicContact CE2-CD1 4.1Å; F596-I638 HydrophobicContact CZ-CD1 3.87Å
597	H	74.5	Confident	73.4	Confident	24 Å²	24	60.6 Å²	60.6	11%	0.111	30%	0.297	C	S	.	.	S	Bend	trans	-82.2	-32.4	-175	-69.5	-105.4	0	0	0	113	Y565 Y569 N593 D594	Y565-H597 PolarHBondContact O-ND1 2.95Å; Y569-H597 HydrophobicContact CD2-CB 3.48Å; Y569-H597 VanDerWaalsContact CD2-CB 3.48Å; Y569-H597 AromaticContact CD2-CG 3.65Å; Y569-H597 AromaticContact CD2-ND1 3.66Å; Y569-H597 HydrophobicContact CE2-CB 4.18Å; Y569-H597 HydrophobicContact CG-CB 4.16Å; Y569-H597 PolarHBondContact N-ND1 3.3Å; N593-H597 PolarHBondContact O-CD2 3.49Å; N593-H597 PolarHBondContact O-NE2 3.33Å; D594-H597 WeakPolarHBondContact CA-CD2 3.24Å; D594-H597 IonicContact OD1-NE2 3.8Å
598	T	81.3	Confident	74.1	Confident	69 Å²	69	57.2 Å²	57.2	42%	0.423	28%	0.279	S	S	.	.	S	Bend	trans	-104.8	149.4	177.4	65.1	0	0	0	0	111.3	G601 T602	T598-G601 PolarHBondContact O-N 3.31Å; T598-G601 WeakPolarHBondContact OG1-CA 3.44Å; T598-G601 PolarHBondContact OG1-N 3.26Å; T598-G601 VanDerWaalsContact OG1-N 3.07Å; T598-T602 WeakPolarHBondContact O-CB 3.34Å; T598-T602 PolarHBondContact O-N 3.13Å; T598-T602 PolarHBondContact O-OG1 3.48Å
599	F	86.4	Confident	74.7	Confident	89 Å²	89	58.8 Å²	58.8	39%	0.39	28%	0.284	S	S	.	.	H	α-helix	trans	-59.1	-47.2	175.4	178.9	-93.9	0	0	0	112.3	F555 T558 I559 T562 T602 C603	F555-F599 AromaticContact CD1-CZ 3.86Å; F555-F599 HydrophobicContact CD1-CZ 3.86Å; F555-F599 HydrophobicContact CE1-CZ 4.22Å; T558-F599 HydrophobicContact CG2-CD2 3.56Å; T558-F599 HydrophobicContact CG2-CE2 3.52Å; T558-F599 HydrophobicContact CG2-CG 4.21Å; T558-F599 HydrophobicContact CG2-CZ 4.15Å; T558-F599 WeakPolarHBondContact CG2-O 3.35Å; I559-F599 HydrophobicContact CG1-CE2 4.04Å; T562-F599 HydrophobicContact CG2-CB 4.28Å; F599-T602 PolarHBondContact O-N 2.63Å; F599-C603 WeakPolarHBondContact O-CB 3.43Å; F599-C603 PolarHBondContact O-N 3.07Å
600	M	84.9	Confident	75.6	Confident	107 Å²	107	50.6 Å²	50.6	53%	0.527	25%	0.246	S	C	.	.	H	α-helix	trans	-66	-43	178.5	-68.1	-60	-69.5	0	0	111.6	T602 C603 Y604	M600-T602 PolarHBondContact O-N 3.49Å; M600-C603 PolarHBondContact O-N 2.82Å; M600-Y604 HydrophobicContact CB-CE2 4.39Å; M600-Y604 HydrophobicContact CE-CE2 4.16Å; M600-Y604 WeakPolarHBondContact O-CD2 3.45Å; M600-Y604 PolarHBondContact O-N 3.2Å
601	G	80.4	Confident	76.6	Confident	15 Å²	15	48.3 Å²	48.3	16%	0.155	23%	0.234	C	C	.	.	H	α-helix	trans	-59.4	-45.1	175.5	0	0	0	0	0	112.6	A595 T598 C603 Y604 A605	A595-G601 CarbonylContact O-C 3.18Å; T598-G601 PolarHBondContact O-N 3.31Å; T598-G601 WeakPolarHBondContact OG1-CA 3.44Å; T598-G601 PolarHBondContact OG1-N 3.26Å; T598-G601 VanDerWaalsContact OG1-N 3.07Å; G601-C603 PolarHBondContact O-N 3.45Å; G601-Y604 PolarHBondContact O-N 3.29Å; G601-A605 PolarHBondContact O-N 2.52Å
602	T	84.1	Confident	77.2	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64.2	-41.4	177.5	-57.2	0	0	0	0	111.8	T558 L561 T562 A595 F596 T598 F599 M600 Y604 A605 L606	T558-T602 HydrophobicContact CG2-CG2 3.77Å; L561-T602 HydrophobicContact CB-CG2 3.84Å; L561-T602 HydrophobicContact CD1-CG2 4.38Å; T562-T602 HydrophobicContact CG2-CG2 4.21Å; T562-T602 WeakPolarHBondContact CG2-OG1 3.47Å; A595-T602 PolarHBondContact O-N 3.05Å; F596-T602 WeakPolarHBondContact CA-OG1 3.5Å; F596-T602 HydrophobicContact CD1-CG2 3.98Å; F596-T602 PolarHBondContact O-OG1 3.13Å; T598-T602 WeakPolarHBondContact O-CB 3.34Å; T598-T602 PolarHBondContact O-N 3.13Å; T598-T602 PolarHBondContact O-OG1 3.48Å; F599-T602 PolarHBondContact O-N 2.63Å; M600-T602 PolarHBondContact O-N 3.49Å; T602-Y604 VanDerWaalsContact C-N 3.35Å; T602-Y604 PolarHBondContact O-N 3.29Å; T602-A605 WeakPolarHBondContact O-CB 3.32Å; T602-A605 PolarHBondContact O-N 3.17Å; T602-L606 HydrophobicContact CG2-CD1 4.18Å; T602-L606 HydrophobicContact CG2-CG 4.47Å; T602-L606 WeakPolarHBondContact O-CG 3.47Å; T602-L606 PolarHBondContact O-N 3.35Å
603	C	87.9	Confident	77.4	Confident	24 Å²	24	54.1 Å²	54.1	16%	0.162	27%	0.271	C	S	.	.	H	α-helix	trans	-62.1	-43	176.1	-172.2	0	0	0	0	111.2	T558 F599 M600 G601 F607	T558-C603 HydrophobicContact CG2-CB 4.09Å; F599-C603 WeakPolarHBondContact O-CB 3.43Å; F599-C603 PolarHBondContact O-N 3.07Å; M600-C603 PolarHBondContact O-N 2.82Å; G601-C603 PolarHBondContact O-N 3.45Å; C603-F607 WeakPolarHBondContact O-CB 3.25Å; C603-F607 PolarHBondContact O-N 3.33Å
604	Y	83.3	Confident	77.3	Confident	125 Å²	125	53.6 Å²	53.6	49%	0.49	27%	0.271	S	S	.	.	H	α-helix	trans	-63.2	-42.2	173.8	-74	-59.3	0	0	0	111.8	M600 G601 T602 F607 W608	M600-Y604 HydrophobicContact CB-CE2 4.39Å; M600-Y604 HydrophobicContact CE-CE2 4.16Å; M600-Y604 WeakPolarHBondContact O-CD2 3.45Å; M600-Y604 PolarHBondContact O-N 3.2Å; G601-Y604 PolarHBondContact O-N 3.29Å; T602-Y604 VanDerWaalsContact C-N 3.35Å; T602-Y604 PolarHBondContact O-N 3.29Å; Y604-F607 PolarHBondContact O-N 3.04Å; Y604-W608 PolarHBondContact O-N 3.02Å; Y604-W608 VanDerWaalsContact O-N 3.11Å
605	A	80.1	Confident	76.8	Confident	11 Å²	11	61 Å²	61	9%	0.091	31%	0.305	C	S	.	.	H	α-helix	trans	-59.7	-51.8	178.6	0	0	0	0	0	111.2	I586 F596 G601 T602 F607 W608 Y609	I586-A605 HydrophobicContact CD1-CB 3.61Å; I586-A605 HydrophobicContact CG1-CB 4.1Å; F596-A605 HydrophobicContact CD1-CB 4.32Å; F596-A605 HydrophobicContact CE1-CB 3.71Å; F596-A605 HydrophobicContact CZ-CB 4.43Å; G601-A605 PolarHBondContact O-N 2.52Å; T602-A605 WeakPolarHBondContact O-CB 3.32Å; T602-A605 PolarHBondContact O-N 3.17Å; A605-F607 VanDerWaalsContact C-N 3.34Å; A605-F607 PolarHBondContact O-N 3.3Å; A605-W608 PolarHBondContact O-N 3.24Å; A605-Y609 WeakPolarHBondContact O-CB 3.45Å; A605-Y609 PolarHBondContact O-N 3.43Å
606	L	85.3	Confident	76.1	Confident	2 Å²	2	61.9 Å²	61.9	1%	0.01	31%	0.309	C	S	.	.	H	α-helix	trans	-65.5	-35.4	-178.7	-72.4	177.7	0	0	0	112.8	L554 F557 T558 L561 T602 Y609 Y641	L554-L606 HydrophobicContact CD1-CB 3.53Å; L554-L606 HydrophobicContact CD1-CD1 4.31Å; F557-L606 HydrophobicContact CB-CD1 4.07Å; T558-L606 WeakPolarHBondContact OG1-CD1 3.48Å; L561-L606 HydrophobicContact CD1-CD1 4.13Å; L561-L606 HydrophobicContact CD1-CD2 3.76Å; L561-L606 HydrophobicContact CD1-CG 4.19Å; T602-L606 HydrophobicContact CG2-CD1 4.18Å; T602-L606 HydrophobicContact CG2-CG 4.47Å; T602-L606 WeakPolarHBondContact O-CG 3.47Å; T602-L606 PolarHBondContact O-N 3.35Å; L606-Y609 WeakPolarHBondContact O-CB 3.19Å; L606-Y609 PolarHBondContact O-N 2.95Å; L606-Y641 HydrophobicContact CB-CE1 4.37Å; L606-Y641 HydrophobicContact CB-CE2 4.48Å; L606-Y641 HydrophobicContact CD2-CD1 3.87Å; L606-Y641 HydrophobicContact CD2-CD2 4.37Å; L606-Y641 HydrophobicContact CD2-CE1 3.84Å; L606-Y641 HydrophobicContact CD2-CE2 4.33Å; L606-Y641 HydrophobicContact CD2-CG 4.15Å; L606-Y641 PolarHBondContact O-OH 3.49Å
607	F	85.6	Confident	74.7	Confident	81 Å²	81	64.1 Å²	64.1	36%	0.355	33%	0.331	S	S	.	.	H	α-helix	trans	-63.1	-51	175.3	175.2	-97.4	0	0	0	111.7	C603 Y604 A605 Y609 I610 F611	C603-F607 WeakPolarHBondContact O-CB 3.25Å; C603-F607 PolarHBondContact O-N 3.33Å; Y604-F607 PolarHBondContact O-N 3.04Å; A605-F607 VanDerWaalsContact C-N 3.34Å; A605-F607 PolarHBondContact O-N 3.3Å; F607-Y609 PolarHBondContact O-N 3.45Å; F607-I610 WeakPolarHBondContact O-CB 3.41Å; F607-I610 PolarHBondContact O-N 2.96Å; F607-F611 HydrophobicContact CE1-CE2 4.12Å; F607-F611 HydrophobicContact CE2-CE2 4.32Å; F607-F611 AromaticContact CZ-CE2 3.86Å; F607-F611 HydrophobicContact CZ-CE2 3.86Å
608	W	80.6	Confident	73.6	Confident	89 Å²	89	69.5 Å²	69.5	34%	0.337	36%	0.36	S	S	.	.	H	α-helix	trans	-68.7	-22.3	179.4	-75	111.5	0	0	0	113.3	F587 Y604 A605 I610 F611 L613	F587-W608 AromaticContact CZ-NE1 3.55Å; Y604-W608 PolarHBondContact O-N 3.02Å; Y604-W608 VanDerWaalsContact O-N 3.11Å; A605-W608 PolarHBondContact O-N 3.24Å; W608-I610 VanDerWaalsContact C-N 3.25Å; W608-I610 PolarHBondContact O-N 3.37Å; W608-F611 HydrophobicContact CE3-CD2 4.44Å; W608-F611 PolarHBondContact O-N 3.18Å; W608-L613 HydrophobicContact CE3-CD1 3.84Å; W608-L613 HydrophobicContact CZ3-CD1 3.79Å
609	Y	79.1	Confident	72.1	Confident	45 Å²	45	72.8 Å²	72.8	18%	0.176	37%	0.368	C	S	.	.	H	α-helix	trans	-60.3	-33.5	174.8	-155.4	-74.7	0	0	0	112.7	A605 L606 F607 F611 S612 A614 I638 N642	A605-Y609 WeakPolarHBondContact O-CB 3.45Å; A605-Y609 PolarHBondContact O-N 3.43Å; L606-Y609 WeakPolarHBondContact O-CB 3.19Å; L606-Y609 PolarHBondContact O-N 2.95Å; F607-Y609 PolarHBondContact O-N 3.45Å; Y609-F611 VanDerWaalsContact C-N 3.29Å; Y609-F611 PolarHBondContact O-N 3.15Å; Y609-S612 PolarHBondContact O-N 3.04Å; Y609-S612 VanDerWaalsContact O-N 3.11Å; Y609-A614 HydrophobicContact CD2-CB 3.91Å; Y609-A614 HydrophobicContact CE2-CB 4.39Å; Y609-A614 HydrophobicContact CG-CB 4.48Å; Y609-I638 HydrophobicContact CE2-CG2 3.82Å; Y609-N642 WeakPolarHBondContact CD1-OD1 3.44Å; Y609-N642 WeakPolarHBondContact CE1-ND2 3.5Å; Y609-N642 WeakPolarHBondContact CE1-OD1 3.44Å; Y609-N642 VanDerWaalsContact CZ-ND2 3.26Å; Y609-N642 PolarHBondContact OH-ND2 2.95Å
610	I	83.1	Confident	70.4	Confident	38 Å²	38	69.1 Å²	69.1	20%	0.195	35%	0.353	C	S	.	.	H	α-helix	trans	-61.2	-38.6	-179.1	-62.9	170.1	0	0	0	112.1	F550 F607 W608 S612 V645	F550-I610 HydrophobicContact CD2-CD1 4.47Å; F550-I610 HydrophobicContact CE1-CD1 4.31Å; F550-I610 HydrophobicContact CE2-CD1 3.26Å; F550-I610 HydrophobicContact CE2-CG1 4.49Å; F550-I610 HydrophobicContact CZ-CD1 3.16Å; F607-I610 WeakPolarHBondContact O-CB 3.41Å; F607-I610 PolarHBondContact O-N 2.96Å; W608-I610 VanDerWaalsContact C-N 3.25Å; W608-I610 PolarHBondContact O-N 3.37Å; I610-S612 PolarHBondContact O-N 3.43Å; I610-V645 HydrophobicContact CD1-CG1 3.82Å; I610-V645 HydrophobicContact CG1-CG1 3.77Å
611	F	78.6	Confident	68.7	Low	125 Å²	125	66.2 Å²	66.2	55%	0.548	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	7.1	-178.2	-64.4	-73.2	0	0	0	113	F607 W608 Y609 L613	F607-F611 HydrophobicContact CE1-CE2 4.12Å; F607-F611 HydrophobicContact CE2-CE2 4.32Å; F607-F611 AromaticContact CZ-CE2 3.86Å; F607-F611 HydrophobicContact CZ-CE2 3.86Å; W608-F611 HydrophobicContact CE3-CD2 4.44Å; W608-F611 PolarHBondContact O-N 3.18Å; Y609-F611 VanDerWaalsContact C-N 3.29Å; Y609-F611 PolarHBondContact O-N 3.15Å; F611-L613 HydrophobicContact CB-CD1 4.18Å; F611-L613 HydrophobicContact CB-CG 4.48Å; F611-L613 PolarHBondContact O-N 3.38Å
612	S	69.3	Low	67.3	Low	94 Å²	94	74.8 Å²	74.8	66%	0.657	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	15.1	-179.1	-166.4	0	0	0	0	114.3	Y609 I610 A614	Y609-S612 PolarHBondContact O-N 3.04Å; Y609-S612 VanDerWaalsContact O-N 3.11Å; I610-S612 PolarHBondContact O-N 3.43Å; S612-A614 PolarHBondContact O-N 3.44Å
613	L	60.2	Low	65.7	Low	126 Å²	126	79.9 Å²	79.9	66%	0.66	40%	0.395	S	S	*	.			trans	-72.5	-13.2	172.7	-77.9	162.4	0	0	0	111.7	W608 F611 H615	W608-L613 HydrophobicContact CE3-CD1 3.84Å; W608-L613 HydrophobicContact CZ3-CD1 3.79Å; F611-L613 HydrophobicContact CB-CD1 4.18Å; F611-L613 HydrophobicContact CB-CG 4.48Å; F611-L613 PolarHBondContact O-N 3.38Å; L613-H615 PolarHBondContact O-N 3.26Å
614	A	54.5	Low	64	Low	24 Å²	24	83 Å²	83	20%	0.198	42%	0.417	C	S	.	.			trans	-88.1	84.6	169.2	0	0	0	0	0	110.3	Y609 S612 V616	Y609-A614 HydrophobicContact CD2-CB 3.91Å; Y609-A614 HydrophobicContact CE2-CB 4.39Å; Y609-A614 HydrophobicContact CG-CB 4.48Å; S612-A614 PolarHBondContact O-N 3.44Å; A614-V616 HydrophobicContact CB-CG2 4.31Å; A614-V616 PolarHBondContact O-N 2.86Å
615	H	51.2	Low	62.5	Low	175 Å²	175	87.1 Å²	87.1	81%	0.81	43%	0.433	S	S	*	.			trans	-58.4	18.1	164.3	-105.1	-85.5	0	0	0	114.4	L613	L613-H615 PolarHBondContact O-N 3.26Å
616	V	51.7	Low	61.2	Low	22 Å²	22	92.6 Å²	92.6	13%	0.133	47%	0.466	C	S	.	.			trans	-123.9	25.5	-152.1	-150.8	0	0	0	0	112	A614 L618 F619 V620	A614-V616 HydrophobicContact CB-CG2 4.31Å; A614-V616 PolarHBondContact O-N 2.86Å; V616-L618 PolarHBondContact O-N 3.32Å; V616-F619 HydrophobicContact CG1-CB 3.65Å; V616-V620 HydrophobicContact CB-CG2 4.36Å; V616-V620 HydrophobicContact CG1-CG2 3.53Å
617	A	47.4	Very low	60.2	Low	62 Å²	62	96.8 Å²	96.8	51%	0.512	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-18.9	154.9	0	0	0	0	0	111.2
618	L	50.7	Low	59.4	Low	137 Å²	137	99.2 Å²	99.2	72%	0.717	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-15.7	-173.1	-75.8	168	0	0	0	115.7	V616	V616-L618 PolarHBondContact O-N 3.32Å
619	F	50.1	Low	59.2	Low	137 Å²	137	101.9 Å²	101.9	60%	0.601	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.5	-28	-175.3	-93.3	-83.7	0	0	0	115.1	V616 T621 R622	V616-F619 HydrophobicContact CG1-CB 3.65Å; F619-T621 VanDerWaalsContact C-N 3.34Å; F619-T621 PolarHBondContact O-N 2.9Å; F619-R622 PolarHBondContact O-N 3.15Å
620	V	50.8	Low	58.9	Low	13 Å²	13	102.5 Å²	102.5	8%	0.079	52%	0.52	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-13.8	-177.6	-168.1	0	0	0	0	113.6	N593 F596 V616	N593-V620 PolarHBondContact ND2-O 3.06Å; N593-V620 WeakPolarHBondContact OD1-CA 3.47Å; N593-V620 WeakPolarHBondContact OD1-CG1 3.3Å; N593-V620 PolarHBondContact OD1-O 3.12Å; F596-V620 HydrophobicContact CD2-CG1 3.78Å; F596-V620 HydrophobicContact CE2-CB 4.29Å; F596-V620 HydrophobicContact CE2-CG1 3.49Å; F596-V620 VanDerWaalsContact CE2-CG1 3.49Å; V616-V620 HydrophobicContact CB-CG2 4.36Å; V616-V620 HydrophobicContact CG1-CG2 3.53Å
621	T	48.8	Very low	58.4	Low	45 Å²	45	102.2 Å²	102.2	28%	0.276	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	2.1	175.8	51	0	0	0	0	113.7	F619 I623 S631 A635	F619-T621 VanDerWaalsContact C-N 3.34Å; F619-T621 PolarHBondContact O-N 2.9Å; T621-I623 PolarHBondContact O-N 2.77Å; T621-S631 WeakPolarHBondContact CB-OG 3.33Å; T621-S631 PolarHBondContact O-OG 2.91Å; T621-A635 HydrophobicContact CG2-CB 4.27Å
622	R	50.2	Low	58.5	Low	196 Å²	196	102.7 Å²	102.7	74%	0.74	52%	0.524	S	S	*	.			trans	-84.9	88.3	171.9	-91.7	-166.5	-179.6	-173.5	2	110.2	F619	F619-R622 PolarHBondContact O-N 3.15Å
623	I	50.8	Low	59.1	Low	107 Å²	107	101.2 Å²	101.2	55%	0.549	51%	0.51	S	S	.	.			trans	-138.5	132.3	150.4	-60	-174.9	0	0	0	110.1	N593 T621	N593-I623 HydrophobicContact CB-CD1 4.36Å; N593-I623 WeakPolarHBondContact ND2-CD1 3.28Å; N593-I623 WeakPolarHBondContact ND2-CG1 3.14Å; T621-I623 PolarHBondContact O-N 2.77Å
624	S	52.5	Low	60	Low	90 Å²	90	95.2 Å²	95.2	63%	0.629	48%	0.479	S	S	*	.			trans	18.7	132.3	155.2	-50.8	0	0	0	0	119.3	T626	S624-T626 PolarHBondContact O-N 2.93Å
625	Y	50.8	Low	61.2	Low	211 Å²	211	96.3 Å²	96.3	83%	0.827	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-39.4	-3.3	-179.2	-92.5	-89.1	0	0	0	119.8
626	T	53.2	Low	62.8	Low	126 Å²	126	92.3 Å²	92.3	77%	0.773	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-12.4	-173	52.4	0	0	0	0	115.2	S624	S624-T626 PolarHBondContact O-N 2.93Å
627	E	64.3	Low	64.5	Low	90 Å²	90	93 Å²	93	42%	0.421	48%	0.475	S	S	.	.			trans	-132.4	43.7	-177.9	-62	-164.5	-178.3	0	0	114.7	L629 R630 S631	E627-L629 VanDerWaalsContact C-N 3.33Å; E627-L629 PolarHBondContact O-N 3.42Å; E627-R630 PolarHBondContact O-N 3.43Å; E627-R630 IonicContact OE1-NH1 2.69Å; E627-R630 WeakPolarHBondContact OE2-CD 3.43Å; E627-R630 IonicContact OE2-CZ 3.69Å; E627-R630 IonicContact OE2-NE 3.35Å; E627-R630 IonicContact OE2-NH1 3.71Å; E627-R630 PolarHBondContact OE2-NH1 2.86Å; E627-S631 PolarHBondContact O-N 3.42Å
628	E	70.3	Confident	66.2	Low	132 Å²	132	91 Å²	91	62%	0.617	46%	0.455	S	S	*	.	H	α-helix	trans	-55.4	-41	-177.7	-66.7	-175.1	167.3	0	0	113.9	R630 F632	E628-R630 PolarHBondContact O-N 3.28Å; E628-F632 VanDerWaalsContact O-CB 3.3Å; E628-F632 WeakPolarHBondContact O-CB 3.06Å; E628-F632 PolarHBondContact O-N 3.42Å
629	L	74.5	Confident	67.8	Low	144 Å²	144	85.9 Å²	85.9	75%	0.754	44%	0.435	S	S	*	.	H	α-helix	trans	-64.4	-40.1	-178.6	-77	171.9	0	0	0	112.9	E627 V633	E627-L629 VanDerWaalsContact C-N 3.33Å; E627-L629 PolarHBondContact O-N 3.42Å; L629-V633 WeakPolarHBondContact O-CB 3.26Å; L629-V633 VanDerWaalsContact O-CG2 3.24Å; L629-V633 WeakPolarHBondContact O-CG2 3.32Å; L629-V633 PolarHBondContact O-N 2.91Å
630	R	73.4	Confident	69.6	Low	58 Å²	58	81.9 Å²	81.9	22%	0.219	42%	0.422	C	S	.	.	H	α-helix	trans	-70.6	-43.6	-178.7	179.9	-176.6	-97.9	172.4	-26.7	110.9	L564 Y565 D568 E627 E628 F632 V633 G634	L564-R630 HydrophobicContact CD1-CG 3.93Å; L564-R630 HydrophobicContact CG-CG 4.05Å; L564-R630 PolarHBondContact O-NE 2.89Å; L564-R630 PolarHBondContact O-NH2 3.47Å; Y565-R630 HydrophobicContact CE1-CG 4.46Å; D568-R630 IonicContact OD1-CZ 3.73Å; D568-R630 IonicContact OD1-NH1 3.59Å; D568-R630 PolarHBondContact OD1-NH1 3.41Å; D568-R630 IonicContact OD1-NH2 3.92Å; D568-R630 IonicContact OD2-CZ 3.92Å; D568-R630 IonicContact OD2-NH1 3.99Å; D568-R630 PolarHBondContact OD2-NH1 2.69Å; D568-R630 VanDerWaalsContact OD2-NH1 3.1Å; D568-R630 IonicContact OD2-NH2 2.8Å; E627-R630 PolarHBondContact O-N 3.43Å; E627-R630 IonicContact OE1-NH1 2.69Å; E627-R630 WeakPolarHBondContact OE2-CD 3.43Å; E627-R630 IonicContact OE2-CZ 3.69Å; E627-R630 IonicContact OE2-NE 3.35Å; E627-R630 IonicContact OE2-NH1 3.71Å; E627-R630 PolarHBondContact OE2-NH1 2.86Å; E628-R630 PolarHBondContact O-N 3.28Å; R630-F632 VanDerWaalsContact C-N 3.33Å; R630-V633 PolarHBondContact O-N 3.41Å; R630-G634 PolarHBondContact O-N 3.22Å
631	S	73.7	Confident	71.4	Confident	33 Å²	33	81.3 Å²	81.3	23%	0.231	42%	0.419	C	S	.	.	H	α-helix	trans	-61.6	-42.6	175.3	-175.6	0	0	0	0	111.3	T621 E627 G634 A635	T621-S631 WeakPolarHBondContact CB-OG 3.33Å; T621-S631 PolarHBondContact O-OG 2.91Å; E627-S631 PolarHBondContact O-N 3.42Å; S631-G634 PolarHBondContact O-N 2.95Å; S631-A635 WeakPolarHBondContact O-CB 3.39Å; S631-A635 PolarHBondContact O-N 3.36Å
632	F	79	Confident	73.2	Confident	135 Å²	135	80.6 Å²	80.6	59%	0.592	41%	0.413	S	S	*	.	H	α-helix	trans	-61.6	-48.1	175.2	179.5	-102	0	0	0	112.6	E628 R630 G634 A635 L636	E628-F632 VanDerWaalsContact O-CB 3.3Å; E628-F632 WeakPolarHBondContact O-CB 3.06Å; E628-F632 PolarHBondContact O-N 3.42Å; R630-F632 VanDerWaalsContact C-N 3.33Å; F632-G634 VanDerWaalsContact C-N 3.34Å; F632-G634 PolarHBondContact O-N 2.88Å; F632-A635 PolarHBondContact O-N 2.57Å; F632-L636 HydrophobicContact CE1-CD1 4.25Å; F632-L636 HydrophobicContact CZ-CD1 4.43Å; F632-L636 WeakPolarHBondContact O-CB 3.26Å; F632-L636 PolarHBondContact O-N 2.94Å
633	V	83.1	Confident	75	Confident	63 Å²	63	75.8 Å²	75.8	38%	0.382	40%	0.401	S	S	.	.	H	α-helix	trans	-62.9	-40.7	177.7	170.9	0	0	0	0	111.2	L564 L629 R630 L636 I637	L564-V633 HydrophobicContact CD1-CG1 4.26Å; L564-V633 HydrophobicContact CD2-CG1 4.2Å; L629-V633 WeakPolarHBondContact O-CB 3.26Å; L629-V633 VanDerWaalsContact O-CG2 3.24Å; L629-V633 WeakPolarHBondContact O-CG2 3.32Å; L629-V633 PolarHBondContact O-N 2.91Å; R630-V633 PolarHBondContact O-N 3.41Å; V633-L636 PolarHBondContact O-N 3.19Å; V633-I637 HydrophobicContact CG1-CD1 3.87Å; V633-I637 HydrophobicContact CG1-CG1 4.44Å; V633-I637 VanDerWaalsContact O-CG1 3.31Å; V633-I637 WeakPolarHBondContact O-CG1 3.32Å; V633-I637 PolarHBondContact O-N 3.47Å
634	G	79.9	Confident	76.9	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-64.7	-42.1	176.3	0	0	0	0	0	112.9	L564 R630 S631 F632 L636 I637 I638	L564-G634 VanDerWaalsContact CD2-CA 3.43Å; R630-G634 PolarHBondContact O-N 3.22Å; S631-G634 PolarHBondContact O-N 2.95Å; F632-G634 VanDerWaalsContact C-N 3.34Å; F632-G634 PolarHBondContact O-N 2.88Å; G634-L636 VanDerWaalsContact C-N 3.31Å; G634-L636 PolarHBondContact O-N 3.41Å; G634-I637 PolarHBondContact O-N 2.71Å; G634-I638 WeakPolarHBondContact O-CG1 3.42Å; G634-I638 PolarHBondContact O-N 3.13Å
635	A	78.5	Confident	78.6	Confident	47 Å²	47	69 Å²	69	39%	0.388	36%	0.361	S	S	.	.	H	α-helix	trans	-61.7	-39.1	173.5	0	0	0	0	0	111.8	T621 S631 F632 G639	T621-A635 HydrophobicContact CG2-CB 4.27Å; S631-A635 WeakPolarHBondContact O-CB 3.39Å; S631-A635 PolarHBondContact O-N 3.36Å; F632-A635 PolarHBondContact O-N 2.57Å; A635-G639 PolarHBondContact O-N 3.33Å
636	L	84.4	Confident	80.2	Confident	91 Å²	91	61.9 Å²	61.9	48%	0.476	34%	0.339	S	S	.	.	H	α-helix	trans	-66.8	-43.4	176.6	-167.6	156.8	0	0	0	111.8	F632 V633 G634 G639 T640	F632-L636 HydrophobicContact CE1-CD1 4.25Å; F632-L636 HydrophobicContact CZ-CD1 4.43Å; F632-L636 WeakPolarHBondContact O-CB 3.26Å; F632-L636 PolarHBondContact O-N 2.94Å; V633-L636 PolarHBondContact O-N 3.19Å; G634-L636 VanDerWaalsContact C-N 3.31Å; G634-L636 PolarHBondContact O-N 3.41Å; L636-G639 PolarHBondContact O-N 2.94Å; L636-T640 HydrophobicContact CD2-CG2 3.92Å; L636-T640 WeakPolarHBondContact O-CB 3.4Å; L636-T640 WeakPolarHBondContact O-CG2 3.49Å; L636-T640 PolarHBondContact O-N 2.84Å; L636-T640 PolarHBondContact O-OG1 2.8Å
637	I	87.3	Confident	81.8	Confident	37 Å²	37	60.6 Å²	60.6	19%	0.19	33%	0.326	C	S	.	.	H	α-helix	trans	-63.6	-43.1	177.3	-67.8	168.4	0	0	0	110.9	F557 L561 L564 V633 G634 T640 Y641	F557-I637 HydrophobicContact CD1-CG2 3.82Å; F557-I637 HydrophobicContact CE1-CG2 4.3Å; L561-I637 HydrophobicContact CD2-CB 4.03Å; L561-I637 HydrophobicContact CD2-CG2 3.65Å; L561-I637 HydrophobicContact CG-CG2 3.9Å; L564-I637 HydrophobicContact CD2-CD1 4.24Å; V633-I637 HydrophobicContact CG1-CD1 3.87Å; V633-I637 HydrophobicContact CG1-CG1 4.44Å; V633-I637 VanDerWaalsContact O-CG1 3.31Å; V633-I637 WeakPolarHBondContact O-CG1 3.32Å; V633-I637 PolarHBondContact O-N 3.47Å; G634-I637 PolarHBondContact O-N 2.71Å; I637-T640 WeakPolarHBondContact CA-OG1 3.38Å; I637-T640 PolarHBondContact O-OG1 3.03Å; I637-Y641 WeakPolarHBondContact O-CB 3.33Å; I637-Y641 PolarHBondContact O-N 3.38Å
638	I	83.2	Confident	83	Confident	19 Å²	19	59.7 Å²	59.7	10%	0.097	33%	0.327	C	S	.	.	H	α-helix	trans	-68	-41.3	176.1	-67.3	168.1	0	0	0	110.8	L561 F596 Y609 G634 T640 Y641 N642	L561-I638 HydrophobicContact CD1-CD1 4.48Å; L561-I638 HydrophobicContact CD1-CG1 3.92Å; L561-I638 HydrophobicContact CD2-CD1 4.47Å; L561-I638 HydrophobicContact CD2-CG1 4.08Å; F596-I638 HydrophobicContact CE2-CD1 4.1Å; F596-I638 HydrophobicContact CZ-CD1 3.87Å; Y609-I638 HydrophobicContact CE2-CG2 3.82Å; G634-I638 WeakPolarHBondContact O-CG1 3.42Å; G634-I638 PolarHBondContact O-N 3.13Å; I638-T640 PolarHBondContact O-N 2.84Å; I638-Y641 WeakPolarHBondContact O-CB 3.35Å; I638-Y641 PolarHBondContact O-N 3.22Å; I638-N642 VanDerWaalsContact O-CG 3.23Å; I638-N642 PolarHBondContact O-N 2.87Å; I638-N642 PolarHBondContact O-ND2 2.97Å; I638-N642 VanDerWaalsContact O-ND2 3.16Å
639	G	84	Confident	84	Confident	29 Å²	29	54 Å²	54	30%	0.299	30%	0.301	S	S	.	.	H	α-helix	trans	-60.9	-44.6	176.5	0	0	0	0	0	112.7	A635 L636 N642 I643	A635-G639 PolarHBondContact O-N 3.33Å; L636-G639 PolarHBondContact O-N 2.94Å; G639-N642 PolarHBondContact O-N 3.21Å; G639-I643 WeakPolarHBondContact O-CG1 3.22Å; G639-I643 PolarHBondContact O-N 3.28Å; G639-I643 VanDerWaalsContact O-N 3.13Å
640	T	88.4	Confident	84.6	Confident	54 Å²	54	49.9 Å²	49.9	33%	0.331	28%	0.282	S	S	.	.	H	α-helix	trans	-66.6	-40	175.2	51.1	0	0	0	0	112	L636 I637 I638 N642 I643 V644	L636-T640 HydrophobicContact CD2-CG2 3.92Å; L636-T640 WeakPolarHBondContact O-CB 3.4Å; L636-T640 WeakPolarHBondContact O-CG2 3.49Å; L636-T640 PolarHBondContact O-N 2.84Å; L636-T640 PolarHBondContact O-OG1 2.8Å; I637-T640 WeakPolarHBondContact CA-OG1 3.38Å; I637-T640 PolarHBondContact O-OG1 3.03Å; I638-T640 PolarHBondContact O-N 2.84Å; T640-N642 VanDerWaalsContact C-N 3.28Å; T640-N642 PolarHBondContact O-N 3.3Å; T640-I643 PolarHBondContact O-N 3.04Å; T640-V644 WeakPolarHBondContact O-CG2 3.47Å; T640-V644 PolarHBondContact O-N 3.05Å
641	Y	89.6	Confident	85.3	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-54.7	-44.2	171.9	171.8	-99.7	0	0	0	111.7	L554 F557 L606 I637 I638 V644 V645	L554-Y641 HydrophobicContact CD1-CE2 4.32Å; F557-Y641 HydrophobicContact CB-CD2 3.89Å; F557-Y641 HydrophobicContact CB-CE2 4.5Å; F557-Y641 HydrophobicContact CD1-CD2 4.26Å; F557-Y641 AromaticContact CD2-CD2 3.84Å; F557-Y641 HydrophobicContact CD2-CD2 3.84Å; F557-Y641 HydrophobicContact CE2-CD2 4.46Å; F557-Y641 AromaticContact CG-CD2 3.74Å; F557-Y641 HydrophobicContact CG-CD2 3.74Å; F557-Y641 HydrophobicContact CG-CG 4.42Å; L606-Y641 HydrophobicContact CB-CE1 4.37Å; L606-Y641 HydrophobicContact CB-CE2 4.48Å; L606-Y641 HydrophobicContact CD2-CD1 3.87Å; L606-Y641 HydrophobicContact CD2-CD2 4.37Å; L606-Y641 HydrophobicContact CD2-CE1 3.84Å; L606-Y641 HydrophobicContact CD2-CE2 4.33Å; L606-Y641 HydrophobicContact CD2-CG 4.15Å; L606-Y641 PolarHBondContact O-OH 3.49Å; I637-Y641 WeakPolarHBondContact O-CB 3.33Å; I637-Y641 PolarHBondContact O-N 3.38Å; I638-Y641 WeakPolarHBondContact O-CB 3.35Å; I638-Y641 PolarHBondContact O-N 3.22Å; Y641-V644 PolarHBondContact O-N 2.91Å; Y641-V645 HydrophobicContact CD2-CG2 3.71Å; Y641-V645 HydrophobicContact CE1-CG2 4.49Å; Y641-V645 HydrophobicContact CE2-CB 4.32Å; Y641-V645 HydrophobicContact CE2-CG2 3.44Å; Y641-V645 VanDerWaalsContact CE2-CG2 3.44Å; Y641-V645 HydrophobicContact CG-CG2 4.36Å; Y641-V645 WeakPolarHBondContact O-CB 3.32Å; Y641-V645 WeakPolarHBondContact O-CG2 3.49Å; Y641-V645 PolarHBondContact O-N 3.42Å
642	N	85.4	Confident	86.1	Confident	30 Å²	30	57.2 Å²	57.2	16%	0.16	32%	0.315	C	S	.	.	H	α-helix	trans	-66.2	-42.3	179	-65.6	-28.2	0	0	0	113.3	Y609 I638 G639 T640 V644 V646 I647	Y609-N642 WeakPolarHBondContact CD1-OD1 3.44Å; Y609-N642 WeakPolarHBondContact CE1-ND2 3.5Å; Y609-N642 WeakPolarHBondContact CE1-OD1 3.44Å; Y609-N642 VanDerWaalsContact CZ-ND2 3.26Å; Y609-N642 PolarHBondContact OH-ND2 2.95Å; I638-N642 VanDerWaalsContact O-CG 3.23Å; I638-N642 PolarHBondContact O-N 2.87Å; I638-N642 PolarHBondContact O-ND2 2.97Å; I638-N642 VanDerWaalsContact O-ND2 3.16Å; G639-N642 PolarHBondContact O-N 3.21Å; T640-N642 VanDerWaalsContact C-N 3.28Å; T640-N642 PolarHBondContact O-N 3.3Å; N642-V644 VanDerWaalsContact C-N 3.32Å; N642-V644 PolarHBondContact O-N 3.33Å; N642-V646 WeakPolarHBondContact O-CA 3.34Å; N642-V646 VanDerWaalsContact O-CB 3.22Å; N642-V646 WeakPolarHBondContact O-CB 3.37Å; N642-V646 PolarHBondContact O-N 3.3Å; N642-I647 PolarHBondContact O-N 3.14Å
643	I	88.1	Confident	86.7	Confident	96 Å²	96	52.3 Å²	52.3	49%	0.492	30%	0.295	S	S	.	.	I	π-helix	trans	-61.2	-46.7	176	-66.2	167.5	0	0	0	109.4	G639 T640 I647 V648	G639-I643 WeakPolarHBondContact O-CG1 3.22Å; G639-I643 PolarHBondContact O-N 3.28Å; G639-I643 VanDerWaalsContact O-N 3.13Å; T640-I643 PolarHBondContact O-N 3.04Å; I643-I647 HydrophobicContact CG1-CD1 4.26Å; I643-I647 HydrophobicContact CG2-CD1 4.5Å; I643-I647 VanDerWaalsContact O-CB 3.26Å; I643-I647 WeakPolarHBondContact O-CB 3.44Å; I643-I647 PolarHBondContact O-N 3.2Å; I643-V648 PolarHBondContact O-N 3.3Å
644	V	90.8	Very high	87	Confident	53 Å²	53	53.7 Å²	53.7	32%	0.321	30%	0.303	S	S	.	.	I	π-helix	trans	-67.1	-50.5	-179.2	174.5	0	0	0	0	111.4	V553 T640 Y641 N642 V648 L649	V553-V644 HydrophobicContact CG1-CG1 4.14Å; T640-V644 WeakPolarHBondContact O-CG2 3.47Å; T640-V644 PolarHBondContact O-N 3.05Å; Y641-V644 PolarHBondContact O-N 2.91Å; N642-V644 VanDerWaalsContact C-N 3.32Å; N642-V644 PolarHBondContact O-N 3.33Å; V644-V648 VanDerWaalsContact O-CB 3.32Å; V644-V648 WeakPolarHBondContact O-CB 3.34Å; V644-V648 PolarHBondContact O-N 3.03Å; V644-L649 HydrophobicContact CG1-CG 4.48Å; V644-L649 WeakPolarHBondContact O-CG 3.39Å; V644-L649 PolarHBondContact O-N 3.16Å
645	V	88.3	Confident	87.5	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.012	33%	0.326	C	S	.	.	I	π-helix	trans	-82.1	-52	-172	176.5	0	0	0	0	112.4	F550 V553 I610 Y641 L649 T650	F550-V645 HydrophobicContact CD2-CG1 4.07Å; F550-V645 HydrophobicContact CE2-CG1 3.65Å; F550-V645 HydrophobicContact CE2-CG2 4.41Å; V553-V645 HydrophobicContact CG1-CG2 3.84Å; I610-V645 HydrophobicContact CD1-CG1 3.82Å; I610-V645 HydrophobicContact CG1-CG1 3.77Å; Y641-V645 HydrophobicContact CD2-CG2 3.71Å; Y641-V645 HydrophobicContact CE1-CG2 4.49Å; Y641-V645 HydrophobicContact CE2-CB 4.32Å; Y641-V645 HydrophobicContact CE2-CG2 3.44Å; Y641-V645 VanDerWaalsContact CE2-CG2 3.44Å; Y641-V645 HydrophobicContact CG-CG2 4.36Å; Y641-V645 WeakPolarHBondContact O-CB 3.32Å; Y641-V645 WeakPolarHBondContact O-CG2 3.49Å; Y641-V645 PolarHBondContact O-N 3.42Å; V645-L649 HydrophobicContact CG2-CD1 4.2Å; V645-L649 WeakPolarHBondContact O-CB 3.36Å; V645-T650 PolarHBondContact O-N 3.5Å; V645-T650 PolarHBondContact O-OG1 3.22Å
646	V	84	Confident	88.1	Confident	60 Å²	60	59.2 Å²	59.2	36%	0.364	33%	0.332	S	S	.	.	I	π-helix	trans	-78.5	-39.8	-173.7	-176.4	0	0	0	0	111.3	N642 T650	N642-V646 WeakPolarHBondContact O-CA 3.34Å; N642-V646 VanDerWaalsContact O-CB 3.22Å; N642-V646 WeakPolarHBondContact O-CB 3.37Å; N642-V646 PolarHBondContact O-N 3.3Å; V646-T650 WeakPolarHBondContact O-CB 3.29Å; V646-T650 PolarHBondContact O-OG1 3.05Å
647	I	87.1	Confident	88.3	Confident	99 Å²	99	57.4 Å²	57.4	51%	0.508	32%	0.323	S	S	.	.	I	π-helix	trans	-87.3	-59.6	-179.4	-51.8	178.4	0	0	0	110.4	N642 I643 K651	N642-I647 PolarHBondContact O-N 3.14Å; I643-I647 HydrophobicContact CG1-CD1 4.26Å; I643-I647 HydrophobicContact CG2-CD1 4.5Å; I643-I647 VanDerWaalsContact O-CB 3.26Å; I643-I647 WeakPolarHBondContact O-CB 3.44Å; I643-I647 PolarHBondContact O-N 3.2Å; I647-K651 VanDerWaalsContact O-CB 3.23Å; I647-K651 WeakPolarHBondContact O-CB 3.31Å; I647-K651 WeakPolarHBondContact O-CG 3.48Å; I647-K651 PolarHBondContact O-N 3.36Å
648	V	90.5	Very high	88.5	Confident	71 Å²	71	60.3 Å²	60.3	43%	0.43	34%	0.335	S	S	.	.	I	π-helix	trans	-74.4	-60.5	-171.9	178.3	0	0	0	0	111.5	I643 V644 T650 K651 L652	I643-V648 PolarHBondContact O-N 3.3Å; V644-V648 VanDerWaalsContact O-CB 3.32Å; V644-V648 WeakPolarHBondContact O-CB 3.34Å; V644-V648 PolarHBondContact O-N 3.03Å; V648-T650 PolarHBondContact O-N 2.92Å; V648-K651 PolarHBondContact O-N 3.06Å; V648-L652 HydrophobicContact CG1-CD1 3.8Å; V648-L652 HydrophobicContact CG1-CG 4.42Å; V648-L652 WeakPolarHBondContact O-CB 3.23Å; V648-L652 VanDerWaalsContact O-CG 3.32Å; V648-L652 WeakPolarHBondContact O-CG 3.33Å; V648-L652 PolarHBondContact O-N 3.18Å
649	L	90	Very high	88.8	Confident	13 Å²	13	65.4 Å²	65.4	7%	0.068	36%	0.356	C	S	.	.	I	π-helix	trans	-65	-42.3	-173.8	-67.7	-175.1	0	0	0	112.5	F546 L549 F550 V553 V644 V645 K651 L652 L653	F546-L649 HydrophobicContact CE1-CB 4.48Å; F546-L649 HydrophobicContact CE2-CD2 4.4Å; F546-L649 HydrophobicContact CZ-CB 3.9Å; F546-L649 HydrophobicContact CZ-CD2 4.02Å; F546-L649 HydrophobicContact CZ-CG 4.47Å; F546-L649 VanDerWaalsContact CZ-O 3.24Å; F546-L649 WeakPolarHBondContact CZ-O 3.49Å; L549-L649 HydrophobicContact CD2-CD1 4.22Å; L549-L649 HydrophobicContact CD2-CD2 3.35Å; L549-L649 HydrophobicContact CD2-CG 4.44Å; F550-L649 HydrophobicContact CD2-CD1 4.3Å; V553-L649 HydrophobicContact CB-CD1 4.43Å; V553-L649 HydrophobicContact CG1-CD1 4.48Å; V553-L649 HydrophobicContact CG2-CD1 4.25Å; V644-L649 HydrophobicContact CG1-CG 4.48Å; V644-L649 WeakPolarHBondContact O-CG 3.39Å; V644-L649 PolarHBondContact O-N 3.16Å; V645-L649 HydrophobicContact CG2-CD1 4.2Å; V645-L649 WeakPolarHBondContact O-CB 3.36Å; L649-K651 PolarHBondContact O-N 3.09Å; L649-L652 PolarHBondContact O-N 3.18Å; L649-L653 VanDerWaalsContact O-CB 3.3Å; L649-L653 WeakPolarHBondContact O-CB 3.49Å; L649-L653 PolarHBondContact O-N 3.28Å
650	T	87.9	Confident	89.1	Confident	58 Å²	58	64.7 Å²	64.7	36%	0.356	35%	0.347	S	S	.	.	H	α-helix	trans	-65	-38.5	179	-54.7	0	0	0	0	111.8	V645 V646 V648 L653 V654	V645-T650 PolarHBondContact O-N 3.5Å; V645-T650 PolarHBondContact O-OG1 3.22Å; V646-T650 WeakPolarHBondContact O-CB 3.29Å; V646-T650 PolarHBondContact O-OG1 3.05Å; V648-T650 PolarHBondContact O-N 2.92Å; T650-L653 PolarHBondContact O-N 2.89Å; T650-V654 WeakPolarHBondContact O-CG2 3.26Å; T650-V654 PolarHBondContact O-N 3.36Å
651	K	89.3	Confident	89.1	Confident	155 Å²	155	66 Å²	66	67%	0.674	35%	0.348	S	S	*	.	H	α-helix	trans	-69.8	-40.2	176.1	-68.8	-69.1	-177.7	-175.9	0	112.4	I647 V648 L649 L653 V654 A655	I647-K651 VanDerWaalsContact O-CB 3.23Å; I647-K651 WeakPolarHBondContact O-CB 3.31Å; I647-K651 WeakPolarHBondContact O-CG 3.48Å; I647-K651 PolarHBondContact O-N 3.36Å; V648-K651 PolarHBondContact O-N 3.06Å; L649-K651 PolarHBondContact O-N 3.09Å; K651-L653 VanDerWaalsContact C-N 3.31Å; K651-V654 PolarHBondContact O-N 3.48Å; K651-A655 PolarHBondContact O-N 3.29Å
652	L	90.4	Very high	89.1	Confident	90 Å²	90	73.7 Å²	73.7	47%	0.471	38%	0.377	S	S	.	.	H	α-helix	trans	-62.1	-41.1	172.9	-71.8	175.9	0	0	0	111.3	F546 V648 L649 V654 A655 M656	F546-L652 HydrophobicContact CE2-CB 4.41Å; V648-L652 HydrophobicContact CG1-CD1 3.8Å; V648-L652 HydrophobicContact CG1-CG 4.42Å; V648-L652 WeakPolarHBondContact O-CB 3.23Å; V648-L652 VanDerWaalsContact O-CG 3.32Å; V648-L652 WeakPolarHBondContact O-CG 3.33Å; V648-L652 PolarHBondContact O-N 3.18Å; L649-L652 PolarHBondContact O-N 3.18Å; L652-V654 PolarHBondContact O-N 3.37Å; L652-A655 PolarHBondContact O-N 3.04Å; L652-M656 WeakPolarHBondContact O-CB 3.37Å; L652-M656 VanDerWaalsContact O-CG 3.31Å; L652-M656 WeakPolarHBondContact O-CG 3.23Å; L652-M656 PolarHBondContact O-N 2.83Å
653	L	89.7	Confident	89.1	Confident	32 Å²	32	77.9 Å²	77.9	17%	0.168	40%	0.396	C	S	.	.	H	α-helix	trans	-60.2	-47.7	176.9	177.8	65.6	0	0	0	111.5	F543 F546 L649 T650 K651 A655 M656 L657	F543-L653 HydrophobicContact CD2-CD1 3.56Å; F543-L653 HydrophobicContact CD2-CD2 4.18Å; F543-L653 HydrophobicContact CD2-CG 4.46Å; F543-L653 HydrophobicContact CE2-CD1 3.95Å; F543-L653 HydrophobicContact CE2-CD2 3.77Å; F546-L653 HydrophobicContact CB-CD1 4.3Å; F546-L653 HydrophobicContact CD1-CB 4.18Å; F546-L653 HydrophobicContact CD1-CD1 3.49Å; F546-L653 VanDerWaalsContact CD1-CD1 3.49Å; F546-L653 HydrophobicContact CD1-CG 4.24Å; F546-L653 HydrophobicContact CE1-CB 3.71Å; F546-L653 HydrophobicContact CE1-CD1 3.93Å; F546-L653 HydrophobicContact CE1-CD2 4.37Å; F546-L653 HydrophobicContact CE1-CG 4.19Å; F546-L653 HydrophobicContact CG-CD1 3.88Å; F546-L653 HydrophobicContact CZ-CB 3.9Å; L649-L653 VanDerWaalsContact O-CB 3.3Å; L649-L653 WeakPolarHBondContact O-CB 3.49Å; L649-L653 PolarHBondContact O-N 3.28Å; T650-L653 PolarHBondContact O-N 2.89Å; K651-L653 VanDerWaalsContact C-N 3.31Å; L653-A655 VanDerWaalsContact C-N 3.32Å; L653-A655 PolarHBondContact O-N 3.19Å; L653-M656 PolarHBondContact O-N 2.92Å; L653-L657 HydrophobicContact CD1-CD1 4.04Å; L653-L657 HydrophobicContact CD1-CG 4.08Å; L653-L657 HydrophobicContact CG-CD1 3.93Å; L653-L657 HydrophobicContact CG-CG 4.37Å; L653-L657 WeakPolarHBondContact O-CB 3.29Å; L653-L657 VanDerWaalsContact O-CG 3.31Å; L653-L657 WeakPolarHBondContact O-CG 3.41Å; L653-L657 PolarHBondContact O-N 3.38Å
654	V	90.1	Very high	89	Confident	91 Å²	91	74.3 Å²	74.3	55%	0.552	38%	0.377	S	S	*	.	H	α-helix	trans	-60.2	-43	177	172.2	0	0	0	0	111.1	T650 K651 L652 H658	T650-V654 WeakPolarHBondContact O-CG2 3.26Å; T650-V654 PolarHBondContact O-N 3.36Å; K651-V654 PolarHBondContact O-N 3.48Å; L652-V654 PolarHBondContact O-N 3.37Å; V654-H658 WeakPolarHBondContact O-CB 3.42Å; V654-H658 PolarHBondContact O-N 3.31Å
655	A	91.2	Very high	88.8	Confident	59 Å²	59	73 Å²	73	49%	0.488	37%	0.373	S	S	.	.	H	α-helix	trans	-63.9	-42.8	177.8	0	0	0	0	0	112.4	K651 L652 L653 H658 K659	K651-A655 PolarHBondContact O-N 3.29Å; L652-A655 PolarHBondContact O-N 3.04Å; L653-A655 VanDerWaalsContact C-N 3.32Å; L653-A655 PolarHBondContact O-N 3.19Å; A655-H658 PolarHBondContact O-N 2.93Å; A655-K659 PolarHBondContact O-N 3.46Å
656	M	89.6	Confident	88.8	Confident	104 Å²	104	79.1 Å²	79.1	51%	0.512	41%	0.405	S	S	.	.	H	α-helix	trans	-67.1	-43.1	178.1	-74	-61.5	-63.9	0	0	112.2	L652 L653 H658 K659 S660	L652-M656 WeakPolarHBondContact O-CB 3.37Å; L652-M656 VanDerWaalsContact O-CG 3.31Å; L652-M656 WeakPolarHBondContact O-CG 3.23Å; L652-M656 PolarHBondContact O-N 2.83Å; L653-M656 PolarHBondContact O-N 2.92Å; M656-H658 VanDerWaalsContact C-N 3.33Å; M656-H658 PolarHBondContact O-N 3.39Å; M656-K659 PolarHBondContact O-N 3.47Å; M656-S660 VanDerWaalsContact O-CB 3.32Å; M656-S660 WeakPolarHBondContact O-CB 3.47Å; M656-S660 PolarHBondContact O-N 3.11Å
657	L	89.8	Confident	88.9	Confident	54 Å²	54	80.4 Å²	80.4	28%	0.283	41%	0.407	S	S	.	.	H	α-helix	trans	-61.8	-40.7	175.1	-73.1	173.9	0	0	0	111.4	M539 F543 L653 S660 F661	M539-L657 HydrophobicContact CB-CD2 4.42Å; F543-L657 HydrophobicContact CB-CD2 4.46Å; L653-L657 HydrophobicContact CD1-CD1 4.04Å; L653-L657 HydrophobicContact CD1-CG 4.08Å; L653-L657 HydrophobicContact CG-CD1 3.93Å; L653-L657 HydrophobicContact CG-CG 4.37Å; L653-L657 WeakPolarHBondContact O-CB 3.29Å; L653-L657 VanDerWaalsContact O-CG 3.31Å; L653-L657 WeakPolarHBondContact O-CG 3.41Å; L653-L657 PolarHBondContact O-N 3.38Å; L657-S660 PolarHBondContact O-N 2.87Å; L657-F661 VanDerWaalsContact O-CB 3.29Å; L657-F661 WeakPolarHBondContact O-CB 3.31Å; L657-F661 PolarHBondContact O-N 3.05Å
658	H	90.4	Very high	88.9	Confident	97 Å²	97	78.7 Å²	78.7	45%	0.449	40%	0.397	S	S	.	.	H	α-helix	trans	-65.3	-44.6	176.3	-174.2	25.9	0	0	0	112.7	V654 A655 M656 S660 F661 R662	V654-H658 WeakPolarHBondContact O-CB 3.42Å; V654-H658 PolarHBondContact O-N 3.31Å; A655-H658 PolarHBondContact O-N 2.93Å; M656-H658 VanDerWaalsContact C-N 3.33Å; M656-H658 PolarHBondContact O-N 3.39Å; H658-S660 VanDerWaalsContact C-N 3.35Å; H658-S660 PolarHBondContact O-N 3.22Å; H658-F661 PolarHBondContact O-N 3.43Å; H658-R662 PolarHBondContact CE1-NE 3.41Å; H658-R662 PolarHBondContact NE2-NH2 3.1Å; H658-R662 PolarHBondContact O-N 3.31Å
659	K	90.7	Very high	88.9	Confident	126 Å²	126	79.3 Å²	79.3	55%	0.548	40%	0.398	S	S	.	.	H	α-helix	trans	-59.7	-46.6	175.2	-177.5	-178.6	176.6	-177.2	0	111.2	A655 M656 R662 Q663	A655-K659 PolarHBondContact O-N 3.46Å; M656-K659 PolarHBondContact O-N 3.47Å; K659-R662 PolarHBondContact O-N 3.41Å; K659-Q663 WeakPolarHBondContact O-CG 3Å; K659-Q663 PolarHBondContact O-N 2.99Å
660	S	89.9	Confident	89	Confident	14 Å²	14	82.5 Å²	82.5	10%	0.098	41%	0.411	C	S	.	.	H	α-helix	trans	-62	-47.6	177.8	-176.6	0	0	0	0	111.4	M656 L657 H658 R662 Q663 I664	M656-S660 VanDerWaalsContact O-CB 3.32Å; M656-S660 WeakPolarHBondContact O-CB 3.47Å; M656-S660 PolarHBondContact O-N 3.11Å; L657-S660 PolarHBondContact O-N 2.87Å; H658-S660 VanDerWaalsContact C-N 3.35Å; H658-S660 PolarHBondContact O-N 3.22Å; S660-R662 PolarHBondContact O-N 3.11Å; S660-Q663 PolarHBondContact O-N 3.15Å; S660-Q663 VanDerWaalsContact O-N 3.13Å; S660-I664 VanDerWaalsContact O-CG1 3.31Å; S660-I664 WeakPolarHBondContact O-CG1 3.47Å; S660-I664 PolarHBondContact O-N 3.13Å; S660-I664 WeakPolarHBondContact OG-CD1 3.36Å
661	F	88.8	Confident	89.1	Confident	82 Å²	82	81 Å²	81	36%	0.36	40%	0.4	S	S	.	.	H	α-helix	trans	-55.6	-47.3	177.4	-178.9	-107	0	0	0	112.3	M539 L657 H658 Q663 I664 A665	M539-F661 HydrophobicContact CE-CD2 3.88Å; M539-F661 HydrophobicContact SD-CB 3.62Å; M539-F661 HydrophobicContact SD-CD2 3.66Å; M539-F661 HydrophobicContact SD-CG 4.09Å; L657-F661 VanDerWaalsContact O-CB 3.29Å; L657-F661 WeakPolarHBondContact O-CB 3.31Å; L657-F661 PolarHBondContact O-N 3.05Å; H658-F661 PolarHBondContact O-N 3.43Å; F661-Q663 VanDerWaalsContact C-N 3.34Å; F661-Q663 PolarHBondContact O-N 2.93Å; F661-I664 PolarHBondContact O-N 3.43Å; F661-A665 VanDerWaalsContact O-CB 3.23Å; F661-A665 WeakPolarHBondContact O-CB 3.3Å; F661-A665 PolarHBondContact O-N 3.29Å
662	R	89.1	Confident	89.3	Confident	162 Å²	162	74.3 Å²	74.3	61%	0.611	37%	0.371	S	S	*	.	H	α-helix	trans	-61.1	-40.2	178.1	-77.4	-173.2	175.9	175.7	1.9	112.9	H658 K659 S660	H658-R662 PolarHBondContact CE1-NE 3.41Å; H658-R662 PolarHBondContact NE2-NH2 3.1Å; H658-R662 PolarHBondContact O-N 3.31Å; K659-R662 PolarHBondContact O-N 3.41Å; S660-R662 PolarHBondContact O-N 3.11Å
663	Q	86.4	Confident	89.5	Confident	118 Å²	118	72.9 Å²	72.9	55%	0.551	36%	0.36	S	S	*	.	H	α-helix	trans	-68.6	-40.5	179.3	-71.4	179.7	-25	0	0	112	K659 S660 F661 H667	K659-Q663 WeakPolarHBondContact O-CG 3Å; K659-Q663 PolarHBondContact O-N 2.99Å; S660-Q663 PolarHBondContact O-N 3.15Å; S660-Q663 VanDerWaalsContact O-N 3.13Å; F661-Q663 VanDerWaalsContact C-N 3.34Å; F661-Q663 PolarHBondContact O-N 2.93Å; Q663-H667 PolarHBondContact O-ND1 3.24Å
664	I	86.1	Confident	89.7	Confident	20 Å²	20	72.4 Å²	72.4	10%	0.103	36%	0.357	C	S	.	.	H	α-helix	trans	-71	-41.6	179.1	-65.3	163.4	0	0	0	111	Q538 M539 S660 F661 N666 H667 E668	Q538-I664 HydrophobicContact CB-CD1 3.81Å; M539-I664 HydrophobicContact CG-CD1 3.79Å; S660-I664 VanDerWaalsContact O-CG1 3.31Å; S660-I664 WeakPolarHBondContact O-CG1 3.47Å; S660-I664 PolarHBondContact O-N 3.13Å; S660-I664 WeakPolarHBondContact OG-CD1 3.36Å; F661-I664 PolarHBondContact O-N 3.43Å; I664-N666 PolarHBondContact O-N 3.01Å; I664-H667 CarbonylContact O-C 3.59Å; I664-H667 PolarHBondContact O-N 3.42Å; I664-E668 PolarHBondContact O-N 3.07Å; I664-E668 VanDerWaalsContact O-N 3.12Å
665	A	86.6	Confident	89.7	Confident	27 Å²	27	69.3 Å²	69.3	22%	0.223	34%	0.341	C	S	.	.	H	α-helix	trans	-56.3	-36.4	-179.9	0	0	0	0	0	112.7	F661 H667 E668	F661-A665 VanDerWaalsContact O-CB 3.23Å; F661-A665 WeakPolarHBondContact O-CB 3.3Å; F661-A665 PolarHBondContact O-N 3.29Å; A665-H667 PolarHBondContact O-N 3.42Å; A665-E668 WeakPolarHBondContact O-CG 3.38Å; A665-E668 PolarHBondContact O-N 3.41Å
666	N	86.7	Confident	89.7	Confident	130 Å²	130	67.9 Å²	67.9	70%	0.695	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-18.4	177.2	-70.5	-19.3	0	0	0	114	I664	I664-N666 PolarHBondContact O-N 3.01Å
667	H	87	Confident	89.8	Confident	86 Å²	86	63 Å²	63	40%	0.398	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.9	2.3	-177.3	-60.5	90	0	0	0	113.3	Q663 I664 A665 D669 K670 E671	Q663-H667 PolarHBondContact O-ND1 3.24Å; I664-H667 CarbonylContact O-C 3.59Å; I664-H667 PolarHBondContact O-N 3.42Å; A665-H667 PolarHBondContact O-N 3.42Å; H667-D669 VanDerWaalsContact C-N 3.31Å; H667-D669 PolarHBondContact O-N 3.46Å; H667-K670 WeakPolarHBondContact O-CB 3.2Å; H667-K670 PolarHBondContact O-N 3.3Å; H667-E671 PolarHBondContact O-N 2.87Å
668	E	86.9	Confident	89.7	Confident	64 Å²	64	63.9 Å²	63.9	30%	0.299	30%	0.301	S	S	.	.	H	α-helix	trans	-57.3	-41.5	-167.7	72	-177.3	173.3	0	0	113.1	P531 I664 A665 K670 E671 W672	P531-E668 HydrophobicContact CB-CB 4.32Å; P531-E668 HydrophobicContact CB-CG 4.13Å; I664-E668 PolarHBondContact O-N 3.07Å; I664-E668 VanDerWaalsContact O-N 3.12Å; A665-E668 WeakPolarHBondContact O-CG 3.38Å; A665-E668 PolarHBondContact O-N 3.41Å; E668-K670 VanDerWaalsContact C-N 3.32Å; E668-K670 PolarHBondContact O-N 2.97Å; E668-E671 PolarHBondContact O-N 3.11Å; E668-W672 VanDerWaalsContact O-CB 3.26Å; E668-W672 WeakPolarHBondContact O-CB 3.33Å; E668-W672 PolarHBondContact O-N 3.5Å
669	D	90.3	Very high	89.6	Confident	83 Å²	83	60.1 Å²	60.1	44%	0.444	28%	0.284	S	S	.	.	H	α-helix	trans	-63.7	-38.9	-179.1	-97.4	1.5	0	0	0	112.4	H667 K673	H667-D669 VanDerWaalsContact C-N 3.31Å; H667-D669 PolarHBondContact O-N 3.46Å; D669-K673 WeakPolarHBondContact O-CB 3.21Å; D669-K673 WeakPolarHBondContact O-CD 3.45Å; D669-K673 WeakPolarHBondContact O-CG 3.49Å; D669-K673 PolarHBondContact O-N 3.04Å
670	K	91.3	Very high	89.5	Confident	80 Å²	80	54.5 Å²	54.5	35%	0.348	26%	0.259	S	S	.	.	H	α-helix	trans	-69.4	-44	-179.1	-54.6	-180	-160.2	175.2	0	109.4	A321 H667 E668 K673 F674	A321-K670 HydrophobicContact CB-CB 4.16Å; H667-K670 WeakPolarHBondContact O-CB 3.2Å; H667-K670 PolarHBondContact O-N 3.3Å; E668-K670 VanDerWaalsContact C-N 3.32Å; E668-K670 PolarHBondContact O-N 2.97Å; K670-K673 PolarHBondContact O-N 3.24Å; K670-F674 WeakPolarHBondContact O-CB 3.36Å; K670-F674 PolarHBondContact O-N 3.45Å
671	E	91.3	Very high	89.3	Confident	27 Å²	27	54.6 Å²	54.6	13%	0.126	26%	0.259	C	S	.	.	H	α-helix	trans	-71.2	-39.6	-178.4	-62.2	-163.6	130	0	0	112.5	K317 I534 Q538 H667 E668 F674 A675	K317-E671 HydrophobicContact CD-CG 4.3Å; K317-E671 IonicContact NZ-OE1 3.99Å; K317-E671 PolarHBondContact NZ-OE1 3.42Å; I534-E671 HydrophobicContact CG2-CB 4.14Å; Q538-E671 VanDerWaalsContact CD-OE2 3.22Å; Q538-E671 PolarHBondContact NE2-OE1 3.01Å; Q538-E671 VanDerWaalsContact NE2-OE1 3.15Å; Q538-E671 PolarHBondContact NE2-OE2 3.06Å; Q538-E671 PolarHBondContact OE1-OE2 3.43Å; H667-E671 PolarHBondContact O-N 2.87Å; E668-E671 PolarHBondContact O-N 3.11Å; E671-F674 PolarHBondContact O-N 3.35Å; E671-A675 WeakPolarHBondContact O-CB 3.44Å; E671-A675 PolarHBondContact O-N 3.36Å
672	W	93.1	Very high	89	Confident	15 Å²	15	52.6 Å²	52.6	6%	0.057	26%	0.255	C	S	.	.	H	α-helix	trans	-60.9	-47.3	172	168.5	63.6	0	0	0	111.7	T524 S526 S527 G530 P531 E668 F674 A675 R676	T524-W672 PolarHBondContact O-NE1 3.14Å; S526-W672 PolarHBondContact O-NE1 3.26Å; S527-W672 VanDerWaalsContact CA-CZ2 3.43Å; G530-W672 VanDerWaalsContact C-CD1 3.47Å; P531-W672 HydrophobicContact CB-CB 4.31Å; P531-W672 HydrophobicContact CG-CB 3.98Å; P531-W672 HydrophobicContact CG-CD2 3.88Å; P531-W672 HydrophobicContact CG-CE3 4.13Å; P531-W672 HydrophobicContact CG-CG 3.77Å; E668-W672 VanDerWaalsContact O-CB 3.26Å; E668-W672 WeakPolarHBondContact O-CB 3.33Å; E668-W672 PolarHBondContact O-N 3.5Å; W672-F674 VanDerWaalsContact C-N 3.28Å; W672-F674 PolarHBondContact O-N 2.9Å; W672-A675 PolarHBondContact O-N 3.44Å; W672-R676 VanDerWaalsContact O-CB 3.24Å; W672-R676 WeakPolarHBondContact O-CB 3.34Å; W672-R676 PolarHBondContact O-N 3.05Å
673	K	93.9	Very high	88.7	Confident	59 Å²	59	46 Å²	46	26%	0.257	23%	0.23	S	C	.	.	H	α-helix	trans	-60.8	-37.5	177	-76.1	167.5	-172.5	163	0	112.2	A321 Q326 D669 K670 A677	A321-K673 HydrophobicContact CB-CB 4.14Å; A321-K673 HydrophobicContact CB-CD 4.35Å; Q326-K673 HydrophobicContact CG-CD 4.44Å; Q326-K673 PolarHBondContact NE2-O 2.86Å; D669-K673 WeakPolarHBondContact O-CB 3.21Å; D669-K673 WeakPolarHBondContact O-CD 3.45Å; D669-K673 WeakPolarHBondContact O-CG 3.49Å; D669-K673 PolarHBondContact O-N 3.04Å; K670-K673 PolarHBondContact O-N 3.24Å; K673-A677 WeakPolarHBondContact O-CB 3.32Å; K673-A677 PolarHBondContact O-N 3.49Å
674	F	93.6	Very high	88.5	Confident	22 Å²	22	41.9 Å²	41.9	10%	0.096	21%	0.21	C	C	.	.	H	α-helix	trans	-65.6	-51.2	174.7	-179.6	-97.8	0	0	0	111.8	I312 K317 V320 K670 E671 W672 R676 A677 K678	I312-F674 HydrophobicContact CB-CE2 4.38Å; I312-F674 HydrophobicContact CB-CZ 4.38Å; I312-F674 HydrophobicContact CG1-CE2 3.97Å; I312-F674 HydrophobicContact CG1-CZ 4.34Å; I312-F674 HydrophobicContact CG2-CZ 4.06Å; K317-F674 HydrophobicContact CB-CD2 4.37Å; K317-F674 HydrophobicContact CB-CG 4.45Å; K317-F674 HydrophobicContact CG-CB 4.42Å; K317-F674 HydrophobicContact CG-CD1 4.24Å; K317-F674 HydrophobicContact CG-CD2 4.11Å; K317-F674 HydrophobicContact CG-CE2 4.43Å; K317-F674 HydrophobicContact CG-CG 4Å; V320-F674 HydrophobicContact CB-CD2 3.96Å; V320-F674 HydrophobicContact CG1-CD2 4.23Å; V320-F674 HydrophobicContact CG2-CD2 4.03Å; V320-F674 HydrophobicContact CG2-CE2 4.19Å; K670-F674 WeakPolarHBondContact O-CB 3.36Å; K670-F674 PolarHBondContact O-N 3.45Å; E671-F674 PolarHBondContact O-N 3.35Å; W672-F674 VanDerWaalsContact C-N 3.28Å; W672-F674 PolarHBondContact O-N 2.9Å; F674-R676 VanDerWaalsContact C-N 3.31Å; F674-R676 PolarHBondContact O-N 3.06Å; F674-A677 PolarHBondContact O-N 3.41Å; F674-K678 PolarHBondContact O-N 3.23Å
675	A	90.3	Very high	87.7	Confident	27 Å²	27	43.1 Å²	43.1	22%	0.223	22%	0.217	C	C	.	.	H	α-helix	trans	-60.2	-40.9	177.5	0	0	0	0	0	111.9	I534 E671 W672 K678 L679	I534-A675 HydrophobicContact CD1-CB 3.75Å; I534-A675 HydrophobicContact CG1-CB 4.31Å; E671-A675 WeakPolarHBondContact O-CB 3.44Å; E671-A675 PolarHBondContact O-N 3.36Å; W672-A675 PolarHBondContact O-N 3.44Å; A675-K678 PolarHBondContact O-N 3.48Å; A675-L679 PolarHBondContact O-N 2.79Å
676	R	91.8	Very high	86.6	Confident	29 Å²	29	44.7 Å²	44.7	11%	0.109	22%	0.222	C	C	.	.	H	α-helix	trans	-62.4	-44.3	174.8	-174.4	-179.5	72.6	176.2	0.1	112	W672 F674 L679 W680	W672-R676 VanDerWaalsContact O-CB 3.24Å; W672-R676 WeakPolarHBondContact O-CB 3.34Å; W672-R676 PolarHBondContact O-N 3.05Å; F674-R676 VanDerWaalsContact C-N 3.31Å; F674-R676 PolarHBondContact O-N 3.06Å; R676-L679 WeakPolarHBondContact O-CB 3.23Å; R676-L679 PolarHBondContact O-N 3.3Å; R676-W680 HydrophobicContact CG-CD2 4.26Å; R676-W680 HydrophobicContact CG-CZ2 3.87Å; R676-W680 VanDerWaalsContact O-CG 3.32Å; R676-W680 PolarHBondContact O-N 3.29Å
677	A	91.4	Very high	85.4	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.008	21%	0.212	C	C	.	.	H	α-helix	trans	-63.9	-41	176.8	0	0	0	0	0	111.8	V320 L329 K673 F674 L679 W680 L681	V320-A677 HydrophobicContact CG1-CB 3.45Å; V320-A677 VanDerWaalsContact CG1-CB 3.45Å; L329-A677 HydrophobicContact CD1-CB 3.93Å; K673-A677 WeakPolarHBondContact O-CB 3.32Å; K673-A677 PolarHBondContact O-N 3.49Å; F674-A677 PolarHBondContact O-N 3.41Å; A677-L679 PolarHBondContact O-N 3.28Å; A677-W680 PolarHBondContact O-N 3.26Å; A677-L681 WeakPolarHBondContact O-CB 3.41Å; A677-L681 PolarHBondContact O-N 3.01Å
678	K	88.7	Confident	84.1	Confident	72 Å²	72	41.6 Å²	41.6	31%	0.313	21%	0.205	S	C	.	.	H	α-helix	trans	-59.8	-44.4	173.7	-169.3	176.1	-173	-179.2	0	111.4	I312 E451 F674 A675 L681 S682	I312-K678 HydrophobicContact CG2-CD 4.16Å; I312-K678 HydrophobicContact CG2-CG 4.12Å; E451-K678 WeakPolarHBondContact OE2-CE 3.01Å; E451-K678 IonicContact OE2-NZ 3.58Å; E451-K678 PolarHBondContact OE2-NZ 3.44Å; F674-K678 PolarHBondContact O-N 3.23Å; A675-K678 PolarHBondContact O-N 3.48Å; K678-L681 PolarHBondContact O-N 2.94Å; K678-S682 PolarHBondContact O-N 3.37Å
679	L	87.5	Confident	83.3	Confident	18 Å²	18	39.6 Å²	39.6	9%	0.094	20%	0.198	C	C	.	.	H	α-helix	trans	-59.9	-48.6	174.4	-179.5	67.9	0	0	0	111.5	F385 T525 A675 R676 A677 L681 S682 Y683	F385-L679 HydrophobicContact CE2-CD2 4.28Å; T525-L679 WeakPolarHBondContact OG1-CD2 3.36Å; A675-L679 PolarHBondContact O-N 2.79Å; R676-L679 WeakPolarHBondContact O-CB 3.23Å; R676-L679 PolarHBondContact O-N 3.3Å; A677-L679 PolarHBondContact O-N 3.28Å; L679-L681 VanDerWaalsContact C-N 3.35Å; L679-L681 PolarHBondContact O-N 2.79Å; L679-S682 WeakPolarHBondContact O-CB 3.37Å; L679-S682 PolarHBondContact O-N 2.96Å; L679-S682 PolarHBondContact O-OG 3.33Å; L679-Y683 HydrophobicContact CD1-CE2 3.96Å; L679-Y683 HydrophobicContact CG-CE2 4.28Å; L679-Y683 VanDerWaalsContact O-CD2 3.28Å; L679-Y683 WeakPolarHBondContact O-CD2 3.26Å
680	W	88.3	Confident	82.9	Confident	9 Å²	9	36.3 Å²	36.3	3%	0.034	18%	0.18	C	C	.	.	H	α-helix	trans	-62.8	-41.1	-178.2	-71.4	0.9	0	0	0	112.9	L329 N330 W333 R676 A677 S682 Y683 F684	L329-W680 HydrophobicContact CB-CE3 4.14Å; L329-W680 HydrophobicContact CB-CZ3 4.06Å; N330-W680 VanDerWaalsContact OD1-CH2 3.27Å; N330-W680 WeakPolarHBondContact OD1-CH2 3.4Å; W333-W680 HydrophobicContact CB-CD2 4.45Å; W333-W680 HydrophobicContact CB-CE3 4.08Å; W333-W680 HydrophobicContact CB-CZ3 4.15Å; W333-W680 AromaticContact CD2-CD2 3.82Å; W333-W680 HydrophobicContact CD2-CD2 3.82Å; W333-W680 AromaticContact CD2-CE2 3.9Å; W333-W680 HydrophobicContact CD2-CE3 4.34Å; W333-W680 AromaticContact CD2-CG 3.93Å; W333-W680 HydrophobicContact CD2-CG 3.93Å; W333-W680 HydrophobicContact CD2-CZ2 4.49Å; W333-W680 AromaticContact CD2-NE1 4Å; W333-W680 AromaticContact CE2-NE1 3.85Å; W333-W680 HydrophobicContact CE3-CB 3.63Å; W333-W680 AromaticContact CE3-CD1 3.66Å; W333-W680 AromaticContact CE3-CD2 3.75Å; W333-W680 HydrophobicContact CE3-CD2 3.75Å; W333-W680 HydrophobicContact CE3-CE3 4.37Å; W333-W680 AromaticContact CE3-CG 3.4Å; W333-W680 HydrophobicContact CE3-CG 3.4Å; W333-W680 HydrophobicContact CG-CD2 4.13Å; W333-W680 HydrophobicContact CG-CE3 4.23Å; W333-W680 HydrophobicContact CG-CH2 4.46Å; W333-W680 HydrophobicContact CG-CZ2 4.33Å; W333-W680 HydrophobicContact CG-CZ3 4.4Å; W333-W680 AromaticContact CH2-CD1 3.56Å; W333-W680 HydrophobicContact CH2-CG 4.13Å; W333-W680 AromaticContact CH2-NE1 3.99Å; W333-W680 AromaticContact CZ2-CD1 3.92Å; W333-W680 AromaticContact CZ2-NE1 3.85Å; W333-W680 HydrophobicContact CZ3-CB 3.67Å; W333-W680 AromaticContact CZ3-CD1 3.45Å; W333-W680 VanDerWaalsContact CZ3-CD1 3.45Å; W333-W680 HydrophobicContact CZ3-CD2 4.32Å; W333-W680 AromaticContact CZ3-CG 3.54Å; W333-W680 HydrophobicContact CZ3-CG 3.54Å; R676-W680 HydrophobicContact CG-CD2 4.26Å; R676-W680 HydrophobicContact CG-CZ2 3.87Å; R676-W680 VanDerWaalsContact O-CG 3.32Å; R676-W680 PolarHBondContact O-N 3.29Å; A677-W680 PolarHBondContact O-N 3.26Å; W680-S682 PolarHBondContact O-N 2.86Å; W680-Y683 PolarHBondContact O-N 3.41Å; W680-F684 HydrophobicContact CB-CZ 4.14Å; W680-F684 PolarHBondContact O-N 3.46Å
681	L	86.2	Confident	82.6	Confident	16 Å²	16	32.5 Å²	32.5	8%	0.084	16%	0.164	C	C	.	.	H	α-helix	trans	-60.7	-31.7	179.9	-165.6	55.6	0	0	0	112.3	L305 K309 I312 A677 K678 L679 Y683 F684	L305-L681 HydrophobicContact CB-CD1 4.27Å; L305-L681 HydrophobicContact CD1-CD1 4.31Å; K309-L681 HydrophobicContact CB-CD2 4.35Å; K309-L681 HydrophobicContact CG-CD1 4.08Å; K309-L681 HydrophobicContact CG-CD2 3.49Å; K309-L681 VanDerWaalsContact CG-CD2 3.49Å; K309-L681 HydrophobicContact CG-CG 4.01Å; I312-L681 HydrophobicContact CD1-CD2 3.35Å; A677-L681 WeakPolarHBondContact O-CB 3.41Å; A677-L681 PolarHBondContact O-N 3.01Å; K678-L681 PolarHBondContact O-N 2.94Å; L679-L681 VanDerWaalsContact C-N 3.35Å; L679-L681 PolarHBondContact O-N 2.79Å; L681-Y683 PolarHBondContact O-N 2.82Å; L681-F684 HydrophobicContact CD1-CB 4.47Å; L681-F684 HydrophobicContact CD1-CD2 3.7Å; L681-F684 PolarHBondContact O-N 2.98Å
682	S	81.8	Confident	82.3	Confident	40 Å²	40	32 Å²	32	28%	0.28	16%	0.163	S	C	.	.	H	α-helix	trans	-64.4	-20.9	174.7	78	0	0	0	0	114.1	K678 L679 W680	K678-S682 PolarHBondContact O-N 3.37Å; L679-S682 WeakPolarHBondContact O-CB 3.37Å; L679-S682 PolarHBondContact O-N 2.96Å; L679-S682 PolarHBondContact O-OG 3.33Å; W680-S682 PolarHBondContact O-N 2.86Å
683	Y	84.2	Confident	81.9	Confident	24 Å²	24	31.9 Å²	31.9	9%	0.094	16%	0.164	C	C	.	.	H	α-helix	trans	-100.3	-10.8	176.7	-65.4	-79.3	0	0	0	113.7	W333 K384 F385 H388 L679 W680 L681	W333-Y683 HydrophobicContact CH2-CD2 4.25Å; W333-Y683 HydrophobicContact CZ3-CD2 4.39Å; K384-Y683 HydrophobicContact CB-CD1 4.2Å; F385-Y683 HydrophobicContact CB-CD1 4.48Å; F385-Y683 HydrophobicContact CB-CD2 4.44Å; F385-Y683 HydrophobicContact CB-CE1 4.45Å; F385-Y683 HydrophobicContact CB-CE2 4.42Å; F385-Y683 HydrophobicContact CB-CG 4.48Å; F385-Y683 HydrophobicContact CD2-CD2 4.31Å; F385-Y683 AromaticContact CD2-CE2 3.62Å; F385-Y683 HydrophobicContact CD2-CE2 3.62Å; F385-Y683 AromaticContact CD2-CZ 3.73Å; F385-Y683 HydrophobicContact CE2-CE2 4.44Å; F385-Y683 HydrophobicContact CG-CE2 4.5Å; H388-Y683 HydrophobicContact CB-CE1 4.16Å; H388-Y683 AromaticContact CD2-CE1 3.76Å; L679-Y683 HydrophobicContact CD1-CE2 3.96Å; L679-Y683 HydrophobicContact CG-CE2 4.28Å; L679-Y683 VanDerWaalsContact O-CD2 3.28Å; L679-Y683 WeakPolarHBondContact O-CD2 3.26Å; W680-Y683 PolarHBondContact O-N 3.41Å; L681-Y683 PolarHBondContact O-N 2.82Å
684	F	81.4	Confident	81.4	Confident	30 Å²	30	30.6 Å²	30.6	13%	0.132	16%	0.16	C	C	.	.	H	α-helix	trans	-72.7	-31.9	174.3	-66.7	-17.6	0	0	0	111.9	L305 L329 V332 W333 P381 W680 L681	L305-F684 HydrophobicContact CD1-CD2 3.56Å; L305-F684 HydrophobicContact CD1-CE2 3.69Å; L329-F684 HydrophobicContact CD2-CE2 3.73Å; L329-F684 HydrophobicContact CD2-CZ 4.27Å; V332-F684 HydrophobicContact CB-CZ 4.27Å; V332-F684 HydrophobicContact CG1-CD1 4.43Å; V332-F684 HydrophobicContact CG1-CE1 4Å; V332-F684 HydrophobicContact CG1-CE2 4.18Å; V332-F684 HydrophobicContact CG1-CZ 3.87Å; W333-F684 HydrophobicContact CB-CE1 4.5Å; W333-F684 AromaticContact CE3-CE1 3.67Å; W333-F684 HydrophobicContact CE3-CE1 3.67Å; W333-F684 HydrophobicContact CE3-CZ 4.2Å; W333-F684 HydrophobicContact CZ3-CE1 4.35Å; P381-F684 HydrophobicContact CB-CD1 3.53Å; P381-F684 HydrophobicContact CB-CE1 3.74Å; P381-F684 HydrophobicContact CG-CD1 3.6Å; P381-F684 HydrophobicContact CG-CE1 3.48Å; P381-F684 VanDerWaalsContact CG-CE1 3.48Å; W680-F684 HydrophobicContact CB-CZ 4.14Å; W680-F684 PolarHBondContact O-N 3.46Å; L681-F684 HydrophobicContact CD1-CB 4.47Å; L681-F684 HydrophobicContact CD1-CD2 3.7Å; L681-F684 PolarHBondContact O-N 2.98Å
685	D	69.8	Low	80.9	Confident	47 Å²	47	30 Å²	30	25%	0.251	16%	0.157	S	C	.	.	S	Bend	trans	-74.4	135	178.3	-72.6	-15.1	0	0	0	112	K309 K687	K309-D685 IonicContact NZ-OD1 3.95Å; K309-D685 PolarHBondContact NZ-OD1 2.91Å; K309-D685 IonicContact NZ-OD2 2.7Å; K309-D685 PolarHBondContact NZ-OD2 3.46Å; D685-K687 HydrophobicContact CB-CG 4.48Å; D685-K687 PolarHBondContact O-N 3.39Å
686	D	63.5	Low	80.3	Confident	59 Å²	59	31.4 Å²	31.4	32%	0.316	16%	0.163	S	C	.	.	G	3₁₀ helix	trans	-76.7	11.5	-178.2	-68.5	-37.1	0	0	0	114.3	R302 H379 K384	R302-D686 IonicContact CZ-OD2 2.66Å; R302-D686 IonicContact NH1-OD2 3.82Å; R302-D686 PolarHBondContact NH1-OD2 3.31Å; H379-D686 IonicContact CD2-OD1 3.32Å; H379-D686 IonicContact CE1-OD1 3.81Å; H379-D686 PolarHBondContact CE1-OD1 3.26Å; H379-D686 IonicContact CE1-OD2 3.55Å; H379-D686 IonicContact ND1-OD1 2.63Å; H379-D686 IonicContact NE2-OD1 2.58Å; H379-D686 PolarHBondContact NE2-OD1 2.98Å; H379-D686 VanDerWaalsContact NE2-OD1 3.09Å; H379-D686 IonicContact NE2-OD2 3.1Å; K384-D686 IonicContact NZ-OD1 3.24Å; K384-D686 PolarHBondContact NZ-OD1 3.3Å
687	K	61.5	Low	79.4	Confident	112 Å²	112	34.8 Å²	34.8	49%	0.487	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-78.9	-21.2	-171	-62.1	-179.9	180	-179	0	113.2	Y442 D685	Y442-K687 HydrophobicContact CD1-CD 4.1Å; Y442-K687 HydrophobicContact CD2-CD 4.01Å; Y442-K687 HydrophobicContact CE1-CD 4.07Å; Y442-K687 HydrophobicContact CE2-CB 4.05Å; Y442-K687 HydrophobicContact CE2-CD 4Å; Y442-K687 HydrophobicContact CE2-CG 4.42Å; Y442-K687 HydrophobicContact CG-CD 4.08Å; D685-K687 HydrophobicContact CB-CG 4.48Å; D685-K687 PolarHBondContact O-N 3.39Å
688	C	60.5	Low	78.1	Confident	39 Å²	39	39.7 Å²	39.7	26%	0.264	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-141	59.4	-177.4	-69.3	0	0	0	0	113.1	H388 L690	H388-C688 PolarHBondContact NE2-O 3.18Å; C688-L690 PolarHBondContact O-N 3.49Å
689	T	69.7	Low	76.7	Confident	23 Å²	23	38 Å²	38	14%	0.141	21%	0.21	C	C	.	.			trans	-73.2	-24.5	-176.6	60.4	0	0	0	0	114.5	Y366	Y366-T689 VanDerWaalsContact CE1-OG1 3.32Å; Y366-T689 WeakPolarHBondContact CE1-OG1 3.4Å
690	L	81.3	Confident	75.5	Confident	13 Å²	13	40.9 Å²	40.9	7%	0.068	23%	0.23	C	C	.	.	S	Bend	trans	-99.1	135.2	-177.9	-71.7	168	0	0	0	111.1	Y366 L367 H388 C688	Y366-L690 HydrophobicContact CD1-CD2 3.9Å; Y366-L690 HydrophobicContact CD1-CG 4.27Å; L367-L690 HydrophobicContact CD1-CD1 4.49Å; H388-L690 PolarHBondContact CE1-O 3.48Å; C688-L690 PolarHBondContact O-N 3.49Å
691	P	85.4	Confident	74.2	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.006	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-73.8	155.1	174.5	35.6	-40	0	0	0	111.8	W359 I387 H388 L694 N695	W359-P691 HydrophobicContact CE3-CG 4.03Å; W359-P691 HydrophobicContact CZ3-CG 3.92Å; I387-P691 HydrophobicContact CG2-CB 4.27Å; I387-P691 HydrophobicContact CG2-CG 3.6Å; H388-P691 VanDerWaalsContact CE1-CA 3.45Å; H388-P691 WeakPolarHBondContact CE1-CA 3.43Å; H388-P691 WeakPolarHBondContact ND1-CA 3.41Å; P691-L694 PolarHBondContact O-N 3.01Å; P691-N695 PolarHBondContact O-N 3.3Å; P691-N695 VanDerWaalsContact O-N 3.11Å
692	P	85.3	Confident	73.1	Confident	17 Å²	17	46.8 Å²	46.8	11%	0.11	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	142	159.3	-23	34.6	0	0	0	109.5	S391 M432	S391-P692 WeakPolarHBondContact CB-O 3.34Å; S391-P692 PolarHBondContact OG-O 3.35Å; M432-P692 HydrophobicContact CG-CB 4.07Å; M432-P692 HydrophobicContact CG-CG 4.05Å
693	P	83.6	Confident	72.3	Confident	11 Å²	11	48.8 Å²	48.8	7%	0.071	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	cis	-82.5	-15.8	0.5	29.9	-27.1	0	0	0	113.9	L427 W428 N695 V696	L427-P693 HydrophobicContact CD2-CB 3.87Å; L427-P693 HydrophobicContact CD2-CG 4.27Å; L427-P693 HydrophobicContact CG-CB 3.69Å; W428-P693 HydrophobicContact CD2-CB 4.21Å; W428-P693 HydrophobicContact CD2-CG 3.91Å; W428-P693 HydrophobicContact CE3-CB 4.44Å; W428-P693 HydrophobicContact CE3-CG 4.09Å; W428-P693 HydrophobicContact CG-CB 4.39Å; W428-P693 HydrophobicContact CG-CG 4.49Å; W428-P693 HydrophobicContact CH2-CG 4.18Å; W428-P693 HydrophobicContact CZ2-CG 3.99Å; W428-P693 HydrophobicContact CZ3-CG 4.23Å; P693-N695 PolarHBondContact O-N 3.34Å; P693-V696 PolarHBondContact O-N 3.31Å
694	L	83.4	Confident	71.4	Confident	32 Å²	32	51.4 Å²	51.4	17%	0.168	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-68.1	-10.5	-170	-62.3	172.4	0	0	0	114.1	W359 S363 I364 P691 V696 L697	W359-L694 HydrophobicContact CZ3-CD1 4.39Å; S363-L694 WeakPolarHBondContact OG-CD1 3.45Å; I364-L694 HydrophobicContact CG1-CD1 4.36Å; P691-L694 PolarHBondContact O-N 3.01Å; L694-V696 PolarHBondContact O-N 2.94Å; L694-L697 HydrophobicContact CD2-CD1 3.99Å; L694-L697 PolarHBondContact O-N 2.93Å
695	N	82.9	Confident	70.6	Confident	10 Å²	10	55.1 Å²	55.1	5%	0.053	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-63.9	-21.1	174	-172.7	23	0	0	0	114.2	K438 P691 P693 L697	K438-N695 PolarHBondContact NZ-OD1 3.47Å; P691-N695 PolarHBondContact O-N 3.3Å; P691-N695 VanDerWaalsContact O-N 3.11Å; P693-N695 PolarHBondContact O-N 3.34Å; N695-L697 VanDerWaalsContact C-N 3.34Å
696	V	79.1	Confident	70.6	Confident	57 Å²	57	58.3 Å²	58.3	35%	0.345	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-72.1	-31.2	177.3	-178.4	0	0	0	0	111.2	I430 P693 L694 T698	I430-V696 HydrophobicContact CG2-CG2 4.04Å; P693-V696 PolarHBondContact O-N 3.31Å; L694-V696 PolarHBondContact O-N 2.94Å; V696-T698 PolarHBondContact O-N 3.27Å
697	L	72.5	Confident	70.9	Confident	99 Å²	99	59.8 Å²	59.8	52%	0.518	33%	0.334	S	S	.	.	S	Bend	trans	-68.8	107.6	177.4	-63.9	170.4	0	0	0	109	L367 L694 N695 S699	L367-L697 HydrophobicContact CD1-CB 3.92Å; L367-L697 HydrophobicContact CD1-CD1 3.85Å; L694-L697 HydrophobicContact CD2-CD1 3.99Å; L694-L697 PolarHBondContact O-N 2.93Å; N695-L697 VanDerWaalsContact C-N 3.34Å; L697-S699 PolarHBondContact O-N 3.16Å
698	T	63	Low	71.2	Confident	104 Å²	104	56.8 Å²	56.8	64%	0.638	33%	0.325	S	S	*	.			trans	-57	128.3	177.4	54.8	0	0	0	0	109.8	V696	V696-T698 PolarHBondContact O-N 3.27Å
699	S	60	Low	71.6	Confident	37 Å²	37	57.6 Å²	57.6	26%	0.259	33%	0.331	S	S	.	.			trans	-60.8	139.3	179.7	75.7	0	0	0	0	110.3	L697 K701 T702	L697-S699 PolarHBondContact O-N 3.16Å; S699-K701 PolarHBondContact O-N 3.49Å; S699-T702 PolarHBondContact N-OG1 3.41Å; S699-T702 PolarHBondContact O-N 3.49Å; S699-T702 PolarHBondContact O-OG1 3.36Å; S699-T702 PolarHBondContact OG-N 3.13Å; S699-T702 VanDerWaalsContact OG-N 3.16Å; S699-T702 PolarHBondContact OG-OG1 3.1Å
700	P	61.2	Low	71.7	Confident	78 Å²	78	60.8 Å²	60.8	51%	0.506	35%	0.347	S	S	.	.	H	α-helix	trans	-55.7	-28	173.7	-25.7	33.2	0	0	0	112.5	C704	P700-C704 WeakPolarHBondContact O-CB 3.24Å; P700-C704 PolarHBondContact O-N 3.33Å
701	K	61.3	Low	71.3	Confident	78 Å²	78	68.6 Å²	68.6	34%	0.339	38%	0.375	S	S	.	.	H	α-helix	trans	-60.9	-46.1	174.7	-66.1	-175.2	-174.6	173.8	0	112.4	S699 V703 C704 Y705	S699-K701 PolarHBondContact O-N 3.49Å; K701-V703 VanDerWaalsContact C-N 3.33Å; K701-V703 PolarHBondContact O-N 3.24Å; K701-C704 PolarHBondContact O-N 3.01Å; K701-Y705 HydrophobicContact CB-CD2 4.17Å; K701-Y705 HydrophobicContact CB-CE2 3.9Å; K701-Y705 WeakPolarHBondContact O-CB 3.42Å; K701-Y705 WeakPolarHBondContact O-CD2 3.37Å; K701-Y705 VanDerWaalsContact O-CG 3.3Å; K701-Y705 PolarHBondContact O-N 2.91Å
702	T	64	Low	70.4	Confident	72 Å²	72	74.8 Å²	74.8	44%	0.442	40%	0.402	S	S	.	.	H	α-helix	trans	-63.3	-39.2	-178.5	33.6	0	0	0	0	111.9	S699 Y705 L706	S699-T702 PolarHBondContact N-OG1 3.41Å; S699-T702 PolarHBondContact O-N 3.49Å; S699-T702 PolarHBondContact O-OG1 3.36Å; S699-T702 PolarHBondContact OG-N 3.13Å; S699-T702 VanDerWaalsContact OG-N 3.16Å; S699-T702 PolarHBondContact OG-OG1 3.1Å; T702-Y705 PolarHBondContact O-N 3.36Å; T702-L706 WeakPolarHBondContact O-CB 3.48Å; T702-L706 PolarHBondContact O-N 2.89Å
703	V	65	Low	69.7	Low	82 Å²	82	82 Å²	82	50%	0.497	43%	0.427	S	S	.	.	H	α-helix	trans	-66.2	-46.9	175	179.7	0	0	0	0	110.8	K701 Y705 L706 V707	K701-V703 VanDerWaalsContact C-N 3.33Å; K701-V703 PolarHBondContact O-N 3.24Å; V703-Y705 VanDerWaalsContact C-N 3.29Å; V703-Y705 PolarHBondContact O-N 2.93Å; V703-L706 PolarHBondContact O-N 3.46Å; V703-V707 WeakPolarHBondContact O-CG2 3.45Å; V703-V707 PolarHBondContact O-N 2.89Å
704	C	64.6	Low	69.2	Low	79 Å²	79	86.6 Å²	86.6	53%	0.534	45%	0.45	S	S	.	.	H	α-helix	trans	-60.2	-38.2	176	-173.7	0	0	0	0	112.3	P700 K701 T708	P700-C704 WeakPolarHBondContact O-CB 3.24Å; P700-C704 PolarHBondContact O-N 3.33Å; K701-C704 PolarHBondContact O-N 3.01Å; C704-T708 PolarHBondContact O-N 2.84Å; C704-T708 PolarHBondContact O-OG1 2.83Å
705	Y	65.4	Low	68.3	Low	108 Å²	108	88 Å²	88	42%	0.424	46%	0.462	S	S	.	.	H	α-helix	trans	-68.8	-39.1	174.7	-73.4	-50.3	0	0	0	113.1	K701 T702 V703 V707 T708 S709	K701-Y705 HydrophobicContact CB-CD2 4.17Å; K701-Y705 HydrophobicContact CB-CE2 3.9Å; K701-Y705 WeakPolarHBondContact O-CB 3.42Å; K701-Y705 WeakPolarHBondContact O-CD2 3.37Å; K701-Y705 VanDerWaalsContact O-CG 3.3Å; K701-Y705 PolarHBondContact O-N 2.91Å; T702-Y705 PolarHBondContact O-N 3.36Å; V703-Y705 VanDerWaalsContact C-N 3.29Å; V703-Y705 PolarHBondContact O-N 2.93Å; Y705-V707 VanDerWaalsContact C-N 3.33Å; Y705-T708 WeakPolarHBondContact CA-OG1 3.5Å; Y705-T708 PolarHBondContact O-N 3.33Å; Y705-T708 PolarHBondContact O-OG1 2.8Å; Y705-S709 VanDerWaalsContact O-CB 3.23Å; Y705-S709 WeakPolarHBondContact O-CB 3.41Å; Y705-S709 PolarHBondContact O-N 2.9Å; Y705-S709 PolarHBondContact O-OG 3.33Å; Y705-S709 VanDerWaalsContact O-OG 3.09Å
706	L	68.8	Low	67.3	Low	114 Å²	114	89.5 Å²	89.5	60%	0.597	47%	0.473	S	S	*	.	H	α-helix	trans	-64.8	-42.7	177.5	-147.9	146.5	0	0	0	109.9	T702 V703 S709 L710	T702-L706 WeakPolarHBondContact O-CB 3.48Å; T702-L706 PolarHBondContact O-N 2.89Å; V703-L706 PolarHBondContact O-N 3.46Å; L706-S709 PolarHBondContact O-N 3.38Å; L706-L710 HydrophobicContact CD2-CD1 3.7Å; L706-L710 HydrophobicContact CD2-CG 4.4Å; L706-L710 WeakPolarHBondContact O-CB 3.45Å; L706-L710 WeakPolarHBondContact O-CD1 3.28Å; L706-L710 VanDerWaalsContact O-CG 3.3Å; L706-L710 WeakPolarHBondContact O-CG 3.26Å; L706-L710 PolarHBondContact O-N 3.46Å
707	V	70.7	Confident	66.6	Low	90 Å²	90	93 Å²	93	55%	0.545	49%	0.485	S	S	.	.	H	α-helix	trans	-63.5	-43.6	173.2	174.3	0	0	0	0	112.1	V703 Y705 R711	V703-V707 WeakPolarHBondContact O-CG2 3.45Å; V703-V707 PolarHBondContact O-N 2.89Å; Y705-V707 VanDerWaalsContact C-N 3.33Å; V707-R711 WeakPolarHBondContact O-CB 3.4Å; V707-R711 PolarHBondContact O-N 3.37Å
708	T	68.3	Low	66.6	Low	49 Å²	49	91.6 Å²	91.6	30%	0.301	48%	0.481	S	S	.	.	H	α-helix	trans	-71.7	-31.3	176.5	28.6	0	0	0	0	113.3	C704 Y705 R711 K712	C704-T708 PolarHBondContact O-N 2.84Å; C704-T708 PolarHBondContact O-OG1 2.83Å; Y705-T708 WeakPolarHBondContact CA-OG1 3.5Å; Y705-T708 PolarHBondContact O-N 3.33Å; Y705-T708 PolarHBondContact O-OG1 2.8Å; T708-R711 PolarHBondContact O-N 2.96Å; T708-K712 WeakPolarHBondContact O-CB 3.37Å; T708-K712 VanDerWaalsContact O-CG 3.27Å; T708-K712 WeakPolarHBondContact O-CG 3.11Å; T708-K712 PolarHBondContact O-N 3.27Å
709	S	67.4	Low	66.8	Low	56 Å²	56	92.2 Å²	92.2	39%	0.392	49%	0.485	S	S	.	.	H	α-helix	trans	-68.9	-42.8	173.5	-74.4	0	0	0	0	111.2	Y705 L706 R711 K712 W713	Y705-S709 VanDerWaalsContact O-CB 3.23Å; Y705-S709 WeakPolarHBondContact O-CB 3.41Å; Y705-S709 PolarHBondContact O-N 2.9Å; Y705-S709 PolarHBondContact O-OG 3.33Å; Y705-S709 VanDerWaalsContact O-OG 3.09Å; L706-S709 PolarHBondContact O-N 3.38Å; S709-R711 PolarHBondContact O-N 3.28Å; S709-K712 PolarHBondContact O-N 2.94Å; S709-W713 WeakPolarHBondContact O-CB 3.28Å; S709-W713 PolarHBondContact O-N 3.27Å
710	L	73.2	Confident	67.2	Low	89 Å²	89	99 Å²	99	47%	0.466	51%	0.51	S	S	.	.	H	α-helix	trans	-58.3	-46.5	170.4	-77.2	161.7	0	0	0	111.1	L706 K712 W713 I714	L706-L710 HydrophobicContact CD2-CD1 3.7Å; L706-L710 HydrophobicContact CD2-CG 4.4Å; L706-L710 WeakPolarHBondContact O-CB 3.45Å; L706-L710 WeakPolarHBondContact O-CD1 3.28Å; L706-L710 VanDerWaalsContact O-CG 3.3Å; L706-L710 WeakPolarHBondContact O-CG 3.26Å; L706-L710 PolarHBondContact O-N 3.46Å; L710-K712 PolarHBondContact O-N 3.46Å; L710-W713 PolarHBondContact O-N 3.27Å; L710-I714 WeakPolarHBondContact O-CD1 3.32Å; L710-I714 VanDerWaalsContact O-CG1 3.28Å; L710-I714 WeakPolarHBondContact O-CG1 3.39Å; L710-I714 PolarHBondContact O-N 3.35Å
711	R	72.7	Confident	67.5	Low	177 Å²	177	96.2 Å²	96.2	67%	0.668	50%	0.495	S	S	*	.	H	α-helix	trans	-61.6	-40.5	175.4	-171.7	178.5	179.1	-174.1	1.4	112.5	V707 T708 S709 C715	V707-R711 WeakPolarHBondContact O-CB 3.4Å; V707-R711 PolarHBondContact O-N 3.37Å; T708-R711 PolarHBondContact O-N 2.96Å; S709-R711 PolarHBondContact O-N 3.28Å; R711-C715 WeakPolarHBondContact O-CB 3.25Å; R711-C715 PolarHBondContact O-N 2.94Å; R711-C715 PolarHBondContact O-SG 3.47Å; R711-C715 VanDerWaalsContact O-SG 3.32Å
712	K	67.1	Low	67.8	Low	132 Å²	132	98.8 Å²	98.8	57%	0.574	51%	0.506	S	S	*	.	H	α-helix	trans	-69.5	-36.1	176.8	-79.5	175.3	-178.1	177.7	0	112.2	T708 S709 L710 C715 S716	T708-K712 WeakPolarHBondContact O-CB 3.37Å; T708-K712 VanDerWaalsContact O-CG 3.27Å; T708-K712 WeakPolarHBondContact O-CG 3.11Å; T708-K712 PolarHBondContact O-N 3.27Å; S709-K712 PolarHBondContact O-N 2.94Å; L710-K712 PolarHBondContact O-N 3.46Å; K712-C715 PolarHBondContact O-N 3.41Å; K712-S716 VanDerWaalsContact O-CB 3.31Å; K712-S716 WeakPolarHBondContact O-CB 3.16Å; K712-S716 PolarHBondContact O-N 3.04Å
713	W	70.2	Confident	68.3	Low	168 Å²	168	99.1 Å²	99.1	64%	0.636	51%	0.508	S	S	*	.	H	α-helix	trans	-62.5	-49.9	175	-179.2	69.2	0	0	0	110.3	S709 L710 C715 S716 H717	S709-W713 WeakPolarHBondContact O-CB 3.28Å; S709-W713 PolarHBondContact O-N 3.27Å; L710-W713 PolarHBondContact O-N 3.27Å; W713-C715 PolarHBondContact O-N 3.11Å; W713-S716 WeakPolarHBondContact O-CB 3.38Å; W713-S716 PolarHBondContact O-N 3.02Å; W713-S716 PolarHBondContact O-OG 3.25Å; W713-H717 PolarHBondContact O-CD2 3.26Å
714	I	73.1	Confident	68.8	Low	108 Å²	108	103.1 Å²	103.1	55%	0.554	52%	0.519	S	S	*	.	H	α-helix	trans	-58.6	-48	174.4	-63.9	162.7	0	0	0	110.9	L710 S716 H717	L710-I714 WeakPolarHBondContact O-CD1 3.32Å; L710-I714 VanDerWaalsContact O-CG1 3.28Å; L710-I714 WeakPolarHBondContact O-CG1 3.39Å; L710-I714 PolarHBondContact O-N 3.35Å; I714-S716 VanDerWaalsContact C-N 3.26Å; I714-S716 PolarHBondContact O-N 3.48Å; I714-H717 PolarHBondContact O-N 2.99Å
715	C	64.8	Low	69.2	Low	62 Å²	62	107.1 Å²	107.1	42%	0.419	52%	0.523	S	S	.	.	H	α-helix	trans	-67.8	-20.6	177.3	-73.4	0	0	0	0	113.8	R711 K712 W713 H717 T718	R711-C715 WeakPolarHBondContact O-CB 3.25Å; R711-C715 PolarHBondContact O-N 2.94Å; R711-C715 PolarHBondContact O-SG 3.47Å; R711-C715 VanDerWaalsContact O-SG 3.32Å; K712-C715 PolarHBondContact O-N 3.41Å; W713-C715 PolarHBondContact O-N 3.11Å; C715-H717 PolarHBondContact O-N 2.74Å; C715-T718 PolarHBondContact O-N 3.29Å; C715-T718 PolarHBondContact O-OG1 2.97Å
716	S	60.8	Low	69.7	Low	40 Å²	40	107.9 Å²	107.9	28%	0.28	53%	0.53	S	S	.	.	H	α-helix	trans	-71	-22	-179.8	83.4	0	0	0	0	113.1	K712 W713 I714 T718	K712-S716 VanDerWaalsContact O-CB 3.31Å; K712-S716 WeakPolarHBondContact O-CB 3.16Å; K712-S716 PolarHBondContact O-N 3.04Å; W713-S716 WeakPolarHBondContact O-CB 3.38Å; W713-S716 PolarHBondContact O-N 3.02Å; W713-S716 PolarHBondContact O-OG 3.25Å; I714-S716 VanDerWaalsContact C-N 3.26Å; I714-S716 PolarHBondContact O-N 3.48Å; S716-T718 PolarHBondContact O-N 3.26Å
717	H	65.6	Low	70.2	Confident	131 Å²	131	106.8 Å²	106.8	61%	0.606	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-12.5	173.9	-72.6	-80.5	0	0	0	112.9	W713 I714 C715	W713-H717 PolarHBondContact O-CD2 3.26Å; I714-H717 PolarHBondContact O-N 2.99Å; C715-H717 PolarHBondContact O-N 2.74Å
718	T	72.7	Confident	70.6	Confident	69 Å²	69	104.6 Å²	104.6	42%	0.423	51%	0.513	S	S	.	.	S	Bend	trans	-83.3	150.5	175.8	71.2	0	0	0	0	112.5	C715 S716 K720 G721 K722	C715-T718 PolarHBondContact O-N 3.29Å; C715-T718 PolarHBondContact O-OG1 2.97Å; S716-T718 PolarHBondContact O-N 3.26Å; T718-K720 VanDerWaalsContact C-N 3.32Å; T718-K720 PolarHBondContact O-N 3.49Å; T718-G721 PolarHBondContact O-N 2.91Å; T718-G721 PolarHBondContact OG1-N 2.99Å; T718-K722 PolarHBondContact O-N 3.07Å; T718-K722 VanDerWaalsContact O-N 3.14Å
719	T	65.3	Low	71.1	Confident	117 Å²	117	105.6 Å²	105.6	72%	0.718	52%	0.516	S	S	*	.	H	α-helix	trans	-58.4	-39.9	178.7	50.9	0	0	0	0	112.7	G721 K722 V723	T719-G721 VanDerWaalsContact C-N 3.34Å; T719-G721 PolarHBondContact O-N 3.44Å; T719-K722 PolarHBondContact O-N 3.34Å; T719-V723 PolarHBondContact O-N 3.02Å
720	K	69.9	Low	71.8	Confident	181 Å²	181	109.1 Å²	109.1	79%	0.787	53%	0.525	S	S	*	.	H	α-helix	trans	-63.5	-35.7	174	-66.6	-176	179.2	179.7	0	112.7	T718 K724	T718-K720 VanDerWaalsContact C-N 3.32Å; T718-K720 PolarHBondContact O-N 3.49Å; K720-K724 PolarHBondContact O-N 3.27Å
721	G	67.1	Low	72.3	Confident	19 Å²	19	110.2 Å²	110.2	20%	0.196	53%	0.528	C	S	.	.	H	α-helix	trans	-67.2	-38.9	176.2	0	0	0	0	0	113.3	T718 T719 K724 R725	T718-G721 PolarHBondContact O-N 2.91Å; T718-G721 PolarHBondContact OG1-N 2.99Å; T719-G721 VanDerWaalsContact C-N 3.34Å; T719-G721 PolarHBondContact O-N 3.44Å; G721-K724 PolarHBondContact O-N 3.15Å; G721-R725 WeakPolarHBondContact O-CB 3.45Å; G721-R725 PolarHBondContact O-N 3.27Å
722	K	68.3	Low	72.6	Confident	131 Å²	131	104.4 Å²	104.4	57%	0.57	51%	0.506	S	S	*	.	H	α-helix	trans	-63.3	-45.3	177	-68.2	-177	-178.9	179.7	0	112.2	T718 T719 R725 Q726	T718-K722 PolarHBondContact O-N 3.07Å; T718-K722 VanDerWaalsContact O-N 3.14Å; T719-K722 PolarHBondContact O-N 3.34Å; K722-R725 PolarHBondContact O-N 3.45Å; K722-Q726 PolarHBondContact O-N 3.42Å
723	V	74.4	Confident	73.3	Confident	80 Å²	80	103.8 Å²	103.8	49%	0.485	50%	0.503	S	S	.	.	H	α-helix	trans	-64.2	-44.9	177.5	177.8	0	0	0	0	111.3	T719 R725 Q726 N727	T719-V723 PolarHBondContact O-N 3.02Å; V723-R725 VanDerWaalsContact C-N 3.31Å; V723-R725 PolarHBondContact O-N 2.79Å; V723-Q726 PolarHBondContact O-N 3.19Å; V723-N727 PolarHBondContact O-N 3.41Å
724	K	75.3	Confident	74	Confident	166 Å²	166	100.8 Å²	100.8	72%	0.722	50%	0.499	S	S	*	.	H	α-helix	trans	-62	-38.2	176.9	-168.8	171.2	-176.1	170.4	0	112.2	K720 G721 S728	K720-K724 PolarHBondContact O-N 3.27Å; G721-K724 PolarHBondContact O-N 3.15Å; K724-S728 WeakPolarHBondContact O-CB 3.42Å; K724-S728 PolarHBondContact O-N 3.05Å; K724-S728 PolarHBondContact O-OG 2.98Å
725	R	72.4	Confident	74.5	Confident	162 Å²	162	99.1 Å²	99.1	61%	0.611	49%	0.491	S	S	*	.	H	α-helix	trans	-64.6	-44.5	174.6	-176.8	178.7	174.7	175.2	-0.4	111.4	G721 K722 V723 S728 L729	G721-R725 WeakPolarHBondContact O-CB 3.45Å; G721-R725 PolarHBondContact O-N 3.27Å; K722-R725 PolarHBondContact O-N 3.45Å; V723-R725 VanDerWaalsContact C-N 3.31Å; V723-R725 PolarHBondContact O-N 2.79Å; R725-S728 PolarHBondContact O-N 3.1Å; R725-S728 PolarHBondContact O-OG 3.16Å; R725-L729 WeakPolarHBondContact O-CB 3.36Å; R725-L729 PolarHBondContact O-N 2.9Å
726	Q	76.6	Confident	75.3	Confident	124 Å²	124	97.8 Å²	97.8	58%	0.579	48%	0.478	S	S	*	.	H	α-helix	trans	-62.7	-45	177.4	-77.7	179.8	-15.8	0	0	112.1	K722 V723 S728 L729 K730	K722-Q726 PolarHBondContact O-N 3.42Å; V723-Q726 PolarHBondContact O-N 3.19Å; Q726-S728 PolarHBondContact O-N 2.93Å; Q726-L729 WeakPolarHBondContact O-CB 3.09Å; Q726-L729 PolarHBondContact O-N 2.68Å; Q726-L729 VanDerWaalsContact O-N 3.14Å; Q726-K730 WeakPolarHBondContact O-CG 3.44Å; Q726-K730 PolarHBondContact O-N 3.39Å
727	N	79.4	Confident	76.5	Confident	92 Å²	92	101 Å²	101	49%	0.492	49%	0.489	S	S	.	.	H	α-helix	trans	-62.5	-44.1	176.9	-71	-5.7	0	0	0	111.7	V723 L729 K730 E731	V723-N727 PolarHBondContact O-N 3.41Å; N727-L729 PolarHBondContact O-N 3.25Å; N727-K730 PolarHBondContact O-N 2.94Å; N727-E731 WeakPolarHBondContact O-CB 3.28Å; N727-E731 PolarHBondContact O-N 3.49Å
728	S	77.5	Confident	77.5	Confident	43 Å²	43	102 Å²	102	30%	0.301	49%	0.492	S	S	.	.	H	α-helix	trans	-62.5	-30.7	174.9	72.5	0	0	0	0	113.3	K295 K724 R725 Q726 W732	K295-S728 PolarHBondContact NZ-OG 3.31Å; K724-S728 WeakPolarHBondContact O-CB 3.42Å; K724-S728 PolarHBondContact O-N 3.05Å; K724-S728 PolarHBondContact O-OG 2.98Å; R725-S728 PolarHBondContact O-N 3.1Å; R725-S728 PolarHBondContact O-OG 3.16Å; Q726-S728 PolarHBondContact O-N 2.93Å; S728-W732 VanDerWaalsContact O-CB 3.27Å; S728-W732 WeakPolarHBondContact O-CB 3.39Å; S728-W732 PolarHBondContact O-N 3.46Å
729	L	79.5	Confident	78.1	Confident	70 Å²	70	103.5 Å²	103.5	37%	0.366	49%	0.49	S	S	.	.	H	α-helix	trans	-75.4	-39.5	177.9	-164.6	109.2	0	0	0	110.8	R725 Q726 N727 W732 K733	R725-L729 WeakPolarHBondContact O-CB 3.36Å; R725-L729 PolarHBondContact O-N 2.9Å; Q726-L729 WeakPolarHBondContact O-CB 3.09Å; Q726-L729 PolarHBondContact O-N 2.68Å; Q726-L729 VanDerWaalsContact O-N 3.14Å; N727-L729 PolarHBondContact O-N 3.25Å; L729-W732 PolarHBondContact O-N 2.94Å; L729-K733 WeakPolarHBondContact O-CG 3.37Å; L729-K733 PolarHBondContact O-N 3.37Å
730	K	82.7	Confident	79.1	Confident	131 Å²	131	100.1 Å²	100.1	57%	0.57	47%	0.467	S	S	*	.	H	α-helix	trans	-62.9	-47	173.5	-72.6	-178.7	178.7	-176.8	0	111.3	Q726 N727 W732 K733 N734	Q726-K730 WeakPolarHBondContact O-CG 3.44Å; Q726-K730 PolarHBondContact O-N 3.39Å; N727-K730 PolarHBondContact O-N 2.94Å; K730-W732 VanDerWaalsContact C-N 3.33Å; K730-W732 PolarHBondContact O-N 3.21Å; K730-K733 PolarHBondContact O-N 3.14Å; K730-N734 VanDerWaalsContact O-CG 3.29Å; K730-N734 PolarHBondContact O-N 2.92Å; K730-N734 PolarHBondContact O-OD1 2.83Å
731	E	82.6	Confident	80.1	Confident	112 Å²	112	95.4 Å²	95.4	52%	0.523	45%	0.448	S	S	.	.	H	α-helix	trans	-59.4	-44.1	176	-172.2	178.8	-174.5	0	0	111.7	N727 N734 L735	N727-E731 WeakPolarHBondContact O-CB 3.28Å; N727-E731 PolarHBondContact O-N 3.49Å; E731-N734 PolarHBondContact O-N 3.15Å; E731-L735 HydrophobicContact CG-CD1 4.25Å; E731-L735 WeakPolarHBondContact O-CB 3.38Å; E731-L735 WeakPolarHBondContact O-CG 3.4Å; E731-L735 PolarHBondContact O-N 3.16Å
732	W	79.1	Confident	81.2	Confident	54 Å²	54	98.1 Å²	98.1	21%	0.205	46%	0.458	C	S	.	.	H	α-helix	trans	-60.5	-45.1	174.6	176.4	88.1	0	0	0	112.6	S728 L729 K730 N734 L735 K736	S728-W732 VanDerWaalsContact O-CB 3.27Å; S728-W732 WeakPolarHBondContact O-CB 3.39Å; S728-W732 PolarHBondContact O-N 3.46Å; L729-W732 PolarHBondContact O-N 2.94Å; K730-W732 VanDerWaalsContact C-N 3.33Å; K730-W732 PolarHBondContact O-N 3.21Å; W732-N734 PolarHBondContact O-N 3.4Å; W732-L735 PolarHBondContact O-N 3.3Å; W732-K736 HydrophobicContact CH2-CD 3.67Å; W732-K736 HydrophobicContact CZ2-CD 3.91Å; W732-K736 HydrophobicContact CZ3-CD 4.28Å; W732-K736 WeakPolarHBondContact O-CB 3.06Å; W732-K736 PolarHBondContact O-N 2.93Å
733	K	81.5	Confident	82.2	Confident	119 Å²	119	92.2 Å²	92.2	52%	0.517	43%	0.432	S	S	.	.	H	α-helix	trans	-60.8	-44.9	177.2	-76	-174	178.1	-165.8	0	111.3	L729 K730 L735 K736 Q737	L729-K733 WeakPolarHBondContact O-CG 3.37Å; L729-K733 PolarHBondContact O-N 3.37Å; K730-K733 PolarHBondContact O-N 3.14Å; K733-L735 PolarHBondContact O-N 3.49Å; K733-K736 PolarHBondContact O-N 3.49Å; K733-Q737 WeakPolarHBondContact O-CB 3.44Å; K733-Q737 PolarHBondContact O-N 2.65Å
734	N	85.8	Confident	83.1	Confident	105 Å²	105	92.6 Å²	92.6	56%	0.561	43%	0.429	S	S	*	.	H	α-helix	trans	-63.7	-41.3	178.5	-68.6	-3	0	0	0	111.9	K730 E731 W732 K738	K730-N734 VanDerWaalsContact O-CG 3.29Å; K730-N734 PolarHBondContact O-N 2.92Å; K730-N734 PolarHBondContact O-OD1 2.83Å; E731-N734 PolarHBondContact O-N 3.15Å; W732-N734 PolarHBondContact O-N 3.4Å; N734-K738 WeakPolarHBondContact O-CB 3.39Å; N734-K738 PolarHBondContact O-N 3.48Å
735	L	82.6	Confident	83.9	Confident	73 Å²	73	91.2 Å²	91.2	38%	0.382	42%	0.423	S	S	.	.	H	α-helix	trans	-66.9	-41.6	176.5	-74.3	170	0	0	0	112.3	E731 W732 K733 K738 R739	E731-L735 HydrophobicContact CG-CD1 4.25Å; E731-L735 WeakPolarHBondContact O-CB 3.38Å; E731-L735 WeakPolarHBondContact O-CG 3.4Å; E731-L735 PolarHBondContact O-N 3.16Å; W732-L735 PolarHBondContact O-N 3.3Å; K733-L735 PolarHBondContact O-N 3.49Å; L735-K738 PolarHBondContact O-N 3.17Å; L735-R739 WeakPolarHBondContact O-CG 3.49Å; L735-R739 PolarHBondContact O-N 3.43Å; L735-R739 VanDerWaalsContact O-N 3.07Å
736	K	82.4	Confident	84.9	Confident	34 Å²	34	84.5 Å²	84.5	15%	0.148	40%	0.398	C	S	.	.	H	α-helix	trans	-60.8	-51.9	175.2	179.5	172.2	176.3	173.6	0	110.4	D290 W732 K733 K738 R739 D740	D290-K736 IonicContact OD1-NZ 3.4Å; D290-K736 PolarHBondContact OD1-NZ 3.41Å; W732-K736 HydrophobicContact CH2-CD 3.67Å; W732-K736 HydrophobicContact CZ2-CD 3.91Å; W732-K736 HydrophobicContact CZ3-CD 4.28Å; W732-K736 WeakPolarHBondContact O-CB 3.06Å; W732-K736 PolarHBondContact O-N 2.93Å; K733-K736 PolarHBondContact O-N 3.49Å; K736-K738 VanDerWaalsContact C-N 3.31Å; K736-K738 PolarHBondContact O-N 3.33Å; K736-R739 WeakPolarHBondContact O-CA 3.17Å; K736-R739 WeakPolarHBondContact O-CB 3.46Å; K736-R739 PolarHBondContact O-N 2.88Å; K736-D740 WeakPolarHBondContact CG-OD2 3.37Å; K736-D740 VanDerWaalsContact O-CG 3.29Å; K736-D740 PolarHBondContact O-N 3.37Å
737	Q	85.8	Confident	85.6	Confident	108 Å²	108	78.9 Å²	78.9	51%	0.505	37%	0.372	S	S	.	.	H	α-helix	trans	-55.2	-45.8	177.4	-177	179.5	-11.4	0	0	112.1	K733 R739 D740 E741	K733-Q737 WeakPolarHBondContact O-CB 3.44Å; K733-Q737 PolarHBondContact O-N 2.65Å; Q737-R739 VanDerWaalsContact C-N 3.29Å; Q737-R739 PolarHBondContact O-N 3.49Å; Q737-D740 PolarHBondContact O-N 3.13Å; Q737-E741 PolarHBondContact NE2-OE1 2.97Å; Q737-E741 WeakPolarHBondContact O-CG 3.41Å; Q737-E741 PolarHBondContact O-N 2.84Å
738	K	86.6	Confident	86.3	Confident	152 Å²	152	78.8 Å²	78.8	66%	0.661	38%	0.378	S	S	*	.	H	α-helix	trans	-62.5	-34.4	177.6	-171.1	174.8	-176.9	177.7	0	112.9	N734 L735 K736 N742	N734-K738 WeakPolarHBondContact O-CB 3.39Å; N734-K738 PolarHBondContact O-N 3.48Å; L735-K738 PolarHBondContact O-N 3.17Å; K736-K738 VanDerWaalsContact C-N 3.31Å; K736-K738 PolarHBondContact O-N 3.33Å; K738-N742 WeakPolarHBondContact O-CB 3.14Å; K738-N742 PolarHBondContact O-N 3.33Å; K738-N742 VanDerWaalsContact O-N 3.14Å
739	R	84.3	Confident	87	Confident	101 Å²	101	79.6 Å²	79.6	38%	0.381	38%	0.383	S	S	.	.	H	α-helix	trans	-70.2	-40.5	174.5	-76.3	179.9	61.5	135.6	-2	111.6	N285 L735 K736 Q737 N742 Y743	N285-R739 PolarHBondContact O-NH2 3.08Å; N285-R739 VanDerWaalsContact O-NH2 3.14Å; L735-R739 WeakPolarHBondContact O-CG 3.49Å; L735-R739 PolarHBondContact O-N 3.43Å; L735-R739 VanDerWaalsContact O-N 3.07Å; K736-R739 WeakPolarHBondContact O-CA 3.17Å; K736-R739 WeakPolarHBondContact O-CB 3.46Å; K736-R739 PolarHBondContact O-N 2.88Å; Q737-R739 VanDerWaalsContact C-N 3.29Å; Q737-R739 PolarHBondContact O-N 3.49Å; R739-N742 PolarHBondContact O-N 2.96Å; R739-Y743 WeakPolarHBondContact O-CB 3.49Å; R739-Y743 PolarHBondContact O-N 3.47Å
740	D	86.9	Confident	87.7	Confident	46 Å²	46	76.3 Å²	76.3	25%	0.246	37%	0.366	C	S	.	.	H	α-helix	trans	-67.6	-43.1	179.8	-62.1	-19.8	0	0	0	110.6	H286 K736 Q737 N742 Y743 Q744	H286-D740 IonicContact CE1-OD1 2.64Å; H286-D740 PolarHBondContact CE1-OD1 3.48Å; H286-D740 IonicContact ND1-OD1 2.92Å; K736-D740 WeakPolarHBondContact CG-OD2 3.37Å; K736-D740 VanDerWaalsContact O-CG 3.29Å; K736-D740 PolarHBondContact O-N 3.37Å; Q737-D740 PolarHBondContact O-N 3.13Å; D740-N742 VanDerWaalsContact C-N 3.32Å; D740-N742 PolarHBondContact O-N 2.92Å; D740-Y743 WeakPolarHBondContact O-CB 3.32Å; D740-Y743 PolarHBondContact O-N 3.34Å; D740-Q744 WeakPolarHBondContact O-CG 3.31Å; D740-Q744 PolarHBondContact O-N 3.05Å
741	E	90.3	Very high	88.2	Confident	81 Å²	81	71 Å²	71	38%	0.379	34%	0.344	S	S	.	.	H	α-helix	trans	-60.4	-40.1	172.2	-72.6	174.3	-165.9	0	0	112.2	Q737 K745	Q737-E741 PolarHBondContact NE2-OE1 2.97Å; Q737-E741 WeakPolarHBondContact O-CG 3.41Å; Q737-E741 PolarHBondContact O-N 2.84Å; E741-K745 VanDerWaalsContact O-CG 3.31Å; E741-K745 WeakPolarHBondContact O-CG 3.17Å; E741-K745 PolarHBondContact O-N 3.28Å; E741-K745 VanDerWaalsContact O-N 3.09Å
742	N	90.4	Very high	88.7	Confident	77 Å²	77	71.6 Å²	71.6	41%	0.412	35%	0.347	S	S	.	.	H	α-helix	trans	-68.1	-39.7	176.5	-169.9	33.8	0	0	0	111.7	K738 R739 D740 K745 I746	K738-N742 WeakPolarHBondContact O-CB 3.14Å; K738-N742 PolarHBondContact O-N 3.33Å; K738-N742 VanDerWaalsContact O-N 3.14Å; R739-N742 PolarHBondContact O-N 2.96Å; D740-N742 VanDerWaalsContact C-N 3.32Å; D740-N742 PolarHBondContact O-N 2.92Å; N742-K745 PolarHBondContact O-N 3.33Å; N742-I746 WeakPolarHBondContact O-CG1 3.33Å; N742-I746 PolarHBondContact O-N 3.01Å; N742-I746 VanDerWaalsContact O-N 3.11Å
743	Y	90.6	Very high	89.5	Confident	6 Å²	6	71.5 Å²	71.5	2%	0.024	35%	0.346	C	S	.	.	H	α-helix	trans	-62.2	-47.7	175.2	176.4	-96.4	0	0	0	111.3	D230 V282 I283 H286 R739 D740 K745 I746 M747	D230-Y743 VanDerWaalsContact CG-OH 3.26Å; D230-Y743 PolarHBondContact OD1-OH 2.98Å; D230-Y743 PolarHBondContact OD2-OH 3.34Å; V282-Y743 HydrophobicContact CG1-CD2 4.19Å; I283-Y743 HydrophobicContact CG1-CE2 4.47Å; H286-Y743 HydrophobicContact CB-CD2 3.59Å; H286-Y743 HydrophobicContact CB-CE2 3.6Å; H286-Y743 HydrophobicContact CB-CG 4.29Å; H286-Y743 AromaticContact CD2-CD1 3.71Å; H286-Y743 AromaticContact CD2-CD2 3.83Å; H286-Y743 AromaticContact CD2-CE1 3.49Å; H286-Y743 VanDerWaalsContact CD2-CE1 3.49Å; H286-Y743 WeakPolarHBondContact CD2-CE1 3.22Å; H286-Y743 AromaticContact CD2-CE2 3.62Å; H286-Y743 AromaticContact CD2-CG 3.87Å; H286-Y743 AromaticContact CD2-CZ 3.43Å; H286-Y743 VanDerWaalsContact CD2-CZ 3.43Å; H286-Y743 AromaticContact CE1-CD1 3.9Å; H286-Y743 AromaticContact CE1-CG 3.97Å; H286-Y743 AromaticContact CG-CD2 3.52Å; H286-Y743 AromaticContact CG-CE2 3.65Å; H286-Y743 AromaticContact CG-CG 3.73Å; H286-Y743 AromaticContact CG-CZ 3.97Å; H286-Y743 AromaticContact ND1-CD2 3.99Å; H286-Y743 AromaticContact ND1-CG 3.77Å; H286-Y743 AromaticContact NE2-CD1 3.66Å; H286-Y743 AromaticContact NE2-CE1 3.7Å; R739-Y743 WeakPolarHBondContact O-CB 3.49Å; R739-Y743 PolarHBondContact O-N 3.47Å; D740-Y743 WeakPolarHBondContact O-CB 3.32Å; D740-Y743 PolarHBondContact O-N 3.34Å; Y743-K745 PolarHBondContact O-N 3.27Å; Y743-I746 PolarHBondContact O-N 3.33Å; Y743-I746 VanDerWaalsContact O-N 3.17Å; Y743-M747 HydrophobicContact CE1-CE 3.99Å; Y743-M747 HydrophobicContact CE2-CE 4.09Å; Y743-M747 VanDerWaalsContact CZ-CE 3.45Å; Y743-M747 WeakPolarHBondContact O-CB 3.44Å; Y743-M747 PolarHBondContact O-N 3.13Å; Y743-M747 WeakPolarHBondContact OH-CE 3.43Å
744	Q	92	Very high	90	Very high	89 Å²	89	66.8 Å²	66.8	42%	0.416	33%	0.325	S	S	.	.	H	α-helix	trans	-59.4	-44	177.2	-74.8	179.5	-19.2	0	0	112	D740 I746 M747 C748	D740-Q744 WeakPolarHBondContact O-CG 3.31Å; D740-Q744 PolarHBondContact O-N 3.05Å; Q744-I746 VanDerWaalsContact C-N 3.33Å; Q744-I746 PolarHBondContact O-N 3.22Å; Q744-M747 PolarHBondContact O-N 3.35Å; Q744-M747 VanDerWaalsContact O-N 3.16Å; Q744-C748 PolarHBondContact O-N 3.41Å; Q744-C748 PolarHBondContact O-SG 3.31Å; Q744-C748 VanDerWaalsContact O-SG 3.32Å
745	K	92.6	Very high	90.3	Very high	137 Å²	137	62.8 Å²	62.8	60%	0.596	30%	0.304	S	S	*	.	H	α-helix	trans	-57.3	-45.8	175	-74.7	170.6	-176.2	171.9	0	112	E741 N742 Y743 M747 C749	E741-K745 VanDerWaalsContact O-CG 3.31Å; E741-K745 WeakPolarHBondContact O-CG 3.17Å; E741-K745 PolarHBondContact O-N 3.28Å; E741-K745 VanDerWaalsContact O-N 3.09Å; N742-K745 PolarHBondContact O-N 3.33Å; Y743-K745 PolarHBondContact O-N 3.27Å; K745-M747 VanDerWaalsContact C-N 3.34Å; K745-C749 PolarHBondContact O-N 3.02Å; K745-C749 VanDerWaalsContact O-N 3.16Å; K745-C749 PolarHBondContact O-SG 2.95Å
746	I	93.2	Very high	90.7	Very high	20 Å²	20	62 Å²	62	10%	0.103	30%	0.302	C	S	.	.	H	α-helix	trans	-65	-41	177.7	-68.8	165.2	0	0	0	110.4	E279 V282 I283 N742 Y743 Q744 C749 L750	E279-I746 HydrophobicContact CB-CG2 4.13Å; E279-I746 HydrophobicContact CG-CG2 4.25Å; V282-I746 HydrophobicContact CB-CD1 3.74Å; V282-I746 HydrophobicContact CG1-CD1 3.75Å; V282-I746 HydrophobicContact CG2-CD1 3.91Å; I283-I746 HydrophobicContact CD1-CG2 4.31Å; I283-I746 HydrophobicContact CG1-CG2 4.28Å; N742-I746 WeakPolarHBondContact O-CG1 3.33Å; N742-I746 PolarHBondContact O-N 3.01Å; N742-I746 VanDerWaalsContact O-N 3.11Å; Y743-I746 PolarHBondContact O-N 3.33Å; Y743-I746 VanDerWaalsContact O-N 3.17Å; Q744-I746 VanDerWaalsContact C-N 3.33Å; Q744-I746 PolarHBondContact O-N 3.22Å; I746-C749 WeakPolarHBondContact O-CB 3.49Å; I746-C749 PolarHBondContact O-N 2.95Å; I746-L750 HydrophobicContact CG2-CD1 3.74Å; I746-L750 HydrophobicContact CG2-CG 4.37Å; I746-L750 WeakPolarHBondContact O-CG 3.45Å; I746-L750 PolarHBondContact O-N 3.35Å
747	M	92.7	Very high	91.1	Very high	7 Å²	7	61.6 Å²	61.6	3%	0.034	30%	0.303	C	S	.	.	H	α-helix	trans	-62.9	-46.2	178.3	-168.1	57.2	72.7	0	0	112	P231 I232 L270 Y743 Q744 K745 C749 L750 V751	P231-M747 HydrophobicContact CG-CE 4.28Å; P231-M747 HydrophobicContact CG-CG 3.99Å; P231-M747 HydrophobicContact CG-SD 3.56Å; P231-M747 VanDerWaalsContact CG-SD 3.56Å; I232-M747 HydrophobicContact CD1-CE 3.81Å; I232-M747 HydrophobicContact CG1-CE 4.06Å; L270-M747 HydrophobicContact CD2-SD 4.03Å; Y743-M747 HydrophobicContact CE1-CE 3.99Å; Y743-M747 HydrophobicContact CE2-CE 4.09Å; Y743-M747 VanDerWaalsContact CZ-CE 3.45Å; Y743-M747 WeakPolarHBondContact O-CB 3.44Å; Y743-M747 PolarHBondContact O-N 3.13Å; Y743-M747 WeakPolarHBondContact OH-CE 3.43Å; Q744-M747 PolarHBondContact O-N 3.35Å; Q744-M747 VanDerWaalsContact O-N 3.16Å; K745-M747 VanDerWaalsContact C-N 3.34Å; M747-C749 VanDerWaalsContact C-N 3.28Å; M747-C749 PolarHBondContact O-N 2.99Å; M747-L750 WeakPolarHBondContact O-CB 3.43Å; M747-L750 PolarHBondContact O-N 3.38Å; M747-L750 VanDerWaalsContact O-N 3.1Å; M747-L750 HydrophobicContact SD-CD1 4.49Å; M747-V751 HydrophobicContact CG-CG2 4.4Å; M747-V751 WeakPolarHBondContact O-CG2 2.93Å; M747-V751 PolarHBondContact O-N 2.64Å; M747-V751 HydrophobicContact SD-CG2 4.43Å
748	C	92.8	Very high	91.1	Very high	89 Å²	89	58.6 Å²	58.6	60%	0.601	29%	0.293	S	S	*	.	H	α-helix	trans	-57.9	-41.6	174.5	-65.4	0	0	0	0	111.8	Q744 H752	Q744-C748 PolarHBondContact O-N 3.41Å; Q744-C748 PolarHBondContact O-SG 3.31Å; Q744-C748 VanDerWaalsContact O-SG 3.32Å; C748-H752 WeakPolarHBondContact O-CB 3.22Å; C748-H752 PolarHBondContact O-N 2.99Å
749	C	93.3	Very high	91	Very high	61 Å²	61	56.9 Å²	56.9	41%	0.412	28%	0.282	S	S	.	.	H	α-helix	trans	-64.6	-39.9	176.5	-65.6	0	0	0	0	112	K745 I746 M747 R753	K745-C749 PolarHBondContact O-N 3.02Å; K745-C749 VanDerWaalsContact O-N 3.16Å; K745-C749 PolarHBondContact O-SG 2.95Å; I746-C749 WeakPolarHBondContact O-CB 3.49Å; I746-C749 PolarHBondContact O-N 2.95Å; M747-C749 VanDerWaalsContact C-N 3.28Å; M747-C749 PolarHBondContact O-N 2.99Å; C749-R753 WeakPolarHBondContact O-CB 3.39Å; C749-R753 VanDerWaalsContact O-CG 3.22Å; C749-R753 WeakPolarHBondContact O-CG 3.42Å; C749-R753 PolarHBondContact O-N 3.2Å
750	L	93.5	Very high	91	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-67.2	-46.6	177.8	-75.5	160.7	0	0	0	112.1	L270 Q273 A274 I283 I746 M747 H752 R753 Y754	L270-L750 HydrophobicContact CD1-CB 4.14Å; Q273-L750 VanDerWaalsContact C-CD2 3.47Å; Q273-L750 HydrophobicContact CB-CD2 3.83Å; A274-L750 HydrophobicContact CB-CD2 4.06Å; A274-L750 VanDerWaalsContact N-CD2 3.35Å; I283-L750 HydrophobicContact CD1-CD1 3.45Å; I283-L750 VanDerWaalsContact CD1-CD1 3.45Å; I283-L750 HydrophobicContact CG1-CD1 4.19Å; I746-L750 HydrophobicContact CG2-CD1 3.74Å; I746-L750 HydrophobicContact CG2-CG 4.37Å; I746-L750 WeakPolarHBondContact O-CG 3.45Å; I746-L750 PolarHBondContact O-N 3.35Å; M747-L750 WeakPolarHBondContact O-CB 3.43Å; M747-L750 PolarHBondContact O-N 3.38Å; M747-L750 VanDerWaalsContact O-N 3.1Å; M747-L750 HydrophobicContact SD-CD1 4.49Å; L750-H752 VanDerWaalsContact C-N 3.32Å; L750-H752 PolarHBondContact O-N 3.19Å; L750-R753 PolarHBondContact O-N 3.2Å; L750-Y754 VanDerWaalsContact O-CB 3.31Å; L750-Y754 WeakPolarHBondContact O-CB 3.5Å; L750-Y754 PolarHBondContact O-N 2.69Å
751	V	93.8	Very high	90.8	Very high	20 Å²	20	60.7 Å²	60.7	12%	0.121	30%	0.301	C	S	.	.	H	α-helix	trans	-59.4	-45.5	176.8	168.4	0	0	0	0	110	M225 P231 L270 M747 R753 Y754 L755	M225-V751 HydrophobicContact CB-CG1 4.06Å; M225-V751 HydrophobicContact CG-CG1 4.13Å; M225-V751 HydrophobicContact CG-CG2 4.33Å; M225-V751 HydrophobicContact SD-CG1 3.85Å; P231-V751 HydrophobicContact CG-CG2 4.41Å; L270-V751 HydrophobicContact CD1-CG2 4.28Å; M747-V751 HydrophobicContact CG-CG2 4.4Å; M747-V751 WeakPolarHBondContact O-CG2 2.93Å; M747-V751 PolarHBondContact O-N 2.64Å; M747-V751 HydrophobicContact SD-CG2 4.43Å; V751-R753 PolarHBondContact O-N 3.26Å; V751-Y754 WeakPolarHBondContact O-CB 2.77Å; V751-Y754 PolarHBondContact O-N 3.43Å; V751-L755 HydrophobicContact CG1-CD1 4.04Å; V751-L755 WeakPolarHBondContact O-CG 2.97Å; V751-L755 PolarHBondContact O-N 3.27Å
752	H	92.8	Very high	90.1	Very high	124 Å²	124	61.8 Å²	61.8	57%	0.574	31%	0.308	S	S	*	.	H	α-helix	trans	-60.9	-46.8	176.2	-173.3	73.1	0	0	0	112.1	C748 L750 Y754 L755 T756	C748-H752 WeakPolarHBondContact O-CB 3.22Å; C748-H752 PolarHBondContact O-N 2.99Å; L750-H752 VanDerWaalsContact C-N 3.32Å; L750-H752 PolarHBondContact O-N 3.19Å; H752-Y754 VanDerWaalsContact C-N 3.34Å; H752-Y754 PolarHBondContact O-N 3.02Å; H752-L755 PolarHBondContact O-N 2.75Å; H752-T756 WeakPolarHBondContact O-CG2 3.11Å; H752-T756 PolarHBondContact O-N 3.4Å; H752-T756 PolarHBondContact O-OG1 3.42Å
753	R	94.7	Very high	89.3	Confident	52 Å²	52	65.2 Å²	65.2	20%	0.196	32%	0.321	C	S	.	.	H	α-helix	trans	-61.4	-41.8	175.6	-71.8	172.6	-166.3	167.7	9.9	111.8	Q273 E279 C749 L750 V751 T756 S757	Q273-R753 HydrophobicContact CB-CB 4.08Å; Q273-R753 HydrophobicContact CG-CB 4.48Å; Q273-R753 PolarHBondContact O-NH1 3.4Å; E279-R753 IonicContact OE1-CZ 3.5Å; E279-R753 IonicContact OE1-NH1 3Å; E279-R753 PolarHBondContact OE1-NH1 3.3Å; E279-R753 VanDerWaalsContact OE1-NH1 3.16Å; E279-R753 IonicContact OE1-NH2 3.56Å; E279-R753 PolarHBondContact OE1-NH2 3.1Å; E279-R753 IonicContact OE2-CZ 3.15Å; E279-R753 IonicContact OE2-NH1 2.89Å; E279-R753 PolarHBondContact OE2-NH1 3.08Å; C749-R753 WeakPolarHBondContact O-CB 3.39Å; C749-R753 VanDerWaalsContact O-CG 3.22Å; C749-R753 WeakPolarHBondContact O-CG 3.42Å; C749-R753 PolarHBondContact O-N 3.2Å; L750-R753 PolarHBondContact O-N 3.2Å; V751-R753 PolarHBondContact O-N 3.26Å; R753-T756 WeakPolarHBondContact CA-OG1 3.3Å; R753-T756 PolarHBondContact O-N 3.4Å; R753-T756 PolarHBondContact O-OG1 3.35Å; R753-S757 WeakPolarHBondContact O-CB 3.45Å; R753-S757 PolarHBondContact O-N 3.11Å
754	Y	94	Very high	88.3	Confident	20 Å²	20	69.5 Å²	69.5	8%	0.078	35%	0.352	C	S	.	.	H	α-helix	trans	-59.7	-50.4	176.4	177.5	-93.9	0	0	0	111	M225 F266 D269 L270 Q273 L750 V751 H752 T756 S757 T758	M225-Y754 HydrophobicContact CE-CD1 3.84Å; M225-Y754 HydrophobicContact CE-CE1 3.72Å; M225-Y754 HydrophobicContact SD-CD1 3.42Å; M225-Y754 WeakPolarHBondContact SD-CD1 3.37Å; M225-Y754 HydrophobicContact SD-CE1 3.8Å; M225-Y754 HydrophobicContact SD-CG 4.41Å; F266-Y754 HydrophobicContact CD2-CE1 4.21Å; F266-Y754 HydrophobicContact CD2-CE2 4.36Å; F266-Y754 AromaticContact CD2-CZ 3.84Å; F266-Y754 HydrophobicContact CE2-CD1 4.46Å; F266-Y754 AromaticContact CE2-CE1 3.98Å; F266-Y754 HydrophobicContact CE2-CE1 3.98Å; D269-Y754 HydrophobicContact CB-CD2 4.48Å; D269-Y754 HydrophobicContact CB-CE2 3.84Å; L270-Y754 HydrophobicContact CD1-CG 4.21Å; Q273-Y754 HydrophobicContact CG-CD2 4.38Å; L750-Y754 VanDerWaalsContact O-CB 3.31Å; L750-Y754 WeakPolarHBondContact O-CB 3.5Å; L750-Y754 PolarHBondContact O-N 2.69Å; V751-Y754 WeakPolarHBondContact O-CB 2.77Å; V751-Y754 PolarHBondContact O-N 3.43Å; H752-Y754 VanDerWaalsContact C-N 3.34Å; H752-Y754 PolarHBondContact O-N 3.02Å; Y754-T756 PolarHBondContact O-N 2.86Å; Y754-S757 PolarHBondContact O-N 2.83Å; Y754-T758 WeakPolarHBondContact O-CB 3.3Å; Y754-T758 PolarHBondContact O-N 3.23Å; Y754-T758 PolarHBondContact O-OG1 3.17Å
755	L	91.9	Very high	86.9	Confident	20 Å²	20	72.4 Å²	72.4	11%	0.105	37%	0.367	C	S	.	.	H	α-helix	trans	-57.9	-47.1	177.4	-72.3	168.9	0	0	0	111.9	Y170 M225 V751 H752 S757 T758 R759	Y170-L755 HydrophobicContact CD1-CD1 4.48Å; Y170-L755 HydrophobicContact CD1-CD2 4.43Å; Y170-L755 HydrophobicContact CD2-CD1 4.02Å; Y170-L755 HydrophobicContact CD2-CD2 3.53Å; Y170-L755 HydrophobicContact CD2-CG 4.44Å; Y170-L755 HydrophobicContact CE1-CD1 4.09Å; Y170-L755 HydrophobicContact CE2-CD1 3.56Å; Y170-L755 HydrophobicContact CE2-CD2 3.96Å; Y170-L755 HydrophobicContact CE2-CG 4.4Å; Y170-L755 HydrophobicContact CG-CD1 4.45Å; Y170-L755 HydrophobicContact CG-CD2 3.79Å; M225-L755 HydrophobicContact CE-CD2 3.55Å; M225-L755 HydrophobicContact CE-CG 4.23Å; M225-L755 HydrophobicContact SD-CD2 4.25Å; M225-L755 HydrophobicContact SD-CG 4.29Å; V751-L755 HydrophobicContact CG1-CD1 4.04Å; V751-L755 WeakPolarHBondContact O-CG 2.97Å; V751-L755 PolarHBondContact O-N 3.27Å; H752-L755 PolarHBondContact O-N 2.75Å; L755-S757 VanDerWaalsContact C-N 3.34Å; L755-S757 PolarHBondContact O-N 3.25Å; L755-T758 PolarHBondContact O-N 3.21Å; L755-R759 WeakPolarHBondContact O-CB 3.3Å; L755-R759 VanDerWaalsContact O-CG 3.32Å; L755-R759 WeakPolarHBondContact O-CG 3.45Å; L755-R759 PolarHBondContact O-N 3.25Å
756	T	90.5	Very high	85.4	Confident	58 Å²	58	70.3 Å²	70.3	36%	0.356	36%	0.363	S	S	.	.	H	α-helix	trans	-62.3	-41.1	177.3	57.6	0	0	0	0	112.3	H752 R753 Y754 Q760	H752-T756 WeakPolarHBondContact O-CG2 3.11Å; H752-T756 PolarHBondContact O-N 3.4Å; H752-T756 PolarHBondContact O-OG1 3.42Å; R753-T756 WeakPolarHBondContact CA-OG1 3.3Å; R753-T756 PolarHBondContact O-N 3.4Å; R753-T756 PolarHBondContact O-OG1 3.35Å; Y754-T756 PolarHBondContact O-N 2.86Å; T756-Q760 WeakPolarHBondContact O-CG 3.27Å; T756-Q760 PolarHBondContact O-N 2.82Å; T756-Q760 VanDerWaalsContact O-N 3.08Å
757	S	89.8	Confident	83.9	Confident	24 Å²	24	77.3 Å²	77.3	17%	0.168	40%	0.395	C	S	.	.	H	α-helix	trans	-67.9	-40	177.9	-178.7	0	0	0	0	112.1	Q273 R753 Y754 L755 Q760 K761	Q273-S757 PolarHBondContact NE2-OG 3.11Å; R753-S757 WeakPolarHBondContact O-CB 3.45Å; R753-S757 PolarHBondContact O-N 3.11Å; Y754-S757 PolarHBondContact O-N 2.83Å; L755-S757 VanDerWaalsContact C-N 3.34Å; L755-S757 PolarHBondContact O-N 3.25Å; S757-Q760 PolarHBondContact O-N 3.49Å; S757-K761 WeakPolarHBondContact O-CG 3.33Å; S757-K761 PolarHBondContact O-N 2.85Å
758	T	86.5	Confident	82.5	Confident	46 Å²	46	81 Å²	81	28%	0.282	43%	0.427	S	S	.	.	H	α-helix	trans	-68.4	-40.9	178.7	-60	0	0	0	0	111.3	Y754 L755 Q760 K761 M762	Y754-T758 WeakPolarHBondContact O-CB 3.3Å; Y754-T758 PolarHBondContact O-N 3.23Å; Y754-T758 PolarHBondContact O-OG1 3.17Å; L755-T758 PolarHBondContact O-N 3.21Å; T758-Q760 PolarHBondContact O-N 2.9Å; T758-K761 PolarHBondContact O-N 2.96Å; T758-M762 PolarHBondContact O-N 3.46Å
759	R	84.8	Confident	81.4	Confident	115 Å²	115	79.6 Å²	79.6	43%	0.434	42%	0.415	S	S	.	.	H	α-helix	trans	-58.8	-47	172.2	-74.1	176.1	-177.8	-158.3	-8	112	E171 L755 K761 M762 Q763	E171-R759 IonicContact OE1-CZ 2.97Å; E171-R759 IonicContact OE1-NH1 2.64Å; E171-R759 PolarHBondContact OE1-NH1 3Å; E171-R759 IonicContact OE1-NH2 3.78Å; E171-R759 PolarHBondContact OE1-NH2 2.88Å; L755-R759 WeakPolarHBondContact O-CB 3.3Å; L755-R759 VanDerWaalsContact O-CG 3.32Å; L755-R759 WeakPolarHBondContact O-CG 3.45Å; L755-R759 PolarHBondContact O-N 3.25Å; R759-K761 VanDerWaalsContact C-N 3.32Å; R759-K761 PolarHBondContact O-N 3.42Å; R759-M762 PolarHBondContact O-N 3.23Å; R759-Q763 WeakPolarHBondContact O-CG 3.42Å; R759-Q763 PolarHBondContact O-N 3.21Å
760	Q	83.9	Confident	80.4	Confident	127 Å²	127	81.7 Å²	81.7	59%	0.593	43%	0.426	S	S	*	.	H	α-helix	trans	-61.6	-40	176.5	-74.7	175.9	-10.9	0	0	112.3	T756 S757 T758 S764	T756-Q760 WeakPolarHBondContact O-CG 3.27Å; T756-Q760 PolarHBondContact O-N 2.82Å; T756-Q760 VanDerWaalsContact O-N 3.08Å; S757-Q760 PolarHBondContact O-N 3.49Å; T758-Q760 PolarHBondContact O-N 2.9Å; Q760-S764 WeakPolarHBondContact O-CB 3.5Å; Q760-S764 PolarHBondContact O-N 2.93Å; Q760-S764 PolarHBondContact O-OG 2.89Å
761	K	82.6	Confident	79.2	Confident	101 Å²	101	88.1 Å²	88.1	44%	0.439	46%	0.456	S	S	.	.	H	α-helix	trans	-63.2	-45.6	176.5	-77.6	176.7	-177.5	178.5	0	111.7	S757 T758 R759 S764 M765	S757-K761 WeakPolarHBondContact O-CG 3.33Å; S757-K761 PolarHBondContact O-N 2.85Å; T758-K761 PolarHBondContact O-N 2.96Å; R759-K761 VanDerWaalsContact C-N 3.32Å; R759-K761 PolarHBondContact O-N 3.42Å; K761-S764 WeakPolarHBondContact CA-OG 3.25Å; K761-S764 PolarHBondContact O-N 3.4Å; K761-S764 VanDerWaalsContact O-N 3.15Å; K761-S764 PolarHBondContact O-OG 2.66Å; K761-M765 WeakPolarHBondContact O-CB 3.35Å; K761-M765 PolarHBondContact O-N 2.91Å
762	M	75.9	Confident	78.3	Confident	104 Å²	104	90.9 Å²	90.9	51%	0.512	47%	0.47	S	S	.	.	H	α-helix	trans	-57.3	-52.5	177.2	-165.7	163.7	177.6	0	0	110.3	T758 R759 S764 M765 D766	T758-M762 PolarHBondContact O-N 3.46Å; R759-M762 PolarHBondContact O-N 3.23Å; M762-S764 PolarHBondContact O-N 3.45Å; M762-S764 VanDerWaalsContact O-N 3.13Å; M762-M765 PolarHBondContact O-N 3.4Å; M762-M765 VanDerWaalsContact O-N 3.11Å; M762-D766 VanDerWaalsContact O-CG 3.22Å; M762-D766 PolarHBondContact O-N 3.01Å
763	Q	73.8	Confident	77.7	Confident	149 Å²	149	90.1 Å²	90.1	70%	0.696	47%	0.47	S	S	*	.	H	α-helix	trans	-57.6	-31.4	175.7	-69.9	175.2	-15.3	0	0	114.4	R759	R759-Q763 WeakPolarHBondContact O-CG 3.42Å; R759-Q763 PolarHBondContact O-N 3.21Å
764	S	69.3	Low	76.8	Confident	95 Å²	95	91.4 Å²	91.4	66%	0.664	48%	0.48	S	S	*	.	H	α-helix	trans	-85.9	-25.1	179.4	70.8	0	0	0	0	114.4	Q760 K761 M762	Q760-S764 WeakPolarHBondContact O-CB 3.5Å; Q760-S764 PolarHBondContact O-N 2.93Å; Q760-S764 PolarHBondContact O-OG 2.89Å; K761-S764 WeakPolarHBondContact CA-OG 3.25Å; K761-S764 PolarHBondContact O-N 3.4Å; K761-S764 VanDerWaalsContact O-N 3.15Å; K761-S764 PolarHBondContact O-OG 2.66Å; M762-S764 PolarHBondContact O-N 3.45Å; M762-S764 VanDerWaalsContact O-N 3.13Å
765	M	62.6	Low	76	Confident	151 Å²	151	92.4 Å²	92.4	74%	0.744	49%	0.487	S	S	*	.	H	α-helix	trans	-89.9	-23.8	-179.7	-93.6	176.9	52.2	0	0	112.4	K761 M762 Q767	K761-M765 WeakPolarHBondContact O-CB 3.35Å; K761-M765 PolarHBondContact O-N 2.91Å; M762-M765 PolarHBondContact O-N 3.4Å; M762-M765 VanDerWaalsContact O-N 3.11Å; M765-Q767 VanDerWaalsContact C-N 3.32Å; M765-Q767 PolarHBondContact O-N 2.88Å
766	D	61.8	Low	75.5	Confident	93 Å²	93	96.3 Å²	96.3	50%	0.497	51%	0.507	S	S	.	.			trans	-63.7	94.7	175.1	-71.4	-18.4	0	0	0	109.3	M762	M762-D766 VanDerWaalsContact O-CG 3.22Å; M762-D766 PolarHBondContact O-N 3.01Å
767	Q	60.4	Low	75.2	Confident	167 Å²	167	102.3 Å²	102.3	78%	0.78	52%	0.523	S	S	*	.			trans	-61.6	135.3	158.5	-66.4	-179.2	-4.3	0	0	106.6	M765 T769	M765-Q767 VanDerWaalsContact C-N 3.32Å; M765-Q767 PolarHBondContact O-N 2.88Å; Q767-T769 WeakPolarHBondContact O-CG2 3.46Å; Q767-T769 PolarHBondContact O-N 3.39Å
768	A	64.9	Low	74.8	Confident	85 Å²	85	101.9 Å²	101.9	70%	0.702	52%	0.519	S	S	*	.			trans	-52.8	107.5	177.8	0	0	0	0	0	109.7
769	T	68.7	Low	74.5	Confident	58 Å²	58	104.6 Å²	104.6	36%	0.356	53%	0.532	S	S	.	.			trans	-78.2	163.2	179	55.2	0	0	0	0	109.6	Q767 E771 N772 L773	Q767-T769 WeakPolarHBondContact O-CG2 3.46Å; Q767-T769 PolarHBondContact O-N 3.39Å; T769-E771 PolarHBondContact O-N 3.4Å; T769-N772 PolarHBondContact O-N 3.43Å; T769-N772 VanDerWaalsContact OG1-CG 3.26Å; T769-N772 PolarHBondContact OG1-N 3.27Å; T769-N772 PolarHBondContact OG1-OD1 3.04Å; T769-L773 PolarHBondContact O-N 2.87Å
770	V	72.8	Confident	74.6	Confident	105 Å²	105	104.2 Å²	104.2	64%	0.636	54%	0.538	S	S	*	.	H	α-helix	trans	-62.6	-30	173.1	177.6	0	0	0	0	110.9	L773 N774	V770-L773 PolarHBondContact O-N 2.97Å; V770-N774 VanDerWaalsContact O-CG 3.32Å; V770-N774 PolarHBondContact O-N 3.23Å; V770-N774 PolarHBondContact O-ND2 3.15Å
771	E	68.4	Low	74.4	Confident	137 Å²	137	99 Å²	99	64%	0.64	52%	0.515	S	S	*	.	H	α-helix	trans	-61.1	-52.9	174.8	-69.3	165	179.9	0	0	111	T769 L773 N774 D775	T769-E771 PolarHBondContact O-N 3.4Å; E771-L773 PolarHBondContact O-N 3.49Å; E771-N774 CarbonylContact O-C 3.57Å; E771-N774 WeakPolarHBondContact O-CA 3.23Å; E771-N774 WeakPolarHBondContact O-CB 3.42Å; E771-N774 PolarHBondContact O-N 3.44Å; E771-D775 VanDerWaalsContact O-CG 3.24Å; E771-D775 PolarHBondContact O-N 2.84Å
772	N	73.6	Confident	74.3	Confident	77 Å²	77	96.2 Å²	96.2	41%	0.412	50%	0.503	S	S	.	.	H	α-helix	trans	-57	-31.7	177	-62.7	-5.5	0	0	0	113.2	T769 L776	T769-N772 PolarHBondContact O-N 3.43Å; T769-N772 VanDerWaalsContact OG1-CG 3.26Å; T769-N772 PolarHBondContact OG1-N 3.27Å; T769-N772 PolarHBondContact OG1-OD1 3.04Å; N772-L776 WeakPolarHBondContact O-CB 3.4Å; N772-L776 PolarHBondContact O-N 2.71Å; N772-L776 VanDerWaalsContact O-N 3.15Å
773	L	80.6	Confident	74.7	Confident	109 Å²	109	97 Å²	97	57%	0.571	50%	0.504	S	S	*	.	H	α-helix	trans	-74.7	-35.2	173.9	-72.3	176.1	0	0	0	112.6	T769 V770 E771 R777	T769-L773 PolarHBondContact O-N 2.87Å; V770-L773 PolarHBondContact O-N 2.97Å; E771-L773 PolarHBondContact O-N 3.49Å; L773-R777 VanDerWaalsContact O-CB 3.3Å; L773-R777 WeakPolarHBondContact O-CB 2.96Å; L773-R777 PolarHBondContact O-N 3.06Å
774	N	76.5	Confident	75.2	Confident	78 Å²	78	97.3 Å²	97.3	42%	0.417	50%	0.499	S	S	.	.	H	α-helix	trans	-66.9	-41.8	173.6	-72.9	-25.6	0	0	0	110.7	V770 E771 L776 R777 Q778	V770-N774 VanDerWaalsContact O-CG 3.32Å; V770-N774 PolarHBondContact O-N 3.23Å; V770-N774 PolarHBondContact O-ND2 3.15Å; E771-N774 CarbonylContact O-C 3.57Å; E771-N774 WeakPolarHBondContact O-CA 3.23Å; E771-N774 WeakPolarHBondContact O-CB 3.42Å; E771-N774 PolarHBondContact O-N 3.44Å; N774-L776 PolarHBondContact O-N 3.41Å; N774-R777 WeakPolarHBondContact O-CB 3.08Å; N774-R777 PolarHBondContact O-N 2.97Å; N774-Q778 VanDerWaalsContact O-CB 3.31Å; N774-Q778 WeakPolarHBondContact O-CB 3.44Å; N774-Q778 PolarHBondContact O-N 3.43Å
775	D	76.1	Confident	75.6	Confident	41 Å²	41	93.5 Å²	93.5	22%	0.219	47%	0.471	C	S	.	.	H	α-helix	trans	-60	-47.9	175.4	-55.8	-23	0	0	0	110.1	E771 R777 Q778 D779	E771-D775 VanDerWaalsContact O-CG 3.24Å; E771-D775 PolarHBondContact O-N 2.84Å; D775-R777 PolarHBondContact O-N 3.19Å; D775-Q778 CarbonylContact O-C 3.6Å; D775-Q778 WeakPolarHBondContact O-CA 3.29Å; D775-Q778 WeakPolarHBondContact O-CB 3.45Å; D775-Q778 PolarHBondContact O-N 3.03Å; D775-D779 PolarHBondContact O-N 2.58Å
776	L	82.3	Confident	76.4	Confident	102 Å²	102	90.3 Å²	90.3	53%	0.534	45%	0.454	S	S	.	.	H	α-helix	trans	-63	-40.4	176.8	-167.4	149.9	0	0	0	112.3	N772 N774 Q778 L780	N772-L776 WeakPolarHBondContact O-CB 3.4Å; N772-L776 PolarHBondContact O-N 2.71Å; N772-L776 VanDerWaalsContact O-N 3.15Å; N774-L776 PolarHBondContact O-N 3.41Å; L776-Q778 PolarHBondContact O-N 3.08Å; L776-L780 HydrophobicContact CD2-CD1 3.66Å; L776-L780 HydrophobicContact CD2-CG 4.28Å; L776-L780 WeakPolarHBondContact O-CB 3.5Å; L776-L780 WeakPolarHBondContact O-CG 3.09Å; L776-L780 PolarHBondContact O-N 3.3Å
777	R	84.3	Confident	77.4	Confident	184 Å²	184	89.4 Å²	89.4	69%	0.694	45%	0.448	S	S	*	.	H	α-helix	trans	-62	-36.7	174.2	176.9	-177	176.5	-175.8	-1.5	110.9	L773 N774 D775 S781	L773-R777 VanDerWaalsContact O-CB 3.3Å; L773-R777 WeakPolarHBondContact O-CB 2.96Å; L773-R777 PolarHBondContact O-N 3.06Å; N774-R777 WeakPolarHBondContact O-CB 3.08Å; N774-R777 PolarHBondContact O-N 2.97Å; D775-R777 PolarHBondContact O-N 3.19Å; R777-S781 WeakPolarHBondContact O-CB 3.3Å; R777-S781 PolarHBondContact O-N 2.9Å
778	Q	80.8	Confident	78.4	Confident	15 Å²	15	85.9 Å²	85.9	7%	0.07	43%	0.428	C	S	.	.	H	α-helix	trans	-74.4	-43.8	-179.5	-173	161	25.5	0	0	111.9	E54 N92 N94 N774 D775 L776 L780 S781 K782	E54-Q778 PolarHBondContact O-NE2 3.44Å; N92-Q778 PolarHBondContact ND2-NE2 2.99Å; N92-Q778 PolarHBondContact O-OE1 3.33Å; N92-Q778 PolarHBondContact OD1-OE1 2.68Å; N92-Q778 VanDerWaalsContact OD1-OE1 3.1Å; N94-Q778 PolarHBondContact ND2-NE2 3.18Å; N774-Q778 VanDerWaalsContact O-CB 3.31Å; N774-Q778 WeakPolarHBondContact O-CB 3.44Å; N774-Q778 PolarHBondContact O-N 3.43Å; D775-Q778 CarbonylContact O-C 3.6Å; D775-Q778 WeakPolarHBondContact O-CA 3.29Å; D775-Q778 WeakPolarHBondContact O-CB 3.45Å; D775-Q778 PolarHBondContact O-N 3.03Å; L776-Q778 PolarHBondContact O-N 3.08Å; Q778-L780 VanDerWaalsContact C-N 3.26Å; Q778-L780 PolarHBondContact O-N 2.98Å; Q778-S781 CarbonylContact O-C 3.51Å; Q778-S781 WeakPolarHBondContact O-CA 3.2Å; Q778-S781 WeakPolarHBondContact O-CB 3.47Å; Q778-S781 PolarHBondContact O-N 3.42Å; Q778-K782 WeakPolarHBondContact O-CB 3.43Å; Q778-K782 PolarHBondContact O-N 3.25Å
779	D	81.1	Confident	78.8	Confident	104 Å²	104	84.2 Å²	84.2	56%	0.556	41%	0.407	S	S	*	.	H	α-helix	trans	-56.3	-42.5	171.1	-81.6	-17.5	0	0	0	111.4	D775 S781 K782 F783	D775-D779 PolarHBondContact O-N 2.58Å; D779-S781 PolarHBondContact O-N 2.98Å; D779-K782 PolarHBondContact O-N 2.94Å; D779-F783 VanDerWaalsContact O-CB 3.26Å; D779-F783 WeakPolarHBondContact O-CB 3.38Å; D779-F783 PolarHBondContact O-N 2.89Å
780	L	85.6	Confident	79.3	Confident	106 Å²	106	88.4 Å²	88.4	56%	0.555	43%	0.426	S	S	*	.	H	α-helix	trans	-63.9	-38.9	172.7	-76.2	172.5	0	0	0	112.5	L776 Q778 R784	L776-L780 HydrophobicContact CD2-CD1 3.66Å; L776-L780 HydrophobicContact CD2-CG 4.28Å; L776-L780 WeakPolarHBondContact O-CB 3.5Å; L776-L780 WeakPolarHBondContact O-CG 3.09Å; L776-L780 PolarHBondContact O-N 3.3Å; Q778-L780 VanDerWaalsContact C-N 3.26Å; Q778-L780 PolarHBondContact O-N 2.98Å; L780-R784 WeakPolarHBondContact O-CB 3.44Å; L780-R784 PolarHBondContact O-N 2.97Å
781	S	81	Confident	79.5	Confident	17 Å²	17	88.4 Å²	88.4	12%	0.119	42%	0.422	C	S	.	.	H	α-helix	trans	-65.5	-44.4	176.1	-177.5	0	0	0	0	111.4	K55 R777 Q778 D779 R784 N785	K55-S781 PolarHBondContact O-OG 3.03Å; R777-S781 WeakPolarHBondContact O-CB 3.3Å; R777-S781 PolarHBondContact O-N 2.9Å; Q778-S781 CarbonylContact O-C 3.51Å; Q778-S781 WeakPolarHBondContact O-CA 3.2Å; Q778-S781 WeakPolarHBondContact O-CB 3.47Å; Q778-S781 PolarHBondContact O-N 3.42Å; D779-S781 PolarHBondContact O-N 2.98Å; S781-R784 PolarHBondContact O-N 3.11Å; S781-R784 PolarHBondContact OG-NH2 2.03Å; S781-N785 WeakPolarHBondContact O-CB 3.33Å; S781-N785 PolarHBondContact O-N 2.95Å; S781-N785 PolarHBondContact O-ND2 3.22Å; S781-N785 PolarHBondContact O-OD1 2.77Å
782	K	79.8	Confident	79.4	Confident	43 Å²	43	83.2 Å²	83.2	19%	0.187	41%	0.405	C	S	.	.	H	α-helix	trans	-60.6	-53.1	175.6	-177.2	-177.1	178	-176.3	0	110.5	D96 Q778 D779 R784 N785 E786	D96-K782 WeakPolarHBondContact OD2-CE 3.49Å; D96-K782 IonicContact OD2-NZ 3.97Å; D96-K782 PolarHBondContact OD2-NZ 3.35Å; Q778-K782 WeakPolarHBondContact O-CB 3.43Å; Q778-K782 PolarHBondContact O-N 3.25Å; D779-K782 PolarHBondContact O-N 2.94Å; K782-R784 VanDerWaalsContact C-N 3.31Å; K782-R784 PolarHBondContact O-N 3.46Å; K782-N785 PolarHBondContact O-N 3.33Å; K782-E786 VanDerWaalsContact CE-OE1 3.24Å; K782-E786 WeakPolarHBondContact CE-OE1 3.02Å; K782-E786 PolarHBondContact O-N 3.38Å
783	F	83.6	Confident	78.8	Confident	122 Å²	122	85.6 Å²	85.6	54%	0.535	41%	0.412	S	S	.	.	H	α-helix	trans	-55.7	-45.1	176.2	177.7	-105	0	0	0	111.9	D779 N785 E786 M787	D779-F783 VanDerWaalsContact O-CB 3.26Å; D779-F783 WeakPolarHBondContact O-CB 3.38Å; D779-F783 PolarHBondContact O-N 2.89Å; F783-N785 VanDerWaalsContact C-N 3.32Å; F783-N785 PolarHBondContact O-N 3.26Å; F783-E786 PolarHBondContact O-N 3.28Å; F783-M787 HydrophobicContact CD1-CG 4.3Å; F783-M787 HydrophobicContact CD2-CG 4.24Å; F783-M787 HydrophobicContact CE1-CG 3.88Å; F783-M787 HydrophobicContact CE2-CG 3.82Å; F783-M787 HydrophobicContact CE2-SD 4.14Å; F783-M787 HydrophobicContact CG-CG 4.47Å; F783-M787 HydrophobicContact CZ-CG 3.62Å; F783-M787 HydrophobicContact CZ-SD 4.05Å; F783-M787 WeakPolarHBondContact O-CB 3.31Å; F783-M787 VanDerWaalsContact O-CG 3.26Å; F783-M787 WeakPolarHBondContact O-CG 3.48Å; F783-M787 PolarHBondContact O-N 3.32Å
784	R	84.8	Confident	77.7	Confident	154 Å²	154	81.4 Å²	81.4	58%	0.581	39%	0.389	S	S	*	.	H	α-helix	trans	-59.7	-42.6	175.7	179.5	-172.6	65.7	-172.8	-7.9	111.8	L780 S781 K782 R788	L780-R784 WeakPolarHBondContact O-CB 3.44Å; L780-R784 PolarHBondContact O-N 2.97Å; S781-R784 PolarHBondContact O-N 3.11Å; S781-R784 PolarHBondContact OG-NH2 2.03Å; K782-R784 VanDerWaalsContact C-N 3.31Å; K782-R784 PolarHBondContact O-N 3.46Å; R784-R788 WeakPolarHBondContact O-CB 3.41Å; R784-R788 PolarHBondContact O-N 3.46Å
785	N	78.1	Confident	76.4	Confident	15 Å²	15	82.5 Å²	82.5	8%	0.08	40%	0.399	C	S	.	.	H	α-helix	trans	-68.8	-45.9	-179.1	-67.7	-22	0	0	0	111.1	S781 K782 F783 M787 R788 D789	S781-N785 WeakPolarHBondContact O-CB 3.33Å; S781-N785 PolarHBondContact O-N 2.95Å; S781-N785 PolarHBondContact O-ND2 3.22Å; S781-N785 PolarHBondContact O-OD1 2.77Å; K782-N785 PolarHBondContact O-N 3.33Å; F783-N785 VanDerWaalsContact C-N 3.32Å; F783-N785 PolarHBondContact O-N 3.26Å; N785-M787 PolarHBondContact O-N 3.49Å; N785-R788 WeakPolarHBondContact O-CB 3.42Å; N785-R788 PolarHBondContact O-N 3.22Å; N785-R788 VanDerWaalsContact O-N 3.13Å; N785-D789 VanDerWaalsContact O-CG 3.25Å; N785-D789 PolarHBondContact O-N 3.4Å
786	E	80.2	Confident	74.9	Confident	85 Å²	85	84.4 Å²	84.4	40%	0.397	42%	0.415	S	S	.	.	H	α-helix	trans	-59.5	-45.5	175.3	-74.4	179.3	-174.8	0	0	112.1	K782 F783 R788 D789 L790	K782-E786 VanDerWaalsContact CE-OE1 3.24Å; K782-E786 WeakPolarHBondContact CE-OE1 3.02Å; K782-E786 PolarHBondContact O-N 3.38Å; F783-E786 PolarHBondContact O-N 3.28Å; E786-R788 VanDerWaalsContact C-N 3.28Å; E786-R788 PolarHBondContact O-N 3.28Å; E786-D789 PolarHBondContact O-N 2.94Å; E786-D789 VanDerWaalsContact O-N 3.16Å; E786-L790 WeakPolarHBondContact O-CB 3.45Å; E786-L790 WeakPolarHBondContact O-CG 3.32Å; E786-L790 PolarHBondContact O-N 2.91Å
787	M	82.3	Confident	73	Confident	74 Å²	74	86.7 Å²	86.7	37%	0.365	42%	0.42	S	S	.	.	H	α-helix	trans	-60.9	-38.9	175.3	-75.2	-61.9	-62.5	0	0	111.8	F783 N785 D789 L791	F783-M787 HydrophobicContact CD1-CG 4.3Å; F783-M787 HydrophobicContact CD2-CG 4.24Å; F783-M787 HydrophobicContact CE1-CG 3.88Å; F783-M787 HydrophobicContact CE2-CG 3.82Å; F783-M787 HydrophobicContact CE2-SD 4.14Å; F783-M787 HydrophobicContact CG-CG 4.47Å; F783-M787 HydrophobicContact CZ-CG 3.62Å; F783-M787 HydrophobicContact CZ-SD 4.05Å; F783-M787 WeakPolarHBondContact O-CB 3.31Å; F783-M787 VanDerWaalsContact O-CG 3.26Å; F783-M787 WeakPolarHBondContact O-CG 3.48Å; F783-M787 PolarHBondContact O-N 3.32Å; N785-M787 PolarHBondContact O-N 3.49Å; M787-D789 VanDerWaalsContact C-N 3.29Å; M787-D789 PolarHBondContact O-N 3.47Å; M787-L791 HydrophobicContact CE-CD1 4.08Å; M787-L791 VanDerWaalsContact O-CB 3.25Å; M787-L791 WeakPolarHBondContact O-CB 3.03Å; M787-L791 WeakPolarHBondContact O-CD1 3.38Å; M787-L791 WeakPolarHBondContact O-CG 3.5Å; M787-L791 PolarHBondContact O-N 3.34Å
788	R	81.3	Confident	71	Confident	93 Å²	93	83.4 Å²	83.4	35%	0.351	41%	0.409	S	S	.	.	H	α-helix	trans	-67.4	-32.9	177.7	-158.8	171.9	96.6	148.5	2.7	112.3	R784 N785 E786 G792 F793 R794	R784-R788 WeakPolarHBondContact O-CB 3.41Å; R784-R788 PolarHBondContact O-N 3.46Å; N785-R788 WeakPolarHBondContact O-CB 3.42Å; N785-R788 PolarHBondContact O-N 3.22Å; N785-R788 VanDerWaalsContact O-N 3.13Å; E786-R788 VanDerWaalsContact C-N 3.28Å; E786-R788 PolarHBondContact O-N 3.28Å; R788-G792 PolarHBondContact O-N 3.12Å; R788-F793 HydrophobicContact CG-CB 3.72Å; R788-F793 PolarHBondContact O-N 2.92Å; R788-F793 VanDerWaalsContact O-N 3.11Å; R788-R794 VanDerWaalsContact NH2-NE 3.19Å
789	D	72.8	Confident	69.1	Low	49 Å²	49	86.6 Å²	86.6	26%	0.262	44%	0.438	S	S	.	.	H	α-helix	trans	-75.3	-46.8	177.6	-66.7	-15	0	0	0	111	Y59 N785 E786 M787 L791 G792 R794	Y59-D789 VanDerWaalsContact CB-OD2 3.24Å; Y59-D789 WeakPolarHBondContact CB-OD2 3.5Å; N785-D789 VanDerWaalsContact O-CG 3.25Å; N785-D789 PolarHBondContact O-N 3.4Å; E786-D789 PolarHBondContact O-N 2.94Å; E786-D789 VanDerWaalsContact O-N 3.16Å; M787-D789 VanDerWaalsContact C-N 3.29Å; M787-D789 PolarHBondContact O-N 3.47Å; D789-L791 VanDerWaalsContact C-N 3.3Å; D789-L791 PolarHBondContact O-N 2.87Å; D789-G792 PolarHBondContact O-N 3.25Å; D789-R794 WeakPolarHBondContact OD1-CD 3.27Å; D789-R794 IonicContact OD1-CZ 3.25Å; D789-R794 IonicContact OD1-NE 3.65Å; D789-R794 IonicContact OD1-NH1 2.69Å; D789-R794 PolarHBondContact OD1-NH1 3.03Å; D789-R794 IonicContact OD2-NH1 3.65Å; D789-R794 PolarHBondContact OD2-NH1 3.26Å
790	L	78.8	Confident	67.2	Low	146 Å²	146	89.6 Å²	89.6	76%	0.764	45%	0.45	S	S	*	.	H	α-helix	trans	-60	-38.8	175.7	-73.6	172.8	0	0	0	112.6	E786 G792	E786-L790 WeakPolarHBondContact O-CB 3.45Å; E786-L790 WeakPolarHBondContact O-CG 3.32Å; E786-L790 PolarHBondContact O-N 2.91Å; L790-G792 PolarHBondContact O-N 3.4Å
791	L	78.8	Confident	64.9	Low	105 Å²	105	92.6 Å²	92.6	55%	0.55	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	0.7	178.3	-66.6	168.9	0	0	0	113.1	M787 D789 F793	M787-L791 HydrophobicContact CE-CD1 4.08Å; M787-L791 VanDerWaalsContact O-CB 3.25Å; M787-L791 WeakPolarHBondContact O-CB 3.03Å; M787-L791 WeakPolarHBondContact O-CD1 3.38Å; M787-L791 WeakPolarHBondContact O-CG 3.5Å; M787-L791 PolarHBondContact O-N 3.34Å; D789-L791 VanDerWaalsContact C-N 3.3Å; D789-L791 PolarHBondContact O-N 2.87Å; L791-F793 HydrophobicContact CB-CD2 3.44Å; L791-F793 VanDerWaalsContact CB-CD2 3.44Å; L791-F793 HydrophobicContact CB-CE2 3.58Å; L791-F793 HydrophobicContact CD1-CD2 4.25Å; L791-F793 HydrophobicContact CD1-CE2 3.92Å; L791-F793 HydrophobicContact CG-CD2 4.47Å; L791-F793 HydrophobicContact CG-CE2 4.3Å; L791-F793 PolarHBondContact O-N 2.87Å
792	G	66	Low	62.6	Low	28 Å²	28	100.7 Å²	100.7	29%	0.289	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.2	11.8	176.2	0	0	0	0	0	114.9	R788 D789 L790 R794 T795	R788-G792 PolarHBondContact O-N 3.12Å; D789-G792 PolarHBondContact O-N 3.25Å; L790-G792 PolarHBondContact O-N 3.4Å; G792-R794 PolarHBondContact O-N 2.61Å; G792-R794 VanDerWaalsContact O-N 3.14Å; G792-T795 PolarHBondContact O-N 3.04Å; G792-T795 PolarHBondContact O-OG1 2.76Å
793	F	60.1	Low	60.5	Low	127 Å²	127	104.2 Å²	104.2	56%	0.557	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-13.1	-178.9	-75.8	-67.6	0	0	0	113.5	R788 L791 S796	R788-F793 HydrophobicContact CG-CB 3.72Å; R788-F793 PolarHBondContact O-N 2.92Å; R788-F793 VanDerWaalsContact O-N 3.11Å; L791-F793 HydrophobicContact CB-CD2 3.44Å; L791-F793 VanDerWaalsContact CB-CD2 3.44Å; L791-F793 HydrophobicContact CB-CE2 3.58Å; L791-F793 HydrophobicContact CD1-CD2 4.25Å; L791-F793 HydrophobicContact CD1-CE2 3.92Å; L791-F793 HydrophobicContact CG-CD2 4.47Å; L791-F793 HydrophobicContact CG-CE2 4.3Å; L791-F793 PolarHBondContact O-N 2.87Å; F793-S796 PolarHBondContact O-OG 3.27Å
794	R	57	Low	58.2	Low	21 Å²	21	110.6 Å²	110.6	8%	0.079	54%	0.536	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-35.7	172.9	-85	-157	171.5	125.5	-6.1	113.9	D57 R788 D789 G792 S796 K797 Y798	D57-R794 IonicContact OD1-CZ 2.74Å; D57-R794 IonicContact OD1-NH1 3.98Å; D57-R794 PolarHBondContact OD1-NH1 3.43Å; D57-R794 IonicContact OD1-NH2 3.13Å; D57-R794 PolarHBondContact OD1-NH2 3.49Å; D57-R794 IonicContact OD2-CZ 2.78Å; D57-R794 IonicContact OD2-NH1 3.73Å; D57-R794 IonicContact OD2-NH2 2.88Å; D57-R794 PolarHBondContact OD2-NH2 3.45Å; R788-R794 VanDerWaalsContact NH2-NE 3.19Å; D789-R794 WeakPolarHBondContact OD1-CD 3.27Å; D789-R794 IonicContact OD1-CZ 3.25Å; D789-R794 IonicContact OD1-NE 3.65Å; D789-R794 IonicContact OD1-NH1 2.69Å; D789-R794 PolarHBondContact OD1-NH1 3.03Å; D789-R794 IonicContact OD2-NH1 3.65Å; D789-R794 PolarHBondContact OD2-NH1 3.26Å; G792-R794 PolarHBondContact O-N 2.61Å; G792-R794 VanDerWaalsContact O-N 3.14Å; R794-S796 PolarHBondContact O-N 3.44Å; R794-K797 PolarHBondContact O-N 3.48Å; R794-Y798 WeakPolarHBondContact O-CD2 3.3Å; R794-Y798 PolarHBondContact O-N 3.34Å
795	T	49.6	Very low	55.8	Low	102 Å²	102	112.1 Å²	112.1	63%	0.626	57%	0.571	S	S	*	*	H	α-helix	trans	-67.4	-27.5	-177	52.6	0	0	0	0	112.1	G792 A799	G792-T795 PolarHBondContact O-N 3.04Å; G792-T795 PolarHBondContact O-OG1 2.76Å; T795-A799 WeakPolarHBondContact O-CB 3.4Å; T795-A799 PolarHBondContact O-N 3.18Å
796	S	45.1	Very low	54.7	Low	80 Å²	80	117 Å²	117	56%	0.559	60%	0.596	S	S	*	*	H	α-helix	trans	-74.6	-29.7	178.3	69.1	0	0	0	0	114.5	F793 R794	F793-S796 PolarHBondContact O-OG 3.27Å; R794-S796 PolarHBondContact O-N 3.44Å
797	K	42.8	Very low	53.3	Low	150 Å²	150	118.7 Å²	118.7	65%	0.652	61%	0.606	S	S	*	*	H	α-helix	trans	-88.3	-29.8	-178.9	-99.8	-176	176.4	-178.5	0	114.3	R794	R794-K797 PolarHBondContact O-N 3.48Å
798	Y	42.3	Very low	51.7	Low	115 Å²	115	121.2 Å²	121.2	45%	0.451	62%	0.619	S	S	.	*	H	α-helix	trans	-87.5	-15.8	177.9	-70.5	-77.3	0	0	0	113.8	R794 M800 F801	R794-Y798 WeakPolarHBondContact O-CD2 3.3Å; R794-Y798 PolarHBondContact O-N 3.34Å; Y798-M800 PolarHBondContact O-N 3.28Å; Y798-M800 VanDerWaalsContact O-N 3.15Å; Y798-F801 PolarHBondContact O-N 3.28Å
799	A	40.9	Very low	50	Low	82 Å²	82	122.8 Å²	122.8	68%	0.678	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-10.1	168.3	0	0	0	0	0	113.4	T795	T795-A799 WeakPolarHBondContact O-CB 3.4Å; T795-A799 PolarHBondContact O-N 3.18Å
800	M	41.5	Very low	48.6	Very low	167 Å²	167	127.4 Å²	127.4	82%	0.823	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-9.9	179.8	-110.3	177.6	178.8	0	0	114.9	Y798	Y798-M800 PolarHBondContact O-N 3.28Å; Y798-M800 VanDerWaalsContact O-N 3.15Å
801	F	36	Very low	46.5	Very low	169 Å²	169	126.2 Å²	126.2	74%	0.741	65%	0.651	S	S	*	*	S	Bend	trans	-110.7	3.7	-172	-85.1	-78.5	0	0	0	116	Y798	Y798-F801 PolarHBondContact O-N 3.28Å
802	Y	32.9	Very low	44.2	Very low	187 Å²	187	127.7 Å²	127.7	73%	0.733	66%	0.659	S	S	*	*			trans	-115.3	106.4	165	-85.9	-83.6	0	0	0	109.3	R804	Y802-R804 PolarHBondContact O-N 3.43Å
803	P	35.7	Very low	42.6	Very low	117 Å²	117	135.4 Å²	135.4	76%	0.76	69%	0.687	S	S	*	*			trans	-65.5	121.8	159.5	27.6	-26.2	0	0	0	106.5	S805	P803-S805 PolarHBondContact O-N 3.25Å
804	R	34.5	Very low	41.1	Very low	256 Å²	256	136.1 Å²	136.1	97%	0.966	70%	0.698	S	S	*	*			trans	-56.1	112.1	163.6	-83.6	179.1	167	173.5	-4.3	107.6	Y802	Y802-R804 PolarHBondContact O-N 3.43Å
805	S	35	Very low	39.7	Very low	187 Å²	187	146.5 Å²	146.5	100%	1.308	75%	0.754	S	S	*	*			trans	-95.1	0	151.4	63.6	0	0	0	0	108.3	P803	P803-S805 PolarHBondContact O-N 3.25Å

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