A0A087XBY5_POEFO Loading...

Sorting nexin 25

AlphaFold DB , UniProt , Accession A0A087XBY5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 982 aa.

						>A0A087XBY5_POEFO|A0A087XBY5
MPTPSTTTTPLAGGSSSRRSSSSSGGEEEPMSASPDSTGGSSFRVVPAFCLGVVAAVAFQLAWGGLTLTSVLLKLFIYVSFALLCFLAGSFVLLVRKSPLKVSCFDRNRRQSAARLEFFNRLMGRFSVPAQESVLSRRVVVSHNVDKALKEVFDLAYRDYILSWYVSLSHDEGQLYSMLLEDWWQMIGQLRSRLADIDVVNVVCYDSVRILHSHFTDLRAASGRSEEAARPFPLHPCLVCPDSEMAFLRCVARILLLCLLPQKDAKSHTLRCCLTEVITTKVLKPLVEVLSDPDSINRMLLSQLEQREQQAEQQKKAYTYAASYEDFIKLISTSTDVNFLKQLRYQIVVEIIHATTISSLPQLKKQKERKGKESAAMKADLLRARDMKRYINQLTVAKKQCEKRIRMFGGPNYENSEEGGADDGDEPQSQKILHFDDILCNPGYREHFRAYMERIDKRTLISFWELVEMLKTANKSEVPQIVGEIYQKFFVESKEIQVEKFLLKEIQESLVGNRGTEVFVRLQEQVAETMRERYYPSFLVSDLYERLIRRDESNSQSQCSPEEKGNGCQGLDAGEEVCDEGTKGINEQASYAATKLRQLYDKLEYKRQALGSIQNAPKPDKKIVSKLKEEIGTMEKEHSELQQHITRTDWWCENLGHWRASITTAEAAEEGGETVACYSVCVSLTEGEETANSCWSVQRKLTEFQMLHRKLTECFPCLKKLQLPSLSKLPFKSIDQKFLEKSKTQLNAFLQRLLTDERLCQSEALYAFLSPSPEYLKVMSVQKKSSFSLASFLERLPGDFFSHTEEDGDDDSDLSDYGDEADGRRNALAEPCFMLIGEIFELRGMFKWVRKTLIALVQVTFGRTINKQIRDTVNWIFCEQMLVCYISVFRDTFWPNGKLAPHAKVRTDSERSETKERAQQKLLDNIPDALANLVGQQNARFGIIKIFNALQEANANKHLIYVLMEMLLKELCPELRAAAENS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.8	Very low	37.8	Very low	242 Å²	242	137.8 Å²	137.8	100%	1.192	83%	0.825	S	S	*	*				0	134.8	0	-81.5	-168.3	167.6	0	0	108.7
2	P	54.6	Low	36.8	Very low	113 Å²	113	134.7 Å²	134.7	73%	0.734	83%	0.825	S	S	*	*			cis	-130.8	125.3	-19.7	24.1	-2	0	0	0	115
3	T	31.3	Very low	35.7	Very low	136 Å²	136	130.7 Å²	130.7	83%	0.834	83%	0.828	S	S	*	*				46.2	130.1	127.2	52.9	0	0	0	0	125.4
4	P	56.7	Low	34.7	Very low	123 Å²	123	126.4 Å²	126.4	80%	0.799	82%	0.821	S	S	*	*			trans	-118	175.5	158.9	40.7	-27.9	0	0	0	114.5
5	S	32.3	Very low	34.1	Very low	112 Å²	112	126.1 Å²	126.1	78%	0.783	82%	0.823	S	S	*	*			trans	150.6	147.4	153.2	50.8	0	0	0	0	109.2
6	T	30.9	Very low	33.5	Very low	130 Å²	130	125.4 Å²	125.4	80%	0.798	82%	0.821	S	S	*	*			cis	-156.7	130.8	22.3	-12.1	0	0	0	0	111.6
7	T	30.4	Very low	33.2	Very low	135 Å²	135	124.6 Å²	124.6	83%	0.828	82%	0.82	S	S	*	*			trans	29.1	136.2	147.8	-30.3	0	0	0	0	125.4
8	T	34.5	Very low	33.2	Very low	123 Å²	123	132.1 Å²	132.1	76%	0.755	83%	0.828	S	S	*	*			trans	-94.2	151.5	-164.1	22	0	0	0	0	118.3
9	T	31.2	Very low	33	Very low	129 Å²	129	137.8 Å²	137.8	79%	0.791	83%	0.832	S	S	*	*			trans	6.6	163.6	137.2	39.8	0	0	0	0	124.5
10	P	55.7	Low	32.8	Very low	107 Å²	107	136.7 Å²	136.7	70%	0.695	83%	0.831	S	S	*	*			trans	-116.7	178.1	-150.8	42.5	-29.9	0	0	0	115.9
11	L	26.9	Very low	32.5	Very low	166 Å²	166	135.3 Å²	135.3	87%	0.869	83%	0.828	S	S	*	*			trans	129.9	130.4	146.8	-81.1	147.5	0	0	0	116.9
12	A	25.7	Very low	32.5	Very low	100 Å²	100	128.9 Å²	128.9	83%	0.826	81%	0.807	S	S	*	*			trans	76	120.4	149.3	0	0	0	0	0	121.5
13	G	22.2	Very low	31.3	Very low	83 Å²	83	128.6 Å²	128.6	86%	0.856	81%	0.807	S	S	*	*			trans	112.2	120.4	135.1	0	0	0	0	0	119.3
14	G	22.2	Very low	31.2	Very low	71 Å²	71	127.5 Å²	127.5	73%	0.732	81%	0.805	S	S	*	*			trans	86.1	94.4	143.8	0	0	0	0	0	117.7
15	S	25.6	Very low	29.8	Very low	122 Å²	122	125.4 Å²	125.4	85%	0.853	81%	0.806	S	S	*	*				77.7	114	89	69.4	0	0	0	0	115.7
16	S	24	Very low	29.6	Very low	114 Å²	114	123.4 Å²	123.4	80%	0.797	80%	0.803	S	S	*	*			trans	-155.8	135.5	152.6	61	0	0	0	0	113.4
17	S	28.5	Very low	29.5	Very low	113 Å²	113	125.7 Å²	125.7	79%	0.79	81%	0.805	S	S	*	*			trans	80.2	92.9	155.1	75.5	0	0	0	0	120.2
18	R	32.6	Very low	29.4	Very low	259 Å²	259	127.5 Å²	127.5	98%	0.977	80%	0.804	S	S	*	*				-121.5	120.7	129.3	-98.7	-176.9	179.7	179.2	0.5	108.3
19	R	29.9	Very low	29.3	Very low	240 Å²	240	130.4 Å²	130.4	91%	0.906	81%	0.809	S	S	*	*			trans	-119.2	130.9	164.2	-102.7	-175.1	-179.1	179.3	0.7	109.3
20	S	29.6	Very low	30.1	Very low	116 Å²	116	129.1 Å²	129.1	81%	0.811	80%	0.802	S	S	*	*			trans	75.9	128.1	145.4	67.4	0	0	0	0	119.6
21	S	26.8	Very low	28.6	Very low	108 Å²	108	131.8 Å²	131.8	76%	0.755	81%	0.808	S	S	*	*			cis	-141.2	137.9	30.9	35.2	0	0	0	0	115.2
22	S	30.3	Very low	28.7	Very low	107 Å²	107	128.9 Å²	128.9	75%	0.748	80%	0.801	S	S	*	*			trans	39	139.5	143.5	58.8	0	0	0	0	119.5
23	S	30.5	Very low	28.6	Very low	107 Å²	107	129.1 Å²	129.1	75%	0.748	80%	0.803	S	S	*	*			cis	173.9	155	14.7	42.1	0	0	0	0	102.6
24	S	28.6	Very low	29.2	Very low	112 Å²	112	130.4 Å²	130.4	78%	0.783	80%	0.799	S	S	*	*			cis	177.6	150.6	21.4	30.7	0	0	0	0	106
25	G	27.8	Very low	30.5	Very low	80 Å²	80	132 Å²	132	83%	0.825	80%	0.797	S	S	*	*			trans	85.6	100.6	145.7	0	0	0	0	0	115.9
26	G	27.4	Very low	30.5	Very low	70 Å²	70	133.1 Å²	133.1	72%	0.722	79%	0.793	S	S	*	*			trans	-85.1	179.6	163.3	0	0	0	0	0	112
27	E	28.9	Very low	30.7	Very low	178 Å²	178	131.8 Å²	131.8	83%	0.832	78%	0.784	S	S	*	*			trans	-179	138.9	138.4	-101.8	166.8	-177.2	0	0	110.2
28	E	28.4	Very low	30.6	Very low	173 Å²	173	133.1 Å²	133.1	81%	0.808	79%	0.787	S	S	*	*			trans	67.6	113.4	143.4	-62.8	-177.1	165.9	0	0	122.5
29	E	33.5	Very low	30.3	Very low	184 Å²	184	124.5 Å²	124.5	86%	0.86	78%	0.779	S	S	*	*			trans	-72.6	154.3	132.1	-88.7	-170.2	173.6	0	0	108.3
30	P	47.3	Very low	30	Very low	101 Å²	101	116.4 Å²	116.4	66%	0.656	77%	0.77	S	S	*	*				-154.9	-169.9	51.8	35.4	-9.8	0	0	0	117
31	M	24.1	Very low	30	Very low	163 Å²	163	116.1 Å²	116.1	80%	0.803	77%	0.768	S	S	*	*			trans	97.5	102.9	153.2	-70.8	-161.8	-87.7	0	0	120.7
32	S	28.4	Very low	30.1	Very low	106 Å²	106	116 Å²	116	74%	0.741	77%	0.768	S	S	*	*				30	118.8	120.1	62.4	0	0	0	0	119.9
33	A	24.7	Very low	30.1	Very low	104 Å²	104	118.5 Å²	118.5	86%	0.86	77%	0.765	S	S	*	*			trans	-166	99.6	136.1	0	0	0	0	0	111
34	S	34.7	Very low	30.6	Very low	111 Å²	111	122.9 Å²	122.9	78%	0.776	77%	0.765	S	S	*	*			trans	-89.9	153	133.5	51.7	0	0	0	0	106.3
35	P	48	Very low	30.6	Very low	104 Å²	104	124.2 Å²	124.2	68%	0.675	77%	0.768	S	S	*	*			cis	-153	-171.8	46.6	38.8	-15	0	0	0	116.1
36	D	26.4	Very low	30.6	Very low	146 Å²	146	126.3 Å²	126.3	78%	0.781	77%	0.765	S	S	*	*			trans	78.4	142.8	156.7	-63.7	-20.1	0	0	0	119.4
37	S	28.4	Very low	30.8	Very low	86 Å²	86	127.7 Å²	127.7	60%	0.601	76%	0.761	S	S	*	*			cis	-176.4	165.4	-24.6	51.7	0	0	0	0	105.6
38	T	27.2	Very low	30.8	Very low	140 Å²	140	123.6 Å²	123.6	86%	0.859	76%	0.758	S	S	*	*			trans	87.2	117.4	160	69.8	0	0	0	0	120
39	G	25.4	Very low	30.8	Very low	79 Å²	79	118.4 Å²	118.4	81%	0.814	73%	0.733	S	S	*	*				131.6	84.4	118.5	0	0	0	0	0	118.6
40	G	24.6	Very low	30.5	Very low	69 Å²	69	113.9 Å²	113.9	71%	0.711	72%	0.72	S	S	*	*				96.6	118.2	119.7	0	0	0	0	0	121.2
41	S	28.1	Very low	29.8	Very low	110 Å²	110	114.4 Å²	114.4	77%	0.769	72%	0.717	S	S	*	*			trans	66	112.7	140	59.6	0	0	0	0	119.4
42	S	30.2	Very low	30	Very low	107 Å²	107	108.9 Å²	108.9	75%	0.748	70%	0.702	S	S	*	*				66.7	120.7	85.2	-64.3	0	0	0	0	115.2
43	F	29.8	Very low	30	Very low	158 Å²	158	104.9 Å²	104.9	69%	0.693	67%	0.673	S	S	*	*			trans	151.9	107.6	130.5	-98	-108.7	0	0	0	110.5
44	R	40.8	Very low	30.5	Very low	200 Å²	200	101.6 Å²	101.6	76%	0.755	64%	0.642	S	S	*	*				63.5	90.7	88.8	-67.8	-168.7	-160.8	171.9	-2.7	113.8
45	V	28.3	Very low	30.4	Very low	140 Å²	140	98.5 Å²	98.5	85%	0.848	62%	0.623	S	S	*	*			trans	-159.6	76.2	145.8	-169.3	0	0	0	0	109.2
46	V	28	Very low	29.5	Very low	123 Å²	123	93.9 Å²	93.9	75%	0.745	59%	0.594	S	S	*	*			trans	-135.9	-11.5	172.8	-173.3	0	0	0	0	115.6	A48	V46-A48 PolarHBondContact O-N 2.98Å
47	P	31.9	Very low	29.8	Very low	99 Å²	99	88 Å²	88	64%	0.643	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	8.7	-168.2	36.1	-35.4	0	0	0	116.8	L51	P47-L51 VanDerWaalsContact O-CD1 3.32Å; P47-L51 WeakPolarHBondContact O-CD1 3.43Å
48	A	28.1	Very low	30.1	Very low	93 Å²	93	85 Å²	85	77%	0.769	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-21.8	-170.3	0	0	0	0	0	115.1	V46	V46-A48 PolarHBondContact O-N 2.98Å
49	F	28.2	Very low	30.5	Very low	63 Å²	63	82.6 Å²	82.6	28%	0.276	52%	0.521	S	S	.	.	S	Bend	trans	-105.9	-30	-166	-160.3	-99.8	0	0	0	113.8	L51 S887 R890 D891	F49-L51 VanDerWaalsContact C-N 3.27Å; F49-L51 PolarHBondContact O-N 3.12Å; F49-S887 WeakPolarHBondContact CE2-OG 3.24Å; F49-S887 WeakPolarHBondContact CZ-OG 3.49Å; F49-R890 VanDerWaalsContact CZ-CZ 3.48Å; F49-D891 WeakPolarHBondContact CD1-OD2 3.49Å; F49-D891 HydrophobicContact CE1-CB 4.27Å; F49-D891 WeakPolarHBondContact CE1-OD2 3.38Å
50	C	27.9	Very low	30.8	Very low	89 Å²	89	79.5 Å²	79.5	60%	0.601	49%	0.486	S	S	*	.	H	α-helix	trans	-68.5	-24.3	174.3	-60.1	0	0	0	0	112.9	V54	C50-V54 WeakPolarHBondContact O-CG2 3.41Å; C50-V54 PolarHBondContact O-N 3.42Å
51	L	32.4	Very low	31.2	Very low	113 Å²	113	79.2 Å²	79.2	59%	0.592	47%	0.467	S	S	*	.	H	α-helix	trans	-75.6	-29.1	-178.3	-100.3	146.8	0	0	0	114	P47 F49 A55	P47-L51 VanDerWaalsContact O-CD1 3.32Å; P47-L51 WeakPolarHBondContact O-CD1 3.43Å; F49-L51 VanDerWaalsContact C-N 3.27Å; F49-L51 PolarHBondContact O-N 3.12Å; L51-A55 PolarHBondContact O-N 2.95Å
52	G	27.9	Very low	31.5	Very low	46 Å²	46	77 Å²	77	47%	0.474	46%	0.455	S	S	.	.	H	α-helix	trans	-74	-32.3	179	0	0	0	0	0	113.7
53	V	30.1	Very low	31.9	Very low	23 Å²	23	75.8 Å²	75.8	14%	0.139	44%	0.435	C	S	.	.	H	α-helix	trans	-87.3	-28.3	-175.8	-176.2	0	0	0	0	111.5	V57 V888	V53-V57 PolarHBondContact O-N 3.46Å; V53-V888 HydrophobicContact CG1-CG2 3.91Å; V53-V888 HydrophobicContact CG2-CG2 4.14Å
54	V	34.1	Very low	31.8	Very low	34 Å²	34	69.5 Å²	69.5	21%	0.206	41%	0.414	C	S	.	.	H	α-helix	trans	-67.7	-38.6	171.6	176.2	0	0	0	0	111.4	C50 A56 V57 A58 Q310	C50-V54 WeakPolarHBondContact O-CG2 3.41Å; C50-V54 PolarHBondContact O-N 3.42Å; V54-A56 VanDerWaalsContact C-N 3.34Å; V54-A56 PolarHBondContact O-N 3.17Å; V54-V57 PolarHBondContact O-N 3.4Å; V54-A58 VanDerWaalsContact O-CB 3.3Å; V54-A58 WeakPolarHBondContact O-CB 3.49Å; V54-A58 PolarHBondContact O-N 3.22Å; V54-A58 VanDerWaalsContact O-N 3.07Å; V54-Q310 HydrophobicContact CG1-CG 4.15Å; V54-Q310 HydrophobicContact CG2-CG 4.26Å
55	A	33.5	Very low	31.5	Very low	46 Å²	46	62.4 Å²	62.4	38%	0.38	40%	0.403	S	S	.	.	H	α-helix	trans	-67.2	-34.2	178.7	0	0	0	0	0	112.7	L51	L51-A55 PolarHBondContact O-N 2.95Å
56	A	28.9	Very low	31.8	Very low	8 Å²	8	57.8 Å²	57.8	7%	0.066	37%	0.374	C	S	.	.	H	α-helix	trans	-66.5	-49.1	173.4	0	0	0	0	0	111.9	V54 W875 M881 C884	V54-A56 VanDerWaalsContact C-N 3.34Å; V54-A56 PolarHBondContact O-N 3.17Å; A56-W875 WeakPolarHBondContact O-CH2 3.44Å; A56-W875 WeakPolarHBondContact O-CZ2 3.45Å; A56-M881 HydrophobicContact CB-CE 3.77Å; A56-M881 HydrophobicContact CB-SD 3.3Å; A56-M881 WeakPolarHBondContact CB-SD 3.45Å; A56-C884 HydrophobicContact CB-CB 4.49Å
57	V	31.5	Very low	32.3	Very low	22 Å²	22	54.3 Å²	54.3	13%	0.133	35%	0.353	C	S	.	.	H	α-helix	trans	-79.1	-29.2	-171.8	-180	0	0	0	0	112.8	V53 V54 Q60 L61	V53-V57 PolarHBondContact O-N 3.46Å; V54-V57 PolarHBondContact O-N 3.4Å; V57-Q60 PolarHBondContact O-N 3.19Å; V57-L61 HydrophobicContact CG1-CD1 3.95Å; V57-L61 WeakPolarHBondContact O-CD1 3.46Å
58	A	35.7	Very low	32.6	Very low	22 Å²	22	49.9 Å²	49.9	18%	0.182	32%	0.324	C	S	.	.	H	α-helix	trans	-74.2	-30.4	178.5	0	0	0	0	0	113.6	V54 Q60	V54-A58 VanDerWaalsContact O-CB 3.3Å; V54-A58 WeakPolarHBondContact O-CB 3.49Å; V54-A58 PolarHBondContact O-N 3.22Å; V54-A58 VanDerWaalsContact O-N 3.07Å; A58-Q60 PolarHBondContact O-N 2.8Å
59	F	34.5	Very low	32.9	Very low	90 Å²	90	46 Å²	46	40%	0.395	29%	0.29	S	S	.	.	H	α-helix	trans	-65.6	-27.1	175.6	-162.3	-97.3	0	0	0	112.3	W875	F59-W875 HydrophobicContact CB-CZ2 3.97Å; F59-W875 AromaticContact CD1-CD1 3.66Å; F59-W875 HydrophobicContact CD1-CD2 4.17Å; F59-W875 AromaticContact CD1-CE2 3.62Å; F59-W875 HydrophobicContact CD1-CG 4.19Å; F59-W875 HydrophobicContact CD1-CZ2 4.2Å; F59-W875 AromaticContact CD1-NE1 3.23Å; F59-W875 AromaticContact CE1-CD1 3.71Å; F59-W875 HydrophobicContact CE1-CG 4.32Å; F59-W875 AromaticContact CE1-NE1 3.76Å; F59-W875 AromaticContact CG-NE1 3.93Å
60	Q	31.8	Very low	33.4	Very low	15 Å²	15	43.6 Å²	43.6	7%	0.07	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-0.7	-174.5	-136.7	-165.8	15	0	0	115.1	V57 A58 K74 W875	V57-Q60 PolarHBondContact O-N 3.19Å; A58-Q60 PolarHBondContact O-N 2.8Å; Q60-K74 PolarHBondContact O-NZ 3.16Å; Q60-W875 HydrophobicContact CB-CE3 4.43Å; Q60-W875 HydrophobicContact CB-CH2 3.62Å; Q60-W875 HydrophobicContact CB-CZ2 4.35Å; Q60-W875 HydrophobicContact CB-CZ3 3.72Å; Q60-W875 HydrophobicContact CG-CE3 3.71Å; Q60-W875 HydrophobicContact CG-CH2 3.76Å; Q60-W875 HydrophobicContact CG-CZ3 3.27Å; Q60-W875 VanDerWaalsContact NE2-CZ3 3.26Å
61	L	33.7	Very low	34	Very low	62 Å²	62	41.9 Å²	41.9	33%	0.325	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-22.7	179.5	-77.7	161.2	0	0	0	113.1	V57 L66 R307	V57-L61 HydrophobicContact CG1-CD1 3.95Å; V57-L61 WeakPolarHBondContact O-CD1 3.46Å; L61-L66 HydrophobicContact CD2-CD1 4.14Å; L61-R307 HydrophobicContact CD1-CG 4.39Å
62	A	35.1	Very low	34.4	Very low	63 Å²	63	36.8 Å²	36.8	52%	0.521	24%	0.241	S	C	.	.	S	Bend	trans	-88.4	-15	-177.1	0	0	0	0	0	114.3
63	W	37.4	Very low	35	Very low	83 Å²	83	35.4 Å²	35.4	31%	0.314	22%	0.223	S	C	.	.	S	Bend	trans	-138.6	-11.1	-174	-112.7	-83.7	0	0	0	118.5	Y345 V349	W63-Y345 HydrophobicContact CB-CE1 4.4Å; W63-Y345 AromaticContact CD1-CZ 3.92Å; W63-Y345 HydrophobicContact CD2-CD1 4.16Å; W63-Y345 AromaticContact CD2-CE1 3.13Å; W63-Y345 HydrophobicContact CD2-CE1 3.13Å; W63-Y345 HydrophobicContact CD2-CE2 4.35Å; W63-Y345 AromaticContact CD2-CZ 3.26Å; W63-Y345 AromaticContact CE2-CE1 3.35Å; W63-Y345 AromaticContact CE2-CE2 3.72Å; W63-Y345 AromaticContact CE2-CZ 3Å; W63-Y345 AromaticContact CE3-CD1 3.66Å; W63-Y345 HydrophobicContact CE3-CD1 3.66Å; W63-Y345 AromaticContact CE3-CE1 2.99Å; W63-Y345 HydrophobicContact CE3-CE1 2.99Å; W63-Y345 AromaticContact CE3-CZ 3.67Å; W63-Y345 AromaticContact CG-CE1 3.82Å; W63-Y345 HydrophobicContact CG-CE1 3.82Å; W63-Y345 AromaticContact CG-CZ 3.7Å; W63-Y345 AromaticContact CH2-CD1 3.13Å; W63-Y345 HydrophobicContact CH2-CD1 3.13Å; W63-Y345 AromaticContact CH2-CD2 3.83Å; W63-Y345 HydrophobicContact CH2-CD2 3.83Å; W63-Y345 AromaticContact CH2-CE1 3.08Å; W63-Y345 HydrophobicContact CH2-CE1 3.08Å; W63-Y345 AromaticContact CH2-CE2 3.74Å; W63-Y345 HydrophobicContact CH2-CE2 3.74Å; W63-Y345 AromaticContact CH2-CG 3.56Å; W63-Y345 HydrophobicContact CH2-CG 3.56Å; W63-Y345 AromaticContact CH2-CZ 3.4Å; W63-Y345 VanDerWaalsContact CH2-CZ 3.4Å; W63-Y345 AromaticContact CZ2-CD1 3.7Å; W63-Y345 HydrophobicContact CZ2-CD1 3.7Å; W63-Y345 AromaticContact CZ2-CD2 3.78Å; W63-Y345 HydrophobicContact CZ2-CD2 3.78Å; W63-Y345 AromaticContact CZ2-CE1 3.22Å; W63-Y345 HydrophobicContact CZ2-CE1 3.22Å; W63-Y345 AromaticContact CZ2-CE2 3.25Å; W63-Y345 HydrophobicContact CZ2-CE2 3.25Å; W63-Y345 AromaticContact CZ2-CG 3.99Å; W63-Y345 HydrophobicContact CZ2-CG 3.99Å; W63-Y345 AromaticContact CZ2-CZ 2.96Å; W63-Y345 WeakPolarHBondContact CZ2-OH 3.27Å; W63-Y345 AromaticContact CZ3-CD1 3.15Å; W63-Y345 HydrophobicContact CZ3-CD1 3.15Å; W63-Y345 AromaticContact CZ3-CE1 3.01Å; W63-Y345 HydrophobicContact CZ3-CE1 3.01Å; W63-Y345 HydrophobicContact CZ3-CG 4.05Å; W63-Y345 AromaticContact CZ3-CZ 3.77Å; W63-Y345 AromaticContact NE1-CZ 3.56Å; W63-Y345 PolarHBondContact NE1-OH 2.87Å; W63-V349 HydrophobicContact CH2-CB 3.47Å; W63-V349 VanDerWaalsContact CH2-CB 3.47Å; W63-V349 HydrophobicContact CH2-CG1 3.87Å; W63-V349 HydrophobicContact CH2-CG2 3.79Å; W63-V349 HydrophobicContact CZ2-CB 3.28Å; W63-V349 HydrophobicContact CZ2-CG1 3.9Å; W63-V349 HydrophobicContact CZ2-CG2 3.02Å
64	G	29.1	Very low	35.5	Very low	25 Å²	25	35 Å²	35	26%	0.258	22%	0.219	S	C	.	.	S	Bend	trans	-99.8	110.9	166	0	0	0	0	0	107.7	L66	G64-L66 PolarHBondContact O-N 3.04Å
65	G	32.9	Very low	35.8	Very low	51 Å²	51	35.5 Å²	35.5	53%	0.526	22%	0.221	S	C	.	.			trans	-47.3	136.9	167.7	0	0	0	0	0	109.1	T67	G65-T67 PolarHBondContact O-N 3.05Å
66	L	35.1	Very low	36.2	Very low	44 Å²	44	33.7 Å²	33.7	23%	0.23	20%	0.204	C	C	.	.			trans	-63.8	79.8	166	-103.8	98.5	0	0	0	107.4	L61 G64 V71 P927	L61-L66 HydrophobicContact CD2-CD1 4.14Å; G64-L66 PolarHBondContact O-N 3.04Å; L66-V71 HydrophobicContact CD2-CG2 3.21Å; L66-V71 HydrophobicContact CG-CG2 3.98Å; L66-P927 HydrophobicContact CB-CB 4.17Å; L66-P927 HydrophobicContact CB-CG 3.7Å; L66-P927 HydrophobicContact CD1-CB 4.38Å; L66-P927 HydrophobicContact CD1-CG 3.79Å; L66-P927 HydrophobicContact CD2-CG 3.52Å; L66-P927 HydrophobicContact CG-CG 3.85Å
67	T	38.8	Very low	36.8	Very low	50 Å²	50	33.5 Å²	33.5	31%	0.307	20%	0.202	S	C	.	.			trans	-62.9	132.9	142.8	56.8	0	0	0	0	104.3	G65 T69 S70 V71 I836	G65-T67 PolarHBondContact O-N 3.05Å; T67-T69 WeakPolarHBondContact CB-OG1 3.34Å; T67-T69 CarbonylContact O-C 3.54Å; T67-T69 PolarHBondContact O-N 2.93Å; T67-T69 PolarHBondContact OG1-OG1 3.13Å; T67-S70 WeakPolarHBondContact O-CA 3.34Å; T67-S70 WeakPolarHBondContact O-CB 3.48Å; T67-S70 PolarHBondContact O-N 3.2Å; T67-S70 PolarHBondContact OG1-N 2.73Å; T67-V71 PolarHBondContact O-N 3.31Å; T67-I836 HydrophobicContact CG2-CD1 4.04Å
68	L	38.1	Very low	37.3	Very low	6 Å²	6	36.3 Å²	36.3	3%	0.031	21%	0.211	C	C	.	.	H	α-helix	trans	-38.2	-29.5	160.3	-173.9	78.5	0	0	0	112.9	V71 L72 L835 I836 I839 F840 I946	L68-V71 PolarHBondContact O-N 3.18Å; L68-L72 HydrophobicContact CD2-CD1 4.18Å; L68-L72 HydrophobicContact CG-CD1 3.79Å; L68-L72 HydrophobicContact CG-CG 4.39Å; L68-L72 VanDerWaalsContact O-CB 3.27Å; L68-L72 WeakPolarHBondContact O-CB 3.47Å; L68-L72 WeakPolarHBondContact O-CG 3.38Å; L68-L72 PolarHBondContact O-N 2.93Å; L68-L835 HydrophobicContact CD2-CD1 4.46Å; L68-L835 HydrophobicContact CD2-CG 3.9Å; L68-L835 WeakPolarHBondContact CD2-O 3.31Å; L68-I836 HydrophobicContact CB-CG1 3.67Å; L68-I836 HydrophobicContact CD2-CB 4.41Å; L68-I836 HydrophobicContact CD2-CG1 4Å; L68-I839 HydrophobicContact CD1-CB 4.2Å; L68-I839 HydrophobicContact CD1-CD1 3.82Å; L68-I839 HydrophobicContact CD1-CG1 4.48Å; L68-I839 HydrophobicContact CD1-CG2 3.8Å; L68-I839 HydrophobicContact CD2-CB 3.51Å; L68-I839 HydrophobicContact CD2-CD1 3.45Å; L68-I839 VanDerWaalsContact CD2-CD1 3.45Å; L68-I839 HydrophobicContact CD2-CG1 3.53Å; L68-I839 HydrophobicContact CD2-CG2 4.11Å; L68-I839 HydrophobicContact CG-CB 4.43Å; L68-I839 HydrophobicContact CG-CD1 3.88Å; L68-I839 HydrophobicContact CG-CG1 4.45Å; L68-F840 HydrophobicContact CB-CE2 4.05Å; L68-F840 HydrophobicContact CD1-CE2 3.71Å; L68-F840 HydrophobicContact CD1-CZ 3.91Å; L68-F840 HydrophobicContact CD2-CE2 4.03Å; L68-F840 HydrophobicContact CG-CE2 4.17Å; L68-I946 HydrophobicContact CD1-CD1 3.23Å; L68-I946 HydrophobicContact CD1-CG1 4.1Å
69	T	34	Very low	37.6	Very low	11 Å²	11	36 Å²	36	7%	0.067	21%	0.207	C	C	.	.	H	α-helix	trans	-71.7	-28.2	173.5	62.5	0	0	0	0	114.5	T67 L73 V208 C832 L835	T67-T69 WeakPolarHBondContact CB-OG1 3.34Å; T67-T69 CarbonylContact O-C 3.54Å; T67-T69 PolarHBondContact O-N 2.93Å; T67-T69 PolarHBondContact OG1-OG1 3.13Å; T69-L73 VanDerWaalsContact O-CA 3.27Å; T69-L73 WeakPolarHBondContact O-CA 3.41Å; T69-L73 WeakPolarHBondContact O-CB 3.48Å; T69-L73 PolarHBondContact O-N 3.39Å; T69-V208 HydrophobicContact CG2-CG1 4.3Å; T69-V208 HydrophobicContact CG2-CG2 4.42Å; T69-C832 VanDerWaalsContact CB-SG 3.5Å; T69-C832 HydrophobicContact CG2-CB 3.29Å; T69-C832 WeakPolarHBondContact CG2-SG 3.17Å; T69-C832 PolarHBondContact OG1-SG 3.4Å; T69-C832 VanDerWaalsContact OG1-SG 3.39Å; T69-L835 HydrophobicContact CG2-CB 4.36Å; T69-L835 HydrophobicContact CG2-CD2 4.01Å; T69-L835 HydrophobicContact CG2-CG 4.49Å
70	S	39.3	Very low	37.8	Very low	12 Å²	12	32.8 Å²	32.8	8%	0.084	20%	0.195	C	C	.	.	H	α-helix	trans	-69.8	-33.6	167.7	-178.4	0	0	0	0	111.8	T67 K74	T67-S70 WeakPolarHBondContact O-CA 3.34Å; T67-S70 WeakPolarHBondContact O-CB 3.48Å; T67-S70 PolarHBondContact O-N 3.2Å; T67-S70 PolarHBondContact OG1-N 2.73Å; S70-K74 WeakPolarHBondContact O-CB 3.31Å; S70-K74 WeakPolarHBondContact O-CG 2.99Å; S70-K74 PolarHBondContact O-N 2.81Å; S70-K74 VanDerWaalsContact OG-CE 3.27Å; S70-K74 WeakPolarHBondContact OG-CE 3.42Å
71	V	40.2	Very low	38.3	Very low	53 Å²	53	33.6 Å²	33.6	32%	0.321	20%	0.199	S	C	.	.	H	α-helix	trans	-73.8	-45.3	173.4	173.3	0	0	0	0	111.2	L66 T67 L68 L73 K74 L75	L66-V71 HydrophobicContact CD2-CG2 3.21Å; L66-V71 HydrophobicContact CG-CG2 3.98Å; T67-V71 PolarHBondContact O-N 3.31Å; L68-V71 PolarHBondContact O-N 3.18Å; V71-L73 VanDerWaalsContact C-N 3.34Å; V71-K74 CarbonylContact O-C 3.49Å; V71-K74 PolarHBondContact O-N 3.31Å; V71-L75 WeakPolarHBondContact O-CB 3.42Å; V71-L75 PolarHBondContact O-N 3.34Å
72	L	39.9	Very low	38.6	Very low	6 Å²	6	31.9 Å²	31.9	3%	0.031	19%	0.193	C	C	.	.	H	α-helix	trans	-75.3	-25.7	179.2	-67.9	173.9	0	0	0	112.4	L68 L75 F76 L211 F215 L835 I839	L68-L72 HydrophobicContact CD2-CD1 4.18Å; L68-L72 HydrophobicContact CG-CD1 3.79Å; L68-L72 HydrophobicContact CG-CG 4.39Å; L68-L72 VanDerWaalsContact O-CB 3.27Å; L68-L72 WeakPolarHBondContact O-CB 3.47Å; L68-L72 WeakPolarHBondContact O-CG 3.38Å; L68-L72 PolarHBondContact O-N 2.93Å; L72-L75 CarbonylContact O-C 3.59Å; L72-F76 WeakPolarHBondContact O-CA 3.47Å; L72-F76 WeakPolarHBondContact O-CB 3.42Å; L72-F76 PolarHBondContact O-N 3.49Å; L72-L211 HydrophobicContact CB-CD1 3.56Å; L72-L211 HydrophobicContact CD1-CB 4.5Å; L72-L211 HydrophobicContact CD1-CD1 4.33Å; L72-L211 HydrophobicContact CD2-CD2 4.1Å; L72-L211 HydrophobicContact CG-CD1 4.36Å; L72-F215 HydrophobicContact CD1-CE2 4.31Å; L72-F215 HydrophobicContact CD2-CE2 4.2Å; L72-L835 HydrophobicContact CD1-CD1 3.96Å; L72-L835 HydrophobicContact CD1-CD2 3.42Å; L72-L835 VanDerWaalsContact CD1-CD2 3.42Å; L72-L835 HydrophobicContact CD1-CG 3.77Å; L72-I839 HydrophobicContact CD1-CD1 3.84Å
73	L	41.4	Very low	38.8	Very low	18 Å²	18	29.5 Å²	29.5	9%	0.094	17%	0.172	C	C	.	.	H	α-helix	trans	-73.2	-44.7	166.3	175.5	51.3	0	0	0	110.2	T69 V71 L75 F76 I77 V203 V873 I876	T69-L73 VanDerWaalsContact O-CA 3.27Å; T69-L73 WeakPolarHBondContact O-CA 3.41Å; T69-L73 WeakPolarHBondContact O-CB 3.48Å; T69-L73 PolarHBondContact O-N 3.39Å; V71-L73 VanDerWaalsContact C-N 3.34Å; L73-L75 PolarHBondContact O-N 3.4Å; L73-F76 HydrophobicContact CD1-CD1 4.19Å; L73-F76 CarbonylContact O-C 3.55Å; L73-F76 PolarHBondContact O-N 3.28Å; L73-I77 HydrophobicContact CD1-CD1 3.46Å; L73-I77 VanDerWaalsContact CD1-CD1 3.46Å; L73-I77 HydrophobicContact CD1-CG1 3.72Å; L73-I77 HydrophobicContact CD2-CD1 4.31Å; L73-I77 HydrophobicContact CG-CD1 3.47Å; L73-I77 VanDerWaalsContact CG-CD1 3.47Å; L73-I77 HydrophobicContact CG-CG1 4.26Å; L73-I77 WeakPolarHBondContact O-CA 3.5Å; L73-I77 VanDerWaalsContact O-CB 3.23Å; L73-I77 WeakPolarHBondContact O-CB 3.29Å; L73-I77 WeakPolarHBondContact O-CD1 3.47Å; L73-I77 WeakPolarHBondContact O-CG1 3.42Å; L73-I77 PolarHBondContact O-N 3.37Å; L73-V203 HydrophobicContact CD1-CB 3.64Å; L73-V203 HydrophobicContact CD1-CG1 3.03Å; L73-V203 HydrophobicContact CD1-CG2 3.57Å; L73-V203 HydrophobicContact CD2-CG1 3.27Å; L73-V203 HydrophobicContact CG-CG1 3.68Å; L73-V873 HydrophobicContact CD2-CG2 4.41Å; L73-I876 HydrophobicContact CD2-CD1 4.11Å; L73-I876 HydrophobicContact CG-CD1 4.38Å
74	K	39.8	Very low	39.1	Very low	14 Å²	14	29.2 Å²	29.2	6%	0.061	18%	0.176	C	C	.	.	H	α-helix	trans	-61.9	-34	170	-77.3	177.1	-144	-151.4	0	111	Q60 S70 V71 Y78	Q60-K74 PolarHBondContact O-NZ 3.16Å; S70-K74 WeakPolarHBondContact O-CB 3.31Å; S70-K74 WeakPolarHBondContact O-CG 2.99Å; S70-K74 PolarHBondContact O-N 2.81Å; S70-K74 VanDerWaalsContact OG-CE 3.27Å; S70-K74 WeakPolarHBondContact OG-CE 3.42Å; V71-K74 CarbonylContact O-C 3.49Å; V71-K74 PolarHBondContact O-N 3.31Å; K74-Y78 HydrophobicContact CB-CD2 4.04Å; K74-Y78 HydrophobicContact CB-CE2 3.78Å; K74-Y78 HydrophobicContact CG-CE2 4.43Å; K74-Y78 WeakPolarHBondContact O-CA 3.33Å; K74-Y78 WeakPolarHBondContact O-CB 3.38Å; K74-Y78 WeakPolarHBondContact O-CD2 3.29Å; K74-Y78 PolarHBondContact O-N 3.09Å
75	L	40.6	Very low	39.5	Very low	45 Å²	45	28.7 Å²	28.7	24%	0.236	17%	0.168	C	C	.	.	H	α-helix	trans	-75	-36.4	176.7	-153.4	143.8	0	0	0	110.2	V71 L72 L73 Y78 V79 L950	V71-L75 WeakPolarHBondContact O-CB 3.42Å; V71-L75 PolarHBondContact O-N 3.34Å; L72-L75 CarbonylContact O-C 3.59Å; L73-L75 PolarHBondContact O-N 3.4Å; L75-Y78 CarbonylContact O-C 3.58Å; L75-V79 HydrophobicContact CD2-CG2 3.99Å; L75-V79 WeakPolarHBondContact O-CA 3.38Å; L75-V79 WeakPolarHBondContact O-CB 3.43Å; L75-V79 WeakPolarHBondContact O-CG2 3.47Å; L75-V79 PolarHBondContact O-N 3.47Å; L75-L950 HydrophobicContact CD1-CD2 4.35Å
76	F	42.5	Very low	39.9	Very low	7 Å²	7	27.2 Å²	27.2	3%	0.031	15%	0.147	C	C	.	.	H	α-helix	trans	-70.3	-40.5	172.6	173.7	-103.7	0	0	0	112	L72 L73 V79 S80 V202 V203 S207 L963 M966 L967	L72-F76 WeakPolarHBondContact O-CA 3.47Å; L72-F76 WeakPolarHBondContact O-CB 3.42Å; L72-F76 PolarHBondContact O-N 3.49Å; L73-F76 HydrophobicContact CD1-CD1 4.19Å; L73-F76 CarbonylContact O-C 3.55Å; L73-F76 PolarHBondContact O-N 3.28Å; F76-V79 CarbonylContact O-C 3.37Å; F76-V79 PolarHBondContact O-N 2.63Å; F76-S80 VanDerWaalsContact CE2-OG 3.3Å; F76-S80 WeakPolarHBondContact CE2-OG 3.22Å; F76-S80 WeakPolarHBondContact CZ-OG 3.42Å; F76-S80 WeakPolarHBondContact O-CA 3.42Å; F76-S80 WeakPolarHBondContact O-CB 3.47Å; F76-S80 PolarHBondContact O-N 3.14Å; F76-S80 PolarHBondContact O-OG 3.08Å; F76-V202 HydrophobicContact CE1-CG1 4.05Å; F76-V202 HydrophobicContact CZ-CG1 4.03Å; F76-V203 HydrophobicContact CD1-CG2 4.45Å; F76-V203 HydrophobicContact CE1-CG2 4.29Å; F76-S207 VanDerWaalsContact CD1-OG 3.24Å; F76-S207 WeakPolarHBondContact CD1-OG 3.35Å; F76-S207 VanDerWaalsContact CD2-OG 3.25Å; F76-S207 WeakPolarHBondContact CD2-OG 3.26Å; F76-S207 WeakPolarHBondContact CE1-OG 3.39Å; F76-S207 WeakPolarHBondContact CE2-OG 3.42Å; F76-S207 WeakPolarHBondContact CG-OG 3.47Å; F76-S207 WeakPolarHBondContact CZ-OG 3.45Å; F76-L963 HydrophobicContact CD2-CD1 3.86Å; F76-L963 HydrophobicContact CD2-CD2 3.63Å; F76-L963 HydrophobicContact CD2-CG 4.21Å; F76-L963 HydrophobicContact CE2-CB 4.23Å; F76-L963 HydrophobicContact CE2-CD1 4.32Å; F76-L963 HydrophobicContact CE2-CD2 3.62Å; F76-L963 HydrophobicContact CE2-CG 4.25Å; F76-M966 HydrophobicContact CE2-CE 3.74Å; F76-M966 HydrophobicContact CZ-CE 3.54Å; F76-L967 HydrophobicContact CE2-CD1 4.45Å; F76-L967 HydrophobicContact CZ-CD1 4.43Å; F76-L967 HydrophobicContact CZ-CD2 3.86Å; F76-L967 HydrophobicContact CZ-CG 4.25Å
77	I	42.2	Very low	40.1	Very low	5 Å²	5	27.4 Å²	27.4	3%	0.026	15%	0.148	C	C	.	.	H	α-helix	trans	-67.9	-50.4	171.9	-69.6	152.4	0	0	0	107.7	L73 V79 S80 F81 I876 F877	L73-I77 HydrophobicContact CD1-CD1 3.46Å; L73-I77 VanDerWaalsContact CD1-CD1 3.46Å; L73-I77 HydrophobicContact CD1-CG1 3.72Å; L73-I77 HydrophobicContact CD2-CD1 4.31Å; L73-I77 HydrophobicContact CG-CD1 3.47Å; L73-I77 VanDerWaalsContact CG-CD1 3.47Å; L73-I77 HydrophobicContact CG-CG1 4.26Å; L73-I77 WeakPolarHBondContact O-CA 3.5Å; L73-I77 VanDerWaalsContact O-CB 3.23Å; L73-I77 WeakPolarHBondContact O-CB 3.29Å; L73-I77 WeakPolarHBondContact O-CD1 3.47Å; L73-I77 WeakPolarHBondContact O-CG1 3.42Å; L73-I77 PolarHBondContact O-N 3.37Å; I77-V79 PolarHBondContact O-N 3.44Å; I77-S80 CarbonylContact O-C 3.47Å; I77-S80 PolarHBondContact O-N 3.25Å; I77-S80 VanDerWaalsContact O-N 3.16Å; I77-F81 HydrophobicContact CG2-CB 4.24Å; I77-F81 VanDerWaalsContact O-CA 3.23Å; I77-F81 WeakPolarHBondContact O-CA 3.42Å; I77-F81 WeakPolarHBondContact O-CB 3.34Å; I77-F81 PolarHBondContact O-N 2.79Å; I77-I876 HydrophobicContact CB-CG2 4.43Å; I77-I876 HydrophobicContact CD1-CB 4.15Å; I77-I876 HydrophobicContact CD1-CD1 3.19Å; I77-I876 HydrophobicContact CD1-CG1 3.85Å; I77-I876 HydrophobicContact CD1-CG2 3.38Å; I77-I876 HydrophobicContact CG1-CG2 3.87Å; I77-I876 HydrophobicContact CG2-CG2 3.75Å; I77-F877 HydrophobicContact CG1-CE2 4.36Å; I77-F877 HydrophobicContact CG1-CZ 4.13Å
78	Y	40.7	Very low	40.3	Very low	81 Å²	81	26.3 Å²	26.3	32%	0.318	15%	0.145	S	C	.	.	H	α-helix	trans	-62.2	-26.7	175	-67.6	-43.7	0	0	0	111.6	K74 L75 A82	K74-Y78 HydrophobicContact CB-CD2 4.04Å; K74-Y78 HydrophobicContact CB-CE2 3.78Å; K74-Y78 HydrophobicContact CG-CE2 4.43Å; K74-Y78 WeakPolarHBondContact O-CA 3.33Å; K74-Y78 WeakPolarHBondContact O-CB 3.38Å; K74-Y78 WeakPolarHBondContact O-CD2 3.29Å; K74-Y78 PolarHBondContact O-N 3.09Å; L75-Y78 CarbonylContact O-C 3.58Å; Y78-A82 VanDerWaalsContact O-CA 3.22Å; Y78-A82 WeakPolarHBondContact O-CA 3.47Å; Y78-A82 WeakPolarHBondContact O-CB 3.36Å; Y78-A82 PolarHBondContact O-N 3.12Å
79	V	41.8	Very low	40.2	Very low	16 Å²	16	26 Å²	26	10%	0.097	14%	0.143	C	C	.	.	H	α-helix	trans	-82.3	-34.6	173.8	164.2	0	0	0	0	111.5	L75 F76 I77 L83 L290 I960 L963	L75-V79 HydrophobicContact CD2-CG2 3.99Å; L75-V79 WeakPolarHBondContact O-CA 3.38Å; L75-V79 WeakPolarHBondContact O-CB 3.43Å; L75-V79 WeakPolarHBondContact O-CG2 3.47Å; L75-V79 PolarHBondContact O-N 3.47Å; F76-V79 CarbonylContact O-C 3.37Å; F76-V79 PolarHBondContact O-N 2.63Å; I77-V79 PolarHBondContact O-N 3.44Å; V79-L83 WeakPolarHBondContact O-CA 3.14Å; V79-L83 WeakPolarHBondContact O-CB 3.43Å; V79-L83 PolarHBondContact O-N 3.3Å; V79-L290 HydrophobicContact CG1-CD1 4.27Å; V79-L290 HydrophobicContact CG2-CD1 4.41Å; V79-I960 HydrophobicContact CG1-CG1 4.47Å; V79-L963 HydrophobicContact CG1-CD1 4.24Å
80	S	39.4	Very low	40.3	Very low	22 Å²	22	25.5 Å²	25.5	15%	0.154	14%	0.14	C	C	.	.	H	α-helix	trans	-79.6	-35.3	177.5	-58.9	0	0	0	0	111.7	F76 I77 L83 L84	F76-S80 VanDerWaalsContact CE2-OG 3.3Å; F76-S80 WeakPolarHBondContact CE2-OG 3.22Å; F76-S80 WeakPolarHBondContact CZ-OG 3.42Å; F76-S80 WeakPolarHBondContact O-CA 3.42Å; F76-S80 WeakPolarHBondContact O-CB 3.47Å; F76-S80 PolarHBondContact O-N 3.14Å; F76-S80 PolarHBondContact O-OG 3.08Å; I77-S80 CarbonylContact O-C 3.47Å; I77-S80 PolarHBondContact O-N 3.25Å; I77-S80 VanDerWaalsContact O-N 3.16Å; S80-L83 CarbonylContact O-C 3.54Å; S80-L83 WeakPolarHBondContact O-CA 3.45Å; S80-L83 VanDerWaalsContact O-CB 3.24Å; S80-L83 WeakPolarHBondContact O-CB 3.21Å; S80-L83 PolarHBondContact O-N 2.78Å; S80-L84 VanDerWaalsContact O-CB 3.27Å; S80-L84 WeakPolarHBondContact O-CB 3.3Å; S80-L84 PolarHBondContact O-N 3.48Å
81	F	41.6	Very low	40.3	Very low	32 Å²	32	28.9 Å²	28.9	14%	0.14	15%	0.153	C	C	.	.	H	α-helix	trans	-83.2	-38.1	175.3	180	-105.1	0	0	0	110.2	I77 L83 L84 C85 Y885	I77-F81 HydrophobicContact CG2-CB 4.24Å; I77-F81 VanDerWaalsContact O-CA 3.23Å; I77-F81 WeakPolarHBondContact O-CA 3.42Å; I77-F81 WeakPolarHBondContact O-CB 3.34Å; I77-F81 PolarHBondContact O-N 2.79Å; F81-L83 VanDerWaalsContact C-N 3.25Å; F81-L84 PolarHBondContact O-N 3.14Å; F81-C85 HydrophobicContact CE1-CB 4.29Å; F81-C85 HydrophobicContact CE2-CB 4.29Å; F81-C85 WeakPolarHBondContact CE2-SG 3.42Å; F81-C85 HydrophobicContact CZ-CB 3.93Å; F81-C85 WeakPolarHBondContact CZ-SG 3.3Å; F81-C85 WeakPolarHBondContact O-CA 3.32Å; F81-C85 WeakPolarHBondContact O-CB 3.41Å; F81-C85 PolarHBondContact O-N 3.28Å; F81-Y885 AromaticContact CD1-CD1 3.95Å; F81-Y885 HydrophobicContact CD1-CD1 3.95Å; F81-Y885 HydrophobicContact CD1-CD2 4.34Å; F81-Y885 HydrophobicContact CD1-CE1 4.46Å; F81-Y885 AromaticContact CD1-CG 3.9Å; F81-Y885 HydrophobicContact CD1-CG 3.9Å; F81-Y885 AromaticContact CD2-CD2 3.55Å; F81-Y885 HydrophobicContact CD2-CD2 3.55Å; F81-Y885 HydrophobicContact CD2-CE2 4.29Å; F81-Y885 AromaticContact CD2-CG 3.74Å; F81-Y885 HydrophobicContact CD2-CG 3.74Å; F81-Y885 AromaticContact CE1-CD1 3.66Å; F81-Y885 HydrophobicContact CE1-CD1 3.66Å; F81-Y885 HydrophobicContact CE1-CD2 4.33Å; F81-Y885 AromaticContact CE1-CG 3.53Å; F81-Y885 HydrophobicContact CE1-CG 3.53Å; F81-Y885 HydrophobicContact CE2-CD1 4.36Å; F81-Y885 AromaticContact CE2-CD2 3.58Å; F81-Y885 HydrophobicContact CE2-CD2 3.58Å; F81-Y885 AromaticContact CE2-CG 3.4Å; F81-Y885 HydrophobicContact CE2-CG 3.4Å; F81-Y885 HydrophobicContact CG-CD1 4.41Å; F81-Y885 AromaticContact CG-CD2 4Å; F81-Y885 HydrophobicContact CG-CD2 4Å; F81-Y885 HydrophobicContact CG-CE2 4.43Å; F81-Y885 HydrophobicContact CG-CG 4.01Å; F81-Y885 AromaticContact CZ-CD1 3.93Å; F81-Y885 HydrophobicContact CZ-CD1 3.93Å; F81-Y885 AromaticContact CZ-CD2 4Å; F81-Y885 HydrophobicContact CZ-CD2 4Å; F81-Y885 AromaticContact CZ-CG 3.3Å; F81-Y885 HydrophobicContact CZ-CG 3.3Å; F81-Y885 WeakPolarHBondContact CZ-O 3.47Å
82	A	40.2	Very low	40.1	Very low	26 Å²	26	26.5 Å²	26.5	22%	0.215	14%	0.139	C	C	.	.	H	α-helix	trans	-64	-35.8	158.9	0	0	0	0	0	108.9	Y78 L84 F86 L290	Y78-A82 VanDerWaalsContact O-CA 3.22Å; Y78-A82 WeakPolarHBondContact O-CA 3.47Å; Y78-A82 WeakPolarHBondContact O-CB 3.36Å; Y78-A82 PolarHBondContact O-N 3.12Å; A82-L84 VanDerWaalsContact C-N 3.29Å; A82-L84 PolarHBondContact O-N 2.85Å; A82-F86 VanDerWaalsContact O-CA 3.23Å; A82-F86 WeakPolarHBondContact O-CA 3.32Å; A82-F86 WeakPolarHBondContact O-CB 3.09Å; A82-F86 PolarHBondContact O-N 3.03Å; A82-L290 HydrophobicContact CB-CD1 3.95Å; A82-L290 HydrophobicContact CB-CD2 3.84Å; A82-L290 HydrophobicContact CB-CG 4.4Å
83	L	40.3	Very low	39.8	Very low	13 Å²	13	29 Å²	29	7%	0.068	15%	0.152	C	C	.	.	H	α-helix	trans	-60.1	-42	173.5	-131.2	94.2	0	0	0	111.1	V79 S80 F81 L87 L286 I960 M964 L967	V79-L83 WeakPolarHBondContact O-CA 3.14Å; V79-L83 WeakPolarHBondContact O-CB 3.43Å; V79-L83 PolarHBondContact O-N 3.3Å; S80-L83 CarbonylContact O-C 3.54Å; S80-L83 WeakPolarHBondContact O-CA 3.45Å; S80-L83 VanDerWaalsContact O-CB 3.24Å; S80-L83 WeakPolarHBondContact O-CB 3.21Å; S80-L83 PolarHBondContact O-N 2.78Å; F81-L83 VanDerWaalsContact C-N 3.25Å; L83-L87 HydrophobicContact CD2-CD1 4.47Å; L83-L87 WeakPolarHBondContact O-CA 3.49Å; L83-L87 WeakPolarHBondContact O-CB 3.21Å; L83-L87 WeakPolarHBondContact O-CD1 3.3Å; L83-L87 WeakPolarHBondContact O-CG 3.49Å; L83-L87 PolarHBondContact O-N 2.8Å; L83-L286 HydrophobicContact CB-CD2 4.12Å; L83-L286 HydrophobicContact CD1-CD2 3.61Å; L83-L286 HydrophobicContact CD1-CG 4.33Å; L83-L286 HydrophobicContact CG-CD2 3.49Å; L83-L286 VanDerWaalsContact CG-CD2 3.49Å; L83-I960 HydrophobicContact CD1-CG2 4.31Å; L83-M964 HydrophobicContact CD2-CB 4.36Å; L83-M964 HydrophobicContact CD2-CG 3.95Å; L83-M964 HydrophobicContact CD2-SD 4.2Å; L83-L967 HydrophobicContact CD2-CD1 4.34Å
84	L	42.5	Very low	39.6	Very low	77 Å²	77	29.3 Å²	29.3	40%	0.403	15%	0.153	S	C	.	.	H	α-helix	trans	-80.1	-42.5	-176.1	-163.4	141.5	0	0	0	112.4	S80 F81 A82 F86 L87 A88	S80-L84 VanDerWaalsContact O-CB 3.27Å; S80-L84 WeakPolarHBondContact O-CB 3.3Å; S80-L84 PolarHBondContact O-N 3.48Å; F81-L84 PolarHBondContact O-N 3.14Å; A82-L84 VanDerWaalsContact C-N 3.29Å; A82-L84 PolarHBondContact O-N 2.85Å; L84-F86 VanDerWaalsContact C-N 3.34Å; L84-L87 PolarHBondContact O-N 3.24Å; L84-A88 WeakPolarHBondContact O-CB 3.37Å; L84-A88 PolarHBondContact O-N 3.48Å
85	C	39	Very low	39.5	Very low	14 Å²	14	31.6 Å²	31.6	10%	0.095	17%	0.168	C	C	.	.	H	α-helix	trans	-77.5	-16.9	172.4	-83.1	0	0	0	0	113.9	F81 G89 F889	F81-C85 HydrophobicContact CE1-CB 4.29Å; F81-C85 HydrophobicContact CE2-CB 4.29Å; F81-C85 WeakPolarHBondContact CE2-SG 3.42Å; F81-C85 HydrophobicContact CZ-CB 3.93Å; F81-C85 WeakPolarHBondContact CZ-SG 3.3Å; F81-C85 WeakPolarHBondContact O-CA 3.32Å; F81-C85 WeakPolarHBondContact O-CB 3.41Å; F81-C85 PolarHBondContact O-N 3.28Å; C85-G89 WeakPolarHBondContact O-CA 3.32Å; C85-G89 PolarHBondContact O-N 3.19Å; C85-F889 HydrophobicContact CB-CB 3.99Å; C85-F889 HydrophobicContact CB-CD2 3.78Å; C85-F889 HydrophobicContact CB-CG 4Å; C85-F889 WeakPolarHBondContact O-CD2 3.32Å; C85-F889 WeakPolarHBondContact O-CE2 3.48Å
86	F	40	Very low	39.4	Very low	20 Å²	20	33.2 Å²	33.2	9%	0.088	17%	0.171	C	C	.	.	H	α-helix	trans	-91.1	-29.8	166.2	-175.5	-76.9	0	0	0	109.7	A82 L84 A88 G89 S90 L93 V282 P285 L286	A82-F86 VanDerWaalsContact O-CA 3.23Å; A82-F86 WeakPolarHBondContact O-CA 3.32Å; A82-F86 WeakPolarHBondContact O-CB 3.09Å; A82-F86 PolarHBondContact O-N 3.03Å; L84-F86 VanDerWaalsContact C-N 3.34Å; F86-A88 PolarHBondContact O-N 3.32Å; F86-G89 CarbonylContact O-C 3.56Å; F86-G89 PolarHBondContact O-N 3.12Å; F86-G89 VanDerWaalsContact O-N 3.11Å; F86-S90 VanDerWaalsContact CD1-CB 3.44Å; F86-S90 WeakPolarHBondContact CD1-OG 3.47Å; F86-S90 WeakPolarHBondContact CD2-OG 3.27Å; F86-S90 WeakPolarHBondContact CE1-OG 3.45Å; F86-S90 WeakPolarHBondContact CE2-OG 3.4Å; F86-S90 WeakPolarHBondContact CG-OG 3.22Å; F86-S90 WeakPolarHBondContact CZ-OG 3.09Å; F86-S90 VanDerWaalsContact O-CA 3.32Å; F86-S90 WeakPolarHBondContact O-CA 3.24Å; F86-S90 WeakPolarHBondContact O-CB 3.44Å; F86-S90 PolarHBondContact O-N 3.21Å; F86-S90 PolarHBondContact O-OG 3.09Å; F86-L93 HydrophobicContact CE2-CD1 3.92Å; F86-L93 HydrophobicContact CZ-CD1 4.28Å; F86-V282 HydrophobicContact CD1-CG1 4.21Å; F86-V282 HydrophobicContact CE1-CG1 4.23Å; F86-V282 WeakPolarHBondContact CE1-O 3.28Å; F86-V282 WeakPolarHBondContact CZ-O 3.43Å; F86-V282 WeakPolarHBondContact O-CG1 3.36Å; F86-P285 HydrophobicContact CE2-CB 4.46Å; F86-P285 HydrophobicContact CZ-CB 3.79Å; F86-P285 HydrophobicContact CZ-CG 4.01Å; F86-L286 HydrophobicContact CB-CD1 3.34Å; F86-L286 HydrophobicContact CB-CD2 4.05Å; F86-L286 HydrophobicContact CB-CG 4.13Å; F86-L286 HydrophobicContact CD1-CB 3.15Å; F86-L286 HydrophobicContact CD1-CD1 3.43Å; F86-L286 VanDerWaalsContact CD1-CD1 3.43Å; F86-L286 HydrophobicContact CD1-CD2 3.45Å; F86-L286 VanDerWaalsContact CD1-CD2 3.45Å; F86-L286 HydrophobicContact CD1-CG 3.42Å; F86-L286 VanDerWaalsContact CD1-CG 3.42Å; F86-L286 HydrophobicContact CD2-CB 4.28Å; F86-L286 HydrophobicContact CD2-CD1 3.59Å; F86-L286 HydrophobicContact CD2-CG 4.38Å; F86-L286 HydrophobicContact CE1-CB 3.01Å; F86-L286 HydrophobicContact CE1-CD1 4.1Å; F86-L286 HydrophobicContact CE1-CD2 4.16Å; F86-L286 HydrophobicContact CE1-CG 3.85Å; F86-L286 VanDerWaalsContact CE2-CA 3.42Å; F86-L286 HydrophobicContact CE2-CB 4.14Å; F86-L286 HydrophobicContact CE2-CD1 4.22Å; F86-L286 HydrophobicContact CG-CB 3.85Å; F86-L286 HydrophobicContact CG-CD1 3.2Å; F86-L286 HydrophobicContact CG-CD2 4.02Å; F86-L286 HydrophobicContact CG-CG 3.78Å; F86-L286 HydrophobicContact CZ-CB 3.59Å; F86-L286 HydrophobicContact CZ-CD1 4.49Å
87	L	40.3	Very low	38.8	Very low	47 Å²	47	37.8 Å²	37.8	25%	0.246	19%	0.191	C	C	.	.	H	α-helix	trans	-57.4	-43	166.2	-83.3	165.2	0	0	0	110.1	L83 L84 F91 L255 V282 L283	L83-L87 HydrophobicContact CD2-CD1 4.47Å; L83-L87 WeakPolarHBondContact O-CA 3.49Å; L83-L87 WeakPolarHBondContact O-CB 3.21Å; L83-L87 WeakPolarHBondContact O-CD1 3.3Å; L83-L87 WeakPolarHBondContact O-CG 3.49Å; L83-L87 PolarHBondContact O-N 2.8Å; L84-L87 PolarHBondContact O-N 3.24Å; L87-F91 WeakPolarHBondContact O-CB 3.46Å; L87-F91 PolarHBondContact O-N 3.41Å; L87-L255 HydrophobicContact CD1-CD1 4.27Å; L87-L255 HydrophobicContact CD2-CD1 3.92Å; L87-V282 HydrophobicContact CB-CG1 4.31Å; L87-V282 HydrophobicContact CD2-CG1 3.65Å; L87-V282 HydrophobicContact CG-CG1 4.27Å; L87-V282 WeakPolarHBondContact O-CG1 3.32Å; L87-L283 HydrophobicContact CD2-CD2 3.4Å; L87-L283 VanDerWaalsContact CD2-CD2 3.4Å; L87-L283 HydrophobicContact CD2-CG 4.19Å; L87-L283 HydrophobicContact CG-CD2 4.26Å
88	A	43	Very low	38.1	Very low	28 Å²	28	42 Å²	42	23%	0.231	22%	0.221	C	C	.	.	H	α-helix	trans	-75.1	-33.3	169.1	0	0	0	0	0	113.8	L84 F86 S90 F91 V92	L84-A88 WeakPolarHBondContact O-CB 3.37Å; L84-A88 PolarHBondContact O-N 3.48Å; F86-A88 PolarHBondContact O-N 3.32Å; A88-S90 VanDerWaalsContact C-N 3.34Å; A88-F91 WeakPolarHBondContact O-CB 3.49Å; A88-V92 WeakPolarHBondContact O-CG2 3.27Å
89	G	36.3	Very low	37.8	Very low	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-78.2	-16.8	-178.2	0	0	0	0	0	116.9	C85 F86 V92 L93 F893	C85-G89 WeakPolarHBondContact O-CA 3.32Å; C85-G89 PolarHBondContact O-N 3.19Å; F86-G89 CarbonylContact O-C 3.56Å; F86-G89 PolarHBondContact O-N 3.12Å; F86-G89 VanDerWaalsContact O-N 3.11Å; G89-V92 CarbonylContact O-C 3.4Å; G89-V92 WeakPolarHBondContact O-CA 3.47Å; G89-V92 WeakPolarHBondContact O-CB 3.39Å; G89-V92 VanDerWaalsContact O-CG1 3.32Å; G89-V92 WeakPolarHBondContact O-CG1 2.97Å; G89-V92 PolarHBondContact O-N 3.48Å; G89-L93 PolarHBondContact O-N 3.38Å; G89-F893 WeakPolarHBondContact O-CE1 3.12Å; G89-F893 VanDerWaalsContact O-CZ 3.25Å; G89-F893 WeakPolarHBondContact O-CZ 3.48Å
90	S	36.3	Very low	37.1	Very low	0 Å²	0	50 Å²	50	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-121.6	-7.8	-172.3	-50.3	0	0	0	0	109.2	F86 A88 V92 L94 K281 V282	F86-S90 VanDerWaalsContact CD1-CB 3.44Å; F86-S90 WeakPolarHBondContact CD1-OG 3.47Å; F86-S90 WeakPolarHBondContact CD2-OG 3.27Å; F86-S90 WeakPolarHBondContact CE1-OG 3.45Å; F86-S90 WeakPolarHBondContact CE2-OG 3.4Å; F86-S90 WeakPolarHBondContact CG-OG 3.22Å; F86-S90 WeakPolarHBondContact CZ-OG 3.09Å; F86-S90 VanDerWaalsContact O-CA 3.32Å; F86-S90 WeakPolarHBondContact O-CA 3.24Å; F86-S90 WeakPolarHBondContact O-CB 3.44Å; F86-S90 PolarHBondContact O-N 3.21Å; F86-S90 PolarHBondContact O-OG 3.09Å; A88-S90 VanDerWaalsContact C-N 3.34Å; S90-V92 PolarHBondContact O-N 3.24Å; S90-L94 WeakPolarHBondContact O-CB 2.97Å; S90-L94 WeakPolarHBondContact O-CD1 3.27Å; S90-L94 VanDerWaalsContact O-CG 3.28Å; S90-L94 WeakPolarHBondContact O-CG 3.26Å; S90-L94 PolarHBondContact O-N 3.36Å; S90-K281 CarbonylContact C-O 3.48Å; S90-K281 WeakPolarHBondContact CA-O 3.36Å; S90-K281 WeakPolarHBondContact CB-O 3.28Å; S90-K281 CarbonylContact O-C 3.35Å; S90-V282 WeakPolarHBondContact O-CG2 3.5Å
91	F	37.7	Very low	36.7	Very low	83 Å²	83	59.1 Å²	59.1	36%	0.364	31%	0.311	S	S	.	.	H	α-helix	trans	-56.5	-27.5	141	-171.3	-99.8	0	0	0	110.5	L87 A88 L94 V282	L87-F91 WeakPolarHBondContact O-CB 3.46Å; L87-F91 PolarHBondContact O-N 3.41Å; A88-F91 WeakPolarHBondContact O-CB 3.49Å; F91-L94 WeakPolarHBondContact O-CB 3.41Å; F91-V282 VanDerWaalsContact N-CG2 3.26Å
92	V	37.3	Very low	36	Very low	2 Å²	2	61.1 Å²	61.1	1%	0.012	33%	0.326	C	S	.	.	H	α-helix	trans	-94.5	-40.5	-179.1	149.5	0	0	0	0	111.9	A88 G89 S90 L94 V95 A156 Y160 F893 W894	A88-V92 WeakPolarHBondContact O-CG2 3.27Å; G89-V92 CarbonylContact O-C 3.4Å; G89-V92 WeakPolarHBondContact O-CA 3.47Å; G89-V92 WeakPolarHBondContact O-CB 3.39Å; G89-V92 VanDerWaalsContact O-CG1 3.32Å; G89-V92 WeakPolarHBondContact O-CG1 2.97Å; G89-V92 PolarHBondContact O-N 3.48Å; S90-V92 PolarHBondContact O-N 3.24Å; V92-L94 PolarHBondContact O-N 2.92Å; V92-V95 PolarHBondContact O-N 3.03Å; V92-A156 HydrophobicContact CG2-CB 4Å; V92-Y160 HydrophobicContact CB-CE2 3.85Å; V92-Y160 HydrophobicContact CG1-CE2 3.58Å; V92-Y160 VanDerWaalsContact CG1-OH 3.32Å; V92-Y160 WeakPolarHBondContact CG1-OH 3.5Å; V92-Y160 HydrophobicContact CG2-CD2 4.34Å; V92-Y160 HydrophobicContact CG2-CE2 3.94Å; V92-Y160 WeakPolarHBondContact O-CE1 3.43Å; V92-Y160 WeakPolarHBondContact O-CE2 3.34Å; V92-Y160 PolarHBondContact O-OH 2.83Å; V92-F893 HydrophobicContact CB-CD1 4.45Å; V92-F893 HydrophobicContact CG1-CB 4.24Å; V92-F893 HydrophobicContact CG1-CD1 3.12Å; V92-F893 HydrophobicContact CG1-CE1 3.48Å; V92-F893 VanDerWaalsContact CG1-CE1 3.48Å; V92-F893 HydrophobicContact CG1-CG 3.78Å; V92-F893 HydrophobicContact CG1-CZ 4.41Å; V92-W894 HydrophobicContact CB-CH2 4.21Å; V92-W894 HydrophobicContact CG1-CH2 3.65Å; V92-W894 HydrophobicContact CG1-CZ2 4.31Å; V92-W894 HydrophobicContact CG1-CZ3 4.05Å; V92-W894 HydrophobicContact CG2-CH2 3.53Å; V92-W894 HydrophobicContact CG2-CZ2 4.47Å; V92-W894 HydrophobicContact CG2-CZ3 4.24Å
93	L	33.7	Very low	35.3	Very low	59 Å²	59	64.8 Å²	64.8	31%	0.309	35%	0.35	S	S	.	.	H	α-helix	trans	-67.7	-21.2	167.9	-68.5	176.7	0	0	0	113.5	F86 G89 V95 R96 F893	F86-L93 HydrophobicContact CE2-CD1 3.92Å; F86-L93 HydrophobicContact CZ-CD1 4.28Å; G89-L93 PolarHBondContact O-N 3.38Å; L93-V95 PolarHBondContact O-N 3.15Å; L93-R96 CarbonylContact O-C 3.44Å; L93-R96 PolarHBondContact O-N 3.02Å; L93-R96 VanDerWaalsContact O-O 3.08Å; L93-F893 HydrophobicContact CD1-CE1 4.47Å; L93-F893 HydrophobicContact CD1-CZ 4.46Å; L93-F893 HydrophobicContact CD2-CE1 3.78Å; L93-F893 HydrophobicContact CG-CE1 3.74Å; L93-F893 HydrophobicContact CG-CZ 4.17Å
94	L	36.7	Very low	34.6	Very low	25 Å²	25	69 Å²	69	13%	0.131	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-24.8	168.9	-103.1	159.4	0	0	0	114.7	S90 F91 V92 V277 K281 V282	S90-L94 WeakPolarHBondContact O-CB 2.97Å; S90-L94 WeakPolarHBondContact O-CD1 3.27Å; S90-L94 VanDerWaalsContact O-CG 3.28Å; S90-L94 WeakPolarHBondContact O-CG 3.26Å; S90-L94 PolarHBondContact O-N 3.36Å; F91-L94 WeakPolarHBondContact O-CB 3.41Å; V92-L94 PolarHBondContact O-N 2.92Å; L94-V277 VanDerWaalsContact CD1-C 3.49Å; L94-V277 HydrophobicContact CD1-CB 4.09Å; L94-V277 HydrophobicContact CD1-CG1 3.19Å; L94-V277 WeakPolarHBondContact CD1-O 3.34Å; L94-V277 VanDerWaalsContact CD2-CA 3.43Å; L94-V277 HydrophobicContact CD2-CB 3.7Å; L94-V277 HydrophobicContact CD2-CG1 3.56Å; L94-V277 HydrophobicContact CD2-CG2 3.96Å; L94-V277 WeakPolarHBondContact CD2-O 3.16Å; L94-V277 HydrophobicContact CG-CG1 3.95Å; L94-V277 WeakPolarHBondContact CG-O 3.43Å; L94-K281 HydrophobicContact CB-CB 4.11Å; L94-K281 HydrophobicContact CB-CG 4.24Å; L94-K281 HydrophobicContact CD2-CB 3.74Å; L94-K281 HydrophobicContact CD2-CD 4.43Å; L94-K281 HydrophobicContact CD2-CG 3.14Å; L94-K281 HydrophobicContact CG-CB 3.53Å; L94-K281 HydrophobicContact CG-CG 3.58Å; L94-V282 HydrophobicContact CD1-CG2 3.59Å; L94-V282 HydrophobicContact CG-CG2 4.49Å
95	V	38.4	Very low	34.2	Very low	62 Å²	62	74.1 Å²	74.1	38%	0.376	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.6	5.2	-171.7	-160.3	0	0	0	0	112.9	V92 L93 Y160	V92-V95 PolarHBondContact O-N 3.03Å; L93-V95 PolarHBondContact O-N 3.15Å; V95-Y160 VanDerWaalsContact C-CD1 3.44Å; V95-Y160 VanDerWaalsContact CB-CB 3.42Å; V95-Y160 HydrophobicContact CB-CD1 3.17Å; V95-Y160 HydrophobicContact CB-CD2 4.4Å; V95-Y160 HydrophobicContact CB-CE1 3.8Å; V95-Y160 HydrophobicContact CB-CG 3.43Å; V95-Y160 VanDerWaalsContact CB-CG 3.43Å; V95-Y160 HydrophobicContact CG1-CD1 3.46Å; V95-Y160 VanDerWaalsContact CG1-CD1 3.46Å; V95-Y160 HydrophobicContact CG1-CE1 4.42Å; V95-Y160 HydrophobicContact CG1-CG 3.77Å; V95-Y160 WeakPolarHBondContact CG1-O 3.22Å; V95-Y160 HydrophobicContact CG2-CD1 4.36Å; V95-Y160 HydrophobicContact CG2-CG 4.2Å; V95-Y160 WeakPolarHBondContact O-CD1 3.36Å; V95-Y160 WeakPolarHBondContact O-CE1 3.41Å
96	R	36.8	Very low	33.8	Very low	79 Å²	79	79.9 Å²	79.9	30%	0.298	43%	0.429	S	S	.	.	S	Bend	trans	-146.3	116.6	163.1	-101.4	-171.4	162	59.9	-19.3	109.5	L93 Y160 L899	L93-R96 CarbonylContact O-C 3.44Å; L93-R96 PolarHBondContact O-N 3.02Å; L93-R96 VanDerWaalsContact O-O 3.08Å; R96-Y160 HydrophobicContact CB-CE1 3.62Å; R96-Y160 HydrophobicContact CG-CD1 4.49Å; R96-Y160 HydrophobicContact CG-CE1 3.64Å; R96-L899 VanDerWaalsContact CD-CG 3.41Å; R96-L899 HydrophobicContact CG-CD2 4.12Å
97	K	31.6	Very low	33.7	Very low	103 Å²	103	89.7 Å²	89.7	45%	0.448	47%	0.465	S	S	.	.	S	Bend	cis	-153	171.7	-4.7	-43.4	-173.3	-167.6	105.6	0	104.2	H902	K97-H902 WeakPolarHBondContact CB-NE2 3.28Å; K97-H902 VanDerWaalsContact CD-CD2 3.49Å; K97-H902 WeakPolarHBondContact CD-CD2 3.4Å; K97-H902 WeakPolarHBondContact CD-NE2 3.16Å; K97-H902 WeakPolarHBondContact CG-CE1 3.05Å; K97-H902 WeakPolarHBondContact CG-NE2 3.22Å; K97-H902 PolarHBondContact NZ-CD2 3.34Å; K97-H902 PolarHBondContact NZ-NE2 3.28Å
98	S	27.1	Very low	33.9	Very low	92 Å²	92	94 Å²	94	64%	0.643	49%	0.489	S	S	*	.			cis	-104.5	164.8	36.6	-58.3	0	0	0	0	113.4	L100	S98-L100 PolarHBondContact O-N 3.47Å
99	P	33.1	Very low	33.7	Very low	119 Å²	119	103.3 Å²	103.3	77%	0.773	52%	0.518	S	S	*	.			trans	-50.9	135.5	163.7	25.7	-35	0	0	0	107.5	K101	P99-K101 PolarHBondContact O-N 2.86Å
100	L	27.6	Very low	34	Very low	148 Å²	148	115.9 Å²	115.9	78%	0.775	57%	0.565	S	S	*	*			trans	-42.6	116.2	164.2	-76.8	154.4	0	0	0	108.2	S98 V102	S98-L100 PolarHBondContact O-N 3.47Å; L100-V102 HydrophobicContact CB-CB 4.21Å; L100-V102 HydrophobicContact CB-CG2 3.61Å; L100-V102 HydrophobicContact CD1-CG2 3.96Å; L100-V102 HydrophobicContact CD2-CG2 4.15Å; L100-V102 HydrophobicContact CG-CG2 4.12Å; L100-V102 PolarHBondContact O-N 2.75Å
101	K	30.7	Very low	34.6	Very low	212 Å²	212	122.9 Å²	122.9	92%	0.922	60%	0.598	S	S	*	*			trans	-69.7	70.2	136.5	-99.9	-174.6	178.2	178.2	0	105.3	P99 S103	P99-K101 PolarHBondContact O-N 2.86Å; K101-S103 PolarHBondContact O-N 3.12Å
102	V	27.7	Very low	35.1	Very low	74 Å²	74	123.1 Å²	123.1	45%	0.448	61%	0.61	S	S	.	*			trans	-50.5	120.4	136.6	162.9	0	0	0	0	101.3	L100 C104	L100-V102 HydrophobicContact CB-CB 4.21Å; L100-V102 HydrophobicContact CB-CG2 3.61Å; L100-V102 HydrophobicContact CD1-CG2 3.96Å; L100-V102 HydrophobicContact CD2-CG2 4.15Å; L100-V102 HydrophobicContact CG-CG2 4.12Å; L100-V102 PolarHBondContact O-N 2.75Å; V102-C104 VanDerWaalsContact C-N 3.35Å; V102-C104 PolarHBondContact O-N 3.28Å
103	S	25.5	Very low	36	Very low	103 Å²	103	126.6 Å²	126.6	72%	0.72	64%	0.639	S	S	*	*			trans	-36.1	112.5	161.5	49.3	0	0	0	0	105.4	K101 F105	K101-S103 PolarHBondContact O-N 3.12Å; S103-F105 PolarHBondContact O-N 3.5Å
104	C	26	Very low	36.7	Very low	102 Å²	102	127.2 Å²	127.2	69%	0.689	65%	0.653	S	S	*	*			trans	-39	113.7	-172.7	-164	0	0	0	0	105.8	V102 D106	V102-C104 VanDerWaalsContact C-N 3.35Å; V102-C104 PolarHBondContact O-N 3.28Å; C104-D106 PolarHBondContact O-N 3.16Å
105	F	34.1	Very low	37.3	Very low	185 Å²	185	133.5 Å²	133.5	81%	0.811	67%	0.674	S	S	*	*			trans	-61.5	102.8	163.7	-123.9	-77.2	0	0	0	101.4	S103 R107	S103-F105 PolarHBondContact O-N 3.5Å; F105-R107 PolarHBondContact O-N 3.32Å
106	D	29.4	Very low	37.9	Very low	134 Å²	134	135.6 Å²	135.6	72%	0.717	68%	0.683	S	S	*	*			trans	-46.8	106.5	-159.9	-163.5	-8.1	0	0	0	108.1	C104 N108	C104-D106 PolarHBondContact O-N 3.16Å; D106-N108 PolarHBondContact O-N 3.39Å
107	R	39.3	Very low	38.8	Very low	226 Å²	226	137.3 Å²	137.3	85%	0.853	70%	0.695	S	S	*	*			trans	-84.6	53.7	-171.2	-160.4	170.4	72.2	-179.8	2.4	108.8	F105	F105-R107 PolarHBondContact O-N 3.32Å
108	N	42.8	Very low	40.1	Very low	139 Å²	139	138.4 Å²	138.4	74%	0.743	70%	0.699	S	S	*	*			trans	-149	78.7	166.8	-100.2	-13.2	0	0	0	110.6	D106	D106-N108 PolarHBondContact O-N 3.39Å
109	R	40.2	Very low	41.3	Very low	223 Å²	223	140.1 Å²	140.1	84%	0.842	70%	0.696	S	S	*	*	S	Bend		177.8	104.5	129.4	-106.5	174.2	162.7	-172.6	-4.5	110.9	Q111	R109-Q111 PolarHBondContact O-N 2.97Å
110	R	42.7	Very low	42.3	Very low	264 Å²	264	137.5 Å²	137.5	100%	0.996	68%	0.675	S	S	*	*	S	Bend	trans	34.2	17.5	142.6	-73.2	-177.5	179.2	174.3	-0.5	121.7
111	Q	47.3	Very low	43.7	Very low	146 Å²	146	139.1 Å²	139.1	68%	0.682	67%	0.671	S	S	*	*			trans	-125.3	20.8	-170.9	-84.3	-172.1	-13.3	0	0	116.2	R109 R115	R109-Q111 PolarHBondContact O-N 2.97Å; Q111-R115 PolarHBondContact O-NE 3.43Å; Q111-R115 PolarHBondContact O-NH2 3.46Å; Q111-R115 VanDerWaalsContact O-NH2 3.15Å
112	S	49.8	Very low	44.7	Very low	89 Å²	89	132.1 Å²	132.1	62%	0.622	64%	0.643	S	S	*	*	S	Bend	trans	-113.1	-19.1	-174	61.6	0	0	0	0	117.1	A114 R115 L116	S112-A114 PolarHBondContact O-N 3.49Å; S112-R115 PolarHBondContact O-N 3.27Å; S112-L116 PolarHBondContact O-N 3.01Å
113	A	54.7	Low	45.7	Very low	75 Å²	75	132.4 Å²	132.4	62%	0.62	64%	0.64	S	S	*	*	H	α-helix	trans	-62.4	-45	-178.4	0	0	0	0	0	112.3	R115 L116 E117	A113-R115 VanDerWaalsContact C-N 3.32Å; A113-R115 PolarHBondContact O-N 3.31Å; A113-L116 PolarHBondContact O-N 2.96Å; A113-E117 WeakPolarHBondContact O-CB 3.26Å; A113-E117 PolarHBondContact O-N 3.14Å
114	A	49.9	Very low	47.2	Very low	72 Å²	72	129.2 Å²	129.2	60%	0.595	62%	0.624	S	S	*	*	H	α-helix	trans	-67.2	-28.4	178.6	0	0	0	0	0	113.7	S112 F118	S112-A114 PolarHBondContact O-N 3.49Å; A114-F118 WeakPolarHBondContact O-CB 3.48Å; A114-F118 PolarHBondContact O-N 3.23Å
115	R	48.4	Very low	48.4	Very low	156 Å²	156	134.5 Å²	134.5	59%	0.589	63%	0.63	S	S	*	*	H	α-helix	trans	-78.1	-35.8	176.1	-97.4	-176.6	-75.6	-161.2	-5.1	112.3	Q111 S112 A113 F118 F119	Q111-R115 PolarHBondContact O-NE 3.43Å; Q111-R115 PolarHBondContact O-NH2 3.46Å; Q111-R115 VanDerWaalsContact O-NH2 3.15Å; S112-R115 PolarHBondContact O-N 3.27Å; A113-R115 VanDerWaalsContact C-N 3.32Å; A113-R115 PolarHBondContact O-N 3.31Å; R115-F118 PolarHBondContact O-N 2.98Å; R115-F119 WeakPolarHBondContact O-CB 3.37Å; R115-F119 PolarHBondContact O-N 3.49Å
116	L	50.1	Low	48.8	Very low	107 Å²	107	132.7 Å²	132.7	56%	0.56	62%	0.622	S	S	*	*	H	α-helix	trans	-68.8	-42.5	173.1	-159.5	78.9	0	0	0	110.6	S112 A113 F119 N120	S112-L116 PolarHBondContact O-N 3.01Å; A113-L116 PolarHBondContact O-N 2.96Å; L116-F119 PolarHBondContact O-N 3.26Å; L116-N120 WeakPolarHBondContact O-CB 3.45Å; L116-N120 PolarHBondContact O-N 3.35Å; L116-N120 PolarHBondContact O-ND2 2.92Å
117	E	56.6	Low	49.6	Very low	115 Å²	115	130.2 Å²	130.2	54%	0.537	62%	0.615	S	S	.	*	H	α-helix	trans	-62.6	-39.6	170	-86.4	-173.7	134.9	0	0	112.6	A113 N120 R121	A113-E117 WeakPolarHBondContact O-CB 3.26Å; A113-E117 PolarHBondContact O-N 3.14Å; E117-N120 PolarHBondContact O-N 3.06Å; E117-R121 WeakPolarHBondContact O-CB 3.36Å; E117-R121 WeakPolarHBondContact O-CG 3.16Å; E117-R121 PolarHBondContact O-N 3.09Å
118	F	58.8	Low	49.8	Very low	125 Å²	125	123.9 Å²	123.9	55%	0.548	60%	0.601	S	S	.	*	H	α-helix	trans	-63.7	-44.9	175.2	178.4	-95.8	0	0	0	111.5	A114 R115 R121 L122	A114-F118 WeakPolarHBondContact O-CB 3.48Å; A114-F118 PolarHBondContact O-N 3.23Å; R115-F118 PolarHBondContact O-N 2.98Å; F118-R121 PolarHBondContact O-N 3.38Å; F118-L122 HydrophobicContact CE1-CD1 4.5Å; F118-L122 HydrophobicContact CZ-CD1 4.3Å; F118-L122 VanDerWaalsContact O-CB 3.27Å; F118-L122 WeakPolarHBondContact O-CB 3.42Å; F118-L122 PolarHBondContact O-N 3.12Å
119	F	51.4	Low	50	Low	129 Å²	129	122.5 Å²	122.5	57%	0.566	60%	0.6	S	S	*	*	H	α-helix	trans	-62.2	-44.1	174.3	-106.8	-86.4	0	0	0	111.8	R115 L116 R121 L122 M123	R115-F119 WeakPolarHBondContact O-CB 3.37Å; R115-F119 PolarHBondContact O-N 3.49Å; L116-F119 PolarHBondContact O-N 3.26Å; F119-R121 PolarHBondContact O-N 2.85Å; F119-L122 PolarHBondContact O-N 3.49Å; F119-M123 WeakPolarHBondContact O-CB 3.25Å; F119-M123 VanDerWaalsContact O-CG 3.28Å; F119-M123 WeakPolarHBondContact O-CG 3.24Å; F119-M123 PolarHBondContact O-N 3.13Å
120	N	54.5	Low	50	Low	63 Å²	63	116 Å²	116	34%	0.337	59%	0.593	S	S	.	*	H	α-helix	trans	-64.2	-39.7	177	-70.7	-9.7	0	0	0	111.8	L116 E117 G124	L116-N120 WeakPolarHBondContact O-CB 3.45Å; L116-N120 PolarHBondContact O-N 3.35Å; L116-N120 PolarHBondContact O-ND2 2.92Å; E117-N120 PolarHBondContact O-N 3.06Å; N120-G124 PolarHBondContact O-N 2.68Å
121	R	58.7	Low	50.2	Low	182 Å²	182	111.4 Å²	111.4	69%	0.687	58%	0.583	S	S	*	*	H	α-helix	trans	-68	-35	173.2	-77.4	-178.6	-178.2	-176.1	3.2	112.9	E117 F118 F119 R125	E117-R121 WeakPolarHBondContact O-CB 3.36Å; E117-R121 WeakPolarHBondContact O-CG 3.16Å; E117-R121 PolarHBondContact O-N 3.09Å; F118-R121 PolarHBondContact O-N 3.38Å; F119-R121 PolarHBondContact O-N 2.85Å; R121-R125 WeakPolarHBondContact O-CG 3.43Å; R121-R125 PolarHBondContact O-N 3.43Å
122	L	51.7	Low	49.9	Very low	65 Å²	65	113 Å²	113	34%	0.34	59%	0.591	S	S	.	*	H	α-helix	trans	-69.7	-45.4	176.8	-161.1	84.2	0	0	0	110.2	F118 F119 R125 F126	F118-L122 HydrophobicContact CE1-CD1 4.5Å; F118-L122 HydrophobicContact CZ-CD1 4.3Å; F118-L122 VanDerWaalsContact O-CB 3.27Å; F118-L122 WeakPolarHBondContact O-CB 3.42Å; F118-L122 PolarHBondContact O-N 3.12Å; F119-L122 PolarHBondContact O-N 3.49Å; L122-R125 WeakPolarHBondContact O-CB 3.44Å; L122-R125 PolarHBondContact O-N 2.6Å; L122-R125 VanDerWaalsContact O-N 3.14Å; L122-F126 HydrophobicContact CG-CE2 4.19Å; L122-F126 WeakPolarHBondContact O-CD2 3.3Å
123	M	48	Very low	49.6	Very low	80 Å²	80	112.5 Å²	112.5	39%	0.394	59%	0.588	S	S	.	*	H	α-helix	trans	-65.3	-38	176.7	-71.6	-63.3	-68.4	0	0	112.3	F119 R125 F126	F119-M123 WeakPolarHBondContact O-CB 3.25Å; F119-M123 VanDerWaalsContact O-CG 3.28Å; F119-M123 WeakPolarHBondContact O-CG 3.24Å; F119-M123 PolarHBondContact O-N 3.13Å; M123-R125 PolarHBondContact O-N 3.3Å; M123-F126 PolarHBondContact O-N 3.24Å
124	G	55.8	Low	49.1	Very low	37 Å²	37	115 Å²	115	38%	0.381	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.4	-15	172.9	0	0	0	0	0	114.6	N120 S127	N120-G124 PolarHBondContact O-N 2.68Å; G124-S127 PolarHBondContact O-OG 2.98Å
125	R	52.2	Low	49	Very low	213 Å²	213	117.8 Å²	117.8	80%	0.804	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-11.6	171.5	-70	177.9	178.6	-173.4	-1.2	113.5	R121 L122 M123	R121-R125 WeakPolarHBondContact O-CG 3.43Å; R121-R125 PolarHBondContact O-N 3.43Å; L122-R125 WeakPolarHBondContact O-CB 3.44Å; L122-R125 PolarHBondContact O-N 2.6Å; L122-R125 VanDerWaalsContact O-N 3.14Å; M123-R125 PolarHBondContact O-N 3.3Å
126	F	42.4	Very low	48.9	Very low	146 Å²	146	116.1 Å²	116.1	64%	0.64	61%	0.611	S	S	*	*			trans	-105.2	18.6	177.3	-67.5	-72.8	0	0	0	112.5	L122 M123 V128	L122-F126 HydrophobicContact CG-CE2 4.19Å; L122-F126 WeakPolarHBondContact O-CD2 3.3Å; M123-F126 PolarHBondContact O-N 3.24Å; F126-V128 PolarHBondContact O-N 3.48Å
127	S	46.5	Very low	49.3	Very low	82 Å²	82	117.5 Å²	117.5	57%	0.573	61%	0.609	S	S	*	*			trans	-60	103.5	170.8	-66.5	0	0	0	0	109.8	G124	G124-S127 PolarHBondContact O-OG 2.98Å
128	V	43.9	Very low	49.7	Very low	93 Å²	93	122.9 Å²	122.9	56%	0.564	62%	0.624	S	S	*	*			trans	-81.7	127.1	173.4	-178.8	0	0	0	0	107.2	F126 A130	F126-V128 PolarHBondContact O-N 3.48Å; V128-A130 PolarHBondContact O-N 3.01Å
129	P	45.9	Very low	50.7	Low	111 Å²	111	120.9 Å²	120.9	72%	0.721	62%	0.622	S	S	*	*			trans	-57.8	139.5	173.5	-20.8	31	0	0	0	110.6	Q131	P129-Q131 PolarHBondContact O-N 3.45Å
130	A	41.6	Very low	52.1	Low	85 Å²	85	116.2 Å²	116.2	70%	0.702	60%	0.604	S	S	*	*			trans	-57.4	109.5	175.1	0	0	0	0	0	109.7	V128 E132	V128-A130 PolarHBondContact O-N 3.01Å; A130-E132 PolarHBondContact O-N 3.45Å
131	Q	45.9	Very low	53.2	Low	168 Å²	168	115.4 Å²	115.4	79%	0.785	60%	0.601	S	S	*	*			trans	-82.7	112.6	170.5	-165.2	162.6	3.3	0	0	107.3	P129 S133	P129-Q131 PolarHBondContact O-N 3.45Å; Q131-S133 VanDerWaalsContact C-N 3.35Å; Q131-S133 PolarHBondContact O-N 3.12Å
132	E	41.5	Very low	54.5	Low	179 Å²	179	107.5 Å²	107.5	84%	0.836	57%	0.574	S	S	*	*			trans	-61.7	95.2	172.3	-77.8	-177.1	156.5	0	0	109.1	A130 V134	A130-E132 PolarHBondContact O-N 3.45Å; E132-V134 VanDerWaalsContact C-N 3.29Å; E132-V134 PolarHBondContact O-N 3.12Å
133	S	42.9	Very low	56.1	Low	80 Å²	80	110.9 Å²	110.9	56%	0.559	59%	0.588	S	S	*	*			trans	-77.1	87.9	166.7	48.8	0	0	0	0	108.2	Q131 L135	Q131-S133 VanDerWaalsContact C-N 3.35Å; Q131-S133 PolarHBondContact O-N 3.12Å; S133-L135 VanDerWaalsContact C-N 3.26Å; S133-L135 PolarHBondContact O-N 3.19Å
134	V	44.4	Very low	57.5	Low	126 Å²	126	111.3 Å²	111.3	76%	0.764	59%	0.591	S	S	*	*			trans	-68.8	87.7	165	-178	0	0	0	0	107.6	E132	E132-V134 VanDerWaalsContact C-N 3.29Å; E132-V134 PolarHBondContact O-N 3.12Å
135	L	47.4	Very low	58.5	Low	132 Å²	132	109.8 Å²	109.8	69%	0.691	58%	0.575	S	S	*	*			trans	-120	107.3	166.6	-77.2	172.3	0	0	0	109.8	S133 R137	S133-L135 VanDerWaalsContact C-N 3.26Å; S133-L135 PolarHBondContact O-N 3.19Å; L135-R137 PolarHBondContact O-N 3.08Å
136	S	47.4	Very low	60.1	Low	120 Å²	120	100.2 Å²	100.2	84%	0.839	54%	0.54	S	S	*	.			trans	-52.3	106.4	166.9	174.7	0	0	0	0	109.3	R138	S136-R138 PolarHBondContact O-N 3.22Å; S136-R138 VanDerWaalsContact O-N 3.15Å
137	R	57.4	Low	62.2	Low	137 Å²	137	99.1 Å²	99.1	52%	0.517	54%	0.535	S	S	.	.			trans	-62.5	113.1	-171.4	-162.8	175.3	-175.8	-165.6	-4.3	111	L135	L135-R137 PolarHBondContact O-N 3.08Å
138	R	64.9	Low	63.8	Low	227 Å²	227	95.5 Å²	95.5	86%	0.857	51%	0.51	S	S	*	.			trans	-82.4	135.3	170.2	-151.8	178	-143.9	-174.4	5.3	108.7	S136 V140	S136-R138 PolarHBondContact O-N 3.22Å; S136-R138 VanDerWaalsContact O-N 3.15Å; R138-V140 PolarHBondContact O-N 3.27Å
139	V	80.4	Confident	65.6	Low	84 Å²	84	92.2 Å²	92.2	51%	0.509	49%	0.489	S	S	.	.			trans	-59.8	128.4	175.2	176.3	0	0	0	0	109.5
140	V	81.3	Confident	67.6	Low	31 Å²	31	89.4 Å²	89.4	19%	0.188	47%	0.465	C	S	.	.	S	Bend	trans	-93.5	-43.1	-174.4	-179.1	0	0	0	0	111.8	R138 D146 W184 I187 R191	R138-V140 PolarHBondContact O-N 3.27Å; V140-D146 PolarHBondContact N-OD2 2.89Å; V140-W184 HydrophobicContact CB-CE3 3.95Å; V140-W184 HydrophobicContact CB-CZ3 4.42Å; V140-W184 HydrophobicContact CG1-CE3 4.36Å; V140-W184 HydrophobicContact CG2-CB 4.26Å; V140-W184 HydrophobicContact CG2-CD2 4.25Å; V140-W184 HydrophobicContact CG2-CE3 3.75Å; V140-W184 HydrophobicContact CG2-CG 4.45Å; V140-I187 HydrophobicContact CG1-CB 4.47Å; V140-I187 HydrophobicContact CG1-CG2 3.97Å; V140-R191 WeakPolarHBondContact O-CD 3.22Å; V140-R191 PolarHBondContact O-NH1 3.2Å
141	V	78	Confident	69.8	Low	45 Å²	45	88.3 Å²	88.3	27%	0.273	45%	0.446	S	S	.	.	S	Bend	trans	-118.3	-67.9	174.3	-176.5	0	0	0	0	109.9	V145 D146 I187	V141-V145 HydrophobicContact CB-CB 4.25Å; V141-V145 HydrophobicContact CB-CG1 4Å; V141-V145 HydrophobicContact CG1-CB 4.1Å; V141-V145 HydrophobicContact CG1-CG1 3.88Å; V141-V145 HydrophobicContact CG1-CG2 4.44Å; V141-V145 HydrophobicContact CG2-CG1 4.45Å; V141-D146 WeakPolarHBondContact CB-OD1 3.43Å; V141-D146 PolarHBondContact N-OD1 3.14Å; V141-I187 HydrophobicContact CG2-CG2 3.81Å
142	S	85.1	Confident	71.4	Confident	16 Å²	16	80.7 Å²	80.7	11%	0.112	41%	0.411	C	S	.	.			trans	-158.1	161.6	173.2	82.6	0	0	0	0	108.4	N144 V145 D146 E879	S142-N144 VanDerWaalsContact C-N 3.26Å; S142-N144 PolarHBondContact O-N 2.96Å; S142-N144 PolarHBondContact OG-N 2.8Å; S142-V145 PolarHBondContact O-N 3.33Å; S142-V145 WeakPolarHBondContact OG-CB 3.46Å; S142-V145 WeakPolarHBondContact OG-CG2 3.41Å; S142-V145 PolarHBondContact OG-N 3.36Å; S142-V145 VanDerWaalsContact OG-N 3.11Å; S142-D146 PolarHBondContact N-OD1 3.37Å; S142-D146 WeakPolarHBondContact O-CB 3.37Å; S142-D146 PolarHBondContact O-N 3.32Å; S142-E879 VanDerWaalsContact CB-CD 3.5Å; S142-E879 VanDerWaalsContact CB-OE1 3.25Å; S142-E879 WeakPolarHBondContact CB-OE1 3.3Å; S142-E879 WeakPolarHBondContact OG-CG 3.31Å; S142-E879 PolarHBondContact OG-OE1 2.94Å
143	H	84.3	Confident	73.4	Confident	136 Å²	136	72.9 Å²	72.9	63%	0.63	37%	0.374	S	S	*	.	H	α-helix	trans	-57.8	-39.3	179.6	-177.2	-87.8	0	0	0	112.7	K147	H143-K147 VanDerWaalsContact O-CB 3.3Å; H143-K147 WeakPolarHBondContact O-CB 3.19Å; H143-K147 PolarHBondContact O-N 3.19Å; H143-K147 VanDerWaalsContact O-N 3.1Å
144	N	78.1	Confident	75.5	Confident	89 Å²	89	71.5 Å²	71.5	48%	0.476	36%	0.36	S	S	.	.	H	α-helix	trans	-75.4	-42.1	-178	-55.8	-49.4	0	0	0	112.4	S142 K147 A148 E879 V883	S142-N144 VanDerWaalsContact C-N 3.26Å; S142-N144 PolarHBondContact O-N 2.96Å; S142-N144 PolarHBondContact OG-N 2.8Å; N144-K147 PolarHBondContact O-N 2.84Å; N144-A148 PolarHBondContact O-N 2.84Å; N144-A148 VanDerWaalsContact O-N 3.07Å; N144-E879 WeakPolarHBondContact CB-OE1 3.24Å; N144-E879 PolarHBondContact ND2-OE1 3.35Å; N144-V883 HydrophobicContact CB-CG2 3.91Å
145	V	77.6	Confident	77.2	Confident	6 Å²	6	66.6 Å²	66.6	4%	0.036	33%	0.33	C	S	.	.	H	α-helix	trans	-68.3	-44.3	178.1	174.9	0	0	0	0	110.2	V141 S142 K147 A148 L149 E879 L882 V883 I886	V141-V145 HydrophobicContact CB-CB 4.25Å; V141-V145 HydrophobicContact CB-CG1 4Å; V141-V145 HydrophobicContact CG1-CB 4.1Å; V141-V145 HydrophobicContact CG1-CG1 3.88Å; V141-V145 HydrophobicContact CG1-CG2 4.44Å; V141-V145 HydrophobicContact CG2-CG1 4.45Å; S142-V145 PolarHBondContact O-N 3.33Å; S142-V145 WeakPolarHBondContact OG-CB 3.46Å; S142-V145 WeakPolarHBondContact OG-CG2 3.41Å; S142-V145 PolarHBondContact OG-N 3.36Å; S142-V145 VanDerWaalsContact OG-N 3.11Å; V145-K147 VanDerWaalsContact C-N 3.27Å; V145-K147 PolarHBondContact O-N 3.49Å; V145-A148 PolarHBondContact O-N 3.11Å; V145-L149 HydrophobicContact CG1-CD1 3.81Å; V145-L149 HydrophobicContact CG1-CG 4.18Å; V145-L149 WeakPolarHBondContact O-CB 3.25Å; V145-L149 WeakPolarHBondContact O-CG 3.48Å; V145-L149 PolarHBondContact O-N 3.05Å; V145-E879 HydrophobicContact CG2-CG 3.66Å; V145-L882 HydrophobicContact CG2-CB 4.23Å; V145-V883 HydrophobicContact CG2-CG2 3.75Å; V145-I886 HydrophobicContact CG1-CD1 3.98Å
146	D	85.9	Confident	78.5	Confident	12 Å²	12	60.7 Å²	60.7	6%	0.064	30%	0.3	C	S	.	.	H	α-helix	trans	-62.1	-37.4	177.7	-68.1	5.7	0	0	0	111	V140 V141 S142 K150 W184	V140-D146 PolarHBondContact N-OD2 2.89Å; V141-D146 WeakPolarHBondContact CB-OD1 3.43Å; V141-D146 PolarHBondContact N-OD1 3.14Å; S142-D146 PolarHBondContact N-OD1 3.37Å; S142-D146 WeakPolarHBondContact O-CB 3.37Å; S142-D146 PolarHBondContact O-N 3.32Å; D146-K150 VanDerWaalsContact O-CB 3.26Å; D146-K150 WeakPolarHBondContact O-CB 3.29Å; D146-K150 PolarHBondContact O-N 2.68Å; D146-W184 HydrophobicContact CB-CH2 3.91Å; D146-W184 HydrophobicContact CB-CZ3 4.08Å; D146-W184 VanDerWaalsContact O-CH2 3.3Å; D146-W184 WeakPolarHBondContact O-CH2 3.22Å
147	K	86.6	Confident	79.9	Confident	122 Å²	122	56 Å²	56	53%	0.53	26%	0.264	S	S	.	.	H	α-helix	trans	-62.2	-50.4	173.3	-176.8	-177.8	176	-175.2	0	111.3	H143 N144 V145 L149 K150 E151	H143-K147 VanDerWaalsContact O-CB 3.3Å; H143-K147 WeakPolarHBondContact O-CB 3.19Å; H143-K147 PolarHBondContact O-N 3.19Å; H143-K147 VanDerWaalsContact O-N 3.1Å; N144-K147 PolarHBondContact O-N 2.84Å; V145-K147 VanDerWaalsContact C-N 3.27Å; V145-K147 PolarHBondContact O-N 3.49Å; K147-L149 PolarHBondContact O-N 3.41Å; K147-K150 PolarHBondContact O-N 3.47Å; K147-E151 WeakPolarHBondContact CE-OE1 3.45Å; K147-E151 WeakPolarHBondContact O-CG 3.45Å; K147-E151 PolarHBondContact O-N 3.05Å
148	A	78.6	Confident	81.2	Confident	7 Å²	7	54.2 Å²	54.2	6%	0.058	26%	0.258	C	S	.	.	H	α-helix	trans	-62.7	-42.4	-179.5	0	0	0	0	0	112.3	N144 V145 E151 V152 V883 I886	N144-A148 PolarHBondContact O-N 2.84Å; N144-A148 VanDerWaalsContact O-N 3.07Å; V145-A148 PolarHBondContact O-N 3.11Å; A148-E151 PolarHBondContact O-N 3.26Å; A148-V152 PolarHBondContact O-N 3.04Å; A148-V883 HydrophobicContact CB-CG1 4.46Å; A148-I886 HydrophobicContact CB-CB 4.17Å; A148-I886 HydrophobicContact CB-CD1 4.39Å; A148-I886 HydrophobicContact CB-CG2 3.75Å
149	L	82.8	Confident	81.7	Confident	24 Å²	24	44.9 Å²	44.9	13%	0.126	23%	0.225	C	C	.	.	H	α-helix	trans	-64.4	-38.7	175.2	-71.9	174.4	0	0	0	112	V145 K147 V152 F153 W183 W184 I187 I886	V145-L149 HydrophobicContact CG1-CD1 3.81Å; V145-L149 HydrophobicContact CG1-CG 4.18Å; V145-L149 WeakPolarHBondContact O-CB 3.25Å; V145-L149 WeakPolarHBondContact O-CG 3.48Å; V145-L149 PolarHBondContact O-N 3.05Å; K147-L149 PolarHBondContact O-N 3.41Å; L149-V152 PolarHBondContact O-N 3.22Å; L149-F153 PolarHBondContact O-N 3.3Å; L149-W183 HydrophobicContact CD2-CZ2 4.4Å; L149-W184 HydrophobicContact CB-CH2 3.96Å; L149-W184 HydrophobicContact CB-CZ3 4.4Å; L149-W184 HydrophobicContact CD1-CZ3 4.32Å; L149-I187 HydrophobicContact CD1-CD1 4.23Å; L149-I187 HydrophobicContact CD1-CG1 4.41Å; L149-I187 HydrophobicContact CD1-CG2 3.93Å; L149-I886 HydrophobicContact CD2-CD1 3.64Å; L149-I886 HydrophobicContact CD2-CG1 4.1Å; L149-I886 HydrophobicContact CD2-CG2 4.46Å; L149-I886 HydrophobicContact CG-CD1 3.8Å
150	K	87.4	Confident	81.2	Confident	51 Å²	51	41.1 Å²	41.1	22%	0.222	20%	0.201	C	C	.	.	H	α-helix	trans	-63.9	-43.7	176.3	-166.2	-165.9	-177.6	-66.1	0	111.3	D146 K147 V152 F153 D154 Y176 W184	D146-K150 VanDerWaalsContact O-CB 3.26Å; D146-K150 WeakPolarHBondContact O-CB 3.29Å; D146-K150 PolarHBondContact O-N 2.68Å; K147-K150 PolarHBondContact O-N 3.47Å; K150-V152 VanDerWaalsContact C-N 3.27Å; K150-V152 PolarHBondContact O-N 3.34Å; K150-F153 PolarHBondContact O-N 2.74Å; K150-F153 VanDerWaalsContact O-N 3.14Å; K150-D154 IonicContact NZ-OD1 3.45Å; K150-D154 PolarHBondContact NZ-OD1 2.93Å; K150-D154 IonicContact NZ-OD2 3.74Å; K150-D154 PolarHBondContact NZ-OD2 3.5Å; K150-D154 WeakPolarHBondContact O-CB 3.45Å; K150-D154 PolarHBondContact O-N 3.25Å; K150-Y176 PolarHBondContact NZ-OH 2.95Å; K150-W184 HydrophobicContact CB-CZ2 4.04Å; K150-W184 HydrophobicContact CG-CZ2 4.45Å
151	E	87.1	Confident	80.6	Confident	62 Å²	62	41.1 Å²	41.1	29%	0.29	20%	0.2	S	C	.	.	H	α-helix	trans	-58.5	-41.4	177.3	-72.3	174.4	-167.9	0	0	111.4	K147 A148 D154 L155 R890	K147-E151 WeakPolarHBondContact CE-OE1 3.45Å; K147-E151 WeakPolarHBondContact O-CG 3.45Å; K147-E151 PolarHBondContact O-N 3.05Å; A148-E151 PolarHBondContact O-N 3.26Å; E151-D154 PolarHBondContact O-N 3.4Å; E151-L155 WeakPolarHBondContact O-CB 3.15Å; E151-L155 VanDerWaalsContact O-CG 3.25Å; E151-L155 WeakPolarHBondContact O-CG 3.49Å; E151-L155 PolarHBondContact O-N 3.34Å; E151-L155 VanDerWaalsContact O-N 3.08Å; E151-R890 IonicContact OE2-CZ 3.95Å; E151-R890 IonicContact OE2-NH1 2.71Å; E151-R890 PolarHBondContact OE2-NH1 2.9Å
152	V	81.4	Confident	80.4	Confident	8 Å²	8	42.1 Å²	42.1	5%	0.048	20%	0.203	C	C	.	.	H	α-helix	trans	-62.2	-47.3	173.5	167.2	0	0	0	0	111.6	A148 L149 K150 D154 L155 A156 I886 F889 R890	A148-V152 PolarHBondContact O-N 3.04Å; L149-V152 PolarHBondContact O-N 3.22Å; K150-V152 VanDerWaalsContact C-N 3.27Å; K150-V152 PolarHBondContact O-N 3.34Å; V152-D154 PolarHBondContact O-N 2.98Å; V152-L155 PolarHBondContact O-N 3.23Å; V152-A156 VanDerWaalsContact O-CB 3.3Å; V152-A156 WeakPolarHBondContact O-CB 3.39Å; V152-A156 PolarHBondContact O-N 3.41Å; V152-I886 HydrophobicContact CG2-CG2 3.75Å; V152-F889 HydrophobicContact CG1-CD1 4.32Å; V152-F889 HydrophobicContact CG1-CE1 3.64Å; V152-F889 HydrophobicContact CG2-CD1 3.95Å; V152-F889 HydrophobicContact CG2-CE1 4.03Å; V152-R890 HydrophobicContact CG2-CB 4.01Å; V152-R890 HydrophobicContact CG2-CG 4.3Å
153	F	83.4	Confident	80.1	Confident	15 Å²	15	45.1 Å²	45.1	7%	0.066	22%	0.224	C	C	.	.	H	α-helix	trans	-59.7	-45	177.5	176.9	-88.7	0	0	0	111.8	L149 K150 L155 A156 Y157 Y176 L179 L180 W183	L149-F153 PolarHBondContact O-N 3.3Å; K150-F153 PolarHBondContact O-N 2.74Å; K150-F153 VanDerWaalsContact O-N 3.14Å; F153-L155 PolarHBondContact O-N 3.43Å; F153-A156 PolarHBondContact O-N 2.94Å; F153-Y157 WeakPolarHBondContact O-CB 3.13Å; F153-Y157 PolarHBondContact O-N 3.41Å; F153-Y176 HydrophobicContact CD1-CE2 4.04Å; F153-Y176 AromaticContact CE1-CD2 3.89Å; F153-Y176 HydrophobicContact CE1-CD2 3.89Å; F153-Y176 AromaticContact CE1-CE2 3.52Å; F153-Y176 HydrophobicContact CE1-CE2 3.52Å; F153-L179 HydrophobicContact CE2-CB 4.3Å; F153-L179 HydrophobicContact CZ-CB 3.94Å; F153-L180 HydrophobicContact CD1-CD1 3.53Å; F153-L180 HydrophobicContact CE1-CB 3.8Å; F153-L180 HydrophobicContact CE1-CD1 3.58Å; F153-L180 HydrophobicContact CE1-CG 4.25Å; F153-L180 HydrophobicContact CG-CD1 4.05Å; F153-L180 HydrophobicContact CZ-CB 3.86Å; F153-L180 HydrophobicContact CZ-CD1 4.15Å; F153-W183 HydrophobicContact CD2-CB 3.89Å; F153-W183 AromaticContact CD2-CD2 3.8Å; F153-W183 HydrophobicContact CD2-CD2 3.8Å; F153-W183 HydrophobicContact CD2-CE3 4.17Å; F153-W183 AromaticContact CD2-CG 3.66Å; F153-W183 HydrophobicContact CD2-CG 3.66Å; F153-W183 HydrophobicContact CE2-CB 3.83Å; F153-W183 HydrophobicContact CE2-CG 4.14Å; F153-W183 HydrophobicContact CG-CG 4.38Å
154	D	85.3	Confident	79.6	Confident	51 Å²	51	44.6 Å²	44.6	27%	0.273	22%	0.217	S	C	.	.	H	α-helix	trans	-62.5	-44.6	-179	-68.5	-21.8	0	0	0	111.4	K150 E151 V152 R158 Y176	K150-D154 IonicContact NZ-OD1 3.45Å; K150-D154 PolarHBondContact NZ-OD1 2.93Å; K150-D154 IonicContact NZ-OD2 3.74Å; K150-D154 PolarHBondContact NZ-OD2 3.5Å; K150-D154 WeakPolarHBondContact O-CB 3.45Å; K150-D154 PolarHBondContact O-N 3.25Å; E151-D154 PolarHBondContact O-N 3.4Å; V152-D154 PolarHBondContact O-N 2.98Å; D154-R158 VanDerWaalsContact O-CB 3.29Å; D154-R158 WeakPolarHBondContact O-CB 3.41Å; D154-R158 PolarHBondContact O-N 3.3Å; D154-Y176 PolarHBondContact OD1-OH 2.83Å
155	L	80.2	Confident	79.3	Confident	23 Å²	23	42.4 Å²	42.4	12%	0.12	20%	0.202	C	C	.	.	H	α-helix	trans	-65.6	-40.9	176.2	-70.6	169.5	0	0	0	111.8	E151 V152 F153 D159 R890 W894	E151-L155 WeakPolarHBondContact O-CB 3.15Å; E151-L155 VanDerWaalsContact O-CG 3.25Å; E151-L155 WeakPolarHBondContact O-CG 3.49Å; E151-L155 PolarHBondContact O-N 3.34Å; E151-L155 VanDerWaalsContact O-N 3.08Å; V152-L155 PolarHBondContact O-N 3.23Å; F153-L155 PolarHBondContact O-N 3.43Å; L155-D159 PolarHBondContact O-N 3.36Å; L155-D159 VanDerWaalsContact O-N 3.1Å; L155-R890 HydrophobicContact CD1-CG 3.71Å; L155-W894 HydrophobicContact CB-CD2 3.8Å; L155-W894 HydrophobicContact CB-CE3 4.23Å; L155-W894 HydrophobicContact CB-CG 4.15Å; L155-W894 HydrophobicContact CB-CH2 4.26Å; L155-W894 HydrophobicContact CB-CZ2 3.87Å; L155-W894 HydrophobicContact CB-CZ3 4.45Å; L155-W894 HydrophobicContact CD1-CB 3.95Å; L155-W894 HydrophobicContact CD1-CD2 4.02Å; L155-W894 HydrophobicContact CD1-CE3 4.21Å; L155-W894 HydrophobicContact CD1-CG 3.91Å; L155-W894 HydrophobicContact CD2-CG 4.26Å; L155-W894 HydrophobicContact CG-CD2 4.41Å; L155-W894 HydrophobicContact CG-CG 4.35Å
156	A	74.8	Confident	79.4	Confident	9 Å²	9	46.9 Å²	46.9	7%	0.074	23%	0.229	C	C	.	.	H	α-helix	trans	-63.9	-51.6	176.6	0	0	0	0	0	111.1	V92 V152 F153 R158 D159 Y160 W894	V92-A156 HydrophobicContact CG2-CB 4Å; V152-A156 VanDerWaalsContact O-CB 3.3Å; V152-A156 WeakPolarHBondContact O-CB 3.39Å; V152-A156 PolarHBondContact O-N 3.41Å; F153-A156 PolarHBondContact O-N 2.94Å; A156-R158 VanDerWaalsContact C-N 3.33Å; A156-R158 PolarHBondContact O-N 3.45Å; A156-D159 PolarHBondContact O-N 3.15Å; A156-Y160 HydrophobicContact CB-CD2 4.25Å; A156-Y160 WeakPolarHBondContact O-CB 3.22Å; A156-Y160 WeakPolarHBondContact O-CD2 3.43Å; A156-Y160 PolarHBondContact O-N 2.68Å; A156-W894 HydrophobicContact CB-CH2 4.08Å; A156-W894 HydrophobicContact CB-CZ2 4.37Å
157	Y	77.8	Confident	79	Confident	20 Å²	20	50.5 Å²	50.5	8%	0.078	26%	0.255	C	S	.	.	I	π-helix	trans	-56.2	-47.5	177.4	-178.8	-89.7	0	0	0	111.5	F153 D159 I161 L162 Y176 L179	F153-Y157 WeakPolarHBondContact O-CB 3.13Å; F153-Y157 PolarHBondContact O-N 3.41Å; Y157-D159 PolarHBondContact O-N 3.39Å; Y157-I161 HydrophobicContact CD2-CB 4.02Å; Y157-I161 HydrophobicContact CD2-CD1 3.95Å; Y157-I161 HydrophobicContact CD2-CG2 4.14Å; Y157-I161 HydrophobicContact CE2-CB 4.26Å; Y157-I161 HydrophobicContact CE2-CG2 3.9Å; Y157-I161 HydrophobicContact CG-CB 4.48Å; Y157-I161 WeakPolarHBondContact O-CA 3.37Å; Y157-I161 WeakPolarHBondContact O-CB 3.21Å; Y157-I161 PolarHBondContact O-N 3Å; Y157-L162 HydrophobicContact CD1-CB 4.31Å; Y157-L162 HydrophobicContact CE1-CB 4.06Å; Y157-L162 HydrophobicContact CE1-CD1 4.06Å; Y157-L162 HydrophobicContact CE1-CD2 4.48Å; Y157-L162 HydrophobicContact CE1-CG 4.44Å; Y157-L162 WeakPolarHBondContact O-CB 3.44Å; Y157-L162 PolarHBondContact O-N 3.06Å; Y157-Y176 AromaticContact CD1-CD2 3.66Å; Y157-Y176 HydrophobicContact CD1-CD2 3.66Å; Y157-Y176 HydrophobicContact CD1-CE2 4.37Å; Y157-Y176 HydrophobicContact CD2-CD2 4.04Å; Y157-Y176 AromaticContact CE1-CD2 3.84Å; Y157-Y176 HydrophobicContact CE1-CD2 3.84Å; Y157-Y176 HydrophobicContact CE1-CG 4.42Å; Y157-Y176 HydrophobicContact CE2-CD2 4.21Å; Y157-Y176 AromaticContact CG-CD2 3.78Å; Y157-Y176 HydrophobicContact CG-CD2 3.78Å; Y157-Y176 HydrophobicContact CG-CE2 4.41Å; Y157-L179 HydrophobicContact CD2-CD1 4.25Å; Y157-L179 HydrophobicContact CE2-CD1 4.16Å
158	R	83.8	Confident	78.4	Confident	101 Å²	101	49 Å²	49	38%	0.381	25%	0.253	S	S	.	.	I	π-helix	trans	-56.6	-53.3	179.5	-177.3	-169	73.1	-163.8	-4	112.3	D154 A156 L162 G897	D154-R158 VanDerWaalsContact O-CB 3.29Å; D154-R158 WeakPolarHBondContact O-CB 3.41Å; D154-R158 PolarHBondContact O-N 3.3Å; A156-R158 VanDerWaalsContact C-N 3.33Å; A156-R158 PolarHBondContact O-N 3.45Å; R158-L162 WeakPolarHBondContact O-CB 3.47Å; R158-G897 PolarHBondContact NH1-O 3.19Å; R158-G897 PolarHBondContact NH2-O 3.45Å
159	D	75.1	Confident	78.3	Confident	30 Å²	30	49.6 Å²	49.6	16%	0.16	26%	0.256	C	S	.	.	I	π-helix	trans	-88	-21.8	-168.1	-68.6	-27.1	0	0	0	113.4	L155 A156 Y157 S163 W894 L899	L155-D159 PolarHBondContact O-N 3.36Å; L155-D159 VanDerWaalsContact O-N 3.1Å; A156-D159 PolarHBondContact O-N 3.15Å; Y157-D159 PolarHBondContact O-N 3.39Å; D159-S163 WeakPolarHBondContact O-CB 3.25Å; D159-S163 PolarHBondContact O-OG 3.06Å; D159-W894 VanDerWaalsContact OD2-CD1 3.26Å; D159-W894 PolarHBondContact OD2-NE1 3.29Å; D159-L899 HydrophobicContact CB-CD2 3.42Å; D159-L899 VanDerWaalsContact CB-CD2 3.42Å; D159-L899 WeakPolarHBondContact OD2-CB 3.27Å
160	Y	70.4	Confident	78	Confident	6 Å²	6	55.4 Å²	55.4	2%	0.024	28%	0.283	C	S	.	.	I	π-helix	trans	-115.8	-25.4	-170.8	-63.6	-52.7	0	0	0	115.1	V92 V95 R96 A156 W164 W894 L899	V92-Y160 HydrophobicContact CB-CE2 3.85Å; V92-Y160 HydrophobicContact CG1-CE2 3.58Å; V92-Y160 VanDerWaalsContact CG1-OH 3.32Å; V92-Y160 WeakPolarHBondContact CG1-OH 3.5Å; V92-Y160 HydrophobicContact CG2-CD2 4.34Å; V92-Y160 HydrophobicContact CG2-CE2 3.94Å; V92-Y160 WeakPolarHBondContact O-CE1 3.43Å; V92-Y160 WeakPolarHBondContact O-CE2 3.34Å; V92-Y160 PolarHBondContact O-OH 2.83Å; V95-Y160 VanDerWaalsContact C-CD1 3.44Å; V95-Y160 VanDerWaalsContact CB-CB 3.42Å; V95-Y160 HydrophobicContact CB-CD1 3.17Å; V95-Y160 HydrophobicContact CB-CD2 4.4Å; V95-Y160 HydrophobicContact CB-CE1 3.8Å; V95-Y160 HydrophobicContact CB-CG 3.43Å; V95-Y160 VanDerWaalsContact CB-CG 3.43Å; V95-Y160 HydrophobicContact CG1-CD1 3.46Å; V95-Y160 VanDerWaalsContact CG1-CD1 3.46Å; V95-Y160 HydrophobicContact CG1-CE1 4.42Å; V95-Y160 HydrophobicContact CG1-CG 3.77Å; V95-Y160 WeakPolarHBondContact CG1-O 3.22Å; V95-Y160 HydrophobicContact CG2-CD1 4.36Å; V95-Y160 HydrophobicContact CG2-CG 4.2Å; V95-Y160 WeakPolarHBondContact O-CD1 3.36Å; V95-Y160 WeakPolarHBondContact O-CE1 3.41Å; R96-Y160 HydrophobicContact CB-CE1 3.62Å; R96-Y160 HydrophobicContact CG-CD1 4.49Å; R96-Y160 HydrophobicContact CG-CE1 3.64Å; A156-Y160 HydrophobicContact CB-CD2 4.25Å; A156-Y160 WeakPolarHBondContact O-CB 3.22Å; A156-Y160 WeakPolarHBondContact O-CD2 3.43Å; A156-Y160 PolarHBondContact O-N 2.68Å; Y160-W164 VanDerWaalsContact O-CD1 3.23Å; Y160-W164 PolarHBondContact O-NE1 3.14Å; Y160-W894 HydrophobicContact CD2-CZ2 4.08Å; Y160-W894 AromaticContact CE2-CH2 3.92Å; Y160-W894 HydrophobicContact CE2-CH2 3.92Å; Y160-W894 AromaticContact CE2-CZ2 3.47Å; Y160-W894 HydrophobicContact CE2-CZ2 3.47Å; Y160-W894 VanDerWaalsContact CE2-CZ2 3.47Å; Y160-L899 HydrophobicContact CD1-CD2 4.31Å; Y160-L899 HydrophobicContact CE1-CD2 3.69Å; Y160-L899 HydrophobicContact CE2-CD1 4.48Å; Y160-L899 HydrophobicContact CE2-CD2 4.09Å; Y160-L899 WeakPolarHBondContact OH-CD1 3.35Å
161	I	68.6	Low	77.4	Confident	31 Å²	31	55 Å²	55	16%	0.159	28%	0.283	C	S	.	.	I	π-helix	trans	-107.5	-55.8	179.5	-59.2	178.3	0	0	0	108.6	Y157 S163 W164 Y165 L175 L179	Y157-I161 HydrophobicContact CD2-CB 4.02Å; Y157-I161 HydrophobicContact CD2-CD1 3.95Å; Y157-I161 HydrophobicContact CD2-CG2 4.14Å; Y157-I161 HydrophobicContact CE2-CB 4.26Å; Y157-I161 HydrophobicContact CE2-CG2 3.9Å; Y157-I161 HydrophobicContact CG-CB 4.48Å; Y157-I161 WeakPolarHBondContact O-CA 3.37Å; Y157-I161 WeakPolarHBondContact O-CB 3.21Å; Y157-I161 PolarHBondContact O-N 3Å; I161-S163 PolarHBondContact O-N 3.28Å; I161-W164 HydrophobicContact CG2-CZ2 4.26Å; I161-W164 PolarHBondContact O-N 3.45Å; I161-Y165 WeakPolarHBondContact O-CB 3.43Å; I161-Y165 PolarHBondContact O-N 2.86Å; I161-L175 HydrophobicContact CG2-CD2 4.03Å; I161-L179 HydrophobicContact CD1-CD1 3.73Å
162	L	75.3	Confident	76.9	Confident	65 Å²	65	61.4 Å²	61.4	34%	0.34	31%	0.313	S	S	.	.	I	π-helix	trans	-61.6	-31.9	-175.9	-166.8	65.8	0	0	0	112.6	Y157 R158 W164 Y165 V166	Y157-L162 HydrophobicContact CD1-CB 4.31Å; Y157-L162 HydrophobicContact CE1-CB 4.06Å; Y157-L162 HydrophobicContact CE1-CD1 4.06Å; Y157-L162 HydrophobicContact CE1-CD2 4.48Å; Y157-L162 HydrophobicContact CE1-CG 4.44Å; Y157-L162 WeakPolarHBondContact O-CB 3.44Å; Y157-L162 PolarHBondContact O-N 3.06Å; R158-L162 WeakPolarHBondContact O-CB 3.47Å; L162-W164 PolarHBondContact O-N 3.28Å; L162-Y165 PolarHBondContact O-N 3.41Å; L162-V166 HydrophobicContact CD1-CB 4.17Å; L162-V166 HydrophobicContact CD1-CG2 4.34Å; L162-V166 PolarHBondContact O-N 3.32Å
163	S	76.9	Confident	76.6	Confident	79 Å²	79	62.2 Å²	62.2	55%	0.552	32%	0.323	S	S	*	.	H	α-helix	trans	-59.5	-27.8	-178	60.1	0	0	0	0	114.7	D159 I161	D159-S163 WeakPolarHBondContact O-CB 3.25Å; D159-S163 PolarHBondContact O-OG 3.06Å; I161-S163 PolarHBondContact O-N 3.28Å
164	W	75.6	Confident	76.4	Confident	125 Å²	125	63.4 Å²	63.4	47%	0.473	33%	0.329	S	S	.	.	H	α-helix	trans	-114	-30.9	172.7	57	-93.5	0	0	0	112.7	Y160 I161 L162 V166 S167 L168	Y160-W164 VanDerWaalsContact O-CD1 3.23Å; Y160-W164 PolarHBondContact O-NE1 3.14Å; I161-W164 HydrophobicContact CG2-CZ2 4.26Å; I161-W164 PolarHBondContact O-N 3.45Å; L162-W164 PolarHBondContact O-N 3.28Å; W164-V166 PolarHBondContact O-N 3.18Å; W164-S167 PolarHBondContact O-N 3.33Å; W164-S167 PolarHBondContact O-OG 3.48Å; W164-L168 HydrophobicContact CE3-CD1 3.95Å; W164-L168 HydrophobicContact CZ3-CD1 4.37Å
165	Y	71.6	Confident	75.9	Confident	44 Å²	44	62.9 Å²	62.9	17%	0.173	33%	0.326	C	S	.	.	H	α-helix	trans	-66.3	-39.1	-174.4	-178.4	-109.9	0	0	0	113.1	I161 L162 S167 L168 S169 D171 L175	I161-Y165 WeakPolarHBondContact O-CB 3.43Å; I161-Y165 PolarHBondContact O-N 2.86Å; L162-Y165 PolarHBondContact O-N 3.41Å; Y165-S167 PolarHBondContact O-N 2.84Å; Y165-S167 VanDerWaalsContact O-N 3.1Å; Y165-L168 PolarHBondContact O-N 2.88Å; Y165-S169 PolarHBondContact O-N 3.31Å; Y165-S169 PolarHBondContact OH-OG 2.98Å; Y165-D171 HydrophobicContact CE1-CB 3.61Å; Y165-D171 WeakPolarHBondContact OH-CB 3.47Å; Y165-L175 HydrophobicContact CD1-CD2 3.67Å; Y165-L175 HydrophobicContact CD2-CD2 3.8Å; Y165-L175 HydrophobicContact CE1-CB 3.89Å; Y165-L175 HydrophobicContact CE1-CD2 3.45Å; Y165-L175 VanDerWaalsContact CE1-CD2 3.45Å; Y165-L175 HydrophobicContact CE1-CG 4.29Å; Y165-L175 HydrophobicContact CE2-CD2 3.61Å; Y165-L175 HydrophobicContact CG-CD2 3.83Å; Y165-L175 VanDerWaalsContact CZ-CD2 3.42Å
166	V	79.6	Confident	76.1	Confident	100 Å²	100	64.4 Å²	64.4	61%	0.606	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-23.5	-178.6	87.5	0	0	0	0	112.8	L162 W164	L162-V166 HydrophobicContact CD1-CB 4.17Å; L162-V166 HydrophobicContact CD1-CG2 4.34Å; L162-V166 PolarHBondContact O-N 3.32Å; W164-V166 PolarHBondContact O-N 3.18Å
167	S	76.1	Confident	76.4	Confident	87 Å²	87	66.8 Å²	66.8	61%	0.608	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-16.2	178	71.7	0	0	0	0	113.6	W164 Y165	W164-S167 PolarHBondContact O-N 3.33Å; W164-S167 PolarHBondContact O-OG 3.48Å; Y165-S167 PolarHBondContact O-N 2.84Å; Y165-S167 VanDerWaalsContact O-N 3.1Å
168	L	75.1	Confident	76.4	Confident	90 Å²	90	70.5 Å²	70.5	47%	0.471	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-19.2	-174.2	-61.6	177.9	0	0	0	113.1	W164 Y165	W164-L168 HydrophobicContact CE3-CD1 3.95Å; W164-L168 HydrophobicContact CZ3-CD1 4.37Å; Y165-L168 PolarHBondContact O-N 2.88Å
169	S	75.8	Confident	76.2	Confident	20 Å²	20	68.3 Å²	68.3	14%	0.14	36%	0.361	C	S	.	.			trans	-132.8	146.7	-172.2	-172.5	0	0	0	0	111.4	Y165 D171	Y165-S169 PolarHBondContact O-N 3.31Å; Y165-S169 PolarHBondContact OH-OG 2.98Å; S169-D171 VanDerWaalsContact C-N 3.3Å; S169-D171 VanDerWaalsContact OG-CB 3.31Å; S169-D171 WeakPolarHBondContact OG-CB 3.1Å; S169-D171 PolarHBondContact OG-N 3.15Å; S169-D171 VanDerWaalsContact OG-N 3.16Å
170	H	76.1	Confident	76.5	Confident	147 Å²	147	68 Å²	68	68%	0.681	36%	0.359	S	S	*	.			trans	-95.1	21.6	168.9	-65.4	-62	0	0	0	112.1	E172	H170-E172 PolarHBondContact O-N 2.92Å
171	D	76.7	Confident	77.1	Confident	41 Å²	41	71.7 Å²	71.7	22%	0.219	38%	0.377	C	S	.	.			trans	-63.2	127.2	177.6	175.1	61.2	0	0	0	111.9	Y165 S169 G173 Q174 L175	Y165-D171 HydrophobicContact CE1-CB 3.61Å; Y165-D171 WeakPolarHBondContact OH-CB 3.47Å; S169-D171 VanDerWaalsContact C-N 3.3Å; S169-D171 VanDerWaalsContact OG-CB 3.31Å; S169-D171 WeakPolarHBondContact OG-CB 3.1Å; S169-D171 PolarHBondContact OG-N 3.15Å; S169-D171 VanDerWaalsContact OG-N 3.16Å; D171-G173 VanDerWaalsContact C-N 3.29Å; D171-G173 PolarHBondContact O-N 3.36Å; D171-G173 PolarHBondContact OD2-N 3.06Å; D171-Q174 WeakPolarHBondContact OD1-CA 3.46Å; D171-Q174 WeakPolarHBondContact OD1-CB 3.03Å; D171-Q174 PolarHBondContact OD1-N 3.45Å; D171-Q174 PolarHBondContact OD2-N 3.29Å; D171-L175 PolarHBondContact OD1-N 3.4Å; D171-L175 WeakPolarHBondContact OD2-CB 3.23Å; D171-L175 PolarHBondContact OD2-N 3.16Å
172	E	75.8	Confident	77.5	Confident	197 Å²	197	71.5 Å²	71.5	92%	0.921	38%	0.376	S	S	*	.	S	Bend	trans	-94.1	39	178.4	-61.7	-169.5	157.1	0	0	111.9	H170	H170-E172 PolarHBondContact O-N 2.92Å
173	G	75.9	Confident	77.8	Confident	25 Å²	25	69.8 Å²	69.8	26%	0.258	37%	0.365	S	S	.	.	S	Bend	trans	94.7	12.1	175.4	0	0	0	0	0	115.4	D171 L175 Y176 S177	D171-G173 VanDerWaalsContact C-N 3.29Å; D171-G173 PolarHBondContact O-N 3.36Å; D171-G173 PolarHBondContact OD2-N 3.06Å; G173-L175 VanDerWaalsContact C-N 3.33Å; G173-Y176 PolarHBondContact O-N 3.23Å; G173-S177 PolarHBondContact O-N 3.2Å; G173-S177 VanDerWaalsContact O-N 3.13Å; G173-S177 PolarHBondContact O-OG 3.37Å; G173-S177 VanDerWaalsContact O-OG 3.09Å
174	Q	77.8	Confident	78.2	Confident	40 Å²	40	67.4 Å²	67.4	19%	0.187	34%	0.344	C	S	.	.	H	α-helix	trans	-67.1	-38.3	173	-158.3	177.9	7.4	0	0	110.5	D171 Y176 S177 M178	D171-Q174 WeakPolarHBondContact OD1-CA 3.46Å; D171-Q174 WeakPolarHBondContact OD1-CB 3.03Å; D171-Q174 PolarHBondContact OD1-N 3.45Å; D171-Q174 PolarHBondContact OD2-N 3.29Å; Q174-Y176 VanDerWaalsContact C-N 3.32Å; Q174-Y176 PolarHBondContact O-N 3.34Å; Q174-S177 PolarHBondContact O-N 3.36Å; Q174-M178 HydrophobicContact CG-CE 4Å; Q174-M178 WeakPolarHBondContact O-CG 2.67Å; Q174-M178 PolarHBondContact O-N 3.28Å
175	L	76	Confident	78.4	Confident	40 Å²	40	64.9 Å²	64.9	21%	0.209	34%	0.337	C	S	.	.	H	α-helix	trans	-62.3	-40.8	174.9	-179.4	65.9	0	0	0	111.6	I161 Y165 D171 G173 S177 M178 L179	I161-L175 HydrophobicContact CG2-CD2 4.03Å; Y165-L175 HydrophobicContact CD1-CD2 3.67Å; Y165-L175 HydrophobicContact CD2-CD2 3.8Å; Y165-L175 HydrophobicContact CE1-CB 3.89Å; Y165-L175 HydrophobicContact CE1-CD2 3.45Å; Y165-L175 VanDerWaalsContact CE1-CD2 3.45Å; Y165-L175 HydrophobicContact CE1-CG 4.29Å; Y165-L175 HydrophobicContact CE2-CD2 3.61Å; Y165-L175 HydrophobicContact CG-CD2 3.83Å; Y165-L175 VanDerWaalsContact CZ-CD2 3.42Å; D171-L175 PolarHBondContact OD1-N 3.4Å; D171-L175 WeakPolarHBondContact OD2-CB 3.23Å; D171-L175 PolarHBondContact OD2-N 3.16Å; G173-L175 VanDerWaalsContact C-N 3.33Å; L175-S177 VanDerWaalsContact C-N 3.33Å; L175-S177 PolarHBondContact O-N 2.86Å; L175-M178 PolarHBondContact O-N 3.02Å; L175-L179 HydrophobicContact CD1-CD1 3.9Å; L175-L179 HydrophobicContact CD1-CG 3.92Å; L175-L179 HydrophobicContact CD2-CD1 4.32Å; L175-L179 HydrophobicContact CG-CD1 3.82Å; L175-L179 HydrophobicContact CG-CG 4.22Å; L175-L179 WeakPolarHBondContact O-CB 3.39Å; L175-L179 VanDerWaalsContact O-CG 3.27Å; L175-L179 WeakPolarHBondContact O-CG 3.4Å; L175-L179 PolarHBondContact O-N 3.38Å
176	Y	82.6	Confident	78.7	Confident	56 Å²	56	65.2 Å²	65.2	22%	0.22	34%	0.341	C	S	.	.	H	α-helix	trans	-58.6	-48	175.6	174.5	-91.9	0	0	0	110.7	K150 F153 D154 Y157 G173 Q174 L179 L180	K150-Y176 PolarHBondContact NZ-OH 2.95Å; F153-Y176 HydrophobicContact CD1-CE2 4.04Å; F153-Y176 AromaticContact CE1-CD2 3.89Å; F153-Y176 HydrophobicContact CE1-CD2 3.89Å; F153-Y176 AromaticContact CE1-CE2 3.52Å; F153-Y176 HydrophobicContact CE1-CE2 3.52Å; D154-Y176 PolarHBondContact OD1-OH 2.83Å; Y157-Y176 AromaticContact CD1-CD2 3.66Å; Y157-Y176 HydrophobicContact CD1-CD2 3.66Å; Y157-Y176 HydrophobicContact CD1-CE2 4.37Å; Y157-Y176 HydrophobicContact CD2-CD2 4.04Å; Y157-Y176 AromaticContact CE1-CD2 3.84Å; Y157-Y176 HydrophobicContact CE1-CD2 3.84Å; Y157-Y176 HydrophobicContact CE1-CG 4.42Å; Y157-Y176 HydrophobicContact CE2-CD2 4.21Å; Y157-Y176 AromaticContact CG-CD2 3.78Å; Y157-Y176 HydrophobicContact CG-CD2 3.78Å; Y157-Y176 HydrophobicContact CG-CE2 4.41Å; G173-Y176 PolarHBondContact O-N 3.23Å; Q174-Y176 VanDerWaalsContact C-N 3.32Å; Q174-Y176 PolarHBondContact O-N 3.34Å; Y176-L179 PolarHBondContact O-N 3.35Å; Y176-L180 HydrophobicContact CE1-CD2 3.73Å; Y176-L180 WeakPolarHBondContact O-CB 3.45Å; Y176-L180 PolarHBondContact O-N 3.45Å
177	S	82.4	Confident	78.7	Confident	58 Å²	58	61.6 Å²	61.6	41%	0.406	32%	0.318	S	S	.	.	H	α-helix	trans	-64	-44.4	-178	-56.8	0	0	0	0	111.9	G173 Q174 L175 L180 E181	G173-S177 PolarHBondContact O-N 3.2Å; G173-S177 VanDerWaalsContact O-N 3.13Å; G173-S177 PolarHBondContact O-OG 3.37Å; G173-S177 VanDerWaalsContact O-OG 3.09Å; Q174-S177 PolarHBondContact O-N 3.36Å; L175-S177 VanDerWaalsContact C-N 3.33Å; L175-S177 PolarHBondContact O-N 2.86Å; S177-L180 PolarHBondContact O-N 3.49Å; S177-E181 PolarHBondContact O-N 3.21Å
178	M	78.3	Confident	78.8	Confident	98 Å²	98	58.8 Å²	58.8	48%	0.483	30%	0.303	S	S	.	.	H	α-helix	trans	-61.9	-50	176	-70.1	-175.1	-179.8	0	0	111.8	Q174 L175 L180 E181 D182	Q174-M178 HydrophobicContact CG-CE 4Å; Q174-M178 WeakPolarHBondContact O-CG 2.67Å; Q174-M178 PolarHBondContact O-N 3.28Å; L175-M178 PolarHBondContact O-N 3.02Å; M178-L180 VanDerWaalsContact C-N 3.3Å; M178-L180 PolarHBondContact O-N 2.73Å; M178-E181 PolarHBondContact O-N 3.46Å; M178-D182 PolarHBondContact O-N 3.32Å
179	L	78.3	Confident	78.9	Confident	55 Å²	55	57.4 Å²	57.4	29%	0.288	29%	0.294	S	S	.	.	H	α-helix	trans	-66	-33.4	180	-70	178.2	0	0	0	112.4	F153 Y157 I161 L175 Y176 W183	F153-L179 HydrophobicContact CE2-CB 4.3Å; F153-L179 HydrophobicContact CZ-CB 3.94Å; Y157-L179 HydrophobicContact CD2-CD1 4.25Å; Y157-L179 HydrophobicContact CE2-CD1 4.16Å; I161-L179 HydrophobicContact CD1-CD1 3.73Å; L175-L179 HydrophobicContact CD1-CD1 3.9Å; L175-L179 HydrophobicContact CD1-CG 3.92Å; L175-L179 HydrophobicContact CD2-CD1 4.32Å; L175-L179 HydrophobicContact CG-CD1 3.82Å; L175-L179 HydrophobicContact CG-CG 4.22Å; L175-L179 WeakPolarHBondContact O-CB 3.39Å; L175-L179 VanDerWaalsContact O-CG 3.27Å; L175-L179 WeakPolarHBondContact O-CG 3.4Å; L175-L179 PolarHBondContact O-N 3.38Å; Y176-L179 PolarHBondContact O-N 3.35Å; L179-W183 WeakPolarHBondContact O-CB 3.45Å; L179-W183 PolarHBondContact O-N 3.46Å
180	L	82.6	Confident	79	Confident	25 Å²	25	58.1 Å²	58.1	13%	0.131	30%	0.296	C	S	.	.	H	α-helix	trans	-69	-39.5	176.1	-176.6	67.3	0	0	0	110.8	F153 Y176 S177 M178 W183 W184	F153-L180 HydrophobicContact CD1-CD1 3.53Å; F153-L180 HydrophobicContact CE1-CB 3.8Å; F153-L180 HydrophobicContact CE1-CD1 3.58Å; F153-L180 HydrophobicContact CE1-CG 4.25Å; F153-L180 HydrophobicContact CG-CD1 4.05Å; F153-L180 HydrophobicContact CZ-CB 3.86Å; F153-L180 HydrophobicContact CZ-CD1 4.15Å; Y176-L180 HydrophobicContact CE1-CD2 3.73Å; Y176-L180 WeakPolarHBondContact O-CB 3.45Å; Y176-L180 PolarHBondContact O-N 3.45Å; S177-L180 PolarHBondContact O-N 3.49Å; M178-L180 VanDerWaalsContact C-N 3.3Å; M178-L180 PolarHBondContact O-N 2.73Å; L180-W183 WeakPolarHBondContact O-CB 3.15Å; L180-W183 PolarHBondContact O-N 2.68Å; L180-W184 VanDerWaalsContact CD1-NE1 3.32Å; L180-W184 PolarHBondContact O-N 2.84Å
181	E	82.4	Confident	79.3	Confident	83 Å²	83	57.2 Å²	57.2	39%	0.388	29%	0.287	S	S	.	.	H	α-helix	trans	-63.4	-48.8	174	-169.9	-178.2	175	0	0	111.1	S177 M178 W183 W184 Q185	S177-E181 PolarHBondContact O-N 3.21Å; M178-E181 PolarHBondContact O-N 3.46Å; E181-W183 VanDerWaalsContact C-N 3.28Å; E181-W183 PolarHBondContact O-N 3.32Å; E181-W184 PolarHBondContact O-N 3.19Å; E181-Q185 WeakPolarHBondContact O-CG 3.13Å; E181-Q185 PolarHBondContact O-N 2.98Å
182	D	77.6	Confident	79.4	Confident	26 Å²	26	58.9 Å²	58.9	14%	0.139	30%	0.301	C	S	.	.	H	α-helix	trans	-61.7	-38.4	177.1	-65.6	-21.9	0	0	0	111	M178 Q185 M186 P261 K263	M178-D182 PolarHBondContact O-N 3.32Å; D182-Q185 PolarHBondContact O-N 2.91Å; D182-M186 VanDerWaalsContact O-CG 3.29Å; D182-M186 WeakPolarHBondContact O-CG 3.27Å; D182-M186 PolarHBondContact O-N 2.81Å; D182-P261 HydrophobicContact CB-CG 4.3Å; D182-K263 VanDerWaalsContact OD1-CE 3.27Å; D182-K263 WeakPolarHBondContact OD1-CE 3.17Å; D182-K263 IonicContact OD1-NZ 2.65Å; D182-K263 PolarHBondContact OD1-NZ 3.47Å
183	W	81.1	Confident	79.4	Confident	30 Å²	30	52.1 Å²	52.1	11%	0.114	27%	0.268	C	S	.	.	H	α-helix	trans	-57.2	-49.9	172.7	174.1	-97.5	0	0	0	112.2	L149 F153 L179 L180 E181 Q185 M186 I187	L149-W183 HydrophobicContact CD2-CZ2 4.4Å; F153-W183 HydrophobicContact CD2-CB 3.89Å; F153-W183 AromaticContact CD2-CD2 3.8Å; F153-W183 HydrophobicContact CD2-CD2 3.8Å; F153-W183 HydrophobicContact CD2-CE3 4.17Å; F153-W183 AromaticContact CD2-CG 3.66Å; F153-W183 HydrophobicContact CD2-CG 3.66Å; F153-W183 HydrophobicContact CE2-CB 3.83Å; F153-W183 HydrophobicContact CE2-CG 4.14Å; F153-W183 HydrophobicContact CG-CG 4.38Å; L179-W183 WeakPolarHBondContact O-CB 3.45Å; L179-W183 PolarHBondContact O-N 3.46Å; L180-W183 WeakPolarHBondContact O-CB 3.15Å; L180-W183 PolarHBondContact O-N 2.68Å; E181-W183 VanDerWaalsContact C-N 3.28Å; E181-W183 PolarHBondContact O-N 3.32Å; W183-Q185 VanDerWaalsContact C-N 3.32Å; W183-Q185 PolarHBondContact O-N 3.47Å; W183-M186 HydrophobicContact CE3-CE 4.18Å; W183-M186 PolarHBondContact O-N 2.94Å; W183-I187 HydrophobicContact CD2-CG1 4.33Å; W183-I187 HydrophobicContact CH2-CD1 4.4Å; W183-I187 HydrophobicContact CZ2-CD1 3.98Å; W183-I187 HydrophobicContact CZ2-CG1 4.23Å; W183-I187 WeakPolarHBondContact O-CG1 3.31Å; W183-I187 PolarHBondContact O-N 3.1Å
184	W	84.1	Confident	79.5	Confident	28 Å²	28	54.3 Å²	54.3	11%	0.106	27%	0.273	C	S	.	.	H	α-helix	trans	-66.8	-34	178.6	-71.7	118.2	0	0	0	112.8	V140 D146 L149 K150 L180 E181 I187 G188	V140-W184 HydrophobicContact CB-CE3 3.95Å; V140-W184 HydrophobicContact CB-CZ3 4.42Å; V140-W184 HydrophobicContact CG1-CE3 4.36Å; V140-W184 HydrophobicContact CG2-CB 4.26Å; V140-W184 HydrophobicContact CG2-CD2 4.25Å; V140-W184 HydrophobicContact CG2-CE3 3.75Å; V140-W184 HydrophobicContact CG2-CG 4.45Å; D146-W184 HydrophobicContact CB-CH2 3.91Å; D146-W184 HydrophobicContact CB-CZ3 4.08Å; D146-W184 VanDerWaalsContact O-CH2 3.3Å; D146-W184 WeakPolarHBondContact O-CH2 3.22Å; L149-W184 HydrophobicContact CB-CH2 3.96Å; L149-W184 HydrophobicContact CB-CZ3 4.4Å; L149-W184 HydrophobicContact CD1-CZ3 4.32Å; K150-W184 HydrophobicContact CB-CZ2 4.04Å; K150-W184 HydrophobicContact CG-CZ2 4.45Å; L180-W184 VanDerWaalsContact CD1-NE1 3.32Å; L180-W184 PolarHBondContact O-N 2.84Å; E181-W184 PolarHBondContact O-N 3.19Å; W184-I187 HydrophobicContact CE3-CB 4.38Å; W184-I187 HydrophobicContact CE3-CG2 4.42Å; W184-I187 HydrophobicContact CZ3-CG2 4.4Å; W184-I187 PolarHBondContact O-N 3.07Å; W184-G188 PolarHBondContact O-N 3.18Å
185	Q	79.7	Confident	79.6	Confident	72 Å²	72	56 Å²	56	34%	0.336	29%	0.294	S	S	.	.	H	α-helix	trans	-64.1	-44.4	172.2	-70.6	-174.2	6.4	0	0	111.4	E181 D182 W183 G188 Q189 P261	E181-Q185 WeakPolarHBondContact O-CG 3.13Å; E181-Q185 PolarHBondContact O-N 2.98Å; D182-Q185 PolarHBondContact O-N 2.91Å; W183-Q185 VanDerWaalsContact C-N 3.32Å; W183-Q185 PolarHBondContact O-N 3.47Å; Q185-G188 PolarHBondContact O-N 3.49Å; Q185-Q189 WeakPolarHBondContact O-CG 3.47Å; Q185-Q189 PolarHBondContact O-N 2.76Å; Q185-P261 HydrophobicContact CB-CG 4.15Å
186	M	78.2	Confident	79.7	Confident	52 Å²	52	60.8 Å²	60.8	26%	0.256	32%	0.319	S	S	.	.	H	α-helix	trans	-61.7	-44.2	175.8	-70	-171.4	-69.3	0	0	112	D182 W183 G188 Q189 L190 L259 L260	D182-M186 VanDerWaalsContact O-CG 3.29Å; D182-M186 WeakPolarHBondContact O-CG 3.27Å; D182-M186 PolarHBondContact O-N 2.81Å; W183-M186 HydrophobicContact CE3-CE 4.18Å; W183-M186 PolarHBondContact O-N 2.94Å; M186-G188 VanDerWaalsContact C-N 3.33Å; M186-G188 PolarHBondContact O-N 2.75Å; M186-Q189 PolarHBondContact O-N 3.06Å; M186-L190 WeakPolarHBondContact O-CB 3.24Å; M186-L190 PolarHBondContact O-N 3.04Å; M186-L259 WeakPolarHBondContact CA-O 2.96Å; M186-L259 VanDerWaalsContact CG-O 3.31Å; M186-L259 WeakPolarHBondContact CG-O 3.29Å; M186-L260 HydrophobicContact SD-CD2 4.18Å
187	I	80.3	Confident	79.6	Confident	23 Å²	23	59.6 Å²	59.6	12%	0.118	32%	0.316	C	S	.	.	H	α-helix	trans	-64.2	-39.1	176.2	-65.7	-62	0	0	0	111.2	V140 V141 L149 W183 W184 L190 R191	V140-I187 HydrophobicContact CG1-CB 4.47Å; V140-I187 HydrophobicContact CG1-CG2 3.97Å; V141-I187 HydrophobicContact CG2-CG2 3.81Å; L149-I187 HydrophobicContact CD1-CD1 4.23Å; L149-I187 HydrophobicContact CD1-CG1 4.41Å; L149-I187 HydrophobicContact CD1-CG2 3.93Å; W183-I187 HydrophobicContact CD2-CG1 4.33Å; W183-I187 HydrophobicContact CH2-CD1 4.4Å; W183-I187 HydrophobicContact CZ2-CD1 3.98Å; W183-I187 HydrophobicContact CZ2-CG1 4.23Å; W183-I187 WeakPolarHBondContact O-CG1 3.31Å; W183-I187 PolarHBondContact O-N 3.1Å; W184-I187 HydrophobicContact CE3-CB 4.38Å; W184-I187 HydrophobicContact CE3-CG2 4.42Å; W184-I187 HydrophobicContact CZ3-CG2 4.4Å; W184-I187 PolarHBondContact O-N 3.07Å; I187-L190 PolarHBondContact O-N 2.91Å; I187-R191 WeakPolarHBondContact O-CB 3.13Å; I187-R191 PolarHBondContact O-N 2.95Å
188	G	79.2	Confident	79.5	Confident	28 Å²	28	61.5 Å²	61.5	29%	0.289	32%	0.322	S	S	.	.	H	α-helix	trans	-62.9	-44.3	175.2	0	0	0	0	0	112.7	W184 Q185 M186 R191 S192	W184-G188 PolarHBondContact O-N 3.18Å; Q185-G188 PolarHBondContact O-N 3.49Å; M186-G188 VanDerWaalsContact C-N 3.33Å; M186-G188 PolarHBondContact O-N 2.75Å; G188-R191 PolarHBondContact O-N 2.84Å; G188-S192 PolarHBondContact O-N 2.66Å
189	Q	76.2	Confident	79.4	Confident	62 Å²	62	58.8 Å²	58.8	29%	0.29	31%	0.311	S	S	.	.	H	α-helix	trans	-64.2	-43.6	175.3	-70	-176.7	27.4	0	0	111.7	Q185 M186 S192 R193 C258 L259 L260	Q185-Q189 WeakPolarHBondContact O-CG 3.47Å; Q185-Q189 PolarHBondContact O-N 2.76Å; M186-Q189 PolarHBondContact O-N 3.06Å; Q189-S192 PolarHBondContact O-N 3.27Å; Q189-R193 PolarHBondContact O-N 3.27Å; Q189-R193 VanDerWaalsContact O-N 3.09Å; Q189-C258 PolarHBondContact OE1-O 2.84Å; Q189-L259 VanDerWaalsContact OE1-CA 3.28Å; Q189-L259 PolarHBondContact OE1-O 3.27Å; Q189-L260 PolarHBondContact NE2-O 3.11Å; Q189-L260 PolarHBondContact OE1-O 3.27Å
190	L	78.3	Confident	79.3	Confident	35 Å²	35	57 Å²	57	18%	0.183	30%	0.302	C	S	.	.	H	α-helix	trans	-60.4	-47.1	175.7	-178.7	60.3	0	0	0	111.3	M186 I187 S192 R193 L194 L259 L971	M186-L190 WeakPolarHBondContact O-CB 3.24Å; M186-L190 PolarHBondContact O-N 3.04Å; I187-L190 PolarHBondContact O-N 2.91Å; L190-S192 VanDerWaalsContact C-N 3.33Å; L190-S192 PolarHBondContact O-N 2.82Å; L190-R193 PolarHBondContact O-N 2.79Å; L190-L194 HydrophobicContact CD1-CD1 3.97Å; L190-L194 HydrophobicContact CD1-CG 4.01Å; L190-L194 HydrophobicContact CD2-CD1 4.45Å; L190-L194 HydrophobicContact CG-CD1 3.8Å; L190-L194 HydrophobicContact CG-CG 4.26Å; L190-L194 WeakPolarHBondContact O-CB 3.2Å; L190-L194 VanDerWaalsContact O-CG 3.26Å; L190-L194 WeakPolarHBondContact O-CG 3.46Å; L190-L194 PolarHBondContact O-N 3.13Å; L190-L259 HydrophobicContact CB-CD2 3.91Å; L190-L259 HydrophobicContact CD1-CD2 4.01Å; L190-L971 HydrophobicContact CD1-CD1 3.98Å
191	R	81.1	Confident	79.2	Confident	128 Å²	128	58.6 Å²	58.6	48%	0.483	31%	0.311	S	S	.	.	H	α-helix	trans	-56.5	-47.5	176.3	176.7	-168	165.4	169.6	2.2	111.2	V140 I187 G188 R193 L194 A195	V140-R191 WeakPolarHBondContact O-CD 3.22Å; V140-R191 PolarHBondContact O-NH1 3.2Å; I187-R191 WeakPolarHBondContact O-CB 3.13Å; I187-R191 PolarHBondContact O-N 2.95Å; G188-R191 PolarHBondContact O-N 2.84Å; R191-R193 VanDerWaalsContact C-N 3.32Å; R191-R193 PolarHBondContact O-N 2.76Å; R191-L194 PolarHBondContact O-N 3.4Å; R191-A195 WeakPolarHBondContact O-CB 3.37Å; R191-A195 PolarHBondContact O-N 2.71Å
192	S	79.3	Confident	79	Confident	75 Å²	75	55 Å²	55	52%	0.524	30%	0.295	S	S	.	.	H	α-helix	trans	-58.3	-46.6	-179.4	-168.8	0	0	0	0	111	G188 Q189 L190 A195	G188-S192 PolarHBondContact O-N 2.66Å; Q189-S192 PolarHBondContact O-N 3.27Å; L190-S192 VanDerWaalsContact C-N 3.33Å; L190-S192 PolarHBondContact O-N 2.82Å; S192-A195 PolarHBondContact O-N 3.42Å
193	R	76.9	Confident	78.8	Confident	56 Å²	56	53.9 Å²	53.9	21%	0.211	29%	0.289	C	S	.	.	H	α-helix	trans	-67.3	-41	179.3	-70	-178.7	171.3	-78.9	-6	112.6	Q189 L190 R191 A195 D196 C258 L971 E974	Q189-R193 PolarHBondContact O-N 3.27Å; Q189-R193 VanDerWaalsContact O-N 3.09Å; L190-R193 PolarHBondContact O-N 2.79Å; R191-R193 VanDerWaalsContact C-N 3.32Å; R191-R193 PolarHBondContact O-N 2.76Å; R193-A195 VanDerWaalsContact C-N 3.26Å; R193-A195 PolarHBondContact O-N 2.69Å; R193-D196 PolarHBondContact O-N 3.32Å; R193-C258 PolarHBondContact NE-O 3.19Å; R193-L971 HydrophobicContact CB-CD1 3.95Å; R193-L971 PolarHBondContact NH1-O 2.99Å; R193-E974 IonicContact CZ-OE1 2.6Å; R193-E974 IonicContact NH1-OE1 3.51Å; R193-E974 PolarHBondContact NH1-OE1 2.98Å; R193-E974 IonicContact NH1-OE2 2.82Å; R193-E974 PolarHBondContact NH1-OE2 3.33Å; R193-E974 VanDerWaalsContact NH1-OE2 3.12Å; R193-E974 IonicContact NH2-OE1 2.71Å; R193-E974 PolarHBondContact NH2-OE1 3.47Å
194	L	78	Confident	78.4	Confident	71 Å²	71	52.7 Å²	52.7	37%	0.372	29%	0.285	S	S	.	.	H	α-helix	trans	-66.6	-27.6	177.5	-70.4	176.2	0	0	0	112.8	L190 R191 D196 I197 L971	L190-L194 HydrophobicContact CD1-CD1 3.97Å; L190-L194 HydrophobicContact CD1-CG 4.01Å; L190-L194 HydrophobicContact CD2-CD1 4.45Å; L190-L194 HydrophobicContact CG-CD1 3.8Å; L190-L194 HydrophobicContact CG-CG 4.26Å; L190-L194 WeakPolarHBondContact O-CB 3.2Å; L190-L194 VanDerWaalsContact O-CG 3.26Å; L190-L194 WeakPolarHBondContact O-CG 3.46Å; L190-L194 PolarHBondContact O-N 3.13Å; R191-L194 PolarHBondContact O-N 3.4Å; L194-D196 PolarHBondContact O-N 2.72Å; L194-I197 HydrophobicContact CD2-CD1 3.8Å; L194-I197 PolarHBondContact O-N 3.18Å; L194-L971 HydrophobicContact CD2-CD1 3.93Å; L194-L971 HydrophobicContact CG-CD1 4.36Å
195	A	78.3	Confident	78.2	Confident	75 Å²	75	56.6 Å²	56.6	62%	0.62	30%	0.3	S	S	*	.	H	α-helix	trans	-67.3	-24.9	178.5	0	0	0	0	0	113	R191 S192 R193	R191-A195 WeakPolarHBondContact O-CB 3.37Å; R191-A195 PolarHBondContact O-N 2.71Å; S192-A195 PolarHBondContact O-N 3.42Å; R193-A195 VanDerWaalsContact C-N 3.26Å; R193-A195 PolarHBondContact O-N 2.69Å
196	D	78.2	Confident	78.2	Confident	140 Å²	140	54 Å²	54	75%	0.749	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-7.7	-179.2	-62.5	-31	0	0	0	113	R193 L194	R193-D196 PolarHBondContact O-N 3.32Å; L194-D196 PolarHBondContact O-N 2.72Å
197	I	80.5	Confident	78.2	Confident	31 Å²	31	51.6 Å²	51.6	16%	0.159	28%	0.277	C	S	.	.	S	Bend	trans	-81.1	128.6	-178.9	-61.2	178.8	0	0	0	110.1	L194 V199 V202 E970 L971	L194-I197 HydrophobicContact CD2-CD1 3.8Å; L194-I197 PolarHBondContact O-N 3.18Å; I197-V199 VanDerWaalsContact C-N 3.25Å; I197-V199 HydrophobicContact CG2-CG2 4.36Å; I197-V199 PolarHBondContact O-N 3.32Å; I197-V202 HydrophobicContact CG2-CG2 3.75Å; I197-E970 HydrophobicContact CD1-CB 4.26Å; I197-E970 HydrophobicContact CG1-CB 4.47Å; I197-E970 HydrophobicContact CG2-CB 4.43Å; I197-L971 HydrophobicContact CD1-CD1 4.4Å
198	D	80.8	Confident	78.1	Confident	98 Å²	98	50.7 Å²	50.7	52%	0.524	27%	0.273	S	S	.	.			trans	-73.4	84.9	165	-173.6	-15.1	0	0	0	109.6	V200 N201 V202	D198-V200 PolarHBondContact O-N 3.41Å; D198-V200 WeakPolarHBondContact OD1-CB 3.23Å; D198-V200 PolarHBondContact OD1-N 2.8Å; D198-V200 VanDerWaalsContact OD1-N 3.11Å; D198-N201 HydrophobicContact CB-CB 3.99Å; D198-N201 PolarHBondContact O-N 2.78Å; D198-N201 VanDerWaalsContact O-N 3.12Å; D198-N201 PolarHBondContact OD1-N 3.34Å; D198-V202 WeakPolarHBondContact O-CG2 3.38Å; D198-V202 PolarHBondContact O-N 2.76Å
199	V	77.5	Confident	78.4	Confident	42 Å²	42	56.3 Å²	56.3	26%	0.255	29%	0.285	S	S	.	.	H	α-helix	trans	-58.5	-31.8	-177.4	-174.5	0	0	0	0	111.4	I197 V203 V873 F877	I197-V199 VanDerWaalsContact C-N 3.25Å; I197-V199 HydrophobicContact CG2-CG2 4.36Å; I197-V199 PolarHBondContact O-N 3.32Å; V199-V203 HydrophobicContact CG1-CG2 4.24Å; V199-V203 WeakPolarHBondContact O-CB 3.27Å; V199-V203 WeakPolarHBondContact O-CG2 3.47Å; V199-V203 PolarHBondContact O-N 2.92Å; V199-V203 VanDerWaalsContact O-N 3.09Å; V199-V873 HydrophobicContact CB-CG1 4.39Å; V199-V873 HydrophobicContact CG1-CG1 3.81Å; V199-F877 HydrophobicContact CG1-CD1 4.2Å; V199-F877 HydrophobicContact CG1-CD2 3.32Å; V199-F877 HydrophobicContact CG1-CE1 4.09Å; V199-F877 HydrophobicContact CG1-CE2 3.2Å; V199-F877 HydrophobicContact CG1-CG 3.85Å; V199-F877 HydrophobicContact CG1-CZ 3.61Å
200	V	74.9	Confident	78.8	Confident	17 Å²	17	54.5 Å²	54.5	10%	0.103	28%	0.277	C	S	.	.	H	α-helix	trans	-68.7	-45	178.5	177.4	0	0	0	0	110.4	D198 V203 C204 L828 R870 V873	D198-V200 PolarHBondContact O-N 3.41Å; D198-V200 WeakPolarHBondContact OD1-CB 3.23Å; D198-V200 PolarHBondContact OD1-N 2.8Å; D198-V200 VanDerWaalsContact OD1-N 3.11Å; V200-V203 PolarHBondContact O-N 3.49Å; V200-C204 VanDerWaalsContact O-CB 3.23Å; V200-C204 WeakPolarHBondContact O-CB 3.32Å; V200-C204 PolarHBondContact O-N 2.92Å; V200-C204 PolarHBondContact O-SG 3.06Å; V200-L828 HydrophobicContact CG1-CD1 3.57Å; V200-L828 HydrophobicContact CG1-CD2 3.82Å; V200-L828 HydrophobicContact CG1-CG 4.36Å; V200-R870 HydrophobicContact CG1-CG 3.81Å; V200-R870 HydrophobicContact CG2-CG 4.11Å; V200-V873 HydrophobicContact CG2-CB 4.16Å; V200-V873 HydrophobicContact CG2-CG1 3.95Å
201	N	81.3	Confident	79.1	Confident	58 Å²	58	53 Å²	53	31%	0.31	27%	0.27	S	S	.	.	H	α-helix	trans	-63.9	-48	177.5	-171.8	62.3	0	0	0	111.7	D198 V203 C204 Y205 D206	D198-N201 HydrophobicContact CB-CB 3.99Å; D198-N201 PolarHBondContact O-N 2.78Å; D198-N201 VanDerWaalsContact O-N 3.12Å; D198-N201 PolarHBondContact OD1-N 3.34Å; N201-V203 VanDerWaalsContact C-N 3.26Å; N201-V203 PolarHBondContact O-N 3.41Å; N201-C204 PolarHBondContact O-N 2.74Å; N201-Y205 WeakPolarHBondContact O-CA 3.33Å; N201-Y205 VanDerWaalsContact O-CB 3.23Å; N201-Y205 WeakPolarHBondContact O-CB 3.48Å; N201-Y205 PolarHBondContact O-N 2.87Å; N201-Y205 WeakPolarHBondContact OD1-CB 3.32Å; N201-D206 PolarHBondContact ND2-OD2 3.13Å; N201-D206 VanDerWaalsContact ND2-OD2 3.1Å; N201-D206 PolarHBondContact O-N 3.26Å; N201-D206 VanDerWaalsContact O-N 3.16Å
202	V	78	Confident	79.2	Confident	9 Å²	9	49.2 Å²	49.2	6%	0.055	26%	0.257	C	S	.	.	I	π-helix	trans	-54.3	-46.9	178.2	171	0	0	0	0	111	F76 I197 D198 S207 M966 L967 E970	F76-V202 HydrophobicContact CE1-CG1 4.05Å; F76-V202 HydrophobicContact CZ-CG1 4.03Å; I197-V202 HydrophobicContact CG2-CG2 3.75Å; D198-V202 WeakPolarHBondContact O-CG2 3.38Å; D198-V202 PolarHBondContact O-N 2.76Å; V202-S207 WeakPolarHBondContact O-CB 3.21Å; V202-S207 PolarHBondContact O-N 3.38Å; V202-S207 PolarHBondContact O-OG 3.21Å; V202-M966 HydrophobicContact CG1-CE 3.9Å; V202-M966 HydrophobicContact CG1-SD 3.91Å; V202-L967 HydrophobicContact CG1-CD2 4.26Å; V202-E970 HydrophobicContact CG2-CB 4.49Å; V202-E970 HydrophobicContact CG2-CG 3.72Å
203	V	72.4	Confident	79.7	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.006	25%	0.252	C	S	.	.	I	π-helix	trans	-73.4	-49.6	-175.8	148.2	0	0	0	0	113.2	L73 F76 V199 V200 N201 V208 V873 F877	L73-V203 HydrophobicContact CD1-CB 3.64Å; L73-V203 HydrophobicContact CD1-CG1 3.03Å; L73-V203 HydrophobicContact CD1-CG2 3.57Å; L73-V203 HydrophobicContact CD2-CG1 3.27Å; L73-V203 HydrophobicContact CG-CG1 3.68Å; F76-V203 HydrophobicContact CD1-CG2 4.45Å; F76-V203 HydrophobicContact CE1-CG2 4.29Å; V199-V203 HydrophobicContact CG1-CG2 4.24Å; V199-V203 WeakPolarHBondContact O-CB 3.27Å; V199-V203 WeakPolarHBondContact O-CG2 3.47Å; V199-V203 PolarHBondContact O-N 2.92Å; V199-V203 VanDerWaalsContact O-N 3.09Å; V200-V203 PolarHBondContact O-N 3.49Å; N201-V203 VanDerWaalsContact C-N 3.26Å; N201-V203 PolarHBondContact O-N 3.41Å; V203-V208 WeakPolarHBondContact O-CG2 3.43Å; V203-V873 HydrophobicContact CB-CG2 4.32Å; V203-V873 HydrophobicContact CG1-CG1 4.35Å; V203-V873 HydrophobicContact CG1-CG2 3.41Å; V203-V873 VanDerWaalsContact CG1-CG2 3.41Å; V203-V873 HydrophobicContact CG2-CG1 4.46Å; V203-F877 HydrophobicContact CG2-CE2 3.95Å; V203-F877 HydrophobicContact CG2-CZ 4.23Å
204	C	72.9	Confident	80.3	Confident	5 Å²	5	46.1 Å²	46.1	3%	0.034	24%	0.243	C	C	.	.	I	π-helix	trans	-90.4	-24.4	-169	-63	0	0	0	0	113.2	V200 N201 V208 L828 I869	V200-C204 VanDerWaalsContact O-CB 3.23Å; V200-C204 WeakPolarHBondContact O-CB 3.32Å; V200-C204 PolarHBondContact O-N 2.92Å; V200-C204 PolarHBondContact O-SG 3.06Å; N201-C204 PolarHBondContact O-N 2.74Å; C204-V208 WeakPolarHBondContact O-CB 3.41Å; C204-V208 VanDerWaalsContact O-CG2 3.3Å; C204-V208 WeakPolarHBondContact O-CG2 3.44Å; C204-L828 HydrophobicContact CB-CB 4.35Å; C204-L828 HydrophobicContact CB-CD2 4.13Å; C204-I869 HydrophobicContact CB-CG2 4.38Å; C204-I869 WeakPolarHBondContact SG-CG2 3.49Å
205	Y	80	Confident	80.7	Confident	110 Å²	110	43.1 Å²	43.1	43%	0.431	23%	0.228	S	C	.	.	I	π-helix	trans	-110.5	-65.6	-176.1	-173.1	-93.1	0	0	0	111	N201 V208 R209 P831	N201-Y205 WeakPolarHBondContact O-CA 3.33Å; N201-Y205 VanDerWaalsContact O-CB 3.23Å; N201-Y205 WeakPolarHBondContact O-CB 3.48Å; N201-Y205 PolarHBondContact O-N 2.87Å; N201-Y205 WeakPolarHBondContact OD1-CB 3.32Å; Y205-V208 PolarHBondContact O-N 2.67Å; Y205-R209 VanDerWaalsContact O-CB 3.24Å; Y205-R209 WeakPolarHBondContact O-CB 3.26Å; Y205-R209 PolarHBondContact O-N 3.39Å; Y205-P831 HydrophobicContact CD2-CG 3.73Å; Y205-P831 HydrophobicContact CE2-CG 4.28Å
206	D	79.3	Confident	81.2	Confident	19 Å²	19	42 Å²	42	10%	0.102	21%	0.213	C	C	.	.	I	π-helix	trans	-65.3	-50.5	-170.2	-67.6	-53.3	0	0	0	112.5	N201 R209 I210 M966	N201-D206 PolarHBondContact ND2-OD2 3.13Å; N201-D206 VanDerWaalsContact ND2-OD2 3.1Å; N201-D206 PolarHBondContact O-N 3.26Å; N201-D206 VanDerWaalsContact O-N 3.16Å; D206-R209 PolarHBondContact O-N 2.97Å; D206-R209 IonicContact OD1-NH2 3.55Å; D206-I210 WeakPolarHBondContact O-CG1 3.49Å; D206-I210 PolarHBondContact O-N 3.35Å; D206-M966 HydrophobicContact CB-CE 4.3Å; D206-M966 HydrophobicContact CB-CG 4.16Å; D206-M966 HydrophobicContact CB-SD 4.15Å
207	S	80	Confident	81.7	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.007	19%	0.188	C	C	.	.	H	α-helix	trans	-65.1	-42.7	179.1	-61.8	0	0	0	0	112.3	F76 V202 R209 I210 L211 M966	F76-S207 VanDerWaalsContact CD1-OG 3.24Å; F76-S207 WeakPolarHBondContact CD1-OG 3.35Å; F76-S207 VanDerWaalsContact CD2-OG 3.25Å; F76-S207 WeakPolarHBondContact CD2-OG 3.26Å; F76-S207 WeakPolarHBondContact CE1-OG 3.39Å; F76-S207 WeakPolarHBondContact CE2-OG 3.42Å; F76-S207 WeakPolarHBondContact CG-OG 3.47Å; F76-S207 WeakPolarHBondContact CZ-OG 3.45Å; V202-S207 WeakPolarHBondContact O-CB 3.21Å; V202-S207 PolarHBondContact O-N 3.38Å; V202-S207 PolarHBondContact O-OG 3.21Å; S207-R209 VanDerWaalsContact C-N 3.3Å; S207-R209 PolarHBondContact O-N 3.05Å; S207-I210 PolarHBondContact O-N 3.42Å; S207-L211 WeakPolarHBondContact O-CB 3.45Å; S207-L211 VanDerWaalsContact O-CD1 3.3Å; S207-L211 WeakPolarHBondContact O-CD1 3.44Å; S207-L211 WeakPolarHBondContact O-CG 3.42Å; S207-L211 PolarHBondContact O-N 3.04Å; S207-M966 WeakPolarHBondContact OG-CE 3.25Å
208	V	78	Confident	82	Confident	4 Å²	4	37.1 Å²	37.1	2%	0.024	19%	0.187	C	C	.	.	H	α-helix	trans	-63.8	-38.3	179.1	174.7	0	0	0	0	110.9	T69 V203 C204 Y205 L211 H212 P831 L835	T69-V208 HydrophobicContact CG2-CG1 4.3Å; T69-V208 HydrophobicContact CG2-CG2 4.42Å; V203-V208 WeakPolarHBondContact O-CG2 3.43Å; C204-V208 WeakPolarHBondContact O-CB 3.41Å; C204-V208 VanDerWaalsContact O-CG2 3.3Å; C204-V208 WeakPolarHBondContact O-CG2 3.44Å; Y205-V208 PolarHBondContact O-N 2.67Å; V208-L211 PolarHBondContact O-N 3.42Å; V208-H212 WeakPolarHBondContact O-CB 3.41Å; V208-H212 PolarHBondContact O-N 2.72Å; V208-P831 HydrophobicContact CB-CB 4.11Å; V208-P831 HydrophobicContact CG1-CB 3.56Å; V208-P831 WeakPolarHBondContact CG1-O 3.39Å; V208-L835 HydrophobicContact CB-CD2 4.43Å; V208-L835 HydrophobicContact CG1-CB 4.09Å; V208-L835 HydrophobicContact CG1-CD2 3.75Å
209	R	85.2	Confident	82.1	Confident	145 Å²	145	35.4 Å²	35.4	55%	0.547	17%	0.173	S	C	.	.	H	α-helix	trans	-66.4	-44.1	174.8	-174.4	177.1	64.7	135.9	-3.4	112.1	Y205 D206 S207 L211 H212 S213	Y205-R209 VanDerWaalsContact O-CB 3.24Å; Y205-R209 WeakPolarHBondContact O-CB 3.26Å; Y205-R209 PolarHBondContact O-N 3.39Å; D206-R209 PolarHBondContact O-N 2.97Å; D206-R209 IonicContact OD1-NH2 3.55Å; S207-R209 VanDerWaalsContact C-N 3.3Å; S207-R209 PolarHBondContact O-N 3.05Å; R209-L211 VanDerWaalsContact C-N 3.32Å; R209-L211 PolarHBondContact O-N 3.41Å; R209-H212 PolarHBondContact O-N 3.23Å; R209-S213 PolarHBondContact O-N 3.38Å
210	I	83.6	Confident	82.4	Confident	24 Å²	24	35.8 Å²	35.8	12%	0.123	18%	0.181	C	C	.	.	H	α-helix	trans	-59.8	-45.6	175.6	-70.7	164.7	0	0	0	110.3	D206 S207 H212 S213 H214 L959 V962 L963 M966	D206-I210 WeakPolarHBondContact O-CG1 3.49Å; D206-I210 PolarHBondContact O-N 3.35Å; S207-I210 PolarHBondContact O-N 3.42Å; I210-H212 PolarHBondContact O-N 3.37Å; I210-S213 PolarHBondContact O-N 3.09Å; I210-H214 WeakPolarHBondContact O-CB 3.31Å; I210-H214 PolarHBondContact O-N 3.21Å; I210-L959 HydrophobicContact CG2-CD1 3.66Å; I210-V962 HydrophobicContact CD1-CG1 4.08Å; I210-V962 HydrophobicContact CG1-CG1 4.05Å; I210-V962 HydrophobicContact CG2-CB 4.37Å; I210-V962 HydrophobicContact CG2-CG1 3.7Å; I210-L963 HydrophobicContact CB-CD2 4.05Å; I210-L963 HydrophobicContact CD1-CD2 3.84Å; I210-L963 HydrophobicContact CG2-CD2 3.66Å; I210-L963 HydrophobicContact CG2-CG 4.2Å; I210-M966 HydrophobicContact CD1-CB 3.89Å; I210-M966 HydrophobicContact CD1-CE 4.32Å; I210-M966 HydrophobicContact CD1-CG 4.02Å
211	L	84.4	Confident	82.8	Confident	5 Å²	5	36.7 Å²	36.7	3%	0.026	19%	0.19	C	C	.	.	H	α-helix	trans	-63.4	-41.4	176.8	-72	161.1	0	0	0	112.2	L72 S207 V208 R209 H214 F215 L835 L959	L72-L211 HydrophobicContact CB-CD1 3.56Å; L72-L211 HydrophobicContact CD1-CB 4.5Å; L72-L211 HydrophobicContact CD1-CD1 4.33Å; L72-L211 HydrophobicContact CD2-CD2 4.1Å; L72-L211 HydrophobicContact CG-CD1 4.36Å; S207-L211 WeakPolarHBondContact O-CB 3.45Å; S207-L211 VanDerWaalsContact O-CD1 3.3Å; S207-L211 WeakPolarHBondContact O-CD1 3.44Å; S207-L211 WeakPolarHBondContact O-CG 3.42Å; S207-L211 PolarHBondContact O-N 3.04Å; V208-L211 PolarHBondContact O-N 3.42Å; R209-L211 VanDerWaalsContact C-N 3.32Å; R209-L211 PolarHBondContact O-N 3.41Å; L211-H214 WeakPolarHBondContact O-CB 3.29Å; L211-H214 PolarHBondContact O-N 2.98Å; L211-F215 VanDerWaalsContact O-CD2 3.31Å; L211-F215 WeakPolarHBondContact O-CD2 3.15Å; L211-F215 PolarHBondContact O-N 3.25Å; L211-L835 HydrophobicContact CB-CD1 4.21Å; L211-L835 HydrophobicContact CB-CD2 3.83Å; L211-L835 HydrophobicContact CD1-CD2 4.36Å; L211-L959 HydrophobicContact CD2-CD1 4.14Å; L211-L959 HydrophobicContact CD2-CD2 3.9Å
212	H	84.7	Confident	82.4	Confident	47 Å²	47	37 Å²	37	22%	0.218	20%	0.197	C	C	.	.	H	α-helix	trans	-60.2	-48.3	175.5	177.8	-81.7	0	0	0	111.5	V208 R209 I210 H214 F215 T216 L835	V208-H212 WeakPolarHBondContact O-CB 3.41Å; V208-H212 PolarHBondContact O-N 2.72Å; R209-H212 PolarHBondContact O-N 3.23Å; I210-H212 PolarHBondContact O-N 3.37Å; H212-H214 VanDerWaalsContact C-N 3.32Å; H212-H214 PolarHBondContact O-N 3.42Å; H212-F215 PolarHBondContact O-N 2.72Å; H212-T216 WeakPolarHBondContact O-CB 3.47Å; H212-T216 PolarHBondContact O-N 3.42Å; H212-T216 PolarHBondContact O-OG1 2.64Å; H212-L835 HydrophobicContact CB-CD1 4.2Å
213	S	89.3	Confident	81.5	Confident	60 Å²	60	38.7 Å²	38.7	42%	0.42	22%	0.216	S	C	.	.	H	α-helix	trans	-56.8	-48.6	174.6	-165.1	0	0	0	0	110.9	R209 I210 F215 T216 D217	R209-S213 PolarHBondContact O-N 3.38Å; I210-S213 PolarHBondContact O-N 3.09Å; S213-F215 PolarHBondContact O-N 3.29Å; S213-T216 WeakPolarHBondContact O-CA 3.21Å; S213-T216 WeakPolarHBondContact O-CB 3.37Å; S213-T216 PolarHBondContact O-N 2.82Å; S213-D217 VanDerWaalsContact O-CG 3.27Å; S213-D217 PolarHBondContact O-N 3.24Å; S213-D217 PolarHBondContact OG-OD2 2.98Å
214	H	89.4	Confident	80.6	Confident	6 Å²	6	46 Å²	46	3%	0.028	24%	0.243	C	C	.	.	H	α-helix	trans	-56.3	-46.5	-179.2	-173.8	67.8	0	0	0	113.3	I210 L211 H212 T216 D217 L218 F232 A955 H958 L959	I210-H214 WeakPolarHBondContact O-CB 3.31Å; I210-H214 PolarHBondContact O-N 3.21Å; L211-H214 WeakPolarHBondContact O-CB 3.29Å; L211-H214 PolarHBondContact O-N 2.98Å; H212-H214 VanDerWaalsContact C-N 3.32Å; H212-H214 PolarHBondContact O-N 3.42Å; H214-T216 VanDerWaalsContact C-N 3.33Å; H214-D217 PolarHBondContact O-N 2.81Å; H214-L218 WeakPolarHBondContact O-CB 3.26Å; H214-L218 WeakPolarHBondContact O-CG 3.37Å; H214-L218 PolarHBondContact O-N 2.75Å; H214-F232 AromaticContact CE1-CZ 3.57Å; H214-F232 AromaticContact ND1-CZ 3.5Å; H214-A955 PolarHBondContact CE1-O 2.64Å; H214-H958 AromaticContact ND1-CD2 3.85Å; H214-L959 HydrophobicContact CB-CD1 4.17Å
215	F	86.8	Confident	79.5	Confident	9 Å²	9	49.2 Å²	49.2	4%	0.039	27%	0.266	C	S	.	.	H	α-helix	trans	-70.7	-28.9	177.2	-84.4	-79.4	0	0	0	113.2	L72 L211 H212 S213 R219 L835 E838 I839 I946 A949	L72-F215 HydrophobicContact CD1-CE2 4.31Å; L72-F215 HydrophobicContact CD2-CE2 4.2Å; L211-F215 VanDerWaalsContact O-CD2 3.31Å; L211-F215 WeakPolarHBondContact O-CD2 3.15Å; L211-F215 PolarHBondContact O-N 3.25Å; H212-F215 PolarHBondContact O-N 2.72Å; S213-F215 PolarHBondContact O-N 3.29Å; F215-R219 PolarHBondContact O-N 2.65Å; F215-R219 VanDerWaalsContact O-N 3.11Å; F215-L835 HydrophobicContact CD2-CD1 4.23Å; F215-E838 HydrophobicContact CB-CG 4.14Å; F215-I839 HydrophobicContact CB-CG1 4.31Å; F215-I839 HydrophobicContact CD1-CD1 3.77Å; F215-I839 HydrophobicContact CD1-CG1 3.92Å; F215-I839 HydrophobicContact CD2-CD1 3.46Å; F215-I839 VanDerWaalsContact CD2-CD1 3.46Å; F215-I839 HydrophobicContact CD2-CG1 4.05Å; F215-I839 HydrophobicContact CE1-CD1 3.66Å; F215-I839 HydrophobicContact CE1-CG1 4.25Å; F215-I839 HydrophobicContact CE2-CD1 3.36Å; F215-I839 HydrophobicContact CE2-CG1 4.38Å; F215-I839 HydrophobicContact CG-CD1 3.69Å; F215-I839 HydrophobicContact CG-CG1 3.82Å; F215-I839 HydrophobicContact CZ-CD1 3.46Å; F215-I839 VanDerWaalsContact CZ-CD1 3.46Å; F215-I839 HydrophobicContact CZ-CG1 4.48Å; F215-I946 HydrophobicContact CE1-CG1 4.48Å; F215-I946 HydrophobicContact CZ-CG1 4.4Å; F215-A949 HydrophobicContact CD1-CB 4.47Å; F215-A949 HydrophobicContact CE1-CB 3.64Å; F215-A949 HydrophobicContact CZ-CB 4.12Å
216	T	87.4	Confident	78	Confident	50 Å²	50	54 Å²	54	31%	0.307	29%	0.292	S	S	.	.	H	α-helix	trans	-67.5	-46.6	173.3	-53.2	0	0	0	0	110.7	H212 S213 H214 R219 A220 E838	H212-T216 WeakPolarHBondContact O-CB 3.47Å; H212-T216 PolarHBondContact O-N 3.42Å; H212-T216 PolarHBondContact O-OG1 2.64Å; S213-T216 WeakPolarHBondContact O-CA 3.21Å; S213-T216 WeakPolarHBondContact O-CB 3.37Å; S213-T216 PolarHBondContact O-N 2.82Å; H214-T216 VanDerWaalsContact C-N 3.33Å; T216-R219 WeakPolarHBondContact O-CB 3.39Å; T216-R219 PolarHBondContact O-N 3.48Å; T216-A220 PolarHBondContact O-N 2.63Å; T216-E838 VanDerWaalsContact CA-OE1 3.24Å; T216-E838 WeakPolarHBondContact CA-OE1 3.5Å; T216-E838 PolarHBondContact OG1-OE1 3.11Å
217	D	89.2	Confident	76.9	Confident	42 Å²	42	60.1 Å²	60.1	23%	0.225	32%	0.32	C	S	.	.	H	α-helix	trans	-66	-41.1	178.9	-66.2	-33.4	0	0	0	111.8	S213 H214 R219 A220 A221 F232 P233	S213-D217 VanDerWaalsContact O-CG 3.27Å; S213-D217 PolarHBondContact O-N 3.24Å; S213-D217 PolarHBondContact OG-OD2 2.98Å; H214-D217 PolarHBondContact O-N 2.81Å; D217-R219 VanDerWaalsContact C-N 3.31Å; D217-R219 PolarHBondContact O-N 3.13Å; D217-A220 PolarHBondContact O-N 2.77Å; D217-A221 WeakPolarHBondContact O-CB 3.37Å; D217-A221 PolarHBondContact O-N 3.43Å; D217-F232 HydrophobicContact CB-CD2 3.92Å; D217-F232 HydrophobicContact CB-CE2 3.6Å; D217-F232 HydrophobicContact CB-CZ 4.43Å; D217-P233 HydrophobicContact CB-CG 4.09Å
218	L	87.7	Confident	75.8	Confident	28 Å²	28	64.5 Å²	64.5	15%	0.147	36%	0.356	C	S	.	.	H	α-helix	trans	-60.5	-39.4	172.7	-80.9	176	0	0	0	112.1	H214 A221 S222 F232 A949 A955	H214-L218 WeakPolarHBondContact O-CB 3.26Å; H214-L218 WeakPolarHBondContact O-CG 3.37Å; H214-L218 PolarHBondContact O-N 2.75Å; L218-A221 PolarHBondContact O-N 3.4Å; L218-S222 WeakPolarHBondContact O-CB 3.44Å; L218-S222 PolarHBondContact O-N 3.34Å; L218-F232 HydrophobicContact CB-CE2 4.49Å; L218-F232 HydrophobicContact CD2-CD2 3.81Å; L218-F232 HydrophobicContact CD2-CE2 3.85Å; L218-F232 HydrophobicContact CG-CD2 4.07Å; L218-F232 HydrophobicContact CG-CE2 3.72Å; L218-A949 HydrophobicContact CD1-CB 3.57Å; L218-A955 HydrophobicContact CD2-CB 3.83Å
219	R	82.3	Confident	75.3	Confident	61 Å²	61	67.4 Å²	67.4	23%	0.23	38%	0.38	C	S	.	.	H	α-helix	trans	-63.9	-49.3	175.2	179	-172.8	-61.6	151.8	20.5	110.9	F215 T216 D217 A221 S222 E838 E841	F215-R219 PolarHBondContact O-N 2.65Å; F215-R219 VanDerWaalsContact O-N 3.11Å; T216-R219 WeakPolarHBondContact O-CB 3.39Å; T216-R219 PolarHBondContact O-N 3.48Å; D217-R219 VanDerWaalsContact C-N 3.31Å; D217-R219 PolarHBondContact O-N 3.13Å; R219-A221 PolarHBondContact O-N 3.33Å; R219-S222 PolarHBondContact O-N 3.48Å; R219-S222 PolarHBondContact O-OG 2.94Å; R219-E838 IonicContact CZ-OE1 3.53Å; R219-E838 IonicContact CZ-OE2 3.7Å; R219-E838 IonicContact NE-OE1 2.76Å; R219-E838 VanDerWaalsContact NH1-CD 3.25Å; R219-E838 IonicContact NH1-OE1 3.17Å; R219-E838 PolarHBondContact NH1-OE1 2.7Å; R219-E838 IonicContact NH1-OE2 3.35Å; R219-E838 PolarHBondContact NH1-OE2 3.07Å; R219-E838 PolarHBondContact NH2-O 3.02Å; R219-E838 IonicContact NH2-OE1 3.42Å; R219-E838 PolarHBondContact NH2-OE1 3.05Å; R219-E838 IonicContact NH2-OE2 3.65Å; R219-E838 PolarHBondContact NH2-OE2 2.8Å; R219-E841 IonicContact NE-OE1 2.83Å
220	A	83.3	Confident	75	Confident	50 Å²	50	69.2 Å²	69.2	41%	0.413	39%	0.388	S	S	.	.	H	α-helix	trans	-58	-33.4	-179.9	0	0	0	0	0	112	T216 D217 R230	T216-A220 PolarHBondContact O-N 2.63Å; D217-A220 PolarHBondContact O-N 2.77Å; A220-R230 PolarHBondContact O-N 2.75Å
221	A	83.6	Confident	74.9	Confident	36 Å²	36	74 Å²	74	30%	0.298	42%	0.42	S	S	.	.	H	α-helix	trans	-76.9	-26.6	174.9	0	0	0	0	0	114.6	D217 L218 R219 G223 R230 F232	D217-A221 WeakPolarHBondContact O-CB 3.37Å; D217-A221 PolarHBondContact O-N 3.43Å; L218-A221 PolarHBondContact O-N 3.4Å; R219-A221 PolarHBondContact O-N 3.33Å; A221-G223 VanDerWaalsContact C-N 3.32Å; A221-G223 PolarHBondContact O-N 2.99Å; A221-R230 WeakPolarHBondContact CA-O 3.36Å; A221-R230 WeakPolarHBondContact CB-O 2.86Å; A221-F232 HydrophobicContact CB-CB 3.96Å
222	S	72.4	Confident	75.1	Confident	66 Å²	66	75.5 Å²	75.5	46%	0.462	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-2.8	-176	70.9	0	0	0	0	115.8	L218 R219 R224	L218-S222 WeakPolarHBondContact O-CB 3.44Å; L218-S222 PolarHBondContact O-N 3.34Å; R219-S222 PolarHBondContact O-N 3.48Å; R219-S222 PolarHBondContact O-OG 2.94Å; S222-R224 PolarHBondContact O-N 3.15Å
223	G	58.6	Low	75.3	Confident	43 Å²	43	76.4 Å²	76.4	44%	0.443	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	19.3	168.1	0	0	0	0	0	117.3	A221 S225	A221-G223 VanDerWaalsContact C-N 3.32Å; A221-G223 PolarHBondContact O-N 2.99Å; G223-S225 VanDerWaalsContact C-N 3.31Å; G223-S225 PolarHBondContact O-N 3.37Å
224	R	53.8	Low	75.3	Confident	155 Å²	155	77.5 Å²	77.5	59%	0.585	44%	0.437	S	S	*	.			trans	-86.7	15.3	-178.7	-67.6	-172.2	177.3	-177	-0.5	115.3	S222 F941	S222-R224 PolarHBondContact O-N 3.15Å; R224-F941 VanDerWaalsContact NH1-CZ 3.29Å
225	S	49.8	Very low	75.4	Confident	73 Å²	73	77.9 Å²	77.9	51%	0.51	44%	0.439	S	S	.	.	S	Bend	trans	-124.3	156.9	178.2	-157.7	0	0	0	0	109.2	G223 E227	G223-S225 VanDerWaalsContact C-N 3.31Å; G223-S225 PolarHBondContact O-N 3.37Å; S225-E227 PolarHBondContact O-N 3.04Å
226	E	50	Low	75.4	Confident	209 Å²	209	82.2 Å²	82.2	98%	0.977	47%	0.468	S	S	*	.	S	Bend	trans	-61.3	-3.4	-179.6	-66.6	178.4	159	0	0	114.2
227	E	55.4	Low	75.5	Confident	149 Å²	149	80.1 Å²	80.1	70%	0.696	46%	0.455	S	S	*	.	S	Bend	trans	-94.1	142.9	175.4	-67.1	177.6	159.3	0	0	112	S225 A229	S225-E227 PolarHBondContact O-N 3.04Å; E227-A229 PolarHBondContact O-N 3.46Å
228	A	57.8	Low	75.5	Confident	93 Å²	93	79.6 Å²	79.6	77%	0.769	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-53.4	129.6	177.9	0	0	0	0	0	112.1	R230	A228-R230 PolarHBondContact O-N 3.34Å
229	A	67.5	Low	75.5	Confident	64 Å²	64	84.3 Å²	84.3	53%	0.529	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-57.8	121.6	-179.2	0	0	0	0	0	111.1	E227	E227-A229 PolarHBondContact O-N 3.46Å
230	R	77.4	Confident	75.8	Confident	184 Å²	184	83.8 Å²	83.8	69%	0.694	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-89.7	138.9	176.2	-66	-175.5	-176.5	-178.4	2.4	109.8	A220 A221 A228	A220-R230 PolarHBondContact O-N 2.75Å; A221-R230 WeakPolarHBondContact CA-O 3.36Å; A221-R230 WeakPolarHBondContact CB-O 2.86Å; A228-R230 PolarHBondContact O-N 3.34Å
231	P	82.6	Confident	76.1	Confident	124 Å²	124	85.9 Å²	85.9	81%	0.805	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-58.2	142.6	175.3	-22.1	32.4	0	0	0	111.9
232	F	88.1	Confident	76.3	Confident	37 Å²	37	90.2 Å²	90.2	16%	0.162	52%	0.515	C	S	.	.	P	Polyproline II helix	trans	-62.9	127.6	175.5	-176.9	-88.8	0	0	0	110.5	H214 D217 L218 A221 L234 A955 H958	H214-F232 AromaticContact CE1-CZ 3.57Å; H214-F232 AromaticContact ND1-CZ 3.5Å; D217-F232 HydrophobicContact CB-CD2 3.92Å; D217-F232 HydrophobicContact CB-CE2 3.6Å; D217-F232 HydrophobicContact CB-CZ 4.43Å; L218-F232 HydrophobicContact CB-CE2 4.49Å; L218-F232 HydrophobicContact CD2-CD2 3.81Å; L218-F232 HydrophobicContact CD2-CE2 3.85Å; L218-F232 HydrophobicContact CG-CD2 4.07Å; L218-F232 HydrophobicContact CG-CE2 3.72Å; A221-F232 HydrophobicContact CB-CB 3.96Å; F232-L234 HydrophobicContact CD1-CD2 3.84Å; F232-L234 HydrophobicContact CD1-CG 4.31Å; F232-L234 HydrophobicContact CE1-CD2 4.09Å; F232-L234 PolarHBondContact O-N 3.24Å; F232-A955 HydrophobicContact CE1-CB 4.22Å; F232-A955 HydrophobicContact CZ-CB 4.22Å; F232-H958 HydrophobicContact CE1-CB 4Å; F232-H958 AromaticContact CE1-CD2 3.71Å; F232-H958 AromaticContact CE1-CG 3.77Å; F232-H958 AromaticContact CZ-CD2 3.67Å
233	P	88.3	Confident	76.9	Confident	65 Å²	65	88.7 Å²	88.7	42%	0.422	50%	0.504	S	S	.	.			trans	-74.1	99.8	-178.2	30.2	-33.3	0	0	0	110.7	D217 H958	D217-P233 HydrophobicContact CB-CG 4.09Å; P233-H958 PolarHBondContact O-CE1 3.24Å; P233-H958 PolarHBondContact O-ND1 3.34Å
234	L	90.4	Very high	78.5	Confident	83 Å²	83	87.3 Å²	87.3	44%	0.435	49%	0.486	S	S	.	.			trans	-73.9	153.5	175.4	-69.1	174.5	0	0	0	111.8	F232 L238 N954 H958	F232-L234 HydrophobicContact CD1-CD2 3.84Å; F232-L234 HydrophobicContact CD1-CG 4.31Å; F232-L234 HydrophobicContact CE1-CD2 4.09Å; F232-L234 PolarHBondContact O-N 3.24Å; L234-L238 HydrophobicContact CB-CB 4.38Å; L234-L238 HydrophobicContact CB-CD1 4.48Å; L234-L238 HydrophobicContact CD2-CD1 4.15Å; L234-N954 HydrophobicContact CD2-CB 4.06Å; L234-H958 HydrophobicContact CD2-CB 4.12Å
235	H	90.9	Very high	80.2	Confident	15 Å²	15	81.4 Å²	81.4	7%	0.069	47%	0.465	C	S	.	.			trans	-64.1	141.6	178.6	-175.1	-90.3	0	0	0	109	C237 L238 F247 H958 E965	H235-C237 WeakPolarHBondContact ND1-CB 3.33Å; H235-C237 PolarHBondContact ND1-N 3.14Å; H235-C237 PolarHBondContact ND1-SG 3.17Å; H235-C237 PolarHBondContact O-N 2.84Å; H235-L238 HydrophobicContact CB-CD1 4.24Å; H235-L238 HydrophobicContact CB-CG 4.42Å; H235-L238 WeakPolarHBondContact O-CB 3.46Å; H235-L238 PolarHBondContact O-N 3.47Å; H235-F247 AromaticContact CE1-CE2 3.92Å; H235-H958 HydrophobicContact CB-CB 4.48Å; H235-H958 PolarHBondContact N-ND1 3.17Å; H235-E965 IonicContact NE2-OE2 2.93Å
236	P	87.3	Confident	81.8	Confident	99 Å²	99	80.5 Å²	80.5	64%	0.643	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-55.7	-28.9	-175.8	-28.5	35.6	0	0	0	114.5	L238 V239	P236-L238 PolarHBondContact O-N 3.36Å; P236-V239 WeakPolarHBondContact O-CG2 3.3Å; P236-V239 PolarHBondContact O-N 3.17Å
237	C	88.8	Confident	83.5	Confident	7 Å²	7	72.7 Å²	72.7	5%	0.047	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-71.4	-9	176	84	0	0	0	0	114.3	H235 S243 E244 F247 Y961	H235-C237 WeakPolarHBondContact ND1-CB 3.33Å; H235-C237 PolarHBondContact ND1-N 3.14Å; H235-C237 PolarHBondContact ND1-SG 3.17Å; H235-C237 PolarHBondContact O-N 2.84Å; C237-S243 CarbonylContact O-C 3.49Å; C237-S243 PolarHBondContact O-OG 3.35Å; C237-E244 WeakPolarHBondContact O-CA 3.37Å; C237-E244 VanDerWaalsContact O-CB 3.25Å; C237-E244 WeakPolarHBondContact O-CB 3.46Å; C237-E244 PolarHBondContact O-N 2.61Å; C237-F247 HydrophobicContact CB-CB 3.57Å; C237-F247 HydrophobicContact CB-CD1 4.32Å; C237-F247 HydrophobicContact CB-CD2 4.36Å; C237-F247 HydrophobicContact CB-CG 3.85Å; C237-Y961 VanDerWaalsContact SG-CD2 3.59Å
238	L	89.9	Confident	84.8	Confident	31 Å²	31	65.6 Å²	65.6	16%	0.162	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-93.2	3	179.1	-69.4	175.5	0	0	0	112.8	L234 H235 P236 C240 E244 K957 H958 Y961	L234-L238 HydrophobicContact CB-CB 4.38Å; L234-L238 HydrophobicContact CB-CD1 4.48Å; L234-L238 HydrophobicContact CD2-CD1 4.15Å; H235-L238 HydrophobicContact CB-CD1 4.24Å; H235-L238 HydrophobicContact CB-CG 4.42Å; H235-L238 WeakPolarHBondContact O-CB 3.46Å; H235-L238 PolarHBondContact O-N 3.47Å; P236-L238 PolarHBondContact O-N 3.36Å; L238-C240 VanDerWaalsContact C-N 3.31Å; L238-C240 PolarHBondContact O-N 3.42Å; L238-E244 HydrophobicContact CD2-CG 4.38Å; L238-K957 HydrophobicContact CD1-CB 3.96Å; L238-K957 HydrophobicContact CD2-CB 4.2Å; L238-K957 HydrophobicContact CD2-CD 4.18Å; L238-H958 HydrophobicContact CD1-CB 4.03Å; L238-Y961 HydrophobicContact CD1-CD2 4.18Å; L238-Y961 HydrophobicContact CD2-CD2 3.98Å; L238-Y961 HydrophobicContact CD2-CE2 3.57Å; L238-Y961 HydrophobicContact CG-CD2 4.02Å; L238-Y961 HydrophobicContact CG-CE2 4.13Å
239	V	87.1	Confident	86	Confident	126 Å²	126	64.6 Å²	64.6	76%	0.764	37%	0.368	S	S	*	.	S	Bend	trans	-60.1	-42.8	177.7	171.8	0	0	0	0	111	P236	P236-V239 WeakPolarHBondContact O-CG2 3.3Å; P236-V239 PolarHBondContact O-N 3.17Å
240	C	87.9	Confident	86.8	Confident	51 Å²	51	64.5 Å²	64.5	35%	0.345	36%	0.363	S	S	.	.	S	Bend	trans	-150.3	160	173.9	70.3	0	0	0	0	112.3	L238 D242 S243 E244	L238-C240 VanDerWaalsContact C-N 3.31Å; L238-C240 PolarHBondContact O-N 3.42Å; C240-D242 PolarHBondContact O-N 3.38Å; C240-S243 PolarHBondContact N-OG 2.85Å; C240-S243 VanDerWaalsContact N-OG 3.1Å; C240-S243 PolarHBondContact O-N 3.5Å; C240-S243 VanDerWaalsContact O-N 3.1Å; C240-S243 PolarHBondContact O-OG 3.11Å; C240-S243 PolarHBondContact SG-N 3.42Å; C240-S243 VanDerWaalsContact SG-N 3.42Å; C240-S243 PolarHBondContact SG-OG 2.91Å; C240-E244 PolarHBondContact O-N 2.91Å; C240-E244 VanDerWaalsContact O-N 3.1Å
241	P	89.5	Confident	86.9	Confident	94 Å²	94	56 Å²	56	61%	0.61	33%	0.332	S	S	*	.	H	α-helix	trans	-56.3	-34.5	179.9	-26.2	35.2	0	0	0	113.9	E244 M245	P241-E244 WeakPolarHBondContact O-CB 3.48Å; P241-E244 PolarHBondContact O-N 2.7Å; P241-M245 WeakPolarHBondContact O-CG 3.42Å; P241-M245 PolarHBondContact O-N 3.42Å
242	D	88.3	Confident	86.7	Confident	127 Å²	127	50.1 Å²	50.1	68%	0.679	29%	0.293	S	S	*	.	H	α-helix	trans	-68.6	-40.1	178.8	-66	-35.3	0	0	0	111.9	C240 E244 M245 A246	C240-D242 PolarHBondContact O-N 3.38Å; D242-E244 VanDerWaalsContact C-N 3.31Å; D242-E244 PolarHBondContact O-N 3.48Å; D242-M245 PolarHBondContact O-N 2.9Å; D242-A246 WeakPolarHBondContact O-CB 3.44Å; D242-A246 PolarHBondContact O-N 3.39Å
243	S	86.4	Confident	86.3	Confident	34 Å²	34	54.7 Å²	54.7	24%	0.238	31%	0.31	C	S	.	.	H	α-helix	trans	-65.9	-35.5	175.3	67.5	0	0	0	0	112.1	C237 C240 A246 F247	C237-S243 CarbonylContact O-C 3.49Å; C237-S243 PolarHBondContact O-OG 3.35Å; C240-S243 PolarHBondContact N-OG 2.85Å; C240-S243 VanDerWaalsContact N-OG 3.1Å; C240-S243 PolarHBondContact O-N 3.5Å; C240-S243 VanDerWaalsContact O-N 3.1Å; C240-S243 PolarHBondContact O-OG 3.11Å; C240-S243 PolarHBondContact SG-N 3.42Å; C240-S243 VanDerWaalsContact SG-N 3.42Å; C240-S243 PolarHBondContact SG-OG 2.91Å; S243-A246 PolarHBondContact O-N 3.35Å; S243-F247 PolarHBondContact O-N 3.36Å
244	E	91.4	Very high	85.8	Confident	13 Å²	13	53.1 Å²	53.1	6%	0.061	30%	0.297	C	S	.	.	H	α-helix	trans	-64.7	-48.6	175.9	-166.8	-175.1	179.3	0	0	110.1	C237 L238 C240 P241 D242 A246 F247 L248 K284 Y961	C237-E244 WeakPolarHBondContact O-CA 3.37Å; C237-E244 VanDerWaalsContact O-CB 3.25Å; C237-E244 WeakPolarHBondContact O-CB 3.46Å; C237-E244 PolarHBondContact O-N 2.61Å; L238-E244 HydrophobicContact CD2-CG 4.38Å; C240-E244 PolarHBondContact O-N 2.91Å; C240-E244 VanDerWaalsContact O-N 3.1Å; P241-E244 WeakPolarHBondContact O-CB 3.48Å; P241-E244 PolarHBondContact O-N 2.7Å; D242-E244 VanDerWaalsContact C-N 3.31Å; D242-E244 PolarHBondContact O-N 3.48Å; E244-A246 VanDerWaalsContact C-N 3.35Å; E244-A246 PolarHBondContact O-N 3.4Å; E244-F247 PolarHBondContact O-N 3.4Å; E244-L248 WeakPolarHBondContact O-CG 3.26Å; E244-L248 PolarHBondContact O-N 3.32Å; E244-K284 IonicContact OE1-NZ 3.58Å; E244-K284 PolarHBondContact OE1-NZ 3.43Å; E244-K284 IonicContact OE2-NZ 2.75Å; E244-K284 PolarHBondContact OE2-NZ 3.44Å; E244-Y961 VanDerWaalsContact CD-OH 3.23Å; E244-Y961 HydrophobicContact CG-CE2 4.05Å; E244-Y961 WeakPolarHBondContact CG-OH 3.22Å; E244-Y961 PolarHBondContact OE1-OH 2.91Å
245	M	88.5	Confident	85	Confident	32 Å²	32	50 Å²	50	16%	0.158	28%	0.281	C	S	.	.	H	α-helix	trans	-64.1	-38.2	176.7	-72	-62.1	-67.5	0	0	112.3	P241 D242 L248 R249 T279 T280 K284	P241-M245 WeakPolarHBondContact O-CG 3.42Å; P241-M245 PolarHBondContact O-N 3.42Å; D242-M245 PolarHBondContact O-N 2.9Å; M245-L248 PolarHBondContact O-N 3.38Å; M245-R249 VanDerWaalsContact O-CG 3.31Å; M245-R249 WeakPolarHBondContact O-CG 3.43Å; M245-R249 PolarHBondContact O-N 3.46Å; M245-T279 HydrophobicContact CE-CG2 3.77Å; M245-T279 HydrophobicContact SD-CG2 4.34Å; M245-T280 HydrophobicContact CE-CG2 3.67Å; M245-K284 HydrophobicContact SD-CB 4.29Å; M245-K284 HydrophobicContact SD-CD 4.06Å; M245-K284 HydrophobicContact SD-CG 4.04Å
246	A	83.5	Confident	84.3	Confident	54 Å²	54	49.8 Å²	49.8	45%	0.446	28%	0.28	S	S	.	.	H	α-helix	trans	-62.9	-43.2	176.1	0	0	0	0	0	111.8	D242 S243 E244 R249 C250	D242-A246 WeakPolarHBondContact O-CB 3.44Å; D242-A246 PolarHBondContact O-N 3.39Å; S243-A246 PolarHBondContact O-N 3.35Å; E244-A246 VanDerWaalsContact C-N 3.35Å; E244-A246 PolarHBondContact O-N 3.4Å; A246-R249 PolarHBondContact O-N 3.42Å; A246-C250 PolarHBondContact O-N 3.37Å
247	F	85.9	Confident	83.9	Confident	45 Å²	45	49.6 Å²	49.6	20%	0.197	27%	0.274	C	S	.	.	H	α-helix	trans	-61.2	-48.4	175.4	-179	-101.4	0	0	0	111.5	H235 C237 S243 E244 R249 C250 V251 Y961 M964	H235-F247 AromaticContact CE1-CE2 3.92Å; C237-F247 HydrophobicContact CB-CB 3.57Å; C237-F247 HydrophobicContact CB-CD1 4.32Å; C237-F247 HydrophobicContact CB-CD2 4.36Å; C237-F247 HydrophobicContact CB-CG 3.85Å; S243-F247 PolarHBondContact O-N 3.36Å; E244-F247 PolarHBondContact O-N 3.4Å; F247-R249 VanDerWaalsContact C-N 3.31Å; F247-R249 PolarHBondContact O-N 3.23Å; F247-C250 WeakPolarHBondContact O-CA 3.38Å; F247-C250 WeakPolarHBondContact O-CB 3.39Å; F247-C250 PolarHBondContact O-N 3.33Å; F247-V251 HydrophobicContact CD1-CG2 4.29Å; F247-V251 HydrophobicContact CE1-CG2 3.97Å; F247-V251 HydrophobicContact CZ-CG2 4.21Å; F247-V251 WeakPolarHBondContact O-CG2 3.21Å; F247-V251 PolarHBondContact O-N 3.29Å; F247-Y961 AromaticContact CD1-CD1 3.76Å; F247-Y961 HydrophobicContact CD1-CD1 3.76Å; F247-Y961 AromaticContact CD1-CE1 3.97Å; F247-Y961 HydrophobicContact CD1-CE1 3.97Å; F247-Y961 AromaticContact CE1-CD1 3.59Å; F247-Y961 HydrophobicContact CE1-CD1 3.59Å; F247-Y961 HydrophobicContact CE1-CE1 4.21Å; F247-Y961 HydrophobicContact CE1-CG 4.45Å; F247-M964 HydrophobicContact CD1-CE 4.13Å; F247-M964 HydrophobicContact CE1-CE 3.48Å; F247-M964 VanDerWaalsContact CE1-CE 3.48Å; F247-M964 HydrophobicContact CZ-CE 4.46Å
248	L	82.9	Confident	83.2	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61.4	-37.4	177.7	-68.5	-178	0	0	0	113.1	E244 M245 C250 V251 A252 T279 L283 K284 Y961 M964	E244-L248 WeakPolarHBondContact O-CG 3.26Å; E244-L248 PolarHBondContact O-N 3.32Å; M245-L248 PolarHBondContact O-N 3.38Å; L248-C250 VanDerWaalsContact C-N 3.3Å; L248-C250 PolarHBondContact O-N 3.39Å; L248-V251 PolarHBondContact O-N 3.49Å; L248-A252 WeakPolarHBondContact O-CB 3.46Å; L248-A252 PolarHBondContact O-N 2.75Å; L248-T279 HydrophobicContact CB-CG2 3.45Å; L248-T279 VanDerWaalsContact CB-CG2 3.45Å; L248-L283 HydrophobicContact CB-CB 4.4Å; L248-L283 HydrophobicContact CB-CD1 4.48Å; L248-L283 HydrophobicContact CD1-CB 4.32Å; L248-L283 HydrophobicContact CD2-CB 3.74Å; L248-L283 HydrophobicContact CD2-CD1 4.36Å; L248-L283 HydrophobicContact CG-CB 4.38Å; L248-L283 WeakPolarHBondContact O-CD1 3.32Å; L248-K284 HydrophobicContact CD1-CB 3.7Å; L248-K284 HydrophobicContact CD1-CD 3.85Å; L248-K284 HydrophobicContact CD1-CG 4.37Å; L248-Y961 HydrophobicContact CD2-CE1 3.66Å; L248-Y961 HydrophobicContact CG-CE1 4.23Å; L248-M964 HydrophobicContact CD2-CE 3.73Å
249	R	84.3	Confident	82.5	Confident	71 Å²	71	50 Å²	50	27%	0.268	28%	0.276	S	S	.	.	H	α-helix	trans	-63.9	-36.9	172.9	-73.4	-178.8	-172.4	108.2	1.9	111.9	M245 A246 F247 R253 T275 E276 T279	M245-R249 VanDerWaalsContact O-CG 3.31Å; M245-R249 WeakPolarHBondContact O-CG 3.43Å; M245-R249 PolarHBondContact O-N 3.46Å; A246-R249 PolarHBondContact O-N 3.42Å; F247-R249 VanDerWaalsContact C-N 3.31Å; F247-R249 PolarHBondContact O-N 3.23Å; R249-R253 VanDerWaalsContact O-CG 3.24Å; R249-R253 WeakPolarHBondContact O-CG 3.35Å; R249-R253 PolarHBondContact O-N 3.48Å; R249-T275 HydrophobicContact CB-CG2 3.99Å; R249-T275 HydrophobicContact CG-CG2 4.15Å; R249-E276 IonicContact CZ-OE1 3.89Å; R249-E276 IonicContact CZ-OE2 2.86Å; R249-E276 IonicContact NE-OE1 3.74Å; R249-E276 IonicContact NE-OE2 2.66Å; R249-E276 PolarHBondContact NE-OE2 2.84Å; R249-E276 IonicContact NH2-OE1 2.57Å; R249-E276 PolarHBondContact NH2-OE1 3.43Å; R249-E276 IonicContact NH2-OE2 3.64Å; R249-E276 PolarHBondContact NH2-OE2 3.29Å; R249-T279 VanDerWaalsContact CA-OG1 3.23Å; R249-T279 WeakPolarHBondContact CA-OG1 3.48Å; R249-T279 HydrophobicContact CG-CG2 3.67Å; R249-T279 WeakPolarHBondContact CG-OG1 3.46Å; R249-T279 PolarHBondContact N-OG1 3.34Å
250	C	83.6	Confident	81.9	Confident	63 Å²	63	44.7 Å²	44.7	43%	0.426	24%	0.243	S	C	.	.	H	α-helix	trans	-61.8	-50.5	174.6	-167.6	0	0	0	0	110.7	A246 F247 L248 A252 R253 I254	A246-C250 PolarHBondContact O-N 3.37Å; F247-C250 WeakPolarHBondContact O-CA 3.38Å; F247-C250 WeakPolarHBondContact O-CB 3.39Å; F247-C250 PolarHBondContact O-N 3.33Å; L248-C250 VanDerWaalsContact C-N 3.3Å; L248-C250 PolarHBondContact O-N 3.39Å; C250-A252 PolarHBondContact O-N 3.28Å; C250-R253 PolarHBondContact O-N 3.3Å; C250-I254 WeakPolarHBondContact O-CG1 3.32Å; C250-I254 PolarHBondContact O-N 2.93Å
251	V	79.9	Confident	81.4	Confident	5 Å²	5	42.4 Å²	42.4	3%	0.03	23%	0.228	C	C	.	.	H	α-helix	trans	-57.1	-48.2	177.1	177.2	0	0	0	0	111.1	F247 L248 R253 I254 L255 L283 M964 L968	F247-V251 HydrophobicContact CD1-CG2 4.29Å; F247-V251 HydrophobicContact CE1-CG2 3.97Å; F247-V251 HydrophobicContact CZ-CG2 4.21Å; F247-V251 WeakPolarHBondContact O-CG2 3.21Å; F247-V251 PolarHBondContact O-N 3.29Å; L248-V251 PolarHBondContact O-N 3.49Å; V251-R253 VanDerWaalsContact C-N 3.34Å; V251-R253 PolarHBondContact O-N 3.4Å; V251-I254 PolarHBondContact O-N 3.49Å; V251-L255 HydrophobicContact CG1-CD1 4.02Å; V251-L255 HydrophobicContact CG1-CG 4.41Å; V251-L255 WeakPolarHBondContact O-CG 3.21Å; V251-L255 PolarHBondContact O-N 3.22Å; V251-L283 HydrophobicContact CB-CD1 4Å; V251-L283 HydrophobicContact CG1-CD1 3.89Å; V251-L283 HydrophobicContact CG1-CD2 4.46Å; V251-M964 HydrophobicContact CG1-CG 4.43Å; V251-M964 HydrophobicContact CG1-SD 4.05Å; V251-M964 HydrophobicContact CG2-CE 4.01Å; V251-M964 HydrophobicContact CG2-SD 4.47Å; V251-L968 HydrophobicContact CB-CD2 4.47Å; V251-L968 HydrophobicContact CG1-CD1 4.48Å; V251-L968 HydrophobicContact CG1-CD2 4.31Å; V251-L968 HydrophobicContact CG2-CD2 4.14Å
252	A	76.9	Confident	80.8	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-59.2	-42	178.1	0	0	0	0	0	112.6	L248 C250 L255 L256 T275 I278 L283	L248-A252 WeakPolarHBondContact O-CB 3.46Å; L248-A252 PolarHBondContact O-N 2.75Å; C250-A252 PolarHBondContact O-N 3.28Å; A252-L255 PolarHBondContact O-N 3.07Å; A252-L256 WeakPolarHBondContact O-CB 3.09Å; A252-L256 WeakPolarHBondContact O-CD1 3.33Å; A252-L256 WeakPolarHBondContact O-CG 3.28Å; A252-L256 PolarHBondContact O-N 2.88Å; A252-T275 HydrophobicContact CB-CG2 4.17Å; A252-I278 HydrophobicContact CB-CB 3.94Å; A252-I278 HydrophobicContact CB-CG2 3.63Å; A252-L283 HydrophobicContact CB-CD1 4Å
253	R	79.8	Confident	80.2	Confident	134 Å²	134	44.7 Å²	44.7	51%	0.506	22%	0.224	S	C	.	.	H	α-helix	trans	-63	-43.2	176.8	-74.8	168.3	-176.4	165.5	2	112.1	R249 C250 V251 L256 L257 T275	R249-R253 VanDerWaalsContact O-CG 3.24Å; R249-R253 WeakPolarHBondContact O-CG 3.35Å; R249-R253 PolarHBondContact O-N 3.48Å; C250-R253 PolarHBondContact O-N 3.3Å; V251-R253 VanDerWaalsContact C-N 3.34Å; V251-R253 PolarHBondContact O-N 3.4Å; R253-L256 PolarHBondContact O-N 2.67Å; R253-L257 VanDerWaalsContact O-CG 3.3Å; R253-L257 WeakPolarHBondContact O-CG 3.43Å; R253-L257 PolarHBondContact O-N 2.94Å; R253-T275 HydrophobicContact CG-CG2 3.67Å; R253-T275 VanDerWaalsContact CG-OG1 3.3Å; R253-T275 WeakPolarHBondContact CG-OG1 3.11Å
254	I	77.7	Confident	79.6	Confident	31 Å²	31	44.6 Å²	44.6	16%	0.159	22%	0.221	C	C	.	.	H	α-helix	trans	-62.5	-49.8	178.5	-69	166.8	0	0	0	109.6	C250 V251 L256 L257 C258 L968 C972 L975	C250-I254 WeakPolarHBondContact O-CG1 3.32Å; C250-I254 PolarHBondContact O-N 2.93Å; V251-I254 PolarHBondContact O-N 3.49Å; I254-L256 VanDerWaalsContact C-N 3.31Å; I254-L256 PolarHBondContact O-N 3.34Å; I254-L257 PolarHBondContact O-N 2.94Å; I254-L257 VanDerWaalsContact O-N 3.14Å; I254-C258 WeakPolarHBondContact O-CB 3.26Å; I254-C258 PolarHBondContact O-N 2.98Å; I254-C258 PolarHBondContact O-SG 3.02Å; I254-C258 VanDerWaalsContact O-SG 3.36Å; I254-L968 HydrophobicContact CB-CD1 4.38Å; I254-L968 HydrophobicContact CB-CD2 4.37Å; I254-L968 HydrophobicContact CD1-CD2 3.74Å; I254-L968 HydrophobicContact CG2-CD1 3.72Å; I254-L968 HydrophobicContact CG2-CD2 4.16Å; I254-L968 HydrophobicContact CG2-CG 4.06Å; I254-C972 HydrophobicContact CG2-CB 4.36Å; I254-L975 HydrophobicContact CD1-CD1 4.19Å; I254-L975 HydrophobicContact CD1-CD2 4.12Å; I254-L975 HydrophobicContact CG2-CD1 3.97Å
255	L	75.7	Confident	78.6	Confident	18 Å²	18	44.7 Å²	44.7	9%	0.094	22%	0.224	C	C	.	.	H	α-helix	trans	-58.3	-43.1	177.8	-68.7	174.8	0	0	0	112	L87 V251 A252 L257 C258 L259 L968 L971	L87-L255 HydrophobicContact CD1-CD1 4.27Å; L87-L255 HydrophobicContact CD2-CD1 3.92Å; V251-L255 HydrophobicContact CG1-CD1 4.02Å; V251-L255 HydrophobicContact CG1-CG 4.41Å; V251-L255 WeakPolarHBondContact O-CG 3.21Å; V251-L255 PolarHBondContact O-N 3.22Å; A252-L255 PolarHBondContact O-N 3.07Å; L255-L257 PolarHBondContact O-N 2.9Å; L255-C258 PolarHBondContact O-N 3.34Å; L255-L259 VanDerWaalsContact O-CB 3.27Å; L255-L259 WeakPolarHBondContact O-CB 3.33Å; L255-L259 VanDerWaalsContact O-CG 3.29Å; L255-L259 WeakPolarHBondContact O-CG 3.2Å; L255-L259 PolarHBondContact O-N 3.34Å; L255-L968 HydrophobicContact CD2-CD1 3.89Å; L255-L968 HydrophobicContact CG-CD1 4.22Å; L255-L971 HydrophobicContact CD2-CD2 3.69Å
256	L	75.5	Confident	78.1	Confident	10 Å²	10	51 Å²	51	5%	0.052	25%	0.251	C	S	.	.	H	α-helix	trans	-62.4	-41.2	176.8	-74.6	168.5	0	0	0	112.3	A252 R253 I254 L260 L274 T275 I278	A252-L256 WeakPolarHBondContact O-CB 3.09Å; A252-L256 WeakPolarHBondContact O-CD1 3.33Å; A252-L256 WeakPolarHBondContact O-CG 3.28Å; A252-L256 PolarHBondContact O-N 2.88Å; R253-L256 PolarHBondContact O-N 2.67Å; I254-L256 VanDerWaalsContact C-N 3.31Å; I254-L256 PolarHBondContact O-N 3.34Å; L256-L260 HydrophobicContact CB-CD1 4.01Å; L256-L260 HydrophobicContact CD2-CD1 3.56Å; L256-L260 HydrophobicContact CD2-CG 4.05Å; L256-L260 HydrophobicContact CG-CD1 4.37Å; L256-L260 VanDerWaalsContact O-CB 3.22Å; L256-L260 WeakPolarHBondContact O-CB 3.28Å; L256-L260 PolarHBondContact O-N 3.18Å; L256-L260 VanDerWaalsContact O-N 3.07Å; L256-L274 HydrophobicContact CD1-CB 3.71Å; L256-L274 HydrophobicContact CD2-CB 3.75Å; L256-L274 HydrophobicContact CD2-CD1 3.81Å; L256-L274 HydrophobicContact CD2-CG 4.43Å; L256-L274 HydrophobicContact CG-CB 4.41Å; L256-T275 WeakPolarHBondContact CD1-OG1 3.44Å; L256-I278 HydrophobicContact CD1-CD1 4.11Å; L256-I278 HydrophobicContact CD2-CD1 3.58Å; L256-I278 HydrophobicContact CG-CD1 3.8Å
257	L	78.3	Confident	77.9	Confident	96 Å²	96	50.7 Å²	50.7	50%	0.503	25%	0.245	S	C	.	.	H	α-helix	trans	-68.9	-34.7	176.3	-71.5	169.8	0	0	0	112.5	R253 I254 L255	R253-L257 VanDerWaalsContact O-CG 3.3Å; R253-L257 WeakPolarHBondContact O-CG 3.43Å; R253-L257 PolarHBondContact O-N 2.94Å; I254-L257 PolarHBondContact O-N 2.94Å; I254-L257 VanDerWaalsContact O-N 3.14Å; L255-L257 PolarHBondContact O-N 2.9Å
258	C	74.1	Confident	77.5	Confident	13 Å²	13	54.4 Å²	54.4	9%	0.088	26%	0.263	C	S	.	.	H	α-helix	trans	-78.6	-26.2	-178.8	-67.7	0	0	0	0	113.2	Q189 R193 I254 L255 C972	Q189-C258 PolarHBondContact OE1-O 2.84Å; R193-C258 PolarHBondContact NE-O 3.19Å; I254-C258 WeakPolarHBondContact O-CB 3.26Å; I254-C258 PolarHBondContact O-N 2.98Å; I254-C258 PolarHBondContact O-SG 3.02Å; I254-C258 VanDerWaalsContact O-SG 3.36Å; L255-C258 PolarHBondContact O-N 3.34Å; C258-C972 WeakPolarHBondContact CB-SG 3.49Å; C258-C972 WeakPolarHBondContact SG-CB 3.11Å; C258-C972 CovalentContact SG-SG 2.09Å; C258-C972 PolarHBondContact SG-SG 2.86Å
259	L	76.3	Confident	77.4	Confident	32 Å²	32	59.2 Å²	59.2	17%	0.168	29%	0.293	C	S	.	.	H	α-helix	trans	-118.5	-25.9	-167.6	-58.1	178.3	0	0	0	115.6	M186 Q189 L190 L255	M186-L259 WeakPolarHBondContact CA-O 2.96Å; M186-L259 VanDerWaalsContact CG-O 3.31Å; M186-L259 WeakPolarHBondContact CG-O 3.29Å; Q189-L259 VanDerWaalsContact OE1-CA 3.28Å; Q189-L259 PolarHBondContact OE1-O 3.27Å; L190-L259 HydrophobicContact CB-CD2 3.91Å; L190-L259 HydrophobicContact CD1-CD2 4.01Å; L255-L259 VanDerWaalsContact O-CB 3.27Å; L255-L259 WeakPolarHBondContact O-CB 3.33Å; L255-L259 VanDerWaalsContact O-CG 3.29Å; L255-L259 WeakPolarHBondContact O-CG 3.2Å; L255-L259 PolarHBondContact O-N 3.34Å
260	L	73.9	Confident	76.8	Confident	15 Å²	15	58.8 Å²	58.8	8%	0.079	30%	0.295	C	S	.	.	S	Bend	trans	-70.3	151.2	-179.2	-84.8	165.2	0	0	0	111.9	M186 Q189 L256 D264 A265 L274	M186-L260 HydrophobicContact SD-CD2 4.18Å; Q189-L260 PolarHBondContact NE2-O 3.11Å; Q189-L260 PolarHBondContact OE1-O 3.27Å; L256-L260 HydrophobicContact CB-CD1 4.01Å; L256-L260 HydrophobicContact CD2-CD1 3.56Å; L256-L260 HydrophobicContact CD2-CG 4.05Å; L256-L260 HydrophobicContact CG-CD1 4.37Å; L256-L260 VanDerWaalsContact O-CB 3.22Å; L256-L260 WeakPolarHBondContact O-CB 3.28Å; L256-L260 PolarHBondContact O-N 3.18Å; L256-L260 VanDerWaalsContact O-N 3.07Å; L260-D264 HydrophobicContact CD2-CB 4.14Å; L260-A265 HydrophobicContact CB-CB 4.05Å; L260-L274 HydrophobicContact CD1-CD1 4.08Å; L260-L274 HydrophobicContact CD2-CD1 4.3Å
261	P	77.9	Confident	76.5	Confident	3 Å²	3	59 Å²	59	2%	0.019	29%	0.287	C	S	.	.			trans	-53	142.4	164.6	-24.8	35.3	0	0	0	111.6	D182 Q185 K263 D264 A265	D182-P261 HydrophobicContact CB-CG 4.3Å; Q185-P261 HydrophobicContact CB-CG 4.15Å; P261-K263 HydrophobicContact CB-CG 3.89Å; P261-K263 PolarHBondContact O-N 2.97Å; P261-K263 VanDerWaalsContact O-N 3.12Å; P261-D264 WeakPolarHBondContact CB-OD2 2.96Å; P261-D264 PolarHBondContact O-N 3.1Å; P261-A265 PolarHBondContact O-N 3.11Å
262	Q	75.4	Confident	76.2	Confident	153 Å²	153	61.4 Å²	61.4	72%	0.715	30%	0.304	S	S	*	.	H	α-helix	trans	-57.9	-32.3	-176.6	-72.4	-169.7	-1.8	0	0	113.6	D264 K266	Q262-D264 VanDerWaalsContact C-N 3.27Å; Q262-D264 PolarHBondContact O-N 3.13Å; Q262-K266 VanDerWaalsContact O-CG 3.27Å; Q262-K266 WeakPolarHBondContact O-CG 3.27Å; Q262-K266 PolarHBondContact O-N 3.38Å
263	K	75.8	Confident	76	Confident	116 Å²	116	65 Å²	65	50%	0.504	33%	0.328	S	S	.	.	H	α-helix	trans	-59.2	-39.4	174.9	54.9	173.5	-172.7	175.9	0	111.6	D182 P261	D182-K263 VanDerWaalsContact OD1-CE 3.27Å; D182-K263 WeakPolarHBondContact OD1-CE 3.17Å; D182-K263 IonicContact OD1-NZ 2.65Å; D182-K263 PolarHBondContact OD1-NZ 3.47Å; P261-K263 HydrophobicContact CB-CG 3.89Å; P261-K263 PolarHBondContact O-N 2.97Å; P261-K263 VanDerWaalsContact O-N 3.12Å
264	D	73.9	Confident	75.6	Confident	32 Å²	32	60.5 Å²	60.5	17%	0.171	31%	0.313	C	S	.	.	H	α-helix	trans	-91	-36.9	-173.5	-59.7	-37.5	0	0	0	111.7	L260 P261 Q262 K266 S267 L270	L260-D264 HydrophobicContact CD2-CB 4.14Å; P261-D264 WeakPolarHBondContact CB-OD2 2.96Å; P261-D264 PolarHBondContact O-N 3.1Å; Q262-D264 VanDerWaalsContact C-N 3.27Å; Q262-D264 PolarHBondContact O-N 3.13Å; D264-K266 PolarHBondContact O-N 2.9Å; D264-S267 WeakPolarHBondContact O-CB 3.17Å; D264-S267 PolarHBondContact O-N 3.35Å; D264-L270 HydrophobicContact CB-CD2 3.71Å
265	A	71.1	Confident	75.5	Confident	15 Å²	15	59.2 Å²	59.2	12%	0.124	31%	0.307	C	S	.	.	H	α-helix	trans	-60.3	-29.8	174	0	0	0	0	0	112.3	L260 P261 S267 R271	L260-A265 HydrophobicContact CB-CB 4.05Å; P261-A265 PolarHBondContact O-N 3.11Å; A265-S267 VanDerWaalsContact C-N 3.29Å; A265-S267 PolarHBondContact O-N 3.5Å; A265-R271 WeakPolarHBondContact O-CD 3.35Å; A265-R271 PolarHBondContact O-NE 3.48Å
266	K	77.3	Confident	75.7	Confident	164 Å²	164	61.8 Å²	61.8	71%	0.713	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-23.6	174.7	-74.5	173.6	-175.8	178.8	0	113	Q262 D264 H268	Q262-K266 VanDerWaalsContact O-CG 3.27Å; Q262-K266 WeakPolarHBondContact O-CG 3.27Å; Q262-K266 PolarHBondContact O-N 3.38Å; D264-K266 PolarHBondContact O-N 2.9Å; K266-H268 PolarHBondContact O-N 2.86Å
267	S	80.4	Confident	75.4	Confident	48 Å²	48	63.7 Å²	63.7	34%	0.336	33%	0.331	S	S	.	.			trans	-73	109.5	179.1	179	0	0	0	0	111.1	D264 A265 L270 R271	D264-S267 WeakPolarHBondContact O-CB 3.17Å; D264-S267 PolarHBondContact O-N 3.35Å; A265-S267 VanDerWaalsContact C-N 3.29Å; A265-S267 PolarHBondContact O-N 3.5Å; S267-L270 WeakPolarHBondContact OG-CB 3.44Å; S267-L270 PolarHBondContact OG-N 3.31Å; S267-R271 WeakPolarHBondContact O-CG 3.14Å; S267-R271 PolarHBondContact O-N 2.91Å; S267-R271 VanDerWaalsContact O-N 3.08Å
268	H	78.1	Confident	74.9	Confident	124 Å²	124	60.3 Å²	60.3	57%	0.574	31%	0.313	S	S	*	.	H	α-helix	trans	-62.6	-44.8	179	-178	68.4	0	0	0	111.9	K266 L270 R271 C272	K266-H268 PolarHBondContact O-N 2.86Å; H268-L270 PolarHBondContact O-N 3.39Å; H268-R271 PolarHBondContact O-N 3.21Å; H268-C272 PolarHBondContact CE1-SG 3.12Å; H268-C272 PolarHBondContact NE2-SG 3.24Å; H268-C272 WeakPolarHBondContact O-CB 3.41Å; H268-C272 PolarHBondContact O-N 3.1Å; H268-C272 PolarHBondContact O-SG 3.23Å; H268-C272 VanDerWaalsContact O-SG 3.38Å
269	T	78.9	Confident	74.9	Confident	101 Å²	101	59.7 Å²	59.7	62%	0.62	31%	0.308	S	S	*	.	H	α-helix	trans	-61.1	-46.3	179.8	-50.5	0	0	0	0	111.5	C272 C273	T269-C272 PolarHBondContact O-N 2.84Å; T269-C273 PolarHBondContact O-N 3.48Å; T269-C273 PolarHBondContact O-SG 2.79Å; T269-C273 VanDerWaalsContact O-SG 3.39Å
270	L	72.6	Confident	74.6	Confident	61 Å²	61	60.2 Å²	60.2	32%	0.319	31%	0.313	S	S	.	.	H	α-helix	trans	-62.6	-45.7	178.9	-177.6	61.8	0	0	0	111.2	D264 S267 H268 C272 C273 L274	D264-L270 HydrophobicContact CB-CD2 3.71Å; S267-L270 WeakPolarHBondContact OG-CB 3.44Å; S267-L270 PolarHBondContact OG-N 3.31Å; H268-L270 PolarHBondContact O-N 3.39Å; L270-C272 PolarHBondContact O-N 3.47Å; L270-C273 PolarHBondContact O-N 3.33Å; L270-L274 HydrophobicContact CD1-CD1 3.78Å; L270-L274 HydrophobicContact CD1-CG 3.91Å; L270-L274 HydrophobicContact CD2-CD1 4.45Å; L270-L274 HydrophobicContact CG-CD1 3.77Å; L270-L274 HydrophobicContact CG-CG 4.25Å; L270-L274 WeakPolarHBondContact O-CB 3.5Å; L270-L274 VanDerWaalsContact O-CG 3.32Å; L270-L274 WeakPolarHBondContact O-CG 3.39Å; L270-L274 PolarHBondContact O-N 3.34Å
271	R	77	Confident	74.1	Confident	69 Å²	69	63.4 Å²	63.4	26%	0.26	33%	0.327	S	S	.	.	H	α-helix	trans	-60.3	-43.6	175.9	-75.8	-169	-65.9	143.2	-1.5	112.6	A265 S267 H268 T275	A265-R271 WeakPolarHBondContact O-CD 3.35Å; A265-R271 PolarHBondContact O-NE 3.48Å; S267-R271 WeakPolarHBondContact O-CG 3.14Å; S267-R271 PolarHBondContact O-N 2.91Å; S267-R271 VanDerWaalsContact O-N 3.08Å; H268-R271 PolarHBondContact O-N 3.21Å; R271-T275 WeakPolarHBondContact O-CB 3.43Å; R271-T275 PolarHBondContact O-N 2.9Å; R271-T275 PolarHBondContact O-OG1 3.38Å
272	C	74.7	Confident	73.4	Confident	55 Å²	55	63.4 Å²	63.4	37%	0.372	33%	0.326	S	S	.	.	H	α-helix	trans	-63.5	-45.9	178.5	-74.2	0	0	0	0	111.7	H268 T269 L270 T275 E276	H268-C272 PolarHBondContact CE1-SG 3.12Å; H268-C272 PolarHBondContact NE2-SG 3.24Å; H268-C272 WeakPolarHBondContact O-CB 3.41Å; H268-C272 PolarHBondContact O-N 3.1Å; H268-C272 PolarHBondContact O-SG 3.23Å; H268-C272 VanDerWaalsContact O-SG 3.38Å; T269-C272 PolarHBondContact O-N 2.84Å; L270-C272 PolarHBondContact O-N 3.47Å; C272-T275 PolarHBondContact O-N 3.36Å; C272-E276 PolarHBondContact O-N 2.91Å
273	C	71.8	Confident	73.1	Confident	75 Å²	75	56.1 Å²	56.1	51%	0.507	29%	0.292	S	S	.	.	H	α-helix	trans	-62	-52.1	176.3	-70.7	0	0	0	0	111.7	T269 L270 T275 E276 V277	T269-C273 PolarHBondContact O-N 3.48Å; T269-C273 PolarHBondContact O-SG 2.79Å; T269-C273 VanDerWaalsContact O-SG 3.39Å; L270-C273 PolarHBondContact O-N 3.33Å; C273-T275 VanDerWaalsContact C-N 3.28Å; C273-T275 PolarHBondContact O-N 3.13Å; C273-E276 PolarHBondContact O-N 3.5Å; C273-V277 VanDerWaalsContact O-CB 3.27Å; C273-V277 WeakPolarHBondContact O-CB 3.48Å; C273-V277 VanDerWaalsContact O-CG2 3.26Å; C273-V277 WeakPolarHBondContact O-CG2 3.48Å; C273-V277 PolarHBondContact O-N 2.96Å
274	L	70.6	Confident	73.4	Confident	39 Å²	39	52 Å²	52	20%	0.204	28%	0.275	C	S	.	.	H	α-helix	trans	-63.5	-33.3	179.4	-69.7	179.1	0	0	0	112.2	L256 L260 L270 V277 I278	L256-L274 HydrophobicContact CD1-CB 3.71Å; L256-L274 HydrophobicContact CD2-CB 3.75Å; L256-L274 HydrophobicContact CD2-CD1 3.81Å; L256-L274 HydrophobicContact CD2-CG 4.43Å; L256-L274 HydrophobicContact CG-CB 4.41Å; L260-L274 HydrophobicContact CD1-CD1 4.08Å; L260-L274 HydrophobicContact CD2-CD1 4.3Å; L270-L274 HydrophobicContact CD1-CD1 3.78Å; L270-L274 HydrophobicContact CD1-CG 3.91Å; L270-L274 HydrophobicContact CD2-CD1 4.45Å; L270-L274 HydrophobicContact CG-CD1 3.77Å; L270-L274 HydrophobicContact CG-CG 4.25Å; L270-L274 WeakPolarHBondContact O-CB 3.5Å; L270-L274 VanDerWaalsContact O-CG 3.32Å; L270-L274 WeakPolarHBondContact O-CG 3.39Å; L270-L274 PolarHBondContact O-N 3.34Å; L274-V277 HydrophobicContact CD2-CG1 4.35Å; L274-I278 VanDerWaalsContact O-CB 3.28Å; L274-I278 WeakPolarHBondContact O-CB 3.38Å; L274-I278 WeakPolarHBondContact O-CG1 3.44Å; L274-I278 PolarHBondContact O-N 3.26Å
275	T	75.9	Confident	73.3	Confident	4 Å²	4	51.8 Å²	51.8	3%	0.025	28%	0.275	C	S	.	.	H	α-helix	trans	-61.6	-48.6	175.5	-65.7	0	0	0	0	110.7	R249 A252 R253 L256 R271 C272 C273 V277 I278 T279	R249-T275 HydrophobicContact CB-CG2 3.99Å; R249-T275 HydrophobicContact CG-CG2 4.15Å; A252-T275 HydrophobicContact CB-CG2 4.17Å; R253-T275 HydrophobicContact CG-CG2 3.67Å; R253-T275 VanDerWaalsContact CG-OG1 3.3Å; R253-T275 WeakPolarHBondContact CG-OG1 3.11Å; L256-T275 WeakPolarHBondContact CD1-OG1 3.44Å; R271-T275 WeakPolarHBondContact O-CB 3.43Å; R271-T275 PolarHBondContact O-N 2.9Å; R271-T275 PolarHBondContact O-OG1 3.38Å; C272-T275 PolarHBondContact O-N 3.36Å; C273-T275 VanDerWaalsContact C-N 3.28Å; C273-T275 PolarHBondContact O-N 3.13Å; T275-V277 VanDerWaalsContact C-N 3.34Å; T275-I278 PolarHBondContact O-N 3.01Å; T275-T279 VanDerWaalsContact O-CB 3.24Å; T275-T279 WeakPolarHBondContact O-CB 2.98Å; T275-T279 PolarHBondContact O-N 3.11Å; T275-T279 PolarHBondContact O-OG1 2.87Å
276	E	79.4	Confident	73.1	Confident	73 Å²	73	51.2 Å²	51.2	34%	0.341	27%	0.269	S	S	.	.	H	α-helix	trans	-67.8	-41.1	-177.8	-165.5	62.8	-160	0	0	111.1	R249 C272 C273 T279 T280	R249-E276 IonicContact CZ-OE1 3.89Å; R249-E276 IonicContact CZ-OE2 2.86Å; R249-E276 IonicContact NE-OE1 3.74Å; R249-E276 IonicContact NE-OE2 2.66Å; R249-E276 PolarHBondContact NE-OE2 2.84Å; R249-E276 IonicContact NH2-OE1 2.57Å; R249-E276 PolarHBondContact NH2-OE1 3.43Å; R249-E276 IonicContact NH2-OE2 3.64Å; R249-E276 PolarHBondContact NH2-OE2 3.29Å; C272-E276 PolarHBondContact O-N 2.91Å; C273-E276 PolarHBondContact O-N 3.5Å; E276-T279 PolarHBondContact O-N 3.2Å; E276-T280 HydrophobicContact CG-CG2 4.11Å; E276-T280 VanDerWaalsContact O-CB 3.31Å; E276-T280 WeakPolarHBondContact O-CB 3.21Å; E276-T280 VanDerWaalsContact O-CG2 3.3Å; E276-T280 WeakPolarHBondContact O-CG2 3.31Å; E276-T280 PolarHBondContact O-N 3.31Å; E276-T280 PolarHBondContact O-OG1 2.91Å; E276-T280 WeakPolarHBondContact OE1-CG2 3.5Å
277	V	70.1	Confident	73.2	Confident	50 Å²	50	43.4 Å²	43.4	30%	0.303	24%	0.236	S	C	.	.	H	α-helix	trans	-53.7	-61.1	172.2	149.4	0	0	0	0	109.4	L94 C273 L274 T275 T279 T280 K281	L94-V277 VanDerWaalsContact CD1-C 3.49Å; L94-V277 HydrophobicContact CD1-CB 4.09Å; L94-V277 HydrophobicContact CD1-CG1 3.19Å; L94-V277 WeakPolarHBondContact CD1-O 3.34Å; L94-V277 VanDerWaalsContact CD2-CA 3.43Å; L94-V277 HydrophobicContact CD2-CB 3.7Å; L94-V277 HydrophobicContact CD2-CG1 3.56Å; L94-V277 HydrophobicContact CD2-CG2 3.96Å; L94-V277 WeakPolarHBondContact CD2-O 3.16Å; L94-V277 HydrophobicContact CG-CG1 3.95Å; L94-V277 WeakPolarHBondContact CG-O 3.43Å; C273-V277 VanDerWaalsContact O-CB 3.27Å; C273-V277 WeakPolarHBondContact O-CB 3.48Å; C273-V277 VanDerWaalsContact O-CG2 3.26Å; C273-V277 WeakPolarHBondContact O-CG2 3.48Å; C273-V277 PolarHBondContact O-N 2.96Å; L274-V277 HydrophobicContact CD2-CG1 4.35Å; T275-V277 VanDerWaalsContact C-N 3.34Å; V277-T279 VanDerWaalsContact C-N 3.3Å; V277-T279 PolarHBondContact O-N 3Å; V277-T280 PolarHBondContact O-N 3.28Å; V277-K281 PolarHBondContact O-N 3.5Å
278	I	67.3	Low	73.3	Confident	24 Å²	24	45.5 Å²	45.5	12%	0.123	24%	0.24	C	C	.	.	I	π-helix	trans	-61.1	-41	-178.7	-67.8	170.9	0	0	0	110.8	A252 L256 L274 T275 V282 L283	A252-I278 HydrophobicContact CB-CB 3.94Å; A252-I278 HydrophobicContact CB-CG2 3.63Å; L256-I278 HydrophobicContact CD1-CD1 4.11Å; L256-I278 HydrophobicContact CD2-CD1 3.58Å; L256-I278 HydrophobicContact CG-CD1 3.8Å; L274-I278 VanDerWaalsContact O-CB 3.28Å; L274-I278 WeakPolarHBondContact O-CB 3.38Å; L274-I278 WeakPolarHBondContact O-CG1 3.44Å; L274-I278 PolarHBondContact O-N 3.26Å; T275-I278 PolarHBondContact O-N 3.01Å; I278-V282 HydrophobicContact CB-CB 4.46Å; I278-V282 HydrophobicContact CB-CG2 4.07Å; I278-V282 HydrophobicContact CG1-CG2 4.12Å; I278-V282 HydrophobicContact CG2-CB 4.01Å; I278-V282 HydrophobicContact CG2-CG2 4.01Å; I278-V282 CarbonylContact O-C 3.24Å; I278-V282 VanDerWaalsContact O-C 3.24Å; I278-V282 WeakPolarHBondContact O-CA 3.31Å; I278-V282 WeakPolarHBondContact O-CB 3.4Å; I278-V282 PolarHBondContact O-N 3.44Å; I278-L283 HydrophobicContact CG2-CD1 4.08Å; I278-L283 HydrophobicContact CG2-CG 4.12Å; I278-L283 PolarHBondContact O-N 2.95Å
279	T	73.8	Confident	73.1	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.234	C	C	.	.	I	π-helix	trans	-65.5	-53.4	-179.6	-57	0	0	0	0	112	M245 L248 R249 T275 E276 V277 K284	M245-T279 HydrophobicContact CE-CG2 3.77Å; M245-T279 HydrophobicContact SD-CG2 4.34Å; L248-T279 HydrophobicContact CB-CG2 3.45Å; L248-T279 VanDerWaalsContact CB-CG2 3.45Å; R249-T279 VanDerWaalsContact CA-OG1 3.23Å; R249-T279 WeakPolarHBondContact CA-OG1 3.48Å; R249-T279 HydrophobicContact CG-CG2 3.67Å; R249-T279 WeakPolarHBondContact CG-OG1 3.46Å; R249-T279 PolarHBondContact N-OG1 3.34Å; T275-T279 VanDerWaalsContact O-CB 3.24Å; T275-T279 WeakPolarHBondContact O-CB 2.98Å; T275-T279 PolarHBondContact O-N 3.11Å; T275-T279 PolarHBondContact O-OG1 2.87Å; E276-T279 PolarHBondContact O-N 3.2Å; V277-T279 VanDerWaalsContact C-N 3.3Å; V277-T279 PolarHBondContact O-N 3Å; T279-K284 VanDerWaalsContact O-CB 3.22Å; T279-K284 WeakPolarHBondContact O-CB 3.41Å; T279-K284 PolarHBondContact O-N 3.42Å
280	T	70.6	Confident	72.9	Confident	44 Å²	44	40 Å²	40	27%	0.27	21%	0.214	S	C	.	.	I	π-helix	trans	-78.8	-27.5	-166.8	56.7	0	0	0	0	113.5	M245 E276 V277 P285	M245-T280 HydrophobicContact CE-CG2 3.67Å; E276-T280 HydrophobicContact CG-CG2 4.11Å; E276-T280 VanDerWaalsContact O-CB 3.31Å; E276-T280 WeakPolarHBondContact O-CB 3.21Å; E276-T280 VanDerWaalsContact O-CG2 3.3Å; E276-T280 WeakPolarHBondContact O-CG2 3.31Å; E276-T280 PolarHBondContact O-N 3.31Å; E276-T280 PolarHBondContact O-OG1 2.91Å; E276-T280 WeakPolarHBondContact OE1-CG2 3.5Å; V277-T280 PolarHBondContact O-N 3.28Å; T280-P285 WeakPolarHBondContact O-CD 3.33Å
281	K	64.3	Low	73.4	Confident	82 Å²	82	37.3 Å²	37.3	36%	0.357	20%	0.199	S	C	.	.	I	π-helix	trans	-132.9	-1.4	177.9	-2.4	-111.4	-164.9	163.4	0	116.4	S90 L94 V277	S90-K281 CarbonylContact C-O 3.48Å; S90-K281 WeakPolarHBondContact CA-O 3.36Å; S90-K281 WeakPolarHBondContact CB-O 3.28Å; S90-K281 CarbonylContact O-C 3.35Å; L94-K281 HydrophobicContact CB-CB 4.11Å; L94-K281 HydrophobicContact CB-CG 4.24Å; L94-K281 HydrophobicContact CD2-CB 3.74Å; L94-K281 HydrophobicContact CD2-CD 4.43Å; L94-K281 HydrophobicContact CD2-CG 3.14Å; L94-K281 HydrophobicContact CG-CB 3.53Å; L94-K281 HydrophobicContact CG-CG 3.58Å; V277-K281 PolarHBondContact O-N 3.5Å
282	V	62.4	Low	73.9	Confident	2 Å²	2	36 Å²	36	1%	0.012	20%	0.197	C	C	.	.	I	π-helix	trans	-88.2	-104.1	149	-162.8	0	0	0	0	108	F86 L87 S90 F91 L94 I278 K284 P285	F86-V282 HydrophobicContact CD1-CG1 4.21Å; F86-V282 HydrophobicContact CE1-CG1 4.23Å; F86-V282 WeakPolarHBondContact CE1-O 3.28Å; F86-V282 WeakPolarHBondContact CZ-O 3.43Å; F86-V282 WeakPolarHBondContact O-CG1 3.36Å; L87-V282 HydrophobicContact CB-CG1 4.31Å; L87-V282 HydrophobicContact CD2-CG1 3.65Å; L87-V282 HydrophobicContact CG-CG1 4.27Å; L87-V282 WeakPolarHBondContact O-CG1 3.32Å; S90-V282 WeakPolarHBondContact O-CG2 3.5Å; F91-V282 VanDerWaalsContact N-CG2 3.26Å; L94-V282 HydrophobicContact CD1-CG2 3.59Å; L94-V282 HydrophobicContact CG-CG2 4.49Å; I278-V282 HydrophobicContact CB-CB 4.46Å; I278-V282 HydrophobicContact CB-CG2 4.07Å; I278-V282 HydrophobicContact CG1-CG2 4.12Å; I278-V282 HydrophobicContact CG2-CB 4.01Å; I278-V282 HydrophobicContact CG2-CG2 4.01Å; I278-V282 CarbonylContact O-C 3.24Å; I278-V282 VanDerWaalsContact O-C 3.24Å; I278-V282 WeakPolarHBondContact O-CA 3.31Å; I278-V282 WeakPolarHBondContact O-CB 3.4Å; I278-V282 PolarHBondContact O-N 3.44Å; V282-K284 VanDerWaalsContact C-N 3.27Å; V282-K284 PolarHBondContact O-N 2.93Å; V282-P285 WeakPolarHBondContact O-CD 3.41Å; V282-P285 VanDerWaalsContact O-CG 3.28Å; V282-P285 WeakPolarHBondContact O-CG 3.44Å
283	L	69.8	Low	74.7	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.187	C	C	.	.	I	π-helix	trans	-48.8	-39.1	-158	-61.6	169.2	0	0	0	115.3	L87 L248 V251 A252 I278 L286 V287 M964	L87-L283 HydrophobicContact CD2-CD2 3.4Å; L87-L283 VanDerWaalsContact CD2-CD2 3.4Å; L87-L283 HydrophobicContact CD2-CG 4.19Å; L87-L283 HydrophobicContact CG-CD2 4.26Å; L248-L283 HydrophobicContact CB-CB 4.4Å; L248-L283 HydrophobicContact CB-CD1 4.48Å; L248-L283 HydrophobicContact CD1-CB 4.32Å; L248-L283 HydrophobicContact CD2-CB 3.74Å; L248-L283 HydrophobicContact CD2-CD1 4.36Å; L248-L283 HydrophobicContact CG-CB 4.38Å; L248-L283 WeakPolarHBondContact O-CD1 3.32Å; V251-L283 HydrophobicContact CB-CD1 4Å; V251-L283 HydrophobicContact CG1-CD1 3.89Å; V251-L283 HydrophobicContact CG1-CD2 4.46Å; A252-L283 HydrophobicContact CB-CD1 4Å; I278-L283 HydrophobicContact CG2-CD1 4.08Å; I278-L283 HydrophobicContact CG2-CG 4.12Å; I278-L283 PolarHBondContact O-N 2.95Å; L283-L286 WeakPolarHBondContact O-CB 3.32Å; L283-L286 PolarHBondContact O-N 2.95Å; L283-V287 WeakPolarHBondContact O-CG2 3.13Å; L283-V287 PolarHBondContact O-N 2.77Å; L283-M964 HydrophobicContact CD2-SD 4.15Å
284	K	80.8	Confident	75.5	Confident	31 Å²	31	31.3 Å²	31.3	14%	0.135	17%	0.165	C	C	.	.	H	α-helix	trans	-64.2	-57.4	-176.5	179.1	62	178.5	170	0	113.3	E244 M245 L248 T279 V282 L286 V287 E288	E244-K284 IonicContact OE1-NZ 3.58Å; E244-K284 PolarHBondContact OE1-NZ 3.43Å; E244-K284 IonicContact OE2-NZ 2.75Å; E244-K284 PolarHBondContact OE2-NZ 3.44Å; M245-K284 HydrophobicContact SD-CB 4.29Å; M245-K284 HydrophobicContact SD-CD 4.06Å; M245-K284 HydrophobicContact SD-CG 4.04Å; L248-K284 HydrophobicContact CD1-CB 3.7Å; L248-K284 HydrophobicContact CD1-CD 3.85Å; L248-K284 HydrophobicContact CD1-CG 4.37Å; T279-K284 VanDerWaalsContact O-CB 3.22Å; T279-K284 WeakPolarHBondContact O-CB 3.41Å; T279-K284 PolarHBondContact O-N 3.42Å; V282-K284 VanDerWaalsContact C-N 3.27Å; V282-K284 PolarHBondContact O-N 2.93Å; K284-L286 PolarHBondContact O-N 3.48Å; K284-V287 PolarHBondContact O-N 2.89Å; K284-E288 WeakPolarHBondContact CE-OE1 3.34Å; K284-E288 IonicContact NZ-OE1 3.97Å; K284-E288 PolarHBondContact O-N 3.24Å
285	P	73.6	Confident	76.1	Confident	27 Å²	27	30.5 Å²	30.5	18%	0.175	16%	0.163	C	C	.	.	H	α-helix	trans	-59.7	-16	174	11.1	-22.3	0	0	0	113.9	F86 T280 V282 V289	F86-P285 HydrophobicContact CE2-CB 4.46Å; F86-P285 HydrophobicContact CZ-CB 3.79Å; F86-P285 HydrophobicContact CZ-CG 4.01Å; T280-P285 WeakPolarHBondContact O-CD 3.33Å; V282-P285 WeakPolarHBondContact O-CD 3.41Å; V282-P285 VanDerWaalsContact O-CG 3.28Å; V282-P285 WeakPolarHBondContact O-CG 3.44Å; P285-V289 WeakPolarHBondContact O-CG2 3.23Å; P285-V289 PolarHBondContact O-N 2.88Å
286	L	66.2	Low	76.3	Confident	2 Å²	2	31.5 Å²	31.5	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-66	-54.7	178	-174.9	33.8	0	0	0	109.3	L83 F86 L283 K284 E288 V289 L290	L83-L286 HydrophobicContact CB-CD2 4.12Å; L83-L286 HydrophobicContact CD1-CD2 3.61Å; L83-L286 HydrophobicContact CD1-CG 4.33Å; L83-L286 HydrophobicContact CG-CD2 3.49Å; L83-L286 VanDerWaalsContact CG-CD2 3.49Å; F86-L286 HydrophobicContact CB-CD1 3.34Å; F86-L286 HydrophobicContact CB-CD2 4.05Å; F86-L286 HydrophobicContact CB-CG 4.13Å; F86-L286 HydrophobicContact CD1-CB 3.15Å; F86-L286 HydrophobicContact CD1-CD1 3.43Å; F86-L286 VanDerWaalsContact CD1-CD1 3.43Å; F86-L286 HydrophobicContact CD1-CD2 3.45Å; F86-L286 VanDerWaalsContact CD1-CD2 3.45Å; F86-L286 HydrophobicContact CD1-CG 3.42Å; F86-L286 VanDerWaalsContact CD1-CG 3.42Å; F86-L286 HydrophobicContact CD2-CB 4.28Å; F86-L286 HydrophobicContact CD2-CD1 3.59Å; F86-L286 HydrophobicContact CD2-CG 4.38Å; F86-L286 HydrophobicContact CE1-CB 3.01Å; F86-L286 HydrophobicContact CE1-CD1 4.1Å; F86-L286 HydrophobicContact CE1-CD2 4.16Å; F86-L286 HydrophobicContact CE1-CG 3.85Å; F86-L286 VanDerWaalsContact CE2-CA 3.42Å; F86-L286 HydrophobicContact CE2-CB 4.14Å; F86-L286 HydrophobicContact CE2-CD1 4.22Å; F86-L286 HydrophobicContact CG-CB 3.85Å; F86-L286 HydrophobicContact CG-CD1 3.2Å; F86-L286 HydrophobicContact CG-CD2 4.02Å; F86-L286 HydrophobicContact CG-CG 3.78Å; F86-L286 HydrophobicContact CZ-CB 3.59Å; F86-L286 HydrophobicContact CZ-CD1 4.49Å; L283-L286 WeakPolarHBondContact O-CB 3.32Å; L283-L286 PolarHBondContact O-N 2.95Å; K284-L286 PolarHBondContact O-N 3.48Å; L286-E288 PolarHBondContact O-N 3.21Å; L286-V289 PolarHBondContact O-N 3.29Å; L286-L290 HydrophobicContact CD1-CD1 3.28Å; L286-L290 HydrophobicContact CD1-CG 3.69Å; L286-L290 HydrophobicContact CG-CD1 4.01Å; L286-L290 WeakPolarHBondContact O-CB 3.31Å; L286-L290 PolarHBondContact O-N 3.41Å
287	V	78.8	Confident	76.8	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.006	15%	0.152	C	C	.	.	H	α-helix	trans	-63.5	-40.9	-176	176.2	0	0	0	0	107.3	L283 K284 S291 K957 I960 Y961	L283-V287 WeakPolarHBondContact O-CG2 3.13Å; L283-V287 PolarHBondContact O-N 2.77Å; K284-V287 PolarHBondContact O-N 2.89Å; V287-S291 WeakPolarHBondContact O-CB 3.37Å; V287-S291 PolarHBondContact O-N 3.25Å; V287-S291 PolarHBondContact O-OG 2.98Å; V287-K957 HydrophobicContact CG1-CB 4.29Å; V287-K957 HydrophobicContact CG1-CD 4.25Å; V287-K957 HydrophobicContact CG1-CG 3.82Å; V287-I960 HydrophobicContact CG2-CG2 3.96Å; V287-Y961 HydrophobicContact CG1-CE1 4.45Å; V287-Y961 HydrophobicContact CG1-CE2 3.76Å; V287-Y961 HydrophobicContact CG2-CE1 3.88Å
288	E	81.9	Confident	77.5	Confident	92 Å²	92	30.5 Å²	30.5	43%	0.43	16%	0.155	S	C	.	.	H	α-helix	trans	-61.2	-47.9	176.3	-67.2	-177.6	163.4	0	0	112.9	K284 L286 S291 D292	K284-E288 WeakPolarHBondContact CE-OE1 3.34Å; K284-E288 IonicContact NZ-OE1 3.97Å; K284-E288 PolarHBondContact O-N 3.24Å; L286-E288 PolarHBondContact O-N 3.21Å; E288-S291 PolarHBondContact O-OG 3.35Å; E288-D292 WeakPolarHBondContact O-CB 3.47Å; E288-D292 PolarHBondContact O-N 3.11Å
289	V	74.6	Confident	77.8	Confident	73 Å²	73	34.9 Å²	34.9	44%	0.442	18%	0.177	S	C	.	.	H	α-helix	trans	-69.9	-41.5	-179.4	172.7	0	0	0	0	112.3	P285 L286 S291 S295	P285-V289 WeakPolarHBondContact O-CG2 3.23Å; P285-V289 PolarHBondContact O-N 2.88Å; L286-V289 PolarHBondContact O-N 3.29Å; V289-S291 VanDerWaalsContact C-N 3.35Å; V289-S295 VanDerWaalsContact O-CB 3.23Å; V289-S295 WeakPolarHBondContact O-CB 3.3Å
290	L	74.4	Confident	77.8	Confident	37 Å²	37	36.8 Å²	36.8	19%	0.194	19%	0.187	C	C	.	.	H	α-helix	trans	-76.6	-21.3	-179	-72.1	-179.1	0	0	0	113.6	V79 A82 L286 I296 I960	V79-L290 HydrophobicContact CG1-CD1 4.27Å; V79-L290 HydrophobicContact CG2-CD1 4.41Å; A82-L290 HydrophobicContact CB-CD1 3.95Å; A82-L290 HydrophobicContact CB-CD2 3.84Å; A82-L290 HydrophobicContact CB-CG 4.4Å; L286-L290 HydrophobicContact CD1-CD1 3.28Å; L286-L290 HydrophobicContact CD1-CG 3.69Å; L286-L290 HydrophobicContact CG-CD1 4.01Å; L286-L290 WeakPolarHBondContact O-CB 3.31Å; L286-L290 PolarHBondContact O-N 3.41Å; L290-I296 WeakPolarHBondContact O-CD1 3.48Å; L290-I960 HydrophobicContact CB-CD1 3.58Å; L290-I960 HydrophobicContact CB-CG1 4.5Å
291	S	84.1	Confident	78.3	Confident	3 Å²	3	35 Å²	35	2%	0.021	18%	0.175	C	C	.	.	H	α-helix	trans	-92.6	-19.2	175.9	63.7	0	0	0	0	114	V287 E288 V289 P293 A953 N956 K957	V287-S291 WeakPolarHBondContact O-CB 3.37Å; V287-S291 PolarHBondContact O-N 3.25Å; V287-S291 PolarHBondContact O-OG 2.98Å; E288-S291 PolarHBondContact O-OG 3.35Å; V289-S291 VanDerWaalsContact C-N 3.35Å; S291-P293 WeakPolarHBondContact O-CD 3.31Å; S291-A953 WeakPolarHBondContact O-CA 3.04Å; S291-N956 PolarHBondContact O-ND2 3.18Å; S291-K957 WeakPolarHBondContact OG-CE 3.12Å; S291-K957 WeakPolarHBondContact OG-CG 3.41Å
292	D	86.6	Confident	78.7	Confident	41 Å²	41	34.2 Å²	34.2	22%	0.219	18%	0.18	C	C	.	.			trans	-71.2	120.6	-178.2	173.8	66.3	0	0	0	112.1	E288 D294 S295 I296	E288-D292 WeakPolarHBondContact O-CB 3.47Å; E288-D292 PolarHBondContact O-N 3.11Å; D292-D294 PolarHBondContact O-N 3.47Å; D292-D294 PolarHBondContact OD2-N 3.47Å; D292-S295 PolarHBondContact O-N 3.5Å; D292-S295 WeakPolarHBondContact OD2-CB 3.29Å; D292-S295 PolarHBondContact OD2-N 3.49Å; D292-S295 PolarHBondContact OD2-OG 3.07Å; D292-I296 WeakPolarHBondContact O-CG1 3.39Å; D292-I296 PolarHBondContact O-N 3.15Å
293	P	92	Very high	78.7	Confident	23 Å²	23	36.6 Å²	36.6	15%	0.149	19%	0.191	C	C	.	.	H	α-helix	trans	-59.2	-37.7	-178.4	-28.6	37.1	0	0	0	114.6	S291 S295 I296 N297 Q951 A953	S291-P293 WeakPolarHBondContact O-CD 3.31Å; P293-S295 VanDerWaalsContact C-N 3.34Å; P293-I296 PolarHBondContact O-N 3.42Å; P293-N297 WeakPolarHBondContact O-CB 3.21Å; P293-N297 PolarHBondContact O-N 3.19Å; P293-N297 PolarHBondContact O-ND2 3.4Å; P293-N297 VanDerWaalsContact O-ND2 3.11Å; P293-Q951 VanDerWaalsContact CG-O 3.25Å; P293-Q951 WeakPolarHBondContact CG-O 3.31Å; P293-A953 HydrophobicContact CG-CB 4.31Å
294	D	89.5	Confident	78.9	Confident	10 Å²	10	37.3 Å²	37.3	5%	0.053	20%	0.195	C	C	.	.	H	α-helix	trans	-66.4	-39.7	178.8	179.2	66.8	0	0	0	111.2	D292 N297 R298 R906 R911	D292-D294 PolarHBondContact O-N 3.47Å; D292-D294 PolarHBondContact OD2-N 3.47Å; D294-N297 PolarHBondContact O-N 2.78Å; D294-R298 WeakPolarHBondContact O-CB 3.41Å; D294-R298 WeakPolarHBondContact O-CG 3.14Å; D294-R298 PolarHBondContact O-N 3.44Å; D294-R298 PolarHBondContact O-NE 3.48Å; D294-R298 IonicContact OD2-CZ 2.61Å; D294-R298 IonicContact OD2-NE 2.7Å; D294-R298 PolarHBondContact OD2-NE 2.8Å; D294-R298 VanDerWaalsContact OD2-NE 3.1Å; D294-R298 IonicContact OD2-NH2 2.91Å; D294-R906 IonicContact OD1-NH1 3.42Å; D294-R906 PolarHBondContact OD1-NH1 2.92Å; D294-R906 IonicContact OD2-NH1 3.69Å; D294-R911 HydrophobicContact CB-CB 4.41Å; D294-R911 HydrophobicContact CB-CG 4Å
295	S	82	Confident	78.7	Confident	21 Å²	21	38.6 Å²	38.6	15%	0.147	20%	0.201	C	C	.	.	H	α-helix	trans	-64.4	-42.3	174.9	-59.1	0	0	0	0	111.8	V289 D292 P293 R298 M299	V289-S295 VanDerWaalsContact O-CB 3.23Å; V289-S295 WeakPolarHBondContact O-CB 3.3Å; D292-S295 PolarHBondContact O-N 3.5Å; D292-S295 WeakPolarHBondContact OD2-CB 3.29Å; D292-S295 PolarHBondContact OD2-N 3.49Å; D292-S295 PolarHBondContact OD2-OG 3.07Å; P293-S295 VanDerWaalsContact C-N 3.34Å; S295-R298 PolarHBondContact OG-NH2 2.84Å; S295-M299 WeakPolarHBondContact O-CB 3.45Å; S295-M299 PolarHBondContact O-N 2.94Å
296	I	80.8	Confident	78.1	Confident	25 Å²	25	40.7 Å²	40.7	13%	0.128	21%	0.209	C	C	.	.	H	α-helix	trans	-62.1	-46.7	173.3	-64.3	166.2	0	0	0	111	L290 D292 P293 R298 M299 L300 L950 N956	L290-I296 WeakPolarHBondContact O-CD1 3.48Å; D292-I296 WeakPolarHBondContact O-CG1 3.39Å; D292-I296 PolarHBondContact O-N 3.15Å; P293-I296 PolarHBondContact O-N 3.42Å; I296-R298 PolarHBondContact O-N 3.05Å; I296-M299 WeakPolarHBondContact O-CB 3.42Å; I296-M299 PolarHBondContact O-N 2.87Å; I296-L300 HydrophobicContact CG2-CD1 4.05Å; I296-L300 HydrophobicContact CG2-CG 4.38Å; I296-L300 WeakPolarHBondContact O-CG 3.31Å; I296-L300 PolarHBondContact O-N 2.93Å; I296-L950 HydrophobicContact CD1-CD2 4.47Å; I296-L950 HydrophobicContact CG2-CB 4.27Å; I296-L950 HydrophobicContact CG2-CD1 4.14Å; I296-N956 WeakPolarHBondContact CD1-ND2 3.19Å
297	N	90.1	Very high	77.6	Confident	2 Å²	2	44 Å²	44	1%	0.011	22%	0.221	C	C	.	.	H	α-helix	trans	-63.7	-40.9	-178.7	-69.3	-25.7	0	0	0	112	P293 D294 L300 L301 T914 A918 F947 Q951	P293-N297 WeakPolarHBondContact O-CB 3.21Å; P293-N297 PolarHBondContact O-N 3.19Å; P293-N297 PolarHBondContact O-ND2 3.4Å; P293-N297 VanDerWaalsContact O-ND2 3.11Å; D294-N297 PolarHBondContact O-N 2.78Å; N297-L300 PolarHBondContact O-N 2.77Å; N297-L301 WeakPolarHBondContact O-CG 3.43Å; N297-L301 PolarHBondContact O-N 2.74Å; N297-T914 HydrophobicContact CB-CG2 4.09Å; N297-A918 HydrophobicContact CB-CB 3.83Å; N297-F947 VanDerWaalsContact OD1-CE2 3.29Å; N297-F947 WeakPolarHBondContact OD1-CE2 3.42Å; N297-F947 WeakPolarHBondContact OD1-CZ 3.49Å; N297-Q951 PolarHBondContact ND2-OE1 2.94Å; N297-Q951 VanDerWaalsContact ND2-OE1 3.08Å; N297-Q951 PolarHBondContact OD1-NE2 2.62Å
298	R	84.5	Confident	77.1	Confident	100 Å²	100	48.7 Å²	48.7	38%	0.377	24%	0.243	S	C	.	.	H	α-helix	trans	-63.1	-42.1	173	-74.4	-176	-72.8	169	3.7	112.2	D294 S295 I296 L301 S302 T914	D294-R298 WeakPolarHBondContact O-CB 3.41Å; D294-R298 WeakPolarHBondContact O-CG 3.14Å; D294-R298 PolarHBondContact O-N 3.44Å; D294-R298 PolarHBondContact O-NE 3.48Å; D294-R298 IonicContact OD2-CZ 2.61Å; D294-R298 IonicContact OD2-NE 2.7Å; D294-R298 PolarHBondContact OD2-NE 2.8Å; D294-R298 VanDerWaalsContact OD2-NE 3.1Å; D294-R298 IonicContact OD2-NH2 2.91Å; S295-R298 PolarHBondContact OG-NH2 2.84Å; I296-R298 PolarHBondContact O-N 3.05Å; R298-L301 PolarHBondContact O-N 3.27Å; R298-S302 WeakPolarHBondContact O-CB 3.19Å; R298-S302 PolarHBondContact O-N 3.14Å; R298-T914 HydrophobicContact CG-CG2 3.7Å
299	M	72.6	Confident	76.2	Confident	117 Å²	117	50.2 Å²	50.2	58%	0.576	25%	0.25	S	S	*	.	H	α-helix	trans	-61.2	-47.4	175.5	-172.6	65.5	70.7	0	0	110.4	S295 I296 L301 S302 Q303	S295-M299 WeakPolarHBondContact O-CB 3.45Å; S295-M299 PolarHBondContact O-N 2.94Å; I296-M299 WeakPolarHBondContact O-CB 3.42Å; I296-M299 PolarHBondContact O-N 2.87Å; M299-L301 PolarHBondContact O-N 3.41Å; M299-S302 PolarHBondContact O-N 3.1Å; M299-Q303 WeakPolarHBondContact O-CB 3.33Å; M299-Q303 WeakPolarHBondContact O-CG 3.44Å; M299-Q303 PolarHBondContact O-N 2.55Å; M299-Q303 HydrophobicContact SD-CG 4.5Å
300	L	74.8	Confident	75	Confident	40 Å²	40	48 Å²	48	21%	0.209	24%	0.235	C	C	.	.	H	α-helix	trans	-57.9	-48.5	177	-74.1	172	0	0	0	112	I296 N297 Q303 L304 F947 L950	I296-L300 HydrophobicContact CG2-CD1 4.05Å; I296-L300 HydrophobicContact CG2-CG 4.38Å; I296-L300 WeakPolarHBondContact O-CG 3.31Å; I296-L300 PolarHBondContact O-N 2.93Å; N297-L300 PolarHBondContact O-N 2.77Å; L300-Q303 PolarHBondContact O-N 2.83Å; L300-L304 WeakPolarHBondContact O-CB 3.31Å; L300-L304 VanDerWaalsContact O-CG 3.3Å; L300-L304 WeakPolarHBondContact O-CG 3.09Å; L300-L304 PolarHBondContact O-N 2.57Å; L300-F947 HydrophobicContact CD1-CD2 4.37Å; L300-F947 HydrophobicContact CD1-CE2 4.31Å; L300-L950 HydrophobicContact CD1-CD1 4.43Å
301	L	81.3	Confident	73.9	Confident	6 Å²	6	48.9 Å²	48.9	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-61.3	-49.6	178.5	-79.7	170.4	0	0	0	112.2	N297 R298 M299 Q303 L304 E305 T914 R917 A918 K921	N297-L301 WeakPolarHBondContact O-CG 3.43Å; N297-L301 PolarHBondContact O-N 2.74Å; R298-L301 PolarHBondContact O-N 3.27Å; M299-L301 PolarHBondContact O-N 3.41Å; L301-Q303 PolarHBondContact O-N 2.71Å; L301-L304 PolarHBondContact O-N 3.02Å; L301-E305 WeakPolarHBondContact O-CB 3.49Å; L301-E305 WeakPolarHBondContact O-CG 3.1Å; L301-E305 PolarHBondContact O-N 3.47Å; L301-T914 HydrophobicContact CD1-CG2 3.77Å; L301-R917 HydrophobicContact CD1-CB 4.26Å; L301-R917 HydrophobicContact CD2-CB 4.34Å; L301-R917 HydrophobicContact CD2-CG 4.39Å; L301-A918 HydrophobicContact CD1-CB 4.07Å; L301-A918 HydrophobicContact CD2-CB 4.28Å; L301-A918 HydrophobicContact CG-CB 3.79Å; L301-K921 HydrophobicContact CD2-CB 4.05Å; L301-K921 HydrophobicContact CD2-CG 4.36Å
302	S	73	Confident	72.6	Confident	65 Å²	65	53.8 Å²	53.8	46%	0.455	27%	0.27	S	S	.	.	H	α-helix	trans	-55.8	-40.8	178.3	-176.7	0	0	0	0	111.3	R298 M299 Q306	R298-S302 WeakPolarHBondContact O-CB 3.19Å; R298-S302 PolarHBondContact O-N 3.14Å; M299-S302 PolarHBondContact O-N 3.1Å; S302-Q306 WeakPolarHBondContact O-CB 3.43Å; S302-Q306 PolarHBondContact O-N 3.46Å
303	Q	61.6	Low	71	Confident	53 Å²	53	58.3 Å²	58.3	25%	0.248	29%	0.29	C	S	.	.	H	α-helix	trans	-72.2	-41	179.8	-67.5	-63.5	-30	0	0	112.6	M299 L300 L301 R307	M299-Q303 WeakPolarHBondContact O-CB 3.33Å; M299-Q303 WeakPolarHBondContact O-CG 3.44Å; M299-Q303 PolarHBondContact O-N 2.55Å; M299-Q303 HydrophobicContact SD-CG 4.5Å; L300-Q303 PolarHBondContact O-N 2.83Å; L301-Q303 PolarHBondContact O-N 2.71Å; Q303-R307 WeakPolarHBondContact O-CG 3.36Å; Q303-R307 PolarHBondContact O-N 3.18Å
304	L	73.7	Confident	68.9	Low	14 Å²	14	62.2 Å²	62.2	7%	0.073	31%	0.306	C	S	.	.	H	α-helix	trans	-72	-44.2	-179.5	-70.1	172.7	0	0	0	112.2	L300 L301 Q306 R307 E308 K921 L922 N925	L300-L304 WeakPolarHBondContact O-CB 3.31Å; L300-L304 VanDerWaalsContact O-CG 3.3Å; L300-L304 WeakPolarHBondContact O-CG 3.09Å; L300-L304 PolarHBondContact O-N 2.57Å; L301-L304 PolarHBondContact O-N 3.02Å; L304-Q306 VanDerWaalsContact C-N 3.35Å; L304-Q306 PolarHBondContact O-N 2.91Å; L304-R307 PolarHBondContact O-N 2.75Å; L304-E308 PolarHBondContact O-N 3.2Å; L304-E308 VanDerWaalsContact O-N 3.15Å; L304-K921 HydrophobicContact CB-CG 3.83Å; L304-K921 HydrophobicContact CD1-CB 4.01Å; L304-K921 HydrophobicContact CD1-CG 3.85Å; L304-K921 HydrophobicContact CG-CG 4.48Å; L304-L922 HydrophobicContact CD1-CB 4.33Å; L304-L922 HydrophobicContact CD1-CD1 4.31Å; L304-N925 HydrophobicContact CD2-CB 4.16Å
305	E	77.7	Confident	67.1	Low	58 Å²	58	68.9 Å²	68.9	27%	0.271	34%	0.335	S	S	.	.	H	α-helix	trans	-63.7	-40.3	178	-69.9	170.9	-178.6	0	0	111.4	L301 R307 E308 Q309 R917	L301-E305 WeakPolarHBondContact O-CB 3.49Å; L301-E305 WeakPolarHBondContact O-CG 3.1Å; L301-E305 PolarHBondContact O-N 3.47Å; E305-R307 VanDerWaalsContact C-N 3.31Å; E305-R307 PolarHBondContact O-N 2.82Å; E305-E308 PolarHBondContact O-N 3.47Å; E305-Q309 WeakPolarHBondContact O-CG 3.24Å; E305-Q309 PolarHBondContact O-N 2.86Å; E305-R917 IonicContact OE1-CZ 3.38Å; E305-R917 IonicContact OE1-NE 3.1Å; E305-R917 IonicContact OE1-NH2 3.51Å; E305-R917 PolarHBondContact OE1-NH2 3.11Å; E305-R917 IonicContact OE2-NH2 3.69Å
306	Q	61.1	Low	65.8	Low	72 Å²	72	72.2 Å²	72.2	34%	0.336	35%	0.347	S	S	.	.	H	α-helix	trans	-63.4	-36	175.9	-174.4	179	7.9	0	0	112.3	S302 L304 Q310	S302-Q306 WeakPolarHBondContact O-CB 3.43Å; S302-Q306 PolarHBondContact O-N 3.46Å; L304-Q306 VanDerWaalsContact C-N 3.35Å; L304-Q306 PolarHBondContact O-N 2.91Å; Q306-Q310 VanDerWaalsContact O-CG 3.27Å; Q306-Q310 WeakPolarHBondContact O-CG 3.24Å; Q306-Q310 PolarHBondContact O-N 3.45Å
307	R	54.4	Low	64.1	Low	71 Å²	71	74.3 Å²	74.3	27%	0.268	37%	0.368	S	S	.	.	H	α-helix	trans	-68.9	-42.9	177.5	-78.1	179.5	-173.6	175.5	2.2	113	L61 Q303 L304 E305 Q309 Q310 A311	L61-R307 HydrophobicContact CD1-CG 4.39Å; Q303-R307 WeakPolarHBondContact O-CG 3.36Å; Q303-R307 PolarHBondContact O-N 3.18Å; L304-R307 PolarHBondContact O-N 2.75Å; E305-R307 VanDerWaalsContact C-N 3.31Å; E305-R307 PolarHBondContact O-N 2.82Å; R307-Q309 VanDerWaalsContact C-N 3.34Å; R307-Q309 PolarHBondContact O-N 3.46Å; R307-Q310 PolarHBondContact O-N 2.76Å; R307-A311 PolarHBondContact O-N 2.93Å
308	E	67.9	Low	61.9	Low	100 Å²	100	81.2 Å²	81.2	47%	0.467	40%	0.395	S	S	.	.	H	α-helix	trans	-60.7	-45.5	-179.1	-172.4	176.4	-163.5	0	0	111.3	L304 E305 Q310 A311 E312 K921	L304-E308 PolarHBondContact O-N 3.2Å; L304-E308 VanDerWaalsContact O-N 3.15Å; E305-E308 PolarHBondContact O-N 3.47Å; E308-Q310 VanDerWaalsContact C-N 3.31Å; E308-Q310 PolarHBondContact O-N 3.41Å; E308-A311 PolarHBondContact O-N 2.93Å; E308-E312 PolarHBondContact O-N 2.76Å; E308-E312 VanDerWaalsContact O-N 3.09Å; E308-K921 VanDerWaalsContact OE2-CE 3.22Å; E308-K921 WeakPolarHBondContact OE2-CE 3.47Å; E308-K921 IonicContact OE2-NZ 3.76Å; E308-K921 PolarHBondContact OE2-NZ 3.33Å
309	Q	62.9	Low	60.1	Low	124 Å²	124	80.9 Å²	80.9	58%	0.579	40%	0.404	S	S	*	.	H	α-helix	trans	-61.3	-38.7	177.3	-68.5	174.8	1.2	0	0	112.6	E305 R307 Q313	E305-Q309 WeakPolarHBondContact O-CG 3.24Å; E305-Q309 PolarHBondContact O-N 2.86Å; R307-Q309 VanDerWaalsContact C-N 3.34Å; R307-Q309 PolarHBondContact O-N 3.46Å; Q309-Q313 WeakPolarHBondContact O-CG 3.09Å; Q309-Q313 PolarHBondContact O-N 3.14Å
310	Q	49.5	Very low	58.6	Low	26 Å²	26	84 Å²	84	12%	0.121	41%	0.41	C	S	.	.	H	α-helix	trans	-68.4	-43.6	177.1	-71.4	168.7	12	0	0	112	V54 Q306 R307 E308 E312 Q313 Q314	V54-Q310 HydrophobicContact CG1-CG 4.15Å; V54-Q310 HydrophobicContact CG2-CG 4.26Å; Q306-Q310 VanDerWaalsContact O-CG 3.27Å; Q306-Q310 WeakPolarHBondContact O-CG 3.24Å; Q306-Q310 PolarHBondContact O-N 3.45Å; R307-Q310 PolarHBondContact O-N 2.76Å; E308-Q310 VanDerWaalsContact C-N 3.31Å; E308-Q310 PolarHBondContact O-N 3.41Å; Q310-E312 VanDerWaalsContact C-N 3.27Å; Q310-E312 PolarHBondContact O-N 2.76Å; Q310-Q313 PolarHBondContact O-N 2.76Å; Q310-Q314 WeakPolarHBondContact O-CB 3.34Å; Q310-Q314 VanDerWaalsContact O-CG 3.32Å; Q310-Q314 WeakPolarHBondContact O-CG 3.16Å; Q310-Q314 PolarHBondContact O-N 3.5Å
311	A	52.5	Low	57.5	Low	56 Å²	56	83.9 Å²	83.9	46%	0.463	42%	0.415	S	S	.	.	H	α-helix	trans	-60.9	-38.6	178.2	0	0	0	0	0	111.6	R307 E308 Q314 K315	R307-A311 PolarHBondContact O-N 2.93Å; E308-A311 PolarHBondContact O-N 2.93Å; A311-Q314 PolarHBondContact O-N 2.93Å; A311-K315 WeakPolarHBondContact O-CB 3.2Å; A311-K315 PolarHBondContact O-N 2.86Å
312	E	57	Low	56	Low	106 Å²	106	88.2 Å²	88.2	50%	0.495	45%	0.452	S	S	.	.	H	α-helix	trans	-69.1	-38.2	179.3	-156.5	-174.6	151.8	0	0	112.8	E308 Q310 K316	E308-E312 PolarHBondContact O-N 2.76Å; E308-E312 VanDerWaalsContact O-N 3.09Å; Q310-E312 VanDerWaalsContact C-N 3.27Å; Q310-E312 PolarHBondContact O-N 2.76Å; E312-K316 WeakPolarHBondContact O-CD 3.49Å; E312-K316 VanDerWaalsContact O-CG 3.28Å; E312-K316 WeakPolarHBondContact O-CG 3.41Å; E312-K316 PolarHBondContact O-N 3.14Å; E312-K316 VanDerWaalsContact O-N 3.16Å; E312-K316 IonicContact OE1-NZ 3.22Å; E312-K316 PolarHBondContact OE1-NZ 2.85Å
313	Q	51.7	Low	55.6	Low	136 Å²	136	87.4 Å²	87.4	64%	0.636	45%	0.446	S	S	*	.	H	α-helix	trans	-69.1	-39.1	175.4	-71.6	176.4	-0	0	0	112.5	Q309 Q310 K316 A317	Q309-Q313 WeakPolarHBondContact O-CG 3.09Å; Q309-Q313 PolarHBondContact O-N 3.14Å; Q310-Q313 PolarHBondContact O-N 2.76Å; Q313-K316 WeakPolarHBondContact O-CB 3.36Å; Q313-K316 PolarHBondContact O-N 3.35Å; Q313-A317 PolarHBondContact O-N 3.2Å
314	Q	48.2	Very low	55.7	Low	104 Å²	104	88.5 Å²	88.5	49%	0.486	45%	0.449	S	S	.	.	H	α-helix	trans	-68.4	-42.2	176.4	-72.6	174	-6.7	0	0	112.2	Q310 A311 K316 A317 Y318	Q310-Q314 WeakPolarHBondContact O-CB 3.34Å; Q310-Q314 VanDerWaalsContact O-CG 3.32Å; Q310-Q314 WeakPolarHBondContact O-CG 3.16Å; Q310-Q314 PolarHBondContact O-N 3.5Å; A311-Q314 PolarHBondContact O-N 2.93Å; Q314-K316 VanDerWaalsContact C-N 3.28Å; Q314-K316 PolarHBondContact O-N 2.74Å; Q314-A317 PolarHBondContact O-N 3.28Å; Q314-Y318 WeakPolarHBondContact O-CB 3.49Å; Q314-Y318 PolarHBondContact O-N 3.49Å
315	K	51.4	Low	55.2	Low	151 Å²	151	93.2 Å²	93.2	66%	0.657	47%	0.47	S	S	*	.	H	α-helix	trans	-55.1	-48.6	173.3	-174.9	177	179.8	-179.6	0	109.9	A311 Y318 T319	A311-K315 WeakPolarHBondContact O-CB 3.2Å; A311-K315 PolarHBondContact O-N 2.86Å; K315-Y318 PolarHBondContact O-N 3.18Å; K315-T319 WeakPolarHBondContact O-CB 3.43Å; K315-T319 PolarHBondContact O-N 3.33Å; K315-T319 PolarHBondContact O-OG1 3.42Å
316	K	54.3	Low	54.6	Low	90 Å²	90	93.8 Å²	93.8	39%	0.391	48%	0.475	S	S	.	.	H	α-helix	trans	-54.8	-56.8	175.7	-76.2	168.4	-170.9	167.4	0	111.2	E312 Q313 Q314 Y318 T319 Y320	E312-K316 WeakPolarHBondContact O-CD 3.49Å; E312-K316 VanDerWaalsContact O-CG 3.28Å; E312-K316 WeakPolarHBondContact O-CG 3.41Å; E312-K316 PolarHBondContact O-N 3.14Å; E312-K316 VanDerWaalsContact O-N 3.16Å; E312-K316 IonicContact OE1-NZ 3.22Å; E312-K316 PolarHBondContact OE1-NZ 2.85Å; Q313-K316 WeakPolarHBondContact O-CB 3.36Å; Q313-K316 PolarHBondContact O-N 3.35Å; Q314-K316 VanDerWaalsContact C-N 3.28Å; Q314-K316 PolarHBondContact O-N 2.74Å; K316-Y318 VanDerWaalsContact C-N 3.32Å; K316-Y318 PolarHBondContact O-N 3.39Å; K316-T319 WeakPolarHBondContact CA-OG1 3.38Å; K316-T319 PolarHBondContact O-N 2.87Å; K316-T319 PolarHBondContact O-OG1 3.42Å; K316-Y320 VanDerWaalsContact C-CD2 3.41Å; K316-Y320 HydrophobicContact CB-CD2 4.13Å; K316-Y320 HydrophobicContact CB-CE2 3.77Å; K316-Y320 HydrophobicContact CG-CE2 4.16Å; K316-Y320 WeakPolarHBondContact O-CB 3.3Å; K316-Y320 WeakPolarHBondContact O-CD2 3.35Å; K316-Y320 PolarHBondContact O-N 3.1Å
317	A	46.5	Very low	55	Low	69 Å²	69	92 Å²	92	57%	0.57	47%	0.467	S	S	*	.	H	α-helix	trans	-58.5	-37.5	-178.5	0	0	0	0	0	114.3	Q313 Q314	Q313-A317 PolarHBondContact O-N 3.2Å; Q314-A317 PolarHBondContact O-N 3.28Å
318	Y	44.4	Very low	56	Low	148 Å²	148	90.2 Å²	90.2	58%	0.58	46%	0.462	S	S	*	.	H	α-helix	trans	-73.5	-43.5	176.7	-177.4	-99	0	0	0	112.5	Q314 K315 K316 Y320 A321	Q314-Y318 WeakPolarHBondContact O-CB 3.49Å; Q314-Y318 PolarHBondContact O-N 3.49Å; K315-Y318 PolarHBondContact O-N 3.18Å; K316-Y318 VanDerWaalsContact C-N 3.32Å; K316-Y318 PolarHBondContact O-N 3.39Å; Y318-Y320 PolarHBondContact O-N 3.22Å; Y318-A321 PolarHBondContact O-N 3.36Å
319	T	45.8	Very low	56.3	Low	92 Å²	92	91.9 Å²	91.9	56%	0.564	47%	0.467	S	S	*	.	H	α-helix	trans	-67.5	-19	175.6	41.5	0	0	0	0	114	K315 K316	K315-T319 WeakPolarHBondContact O-CB 3.43Å; K315-T319 PolarHBondContact O-N 3.33Å; K315-T319 PolarHBondContact O-OG1 3.42Å; K316-T319 WeakPolarHBondContact CA-OG1 3.38Å; K316-T319 PolarHBondContact O-N 2.87Å; K316-T319 PolarHBondContact O-OG1 3.42Å
320	Y	42.1	Very low	56.8	Low	183 Å²	183	89.6 Å²	89.6	72%	0.718	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-6.9	178.6	-71.3	-56.6	0	0	0	114.2	K316 Y318 A322	K316-Y320 VanDerWaalsContact C-CD2 3.41Å; K316-Y320 HydrophobicContact CB-CD2 4.13Å; K316-Y320 HydrophobicContact CB-CE2 3.77Å; K316-Y320 HydrophobicContact CG-CE2 4.16Å; K316-Y320 WeakPolarHBondContact O-CB 3.3Å; K316-Y320 WeakPolarHBondContact O-CD2 3.35Å; K316-Y320 PolarHBondContact O-N 3.1Å; Y318-Y320 PolarHBondContact O-N 3.22Å; Y320-A322 PolarHBondContact O-N 3.35Å
321	A	50	Low	58.1	Low	38 Å²	38	88.4 Å²	88.4	31%	0.314	45%	0.453	S	S	.	.			trans	-77.5	98.1	168.2	0	0	0	0	0	109	Y318 S323	Y318-A321 PolarHBondContact O-N 3.36Å; A321-S323 VanDerWaalsContact C-N 3.34Å; A321-S323 PolarHBondContact O-N 3.38Å
322	A	50.8	Low	59.2	Low	96 Å²	96	88 Å²	88	79%	0.793	45%	0.448	S	S	*	.			trans	-77.4	-15.8	-170.6	0	0	0	0	0	114	Y320	Y320-A322 PolarHBondContact O-N 3.35Å
323	S	64.6	Low	60	Low	49 Å²	49	87.3 Å²	87.3	34%	0.343	45%	0.45	S	S	.	.	S	Bend	trans	-150.8	164.3	-176.1	71.6	0	0	0	0	113.3	A321 E325 D326 F327	A321-S323 VanDerWaalsContact C-N 3.34Å; A321-S323 PolarHBondContact O-N 3.38Å; S323-E325 PolarHBondContact O-N 3.03Å; S323-E325 PolarHBondContact OG-N 3.43Å; S323-D326 PolarHBondContact N-OD2 3.39Å; S323-D326 PolarHBondContact O-N 3.49Å; S323-D326 VanDerWaalsContact OG-CG 3.3Å; S323-D326 PolarHBondContact OG-N 3.11Å; S323-D326 PolarHBondContact OG-OD2 3.34Å; S323-F327 PolarHBondContact O-N 3.36Å
324	Y	64.3	Low	61	Low	76 Å²	76	81.7 Å²	81.7	30%	0.298	43%	0.426	S	S	.	.	H	α-helix	trans	-60	-29.2	171.7	177.9	-106.8	0	0	0	112.2	F327 I328 Q393 V396 A397	Y324-F327 WeakPolarHBondContact O-CB 3.2Å; Y324-F327 PolarHBondContact O-N 3.11Å; Y324-I328 HydrophobicContact CD1-CG1 4.21Å; Y324-I328 HydrophobicContact CE1-CD1 4.27Å; Y324-I328 HydrophobicContact CE1-CG1 3.75Å; Y324-I328 HydrophobicContact CE2-CD1 4.05Å; Y324-I328 HydrophobicContact CE2-CG1 4.15Å; Y324-I328 WeakPolarHBondContact O-CG1 3.23Å; Y324-I328 PolarHBondContact O-N 2.89Å; Y324-Q393 HydrophobicContact CD2-CB 4.06Å; Y324-Q393 HydrophobicContact CD2-CG 4.41Å; Y324-Q393 HydrophobicContact CE2-CB 3.64Å; Y324-Q393 HydrophobicContact CE2-CG 4.23Å; Y324-Q393 VanDerWaalsContact CE2-O 3.32Å; Y324-Q393 WeakPolarHBondContact CE2-O 3.32Å; Y324-Q393 PolarHBondContact OH-O 3.01Å; Y324-V396 WeakPolarHBondContact OH-CB 3.28Å; Y324-V396 WeakPolarHBondContact OH-CG1 3.48Å; Y324-A397 HydrophobicContact CE2-CB 4.25Å
325	E	62.4	Low	62.1	Low	112 Å²	112	81.4 Å²	81.4	52%	0.523	43%	0.432	S	S	.	.	H	α-helix	trans	-71.2	-41.5	179.3	-62.1	-173.7	163.2	0	0	111.8	S323 F327 I328 K329 H434	S323-E325 PolarHBondContact O-N 3.03Å; S323-E325 PolarHBondContact OG-N 3.43Å; E325-F327 PolarHBondContact O-N 2.84Å; E325-I328 PolarHBondContact O-N 2.64Å; E325-K329 WeakPolarHBondContact O-CB 3.49Å; E325-K329 PolarHBondContact O-N 3.46Å; E325-H434 IonicContact OE1-CE1 2.69Å; E325-H434 PolarHBondContact OE1-CE1 3.35Å; E325-H434 VanDerWaalsContact OE1-CE1 3.23Å; E325-H434 IonicContact OE1-ND1 2.98Å; E325-H434 PolarHBondContact OE1-ND1 2.76Å; E325-H434 IonicContact OE2-CE1 2.76Å; E325-H434 PolarHBondContact OE2-CE1 3.12Å
326	D	64	Low	63	Low	71 Å²	71	77.5 Å²	77.5	38%	0.38	42%	0.418	S	S	.	.	H	α-helix	trans	-62.1	-35.2	172.9	-63.5	-48.6	0	0	0	111.4	S323 K329 L330	S323-D326 PolarHBondContact N-OD2 3.39Å; S323-D326 PolarHBondContact O-N 3.49Å; S323-D326 VanDerWaalsContact OG-CG 3.3Å; S323-D326 PolarHBondContact OG-N 3.11Å; S323-D326 PolarHBondContact OG-OD2 3.34Å; D326-K329 PolarHBondContact O-N 2.84Å; D326-L330 WeakPolarHBondContact O-CB 3.44Å; D326-L330 PolarHBondContact O-N 3.23Å
327	F	69.4	Low	63.3	Low	35 Å²	35	74.4 Å²	74.4	15%	0.154	41%	0.407	C	S	.	.	H	α-helix	trans	-67	-43.3	175.6	-173	-108.2	0	0	0	112.6	S323 Y324 E325 L330 I331 L343 I347 A397	S323-F327 PolarHBondContact O-N 3.36Å; Y324-F327 WeakPolarHBondContact O-CB 3.2Å; Y324-F327 PolarHBondContact O-N 3.11Å; E325-F327 PolarHBondContact O-N 2.84Å; F327-L330 WeakPolarHBondContact O-CB 3.42Å; F327-L330 PolarHBondContact O-N 2.98Å; F327-I331 HydrophobicContact CD1-CD1 4.17Å; F327-I331 HydrophobicContact CE1-CD1 3.98Å; F327-I331 WeakPolarHBondContact O-CG1 3.39Å; F327-I331 PolarHBondContact O-N 3.44Å; F327-L343 HydrophobicContact CE2-CD1 3.58Å; F327-L343 HydrophobicContact CZ-CD1 3.55Å; F327-L343 HydrophobicContact CZ-CG 4.24Å; F327-I347 HydrophobicContact CE1-CD1 3.79Å; F327-I347 HydrophobicContact CE1-CG1 4.04Å; F327-I347 HydrophobicContact CZ-CD1 3.82Å; F327-I347 HydrophobicContact CZ-CG1 3.85Å; F327-A397 HydrophobicContact CD1-CB 4.24Å; F327-A397 HydrophobicContact CE1-CB 3.8Å
328	I	76.5	Confident	63.7	Low	32 Å²	32	75.4 Å²	75.4	16%	0.164	40%	0.402	C	S	.	.	H	α-helix	trans	-69	-35.3	173.8	-65	-55.9	0	0	0	111.5	Y324 E325 L330 I331 S332 A397	Y324-I328 HydrophobicContact CD1-CG1 4.21Å; Y324-I328 HydrophobicContact CE1-CD1 4.27Å; Y324-I328 HydrophobicContact CE1-CG1 3.75Å; Y324-I328 HydrophobicContact CE2-CD1 4.05Å; Y324-I328 HydrophobicContact CE2-CG1 4.15Å; Y324-I328 WeakPolarHBondContact O-CG1 3.23Å; Y324-I328 PolarHBondContact O-N 2.89Å; E325-I328 PolarHBondContact O-N 2.64Å; I328-L330 VanDerWaalsContact C-N 3.32Å; I328-L330 PolarHBondContact O-N 2.92Å; I328-I331 HydrophobicContact CD1-CD1 4.07Å; I328-I331 PolarHBondContact O-N 3.35Å; I328-S332 WeakPolarHBondContact O-CB 3.29Å; I328-S332 PolarHBondContact O-N 3.13Å; I328-S332 PolarHBondContact O-OG 3.19Å; I328-A397 HydrophobicContact CD1-CB 3.69Å
329	K	73.6	Confident	64.7	Low	135 Å²	135	71.8 Å²	71.8	59%	0.587	39%	0.39	S	S	*	.	H	α-helix	trans	-62.4	-40.4	174.1	-167.4	175.1	-178.7	178.2	0	111.3	E325 D326 I331 S332 T333	E325-K329 WeakPolarHBondContact O-CB 3.49Å; E325-K329 PolarHBondContact O-N 3.46Å; D326-K329 PolarHBondContact O-N 2.84Å; K329-I331 PolarHBondContact O-N 2.93Å; K329-S332 WeakPolarHBondContact CA-OG 3.19Å; K329-S332 PolarHBondContact O-N 3.04Å; K329-S332 PolarHBondContact O-OG 3.28Å; K329-S332 VanDerWaalsContact O-OG 3.07Å; K329-T333 HydrophobicContact CG-CG2 4.24Å; K329-T333 VanDerWaalsContact O-CB 3.32Å; K329-T333 WeakPolarHBondContact O-CB 3.38Å; K329-T333 VanDerWaalsContact O-CG2 3.28Å; K329-T333 WeakPolarHBondContact O-CG2 3.34Å; K329-T333 PolarHBondContact O-N 2.83Å; K329-T333 PolarHBondContact O-OG1 2.81Å
330	L	74.3	Confident	65.5	Low	77 Å²	77	67.4 Å²	67.4	40%	0.403	36%	0.363	S	S	.	.	H	α-helix	trans	-61.1	-41.2	173.1	-178.5	65.3	0	0	0	112.2	D326 F327 I328 S334 F339	D326-L330 WeakPolarHBondContact O-CB 3.44Å; D326-L330 PolarHBondContact O-N 3.23Å; F327-L330 WeakPolarHBondContact O-CB 3.42Å; F327-L330 PolarHBondContact O-N 2.98Å; I328-L330 VanDerWaalsContact C-N 3.32Å; I328-L330 PolarHBondContact O-N 2.92Å; L330-S334 VanDerWaalsContact O-CB 3.28Å; L330-S334 WeakPolarHBondContact O-CB 3.44Å; L330-S334 PolarHBondContact O-N 2.95Å; L330-F339 HydrophobicContact CD1-CE1 4.5Å; L330-F339 HydrophobicContact CD1-CZ 4.09Å; L330-F339 HydrophobicContact CD2-CZ 3.89Å; L330-F339 HydrophobicContact CG-CE1 4.16Å; L330-F339 HydrophobicContact CG-CZ 3.8Å
331	I	76.7	Confident	66.1	Low	0 Å²	0	61.7 Å²	61.7	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-66	-49.1	176	-66.8	167.9	0	0	0	111.3	F327 I328 K329 S334 L340 L343 I347 A397 Q400 C401	F327-I331 HydrophobicContact CD1-CD1 4.17Å; F327-I331 HydrophobicContact CE1-CD1 3.98Å; F327-I331 WeakPolarHBondContact O-CG1 3.39Å; F327-I331 PolarHBondContact O-N 3.44Å; I328-I331 HydrophobicContact CD1-CD1 4.07Å; I328-I331 PolarHBondContact O-N 3.35Å; K329-I331 PolarHBondContact O-N 2.93Å; I331-S334 PolarHBondContact O-N 2.87Å; I331-L340 HydrophobicContact CB-CD2 4.48Å; I331-L340 HydrophobicContact CG2-CD2 3.87Å; I331-L340 WeakPolarHBondContact O-CD2 3.42Å; I331-L343 HydrophobicContact CD1-CD2 4.08Å; I331-L343 HydrophobicContact CG1-CD2 3.35Å; I331-L343 HydrophobicContact CG1-CG 4.24Å; I331-I347 HydrophobicContact CD1-CD1 4.16Å; I331-A397 HydrophobicContact CD1-CB 3.9Å; I331-Q400 HydrophobicContact CG2-CB 4.13Å; I331-C401 HydrophobicContact CG2-CB 4.34Å
332	S	74.5	Confident	66.3	Low	49 Å²	49	62 Å²	62	34%	0.343	34%	0.337	S	S	.	.	H	α-helix	trans	-68.9	-37.6	-175.2	51.9	0	0	0	0	112.9	I328 K329 R404	I328-S332 WeakPolarHBondContact O-CB 3.29Å; I328-S332 PolarHBondContact O-N 3.13Å; I328-S332 PolarHBondContact O-OG 3.19Å; K329-S332 WeakPolarHBondContact CA-OG 3.19Å; K329-S332 PolarHBondContact O-N 3.04Å; K329-S332 PolarHBondContact O-OG 3.28Å; K329-S332 VanDerWaalsContact O-OG 3.07Å; S332-R404 PolarHBondContact O-NE 3.47Å; S332-R404 PolarHBondContact O-NH2 3.01Å
333	T	75.6	Confident	66.9	Low	90 Å²	90	58 Å²	58	55%	0.552	30%	0.302	S	S	*	.	H	α-helix	trans	-79.4	-17.7	178.4	57.2	0	0	0	0	113.7	K329	K329-T333 HydrophobicContact CG-CG2 4.24Å; K329-T333 VanDerWaalsContact O-CB 3.32Å; K329-T333 WeakPolarHBondContact O-CB 3.38Å; K329-T333 VanDerWaalsContact O-CG2 3.28Å; K329-T333 WeakPolarHBondContact O-CG2 3.34Å; K329-T333 PolarHBondContact O-N 2.83Å; K329-T333 PolarHBondContact O-OG1 2.81Å
334	S	72.9	Confident	67.1	Low	19 Å²	19	57.8 Å²	57.8	13%	0.133	29%	0.294	C	S	.	.			trans	-71.9	136.3	178	-169.2	0	0	0	0	112.2	L330 I331 D336 F339 R404	L330-S334 VanDerWaalsContact O-CB 3.28Å; L330-S334 WeakPolarHBondContact O-CB 3.44Å; L330-S334 PolarHBondContact O-N 2.95Å; I331-S334 PolarHBondContact O-N 2.87Å; S334-D336 PolarHBondContact OG-N 2.61Å; S334-F339 WeakPolarHBondContact OG-CD1 3.25Å; S334-R404 PolarHBondContact O-NE 3.12Å
335	T	69.4	Low	66.5	Low	97 Å²	97	57.1 Å²	57.1	60%	0.595	29%	0.291	S	S	*	.			trans	-109.1	-4.6	175.8	52.8	0	0	0	0	112.1	V337 F408	T335-V337 PolarHBondContact O-N 2.82Å; T335-F408 HydrophobicContact CG2-CE2 4.42Å; T335-F408 HydrophobicContact CG2-CZ 3.89Å
336	D	71.4	Confident	66	Low	69 Å²	69	56.1 Å²	56.1	37%	0.369	29%	0.286	S	S	.	.			trans	-88.4	107.4	-179.6	178.7	0.9	0	0	0	110.6	S334 N338 F339 L340	S334-D336 PolarHBondContact OG-N 2.61Å; D336-N338 PolarHBondContact O-N 2.89Å; D336-N338 WeakPolarHBondContact OD1-CB 3.48Å; D336-N338 PolarHBondContact OD1-N 3.34Å; D336-F339 HydrophobicContact CB-CB 3.81Å; D336-F339 WeakPolarHBondContact O-CB 3.38Å; D336-F339 PolarHBondContact O-N 2.97Å; D336-F339 PolarHBondContact OD1-N 3.06Å; D336-L340 WeakPolarHBondContact O-CD1 3.48Å; D336-L340 VanDerWaalsContact O-CG 3.31Å; D336-L340 WeakPolarHBondContact O-CG 3.43Å; D336-L340 PolarHBondContact O-N 3.49Å
337	V	61.2	Low	65.8	Low	26 Å²	26	52.8 Å²	52.8	16%	0.158	27%	0.269	C	S	.	.	H	α-helix	trans	-58.2	-33.5	178.9	-173.4	0	0	0	0	112.4	T335 K341 I405 F408	T335-V337 PolarHBondContact O-N 2.82Å; V337-K341 HydrophobicContact CG1-CD 4.32Å; V337-K341 WeakPolarHBondContact O-CB 3.32Å; V337-K341 WeakPolarHBondContact O-CG 2.83Å; V337-K341 PolarHBondContact O-N 3.48Å; V337-I405 HydrophobicContact CG1-CB 4.46Å; V337-I405 HydrophobicContact CG1-CG1 4.48Å; V337-I405 HydrophobicContact CG1-CG2 3.89Å; V337-F408 HydrophobicContact CG2-CB 3.28Å; V337-F408 HydrophobicContact CG2-CD2 4.41Å; V337-F408 HydrophobicContact CG2-CG 4.17Å
338	N	54.9	Low	64.8	Low	90 Å²	90	52.4 Å²	52.4	48%	0.481	27%	0.269	S	S	.	.	H	α-helix	trans	-76.8	-41.4	-178.9	-63.7	-42.8	0	0	0	111.2	D336 L340 K341 Q342	D336-N338 PolarHBondContact O-N 2.89Å; D336-N338 WeakPolarHBondContact OD1-CB 3.48Å; D336-N338 PolarHBondContact OD1-N 3.34Å; N338-L340 VanDerWaalsContact C-N 3.33Å; N338-L340 PolarHBondContact O-N 2.79Å; N338-K341 PolarHBondContact O-N 2.84Å; N338-Q342 WeakPolarHBondContact O-CB 3.3Å; N338-Q342 PolarHBondContact O-N 2.71Å
339	F	63.9	Low	63.4	Low	72 Å²	72	52.3 Å²	52.3	32%	0.316	27%	0.27	S	S	.	.	H	α-helix	trans	-55.7	-48	169.3	171.7	-97.8	0	0	0	111.4	L330 S334 D336 K341 Q342 L343	L330-F339 HydrophobicContact CD1-CE1 4.5Å; L330-F339 HydrophobicContact CD1-CZ 4.09Å; L330-F339 HydrophobicContact CD2-CZ 3.89Å; L330-F339 HydrophobicContact CG-CE1 4.16Å; L330-F339 HydrophobicContact CG-CZ 3.8Å; S334-F339 WeakPolarHBondContact OG-CD1 3.25Å; D336-F339 HydrophobicContact CB-CB 3.81Å; D336-F339 WeakPolarHBondContact O-CB 3.38Å; D336-F339 PolarHBondContact O-N 2.97Å; D336-F339 PolarHBondContact OD1-N 3.06Å; F339-K341 PolarHBondContact O-N 3.17Å; F339-Q342 PolarHBondContact O-N 3Å; F339-L343 HydrophobicContact CE1-CD2 3.7Å; F339-L343 HydrophobicContact CZ-CD2 3.82Å; F339-L343 VanDerWaalsContact O-CB 3.24Å; F339-L343 WeakPolarHBondContact O-CB 3.47Å; F339-L343 PolarHBondContact O-N 2.76Å
340	L	63.1	Low	62.5	Low	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64	-39.4	178.7	-67.5	162.1	0	0	0	112.3	I331 D336 N338 R344 C401 R404 I405	I331-L340 HydrophobicContact CB-CD2 4.48Å; I331-L340 HydrophobicContact CG2-CD2 3.87Å; I331-L340 WeakPolarHBondContact O-CD2 3.42Å; D336-L340 WeakPolarHBondContact O-CD1 3.48Å; D336-L340 VanDerWaalsContact O-CG 3.31Å; D336-L340 WeakPolarHBondContact O-CG 3.43Å; D336-L340 PolarHBondContact O-N 3.49Å; N338-L340 VanDerWaalsContact C-N 3.33Å; N338-L340 PolarHBondContact O-N 2.79Å; L340-R344 WeakPolarHBondContact O-CB 3.11Å; L340-R344 PolarHBondContact O-N 2.75Å; L340-C401 PolarHBondContact O-SG 3.29Å; L340-R404 HydrophobicContact CD1-CB 3.72Å; L340-R404 HydrophobicContact CD1-CG 3.34Å; L340-R404 HydrophobicContact CD2-CB 4.1Å; L340-R404 HydrophobicContact CD2-CG 4.03Å; L340-R404 HydrophobicContact CG-CB 4.5Å; L340-R404 HydrophobicContact CG-CG 4.33Å; L340-I405 HydrophobicContact CB-CD1 4.06Å; L340-I405 HydrophobicContact CB-CG1 3.52Å
341	K	54.7	Low	61.4	Low	62 Å²	62	46.3 Å²	46.3	27%	0.27	24%	0.242	S	C	.	.	H	α-helix	trans	-62.4	-41.3	174.1	-78.6	169.4	178.7	173.1	0	112.3	V337 N338 F339 R344 Y345 I405	V337-K341 HydrophobicContact CG1-CD 4.32Å; V337-K341 WeakPolarHBondContact O-CB 3.32Å; V337-K341 WeakPolarHBondContact O-CG 2.83Å; V337-K341 PolarHBondContact O-N 3.48Å; N338-K341 PolarHBondContact O-N 2.84Å; F339-K341 PolarHBondContact O-N 3.17Å; K341-R344 WeakPolarHBondContact O-CB 3.32Å; K341-Y345 WeakPolarHBondContact O-CB 3.36Å; K341-Y345 PolarHBondContact O-N 3.23Å; K341-I405 HydrophobicContact CB-CD1 4.26Å; K341-I405 HydrophobicContact CG-CD1 3.71Å; K341-I405 HydrophobicContact CG-CG1 4.09Å; K341-I405 HydrophobicContact CG-CG2 4.22Å
342	Q	53.5	Low	60	Low	46 Å²	46	50.2 Å²	50.2	22%	0.215	26%	0.262	C	S	.	.	H	α-helix	trans	-70.7	-42.5	179.4	-169.2	119.4	1.1	0	0	111.4	N338 F339 Y345 Q346	N338-Q342 WeakPolarHBondContact O-CB 3.3Å; N338-Q342 PolarHBondContact O-N 2.71Å; F339-Q342 PolarHBondContact O-N 3Å; Q342-Y345 WeakPolarHBondContact O-CB 3.34Å; Q342-Y345 PolarHBondContact O-N 3.26Å; Q342-Y345 VanDerWaalsContact O-N 3.16Å; Q342-Q346 PolarHBondContact O-N 3.05Å
343	L	63.3	Low	58.7	Low	12 Å²	12	53.3 Å²	53.3	6%	0.063	27%	0.271	C	S	.	.	H	α-helix	trans	-62.4	-45.9	175.2	-171.3	54.2	0	0	0	110.7	F327 I331 F339 Y345 Q346 I347	F327-L343 HydrophobicContact CE2-CD1 3.58Å; F327-L343 HydrophobicContact CZ-CD1 3.55Å; F327-L343 HydrophobicContact CZ-CG 4.24Å; I331-L343 HydrophobicContact CD1-CD2 4.08Å; I331-L343 HydrophobicContact CG1-CD2 3.35Å; I331-L343 HydrophobicContact CG1-CG 4.24Å; F339-L343 HydrophobicContact CE1-CD2 3.7Å; F339-L343 HydrophobicContact CZ-CD2 3.82Å; F339-L343 VanDerWaalsContact O-CB 3.24Å; F339-L343 WeakPolarHBondContact O-CB 3.47Å; F339-L343 PolarHBondContact O-N 2.76Å; L343-Y345 VanDerWaalsContact C-N 3.27Å; L343-Y345 PolarHBondContact O-N 3.33Å; L343-Q346 PolarHBondContact O-N 2.85Å; L343-I347 HydrophobicContact CD1-CD1 4.38Å; L343-I347 HydrophobicContact CG-CD1 4Å; L343-I347 WeakPolarHBondContact O-CB 3.41Å; L343-I347 VanDerWaalsContact O-CD1 3.31Å; L343-I347 WeakPolarHBondContact O-CD1 3.18Å; L343-I347 WeakPolarHBondContact O-CG1 3.5Å; L343-I347 PolarHBondContact O-N 3.16Å
344	R	69.4	Low	57.8	Low	44 Å²	44	49.2 Å²	49.2	17%	0.166	25%	0.246	C	C	.	.	H	α-helix	trans	-53.9	-43.1	171	-172.5	-160	81.4	103.4	-3.4	112.2	L340 K341 I347 V348 K398 C401 E402 I405	L340-R344 WeakPolarHBondContact O-CB 3.11Å; L340-R344 PolarHBondContact O-N 2.75Å; K341-R344 WeakPolarHBondContact O-CB 3.32Å; R344-I347 PolarHBondContact O-N 3.25Å; R344-V348 WeakPolarHBondContact O-CB 3.4Å; R344-V348 WeakPolarHBondContact O-CG2 3.5Å; R344-V348 PolarHBondContact O-N 3.04Å; R344-K398 HydrophobicContact CG-CG 3.81Å; R344-C401 HydrophobicContact CB-CB 3.86Å; R344-C401 HydrophobicContact CG-CB 4.31Å; R344-E402 WeakPolarHBondContact CD-OE1 3.37Å; R344-E402 HydrophobicContact CG-CG 3.87Å; R344-E402 IonicContact CZ-OE1 3.66Å; R344-E402 IonicContact NE-OE1 3.66Å; R344-E402 IonicContact NH1-OE1 2.85Å; R344-E402 PolarHBondContact NH1-OE1 2.91Å; R344-I405 HydrophobicContact CB-CD1 4.41Å
345	Y	51.5	Low	56.8	Low	61 Å²	61	50.8 Å²	50.8	24%	0.239	26%	0.255	C	S	.	.	H	α-helix	trans	-70.2	-42.4	-177.8	-178.5	-132	0	0	0	112.8	W63 K341 Q342 L343 I347 V348 V349	W63-Y345 HydrophobicContact CB-CE1 4.4Å; W63-Y345 AromaticContact CD1-CZ 3.92Å; W63-Y345 HydrophobicContact CD2-CD1 4.16Å; W63-Y345 AromaticContact CD2-CE1 3.13Å; W63-Y345 HydrophobicContact CD2-CE1 3.13Å; W63-Y345 HydrophobicContact CD2-CE2 4.35Å; W63-Y345 AromaticContact CD2-CZ 3.26Å; W63-Y345 AromaticContact CE2-CE1 3.35Å; W63-Y345 AromaticContact CE2-CE2 3.72Å; W63-Y345 AromaticContact CE2-CZ 3Å; W63-Y345 AromaticContact CE3-CD1 3.66Å; W63-Y345 HydrophobicContact CE3-CD1 3.66Å; W63-Y345 AromaticContact CE3-CE1 2.99Å; W63-Y345 HydrophobicContact CE3-CE1 2.99Å; W63-Y345 AromaticContact CE3-CZ 3.67Å; W63-Y345 AromaticContact CG-CE1 3.82Å; W63-Y345 HydrophobicContact CG-CE1 3.82Å; W63-Y345 AromaticContact CG-CZ 3.7Å; W63-Y345 AromaticContact CH2-CD1 3.13Å; W63-Y345 HydrophobicContact CH2-CD1 3.13Å; W63-Y345 AromaticContact CH2-CD2 3.83Å; W63-Y345 HydrophobicContact CH2-CD2 3.83Å; W63-Y345 AromaticContact CH2-CE1 3.08Å; W63-Y345 HydrophobicContact CH2-CE1 3.08Å; W63-Y345 AromaticContact CH2-CE2 3.74Å; W63-Y345 HydrophobicContact CH2-CE2 3.74Å; W63-Y345 AromaticContact CH2-CG 3.56Å; W63-Y345 HydrophobicContact CH2-CG 3.56Å; W63-Y345 AromaticContact CH2-CZ 3.4Å; W63-Y345 VanDerWaalsContact CH2-CZ 3.4Å; W63-Y345 AromaticContact CZ2-CD1 3.7Å; W63-Y345 HydrophobicContact CZ2-CD1 3.7Å; W63-Y345 AromaticContact CZ2-CD2 3.78Å; W63-Y345 HydrophobicContact CZ2-CD2 3.78Å; W63-Y345 AromaticContact CZ2-CE1 3.22Å; W63-Y345 HydrophobicContact CZ2-CE1 3.22Å; W63-Y345 AromaticContact CZ2-CE2 3.25Å; W63-Y345 HydrophobicContact CZ2-CE2 3.25Å; W63-Y345 AromaticContact CZ2-CG 3.99Å; W63-Y345 HydrophobicContact CZ2-CG 3.99Å; W63-Y345 AromaticContact CZ2-CZ 2.96Å; W63-Y345 WeakPolarHBondContact CZ2-OH 3.27Å; W63-Y345 AromaticContact CZ3-CD1 3.15Å; W63-Y345 HydrophobicContact CZ3-CD1 3.15Å; W63-Y345 AromaticContact CZ3-CE1 3.01Å; W63-Y345 HydrophobicContact CZ3-CE1 3.01Å; W63-Y345 HydrophobicContact CZ3-CG 4.05Å; W63-Y345 AromaticContact CZ3-CZ 3.77Å; W63-Y345 AromaticContact NE1-CZ 3.56Å; W63-Y345 PolarHBondContact NE1-OH 2.87Å; K341-Y345 WeakPolarHBondContact O-CB 3.36Å; K341-Y345 PolarHBondContact O-N 3.23Å; Q342-Y345 WeakPolarHBondContact O-CB 3.34Å; Q342-Y345 PolarHBondContact O-N 3.26Å; Q342-Y345 VanDerWaalsContact O-N 3.16Å; L343-Y345 VanDerWaalsContact C-N 3.27Å; L343-Y345 PolarHBondContact O-N 3.33Å; Y345-I347 VanDerWaalsContact C-N 3.35Å; Y345-V348 CarbonylContact O-C 3.6Å; Y345-V348 WeakPolarHBondContact O-CA 3.5Å; Y345-V348 WeakPolarHBondContact O-CB 3.3Å; Y345-V348 PolarHBondContact O-N 3.31Å; Y345-V348 VanDerWaalsContact O-N 3.14Å; Y345-V349 PolarHBondContact O-N 2.93Å
346	Q	52.7	Low	55.7	Low	91 Å²	91	49.3 Å²	49.3	43%	0.425	25%	0.247	S	C	.	.	H	α-helix	trans	-61.1	-45.6	172.1	-75.1	179.8	-16.8	0	0	111.2	Q342 L343 V348 V349 E350	Q342-Q346 PolarHBondContact O-N 3.05Å; L343-Q346 PolarHBondContact O-N 2.85Å; Q346-V348 VanDerWaalsContact C-N 3.27Å; Q346-V348 PolarHBondContact O-N 2.87Å; Q346-V349 PolarHBondContact O-N 3.25Å; Q346-V349 VanDerWaalsContact O-N 3.17Å; Q346-E350 PolarHBondContact O-N 2.91Å
347	I	58.5	Low	54.7	Low	2 Å²	2	51.4 Å²	51.4	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-57.1	-42.5	172.8	-68.9	165	0	0	0	110.5	F327 I331 L343 R344 Y345 I351 L394 A397 K398	F327-I347 HydrophobicContact CE1-CD1 3.79Å; F327-I347 HydrophobicContact CE1-CG1 4.04Å; F327-I347 HydrophobicContact CZ-CD1 3.82Å; F327-I347 HydrophobicContact CZ-CG1 3.85Å; I331-I347 HydrophobicContact CD1-CD1 4.16Å; L343-I347 HydrophobicContact CD1-CD1 4.38Å; L343-I347 HydrophobicContact CG-CD1 4Å; L343-I347 WeakPolarHBondContact O-CB 3.41Å; L343-I347 VanDerWaalsContact O-CD1 3.31Å; L343-I347 WeakPolarHBondContact O-CD1 3.18Å; L343-I347 WeakPolarHBondContact O-CG1 3.5Å; L343-I347 PolarHBondContact O-N 3.16Å; R344-I347 PolarHBondContact O-N 3.25Å; Y345-I347 VanDerWaalsContact C-N 3.35Å; I347-I351 HydrophobicContact CG2-CD1 4Å; I347-I351 WeakPolarHBondContact O-CB 3.47Å; I347-I351 WeakPolarHBondContact O-CD1 3.47Å; I347-I351 WeakPolarHBondContact O-CG1 3.27Å; I347-I351 PolarHBondContact O-N 2.81Å; I347-L394 HydrophobicContact CB-CD2 4.48Å; I347-L394 HydrophobicContact CG1-CD2 4.31Å; I347-L394 HydrophobicContact CG2-CB 3.77Å; I347-L394 HydrophobicContact CG2-CD2 4.08Å; I347-L394 WeakPolarHBondContact CG2-O 3.5Å; I347-A397 HydrophobicContact CD1-CB 3.71Å; I347-A397 HydrophobicContact CG1-CB 4.48Å; I347-A397 HydrophobicContact CG2-CB 4.47Å; I347-K398 HydrophobicContact CG2-CB 3.71Å
348	V	48.3	Very low	54.2	Low	27 Å²	27	52.8 Å²	52.8	16%	0.164	27%	0.267	C	S	.	.	H	α-helix	trans	-65.7	-40	176.5	166.3	0	0	0	0	112.3	R344 Y345 Q346 I351 I352 K398	R344-V348 WeakPolarHBondContact O-CB 3.4Å; R344-V348 WeakPolarHBondContact O-CG2 3.5Å; R344-V348 PolarHBondContact O-N 3.04Å; Y345-V348 CarbonylContact O-C 3.6Å; Y345-V348 WeakPolarHBondContact O-CA 3.5Å; Y345-V348 WeakPolarHBondContact O-CB 3.3Å; Y345-V348 PolarHBondContact O-N 3.31Å; Y345-V348 VanDerWaalsContact O-N 3.14Å; Q346-V348 VanDerWaalsContact C-N 3.27Å; Q346-V348 PolarHBondContact O-N 2.87Å; V348-I351 CarbonylContact O-C 3.6Å; V348-I351 WeakPolarHBondContact O-CB 3.48Å; V348-I351 PolarHBondContact O-N 2.81Å; V348-I352 HydrophobicContact CG1-CD1 3.8Å; V348-I352 HydrophobicContact CG1-CG1 4.44Å; V348-I352 VanDerWaalsContact O-CG1 3.23Å; V348-I352 WeakPolarHBondContact O-CG1 3.29Å; V348-I352 PolarHBondContact O-N 2.77Å; V348-K398 HydrophobicContact CG2-CD 3.5Å; V348-K398 VanDerWaalsContact CG2-CE 3.48Å; V348-K398 HydrophobicContact CG2-CG 3.87Å
349	V	47.2	Very low	53.7	Low	30 Å²	30	52.5 Å²	52.5	18%	0.182	27%	0.272	C	S	.	.	H	α-helix	trans	-76	-32.9	177.3	128.3	0	0	0	0	113.2	W63 Y345 Q346 I351 I352 H353	W63-V349 HydrophobicContact CH2-CB 3.47Å; W63-V349 VanDerWaalsContact CH2-CB 3.47Å; W63-V349 HydrophobicContact CH2-CG1 3.87Å; W63-V349 HydrophobicContact CH2-CG2 3.79Å; W63-V349 HydrophobicContact CZ2-CB 3.28Å; W63-V349 HydrophobicContact CZ2-CG1 3.9Å; W63-V349 HydrophobicContact CZ2-CG2 3.02Å; Y345-V349 PolarHBondContact O-N 2.93Å; Q346-V349 PolarHBondContact O-N 3.25Å; Q346-V349 VanDerWaalsContact O-N 3.17Å; V349-I351 VanDerWaalsContact C-N 3.29Å; V349-I352 HydrophobicContact CG2-CD1 4.33Å; V349-I352 CarbonylContact O-C 3.5Å; V349-I352 PolarHBondContact O-N 2.92Å; V349-H353 VanDerWaalsContact O-CB 3.31Å; V349-H353 WeakPolarHBondContact O-CB 3.34Å; V349-H353 PolarHBondContact O-N 2.94Å
350	E	55.4	Low	52.6	Low	60 Å²	60	53.8 Å²	53.8	28%	0.28	28%	0.282	S	S	.	.	H	α-helix	trans	-63	-40.1	167.3	-77.6	-159.2	149	0	0	110.5	Q346 I352 H353 A354 Y390 L394	Q346-E350 PolarHBondContact O-N 2.91Å; E350-I352 VanDerWaalsContact C-N 3.35Å; E350-I352 PolarHBondContact O-N 3.11Å; E350-H353 PolarHBondContact O-N 3.34Å; E350-A354 WeakPolarHBondContact O-CA 3.42Å; E350-A354 WeakPolarHBondContact O-CB 3.19Å; E350-A354 PolarHBondContact O-N 3.42Å; E350-Y390 PolarHBondContact OE1-OH 3.42Å; E350-Y390 PolarHBondContact OE2-OH 2.88Å; E350-L394 HydrophobicContact CB-CD1 3.5Å; E350-L394 VanDerWaalsContact CB-CD1 3.5Å; E350-L394 HydrophobicContact CB-CD2 4.43Å; E350-L394 VanDerWaalsContact OE2-CD2 3.31Å; E350-L394 WeakPolarHBondContact OE2-CD2 3.32Å
351	I	52.2	Low	51.6	Low	25 Å²	25	58.4 Å²	58.4	13%	0.128	31%	0.312	C	S	.	.	H	α-helix	trans	-58.3	-48	170.4	-71.4	160.9	0	0	0	110	I347 V348 V349 T355 I391 L394 K398	I347-I351 HydrophobicContact CG2-CD1 4Å; I347-I351 WeakPolarHBondContact O-CB 3.47Å; I347-I351 WeakPolarHBondContact O-CD1 3.47Å; I347-I351 WeakPolarHBondContact O-CG1 3.27Å; I347-I351 PolarHBondContact O-N 2.81Å; V348-I351 CarbonylContact O-C 3.6Å; V348-I351 WeakPolarHBondContact O-CB 3.48Å; V348-I351 PolarHBondContact O-N 2.81Å; V349-I351 VanDerWaalsContact C-N 3.29Å; I351-T355 HydrophobicContact CG2-CG2 4.36Å; I351-T355 VanDerWaalsContact O-CB 3.26Å; I351-T355 WeakPolarHBondContact O-CB 3.47Å; I351-T355 WeakPolarHBondContact O-CG2 3.5Å; I351-T355 PolarHBondContact O-N 2.85Å; I351-T355 PolarHBondContact O-OG1 2.98Å; I351-I391 HydrophobicContact CG2-CG2 4.19Å; I351-L394 HydrophobicContact CD1-CB 3.89Å; I351-L394 HydrophobicContact CG1-CB 3.48Å; I351-L394 VanDerWaalsContact CG1-CB 3.48Å; I351-L394 HydrophobicContact CG1-CD1 4.18Å; I351-K398 HydrophobicContact CD1-CB 4.49Å; I351-K398 HydrophobicContact CD1-CD 4.34Å
352	I	45.6	Very low	51.1	Low	82 Å²	82	63.8 Å²	63.8	42%	0.421	34%	0.338	S	S	.	.	H	α-helix	trans	-64.5	-43.2	-179.6	-69	163.3	0	0	0	111.1	V348 V349 E350 T355 T356	V348-I352 HydrophobicContact CG1-CD1 3.8Å; V348-I352 HydrophobicContact CG1-CG1 4.44Å; V348-I352 VanDerWaalsContact O-CG1 3.23Å; V348-I352 WeakPolarHBondContact O-CG1 3.29Å; V348-I352 PolarHBondContact O-N 2.77Å; V349-I352 HydrophobicContact CG2-CD1 4.33Å; V349-I352 CarbonylContact O-C 3.5Å; V349-I352 PolarHBondContact O-N 2.92Å; E350-I352 VanDerWaalsContact C-N 3.35Å; E350-I352 PolarHBondContact O-N 3.11Å; I352-T355 VanDerWaalsContact CA-OG1 3.28Å; I352-T355 WeakPolarHBondContact CA-OG1 3.43Å; I352-T355 PolarHBondContact O-OG1 3.29Å; I352-T355 VanDerWaalsContact O-OG1 3.14Å; I352-T356 WeakPolarHBondContact O-CA 3.36Å; I352-T356 WeakPolarHBondContact O-CB 3.42Å; I352-T356 PolarHBondContact O-N 3.33Å; I352-T356 PolarHBondContact O-OG1 2.86Å
353	H	48.2	Very low	50.7	Low	114 Å²	114	67 Å²	67	53%	0.528	36%	0.356	S	S	.	.	H	α-helix	trans	-67.7	-47.6	178	-82	-156.5	0	0	0	110.7	V349 E350 T355 T356 I357	V349-H353 VanDerWaalsContact O-CB 3.31Å; V349-H353 WeakPolarHBondContact O-CB 3.34Å; V349-H353 PolarHBondContact O-N 2.94Å; E350-H353 PolarHBondContact O-N 3.34Å; H353-T355 VanDerWaalsContact C-N 3.34Å; H353-T355 PolarHBondContact O-N 3.28Å; H353-T356 PolarHBondContact O-N 3.26Å; H353-I357 VanDerWaalsContact O-CB 3.29Å; H353-I357 WeakPolarHBondContact O-CB 3.45Å; H353-I357 WeakPolarHBondContact O-CD1 3.12Å; H353-I357 WeakPolarHBondContact O-CG1 3.47Å; H353-I357 PolarHBondContact O-N 3.45Å
354	A	55.8	Low	49.6	Very low	4 Å²	4	75 Å²	75	3%	0.033	39%	0.391	C	S	.	.	H	α-helix	trans	-60.8	-42.4	175.7	0	0	0	0	0	111.6	E350 S358 M387 Y390 I391	E350-A354 WeakPolarHBondContact O-CA 3.42Å; E350-A354 WeakPolarHBondContact O-CB 3.19Å; E350-A354 PolarHBondContact O-N 3.42Å; A354-S358 VanDerWaalsContact O-CB 3.29Å; A354-S358 WeakPolarHBondContact O-CB 3.48Å; A354-S358 PolarHBondContact O-N 2.85Å; A354-M387 HydrophobicContact CB-CG 4.28Å; A354-M387 HydrophobicContact CB-SD 3.44Å; A354-M387 WeakPolarHBondContact CB-SD 3.28Å; A354-M387 WeakPolarHBondContact O-CG 3.12Å; A354-Y390 HydrophobicContact CB-CD1 4.06Å; A354-Y390 HydrophobicContact CB-CE1 4.24Å; A354-I391 HydrophobicContact CB-CD1 3.99Å; A354-I391 HydrophobicContact CB-CG1 3.49Å; A354-I391 VanDerWaalsContact CB-CG1 3.49Å
355	T	52.5	Low	48.3	Very low	52 Å²	52	81.8 Å²	81.8	32%	0.319	42%	0.421	S	S	.	.	H	α-helix	trans	-70.6	-38.7	175	44.5	0	0	0	0	112.2	I351 I352 H353 S358 S359 I391	I351-T355 HydrophobicContact CG2-CG2 4.36Å; I351-T355 VanDerWaalsContact O-CB 3.26Å; I351-T355 WeakPolarHBondContact O-CB 3.47Å; I351-T355 WeakPolarHBondContact O-CG2 3.5Å; I351-T355 PolarHBondContact O-N 2.85Å; I351-T355 PolarHBondContact O-OG1 2.98Å; I352-T355 VanDerWaalsContact CA-OG1 3.28Å; I352-T355 WeakPolarHBondContact CA-OG1 3.43Å; I352-T355 PolarHBondContact O-OG1 3.29Å; I352-T355 VanDerWaalsContact O-OG1 3.14Å; H353-T355 VanDerWaalsContact C-N 3.34Å; H353-T355 PolarHBondContact O-N 3.28Å; T355-S358 WeakPolarHBondContact CA-OG 3.37Å; T355-S358 CarbonylContact O-C 3.47Å; T355-S358 PolarHBondContact O-N 2.97Å; T355-S358 PolarHBondContact O-OG 3.46Å; T355-S359 WeakPolarHBondContact O-CB 3.5Å; T355-S359 PolarHBondContact O-N 3.46Å; T355-S359 PolarHBondContact O-OG 3.3Å; T355-S359 VanDerWaalsContact O-OG 3.1Å; T355-I391 HydrophobicContact CG2-CD1 3.58Å; T355-I391 HydrophobicContact CG2-CG1 4.12Å; T355-I391 HydrophobicContact CG2-CG2 4.04Å
356	T	46.2	Very low	48	Very low	67 Å²	67	86.2 Å²	86.2	41%	0.411	44%	0.444	S	S	.	.	H	α-helix	trans	-64	-45.6	176.7	-60	0	0	0	0	110.6	I352 H353 S358 S359 L360	I352-T356 WeakPolarHBondContact O-CA 3.36Å; I352-T356 WeakPolarHBondContact O-CB 3.42Å; I352-T356 PolarHBondContact O-N 3.33Å; I352-T356 PolarHBondContact O-OG1 2.86Å; H353-T356 PolarHBondContact O-N 3.26Å; T356-S358 VanDerWaalsContact C-N 3.31Å; T356-S358 PolarHBondContact O-N 3.47Å; T356-S359 WeakPolarHBondContact CA-OG 3.4Å; T356-S359 CarbonylContact O-C 3.54Å; T356-S359 PolarHBondContact O-N 3.43Å; T356-S359 VanDerWaalsContact O-N 3.11Å; T356-S359 PolarHBondContact O-OG 3.29Å; T356-L360 PolarHBondContact O-N 2.82Å
357	I	50	Low	47.5	Very low	113 Å²	113	91.3 Å²	91.3	58%	0.579	47%	0.465	S	S	*	.	H	α-helix	trans	-62.7	-38.4	173.5	-67.2	165.1	0	0	0	110.6	H353 S359 M387	H353-I357 VanDerWaalsContact O-CB 3.29Å; H353-I357 WeakPolarHBondContact O-CB 3.45Å; H353-I357 WeakPolarHBondContact O-CD1 3.12Å; H353-I357 WeakPolarHBondContact O-CG1 3.47Å; H353-I357 PolarHBondContact O-N 3.45Å; I357-S359 VanDerWaalsContact C-N 3.31Å; I357-S359 PolarHBondContact O-N 3.36Å; I357-M387 HydrophobicContact CG2-CE 4.15Å
358	S	51.2	Low	46.6	Very low	54 Å²	54	100.2 Å²	100.2	38%	0.378	51%	0.506	S	S	.	.	H	α-helix	trans	-70.5	-24.1	174.4	83.1	0	0	0	0	114	A354 T355 T356	A354-S358 VanDerWaalsContact O-CB 3.29Å; A354-S358 WeakPolarHBondContact O-CB 3.48Å; A354-S358 PolarHBondContact O-N 2.85Å; T355-S358 WeakPolarHBondContact CA-OG 3.37Å; T355-S358 CarbonylContact O-C 3.47Å; T355-S358 PolarHBondContact O-N 2.97Å; T355-S358 PolarHBondContact O-OG 3.46Å; T356-S358 VanDerWaalsContact C-N 3.31Å; T356-S358 PolarHBondContact O-N 3.47Å
359	S	43.7	Very low	46.3	Very low	84 Å²	84	110 Å²	110	59%	0.587	54%	0.54	S	S	*	.	H	α-helix	trans	-98.4	-7.4	-175.4	72	0	0	0	0	114.4	T355 T356 I357	T355-S359 WeakPolarHBondContact O-CB 3.5Å; T355-S359 PolarHBondContact O-N 3.46Å; T355-S359 PolarHBondContact O-OG 3.3Å; T355-S359 VanDerWaalsContact O-OG 3.1Å; T356-S359 WeakPolarHBondContact CA-OG 3.4Å; T356-S359 CarbonylContact O-C 3.54Å; T356-S359 PolarHBondContact O-N 3.43Å; T356-S359 VanDerWaalsContact O-N 3.11Å; T356-S359 PolarHBondContact O-OG 3.29Å; I357-S359 VanDerWaalsContact C-N 3.31Å; I357-S359 PolarHBondContact O-N 3.36Å
360	L	41.6	Very low	46.2	Very low	99 Å²	99	119 Å²	119	52%	0.518	58%	0.577	S	S	.	*	S	Bend	trans	-58.3	131.2	178.6	-133.8	76.1	0	0	0	110.2	T356 Q362	T356-L360 PolarHBondContact O-N 2.82Å; L360-Q362 PolarHBondContact O-N 3.43Å
361	P	42.5	Very low	45.6	Very low	97 Å²	97	119.3 Å²	119.3	63%	0.63	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	40.2	-166.3	30.7	-35.6	0	0	0	114.8
362	Q	44.6	Very low	45.3	Very low	175 Å²	175	128 Å²	128	82%	0.818	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-18	160.4	-71.1	-170.2	-12.1	0	0	111.9	L360	L360-Q362 PolarHBondContact O-N 3.43Å
363	L	44.3	Very low	45.3	Very low	115 Å²	115	131.5 Å²	131.5	60%	0.602	65%	0.648	S	S	*	*	S	Bend	trans	-86.8	-19.8	177.6	-88.5	135.3	0	0	0	115.1
364	K	40.5	Very low	45.3	Very low	180 Å²	180	129.5 Å²	129.5	78%	0.783	65%	0.647	S	S	*	*	S	Bend	trans	-89.3	-17.3	-175.1	-92.2	-176.8	177.3	177.7	0	115.4	Q366	K364-Q366 PolarHBondContact O-N 3.17Å
365	K	42.6	Very low	44.8	Very low	185 Å²	185	133.3 Å²	133.3	80%	0.804	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	0.7	179.5	-101.8	-175.5	179	-179.9	0	115.7
366	Q	45.2	Very low	44.3	Very low	155 Å²	155	133.5 Å²	133.5	72%	0.724	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.6	10.1	-179.4	-82.7	-173.7	-2.9	0	0	114.8	K364 E368	K364-Q366 PolarHBondContact O-N 3.17Å; Q366-E368 PolarHBondContact O-N 3.15Å
367	K	40.8	Very low	44.1	Very low	198 Å²	198	134.6 Å²	134.6	86%	0.861	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-2.7	179.4	-146.6	175.4	-179.7	-178	0	114.4
368	E	41	Very low	43.9	Very low	188 Å²	188	132.6 Å²	132.6	88%	0.879	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.4	-0.9	-177.1	-71.1	-168.3	159.9	0	0	116.5	Q366 K370	Q366-E368 PolarHBondContact O-N 3.15Å; E368-K370 PolarHBondContact O-N 3.27Å
369	R	40.4	Very low	43.6	Very low	232 Å²	232	132 Å²	132	88%	0.875	67%	0.672	S	S	*	*			trans	-100.2	89.7	172.9	-71.4	-170.3	-179.9	-167.2	0.3	110.9	G371	R369-G371 PolarHBondContact O-N 3.33Å; R369-G371 VanDerWaalsContact O-N 3.14Å
370	K	45.9	Very low	43.7	Very low	220 Å²	220	131.2 Å²	131.2	96%	0.957	66%	0.661	S	S	*	*			trans	-58.3	108.4	165	-85.8	179.5	173	175.8	0	109.6	E368	E368-K370 PolarHBondContact O-N 3.27Å
371	G	42.8	Very low	43.9	Very low	67 Å²	67	131.1 Å²	131.1	69%	0.691	66%	0.661	S	S	*	*	S	Bend	trans	160.4	116.7	166.4	0	0	0	0	0	114.6	R369	R369-G371 PolarHBondContact O-N 3.33Å; R369-G371 VanDerWaalsContact O-N 3.14Å
372	K	46.3	Very low	43.8	Very low	208 Å²	208	130.6 Å²	130.6	90%	0.904	65%	0.652	S	S	*	*			trans	43.7	108.3	168	-70.9	-178.9	178.4	177	0	117.4	S374	K372-S374 PolarHBondContact O-N 3.36Å; K372-S374 VanDerWaalsContact O-N 3.17Å
373	E	45.9	Very low	44.3	Very low	154 Å²	154	129.6 Å²	129.6	72%	0.72	64%	0.641	S	S	*	*			trans	-53.4	112.6	172.9	-64.6	174.4	172.9	0	0	111.9	M377	E373-M377 HydrophobicContact CB-SD 4.48Å; E373-M377 HydrophobicContact CG-SD 4.25Å
374	S	48.6	Very low	44.5	Very low	73 Å²	73	126 Å²	126	51%	0.51	63%	0.628	S	S	.	*			trans	-80.2	151.3	177.4	167.9	0	0	0	0	111.4	K372 A376 M377 K378	K372-S374 PolarHBondContact O-N 3.36Å; K372-S374 VanDerWaalsContact O-N 3.17Å; S374-A376 PolarHBondContact O-N 3.36Å; S374-A376 VanDerWaalsContact O-N 3.11Å; S374-A376 PolarHBondContact OG-N 2.97Å; S374-M377 WeakPolarHBondContact O-CA 3.11Å; S374-M377 VanDerWaalsContact O-CB 3.26Å; S374-M377 WeakPolarHBondContact O-CB 3.4Å; S374-M377 PolarHBondContact O-N 3.43Å; S374-K378 PolarHBondContact O-N 3.37Å
375	A	44.5	Very low	45.2	Very low	84 Å²	84	124.5 Å²	124.5	69%	0.694	62%	0.617	S	S	*	*	H	α-helix	trans	-54.5	-27.9	172.2	0	0	0	0	0	113.1	M377 K378 A379	A375-M377 VanDerWaalsContact C-N 3.35Å; A375-K378 PolarHBondContact O-N 3.08Å; A375-A379 PolarHBondContact O-N 3.03Å
376	A	40.8	Very low	45.8	Very low	56 Å²	56	119.6 Å²	119.6	46%	0.463	60%	0.6	S	S	.	*	H	α-helix	trans	-63.9	-38.9	172.1	0	0	0	0	0	112.1	S374 K378 A379 D380	S374-A376 PolarHBondContact O-N 3.36Å; S374-A376 VanDerWaalsContact O-N 3.11Å; S374-A376 PolarHBondContact OG-N 2.97Å; A376-K378 PolarHBondContact O-N 3.02Å; A376-A379 PolarHBondContact O-N 3.14Å; A376-D380 WeakPolarHBondContact O-CB 3.43Å; A376-D380 PolarHBondContact O-N 3.01Å
377	M	43.8	Very low	46.5	Very low	90 Å²	90	114.6 Å²	114.6	44%	0.443	58%	0.577	S	S	.	*	H	α-helix	trans	-67.3	-36.8	178	-170.1	176.6	168.7	0	0	111.7	E373 S374 A375 L381	E373-M377 HydrophobicContact CB-SD 4.48Å; E373-M377 HydrophobicContact CG-SD 4.25Å; S374-M377 WeakPolarHBondContact O-CA 3.11Å; S374-M377 VanDerWaalsContact O-CB 3.26Å; S374-M377 WeakPolarHBondContact O-CB 3.4Å; S374-M377 PolarHBondContact O-N 3.43Å; A375-M377 VanDerWaalsContact C-N 3.35Å; M377-L381 HydrophobicContact CG-CD1 4.43Å; M377-L381 WeakPolarHBondContact O-CB 3.16Å; M377-L381 WeakPolarHBondContact O-CG 3.47Å; M377-L381 PolarHBondContact O-N 3.42Å
378	K	45.7	Very low	47.4	Very low	70 Å²	70	112 Å²	112	30%	0.304	57%	0.566	S	S	.	*	H	α-helix	trans	-69.3	-41	172.8	-79.8	-173.1	173.5	-173.3	0	112.9	S374 A375 A376 D380 L381 L382 E499	S374-K378 PolarHBondContact O-N 3.37Å; A375-K378 PolarHBondContact O-N 3.08Å; A376-K378 PolarHBondContact O-N 3.02Å; K378-D380 VanDerWaalsContact C-N 3.31Å; K378-D380 PolarHBondContact O-N 3.02Å; K378-L381 PolarHBondContact O-N 2.87Å; K378-L382 WeakPolarHBondContact O-CB 3.43Å; K378-L382 VanDerWaalsContact O-CG 3.32Å; K378-L382 WeakPolarHBondContact O-CG 3.48Å; K378-L382 PolarHBondContact O-N 2.88Å; K378-E499 IonicContact NZ-OE1 3.79Å
379	A	43.8	Very low	48.4	Very low	41 Å²	41	107.3 Å²	107.3	34%	0.339	54%	0.54	S	S	.	.	H	α-helix	trans	-65.3	-35.4	175.7	0	0	0	0	0	112.3	A375 A376 R383	A375-A379 PolarHBondContact O-N 3.03Å; A376-A379 PolarHBondContact O-N 3.14Å; A379-R383 WeakPolarHBondContact O-CB 3.25Å; A379-R383 PolarHBondContact O-N 3.02Å
380	D	45.2	Very low	49.5	Very low	69 Å²	69	100.2 Å²	100.2	37%	0.369	51%	0.514	S	S	.	.	H	α-helix	trans	-73.8	-36.8	175.7	-69	-22	0	0	0	112	A376 K378 R383 A384	A376-D380 WeakPolarHBondContact O-CB 3.43Å; A376-D380 PolarHBondContact O-N 3.01Å; K378-D380 VanDerWaalsContact C-N 3.31Å; K378-D380 PolarHBondContact O-N 3.02Å; D380-R383 IonicContact OD1-CZ 3.4Å; D380-R383 IonicContact OD1-NH1 3.7Å; D380-R383 PolarHBondContact OD1-NH1 2.81Å; D380-R383 IonicContact OD1-NH2 2.64Å; D380-R383 PolarHBondContact OD1-NH2 3.32Å; D380-A384 VanDerWaalsContact O-CB 3.26Å; D380-A384 WeakPolarHBondContact O-CB 3.44Å; D380-A384 PolarHBondContact O-N 3.45Å
381	L	45.8	Very low	50.3	Low	97 Å²	97	90.8 Å²	90.8	51%	0.508	47%	0.474	S	S	.	.	H	α-helix	trans	-66.5	-37.9	171.8	-75.6	170.2	0	0	0	112.4	M377 K378 A384 R385	M377-L381 HydrophobicContact CG-CD1 4.43Å; M377-L381 WeakPolarHBondContact O-CB 3.16Å; M377-L381 WeakPolarHBondContact O-CG 3.47Å; M377-L381 PolarHBondContact O-N 3.42Å; K378-L381 PolarHBondContact O-N 2.87Å; L381-A384 PolarHBondContact O-N 3Å; L381-R385 VanDerWaalsContact O-CB 3.32Å; L381-R385 WeakPolarHBondContact O-CB 3.42Å; L381-R385 PolarHBondContact O-N 3.34Å
382	L	42.1	Very low	51.4	Low	85 Å²	85	92.2 Å²	92.2	45%	0.445	47%	0.465	S	S	.	.	H	α-helix	trans	-67.2	-46.5	174.3	-75	168	0	0	0	111.3	K378 A384 R385 D386	K378-L382 WeakPolarHBondContact O-CB 3.43Å; K378-L382 VanDerWaalsContact O-CG 3.32Å; K378-L382 WeakPolarHBondContact O-CG 3.48Å; K378-L382 PolarHBondContact O-N 2.88Å; L382-A384 VanDerWaalsContact C-N 3.28Å; L382-A384 PolarHBondContact O-N 3Å; L382-R385 WeakPolarHBondContact O-CB 3.4Å; L382-R385 PolarHBondContact O-N 3.36Å; L382-R385 VanDerWaalsContact O-N 3.07Å; L382-D386 VanDerWaalsContact O-CG 3.27Å; L382-D386 PolarHBondContact O-N 3.31Å
383	R	53.5	Low	52.6	Low	154 Å²	154	85.7 Å²	85.7	58%	0.581	44%	0.438	S	S	*	.	H	α-helix	trans	-58	-40	171.8	-101.7	-177	-83.6	116.6	7.1	112.1	A379 D380 M387	A379-R383 WeakPolarHBondContact O-CB 3.25Å; A379-R383 PolarHBondContact O-N 3.02Å; D380-R383 IonicContact OD1-CZ 3.4Å; D380-R383 IonicContact OD1-NH1 3.7Å; D380-R383 PolarHBondContact OD1-NH1 2.81Å; D380-R383 IonicContact OD1-NH2 2.64Å; D380-R383 PolarHBondContact OD1-NH2 3.32Å; R383-M387 WeakPolarHBondContact O-CB 3.37Å; R383-M387 PolarHBondContact O-N 2.99Å
384	A	50.3	Low	53.5	Low	40 Å²	40	78.8 Å²	78.8	33%	0.331	41%	0.406	S	S	.	.	H	α-helix	trans	-68.6	-35	175.6	0	0	0	0	0	112.6	D380 L381 L382 K388	D380-A384 VanDerWaalsContact O-CB 3.26Å; D380-A384 WeakPolarHBondContact O-CB 3.44Å; D380-A384 PolarHBondContact O-N 3.45Å; L381-A384 PolarHBondContact O-N 3Å; L382-A384 VanDerWaalsContact C-N 3.28Å; L382-A384 PolarHBondContact O-N 3Å; A384-K388 WeakPolarHBondContact O-CB 2.94Å; A384-K388 PolarHBondContact O-N 2.93Å
385	R	54	Low	54.3	Low	148 Å²	148	77.6 Å²	77.6	56%	0.558	40%	0.396	S	S	*	.	H	α-helix	trans	-69.9	-43.7	176.1	-169.1	-178	74.3	161.7	4.9	111.7	L381 L382 M387 K388 R389	L381-R385 VanDerWaalsContact O-CB 3.32Å; L381-R385 WeakPolarHBondContact O-CB 3.42Å; L381-R385 PolarHBondContact O-N 3.34Å; L382-R385 WeakPolarHBondContact O-CB 3.4Å; L382-R385 PolarHBondContact O-N 3.36Å; L382-R385 VanDerWaalsContact O-N 3.07Å; R385-M387 VanDerWaalsContact C-N 3.35Å; R385-K388 WeakPolarHBondContact O-CB 3.42Å; R385-K388 PolarHBondContact O-N 3.35Å; R385-R389 PolarHBondContact O-N 3.21Å
386	D	55.6	Low	55.8	Low	83 Å²	83	77.3 Å²	77.3	44%	0.444	39%	0.385	S	S	.	.	H	α-helix	trans	-66.6	-39.4	176.5	-63.9	-20.2	0	0	0	110.7	L382 K388 R389 Y390	L382-D386 VanDerWaalsContact O-CG 3.27Å; L382-D386 PolarHBondContact O-N 3.31Å; D386-K388 PolarHBondContact O-N 3.1Å; D386-R389 PolarHBondContact O-N 3.49Å; D386-Y390 WeakPolarHBondContact O-CB 2.97Å; D386-Y390 PolarHBondContact O-N 2.83Å
387	M	59.6	Low	57.3	Low	50 Å²	50	74.6 Å²	74.6	25%	0.246	36%	0.363	C	S	.	.	H	α-helix	trans	-61.9	-42.6	171.8	-165.9	63	69.1	0	0	111.4	A354 I357 R383 R385 R389 Y390 I391	A354-M387 HydrophobicContact CB-CG 4.28Å; A354-M387 HydrophobicContact CB-SD 3.44Å; A354-M387 WeakPolarHBondContact CB-SD 3.28Å; A354-M387 WeakPolarHBondContact O-CG 3.12Å; I357-M387 HydrophobicContact CG2-CE 4.15Å; R383-M387 WeakPolarHBondContact O-CB 3.37Å; R383-M387 PolarHBondContact O-N 2.99Å; R385-M387 VanDerWaalsContact C-N 3.35Å; M387-R389 PolarHBondContact O-N 3.32Å; M387-Y390 PolarHBondContact O-N 2.69Å; M387-Y390 HydrophobicContact SD-CD1 4.24Å; M387-I391 HydrophobicContact CG-CD1 3.92Å; M387-I391 WeakPolarHBondContact O-CB 3.29Å; M387-I391 VanDerWaalsContact O-CD1 3.29Å; M387-I391 WeakPolarHBondContact O-CD1 3.3Å; M387-I391 WeakPolarHBondContact O-CG1 3.3Å; M387-I391 PolarHBondContact O-N 3.01Å
388	K	60.4	Low	58.9	Low	143 Å²	143	73.2 Å²	73.2	62%	0.622	36%	0.355	S	S	*	.	H	α-helix	trans	-64.4	-38.9	176.5	-171.5	177.9	-178.9	-179.2	0	112.3	A384 R385 D386 N392	A384-K388 WeakPolarHBondContact O-CB 2.94Å; A384-K388 PolarHBondContact O-N 2.93Å; R385-K388 WeakPolarHBondContact O-CB 3.42Å; R385-K388 PolarHBondContact O-N 3.35Å; D386-K388 PolarHBondContact O-N 3.1Å; K388-N392 WeakPolarHBondContact O-CB 3.49Å; K388-N392 PolarHBondContact O-N 3.35Å
389	R	61.7	Low	60.3	Low	89 Å²	89	76.4 Å²	76.4	34%	0.336	37%	0.368	S	S	.	.	H	α-helix	trans	-64	-48	174.2	-178.8	-170.1	-87.2	-166.6	-0.6	111.1	R385 D386 M387 N392 Q393 E528 E532	R385-R389 PolarHBondContact O-N 3.21Å; D386-R389 PolarHBondContact O-N 3.49Å; M387-R389 PolarHBondContact O-N 3.32Å; R389-N392 WeakPolarHBondContact O-CB 3.38Å; R389-N392 PolarHBondContact O-N 2.91Å; R389-N392 VanDerWaalsContact O-N 3.13Å; R389-Q393 PolarHBondContact O-N 2.9Å; R389-E528 IonicContact CZ-OE1 3.83Å; R389-E528 IonicContact NH1-OE1 3.09Å; R389-E528 IonicContact NH2-OE1 3.78Å; R389-E528 PolarHBondContact NH2-OE1 2.62Å; R389-E532 IonicContact CZ-OE1 2.77Å; R389-E532 IonicContact NE-OE1 2.62Å; R389-E532 PolarHBondContact NE-OE1 3.37Å; R389-E532 VanDerWaalsContact NH2-CD 3.35Å; R389-E532 IonicContact NH2-OE1 3.31Å; R389-E532 PolarHBondContact NH2-OE1 3.4Å
390	Y	62.7	Low	61.8	Low	84 Å²	84	78.3 Å²	78.3	33%	0.329	37%	0.37	S	S	.	.	H	α-helix	trans	-60.6	-44.7	177.4	178.1	-122.6	0	0	0	112	E350 A354 D386 M387 N392 Q393 L394	E350-Y390 PolarHBondContact OE1-OH 3.42Å; E350-Y390 PolarHBondContact OE2-OH 2.88Å; A354-Y390 HydrophobicContact CB-CD1 4.06Å; A354-Y390 HydrophobicContact CB-CE1 4.24Å; D386-Y390 WeakPolarHBondContact O-CB 2.97Å; D386-Y390 PolarHBondContact O-N 2.83Å; M387-Y390 PolarHBondContact O-N 2.69Å; M387-Y390 HydrophobicContact SD-CD1 4.24Å; Y390-N392 VanDerWaalsContact C-N 3.3Å; Y390-N392 PolarHBondContact O-N 2.74Å; Y390-Q393 PolarHBondContact O-N 2.93Å; Y390-L394 HydrophobicContact CD1-CD1 4.03Å; Y390-L394 HydrophobicContact CD2-CD1 4.22Å; Y390-L394 HydrophobicContact CD2-CG 4.33Å; Y390-L394 HydrophobicContact CE1-CD1 3.72Å; Y390-L394 HydrophobicContact CE2-CD1 3.89Å; Y390-L394 HydrophobicContact CE2-CD2 4.36Å; Y390-L394 HydrophobicContact CE2-CG 4.11Å; Y390-L394 HydrophobicContact CG-CD1 4.29Å; Y390-L394 WeakPolarHBondContact O-CB 3.03Å; Y390-L394 VanDerWaalsContact O-CG 3.3Å; Y390-L394 WeakPolarHBondContact O-CG 3.28Å; Y390-L394 PolarHBondContact O-N 3.15Å
391	I	62.4	Low	62.9	Low	21 Å²	21	75 Å²	75	11%	0.108	35%	0.353	C	S	.	.	H	α-helix	trans	-58.1	-41.7	172.7	-69.3	159	0	0	0	111.3	I351 A354 T355 M387 T395	I351-I391 HydrophobicContact CG2-CG2 4.19Å; A354-I391 HydrophobicContact CB-CD1 3.99Å; A354-I391 HydrophobicContact CB-CG1 3.49Å; A354-I391 VanDerWaalsContact CB-CG1 3.49Å; T355-I391 HydrophobicContact CG2-CD1 3.58Å; T355-I391 HydrophobicContact CG2-CG1 4.12Å; T355-I391 HydrophobicContact CG2-CG2 4.04Å; M387-I391 HydrophobicContact CG-CD1 3.92Å; M387-I391 WeakPolarHBondContact O-CB 3.29Å; M387-I391 VanDerWaalsContact O-CD1 3.29Å; M387-I391 WeakPolarHBondContact O-CD1 3.3Å; M387-I391 WeakPolarHBondContact O-CG1 3.3Å; M387-I391 PolarHBondContact O-N 3.01Å; I391-T395 WeakPolarHBondContact O-CB 3.41Å; I391-T395 PolarHBondContact O-N 3.31Å; I391-T395 PolarHBondContact O-OG1 3.26Å
392	N	66.8	Low	64.4	Low	97 Å²	97	71.8 Å²	71.8	52%	0.519	34%	0.335	S	S	.	.	H	α-helix	trans	-66.4	-44	177.2	-92.6	1.6	0	0	0	112.6	K388 R389 Y390 L394 T395 V396	K388-N392 WeakPolarHBondContact O-CB 3.49Å; K388-N392 PolarHBondContact O-N 3.35Å; R389-N392 WeakPolarHBondContact O-CB 3.38Å; R389-N392 PolarHBondContact O-N 2.91Å; R389-N392 VanDerWaalsContact O-N 3.13Å; Y390-N392 VanDerWaalsContact C-N 3.3Å; Y390-N392 PolarHBondContact O-N 2.74Å; N392-L394 VanDerWaalsContact C-N 3.33Å; N392-L394 PolarHBondContact O-N 2.57Å; N392-T395 WeakPolarHBondContact O-CB 3.46Å; N392-T395 PolarHBondContact O-N 3.01Å; N392-T395 VanDerWaalsContact O-N 3.1Å; N392-V396 WeakPolarHBondContact O-CG2 3.16Å; N392-V396 PolarHBondContact O-N 3.47Å
393	Q	71.1	Confident	66	Low	72 Å²	72	74.6 Å²	74.6	34%	0.336	34%	0.344	S	S	.	.	H	α-helix	trans	-59.5	-45.4	176.4	-78	177	-17.6	0	0	111.5	Y324 R389 Y390 T395 V396 A397	Y324-Q393 HydrophobicContact CD2-CB 4.06Å; Y324-Q393 HydrophobicContact CD2-CG 4.41Å; Y324-Q393 HydrophobicContact CE2-CB 3.64Å; Y324-Q393 HydrophobicContact CE2-CG 4.23Å; Y324-Q393 VanDerWaalsContact CE2-O 3.32Å; Y324-Q393 WeakPolarHBondContact CE2-O 3.32Å; Y324-Q393 PolarHBondContact OH-O 3.01Å; R389-Q393 PolarHBondContact O-N 2.9Å; Y390-Q393 PolarHBondContact O-N 2.93Å; Q393-T395 VanDerWaalsContact C-N 3.34Å; Q393-V396 PolarHBondContact O-N 3.27Å; Q393-A397 WeakPolarHBondContact O-CB 3.18Å; Q393-A397 PolarHBondContact O-N 3.02Å
394	L	64.2	Low	67.1	Low	9 Å²	9	69.6 Å²	69.6	5%	0.047	33%	0.325	C	S	.	.	H	α-helix	trans	-62.3	-42.2	172.9	-68.5	173.2	0	0	0	111	I347 E350 I351 Y390 N392 V396 A397 K398	I347-L394 HydrophobicContact CB-CD2 4.48Å; I347-L394 HydrophobicContact CG1-CD2 4.31Å; I347-L394 HydrophobicContact CG2-CB 3.77Å; I347-L394 HydrophobicContact CG2-CD2 4.08Å; I347-L394 WeakPolarHBondContact CG2-O 3.5Å; E350-L394 HydrophobicContact CB-CD1 3.5Å; E350-L394 VanDerWaalsContact CB-CD1 3.5Å; E350-L394 HydrophobicContact CB-CD2 4.43Å; E350-L394 VanDerWaalsContact OE2-CD2 3.31Å; E350-L394 WeakPolarHBondContact OE2-CD2 3.32Å; I351-L394 HydrophobicContact CD1-CB 3.89Å; I351-L394 HydrophobicContact CG1-CB 3.48Å; I351-L394 VanDerWaalsContact CG1-CB 3.48Å; I351-L394 HydrophobicContact CG1-CD1 4.18Å; Y390-L394 HydrophobicContact CD1-CD1 4.03Å; Y390-L394 HydrophobicContact CD2-CD1 4.22Å; Y390-L394 HydrophobicContact CD2-CG 4.33Å; Y390-L394 HydrophobicContact CE1-CD1 3.72Å; Y390-L394 HydrophobicContact CE2-CD1 3.89Å; Y390-L394 HydrophobicContact CE2-CD2 4.36Å; Y390-L394 HydrophobicContact CE2-CG 4.11Å; Y390-L394 HydrophobicContact CG-CD1 4.29Å; Y390-L394 WeakPolarHBondContact O-CB 3.03Å; Y390-L394 VanDerWaalsContact O-CG 3.3Å; Y390-L394 WeakPolarHBondContact O-CG 3.28Å; Y390-L394 PolarHBondContact O-N 3.15Å; N392-L394 VanDerWaalsContact C-N 3.33Å; N392-L394 PolarHBondContact O-N 2.57Å; L394-V396 VanDerWaalsContact C-N 3.3Å; L394-V396 PolarHBondContact O-N 3.37Å; L394-A397 PolarHBondContact O-N 2.9Å; L394-K398 WeakPolarHBondContact O-CB 3.45Å; L394-K398 PolarHBondContact O-N 2.91Å
395	T	67.1	Low	67.9	Low	47 Å²	47	67.7 Å²	67.7	29%	0.288	31%	0.309	S	S	.	.	H	α-helix	trans	-62.4	-37.1	178.5	-58.5	0	0	0	0	112.2	I391 N392 Q393 K398 K399	I391-T395 WeakPolarHBondContact O-CB 3.41Å; I391-T395 PolarHBondContact O-N 3.31Å; I391-T395 PolarHBondContact O-OG1 3.26Å; N392-T395 WeakPolarHBondContact O-CB 3.46Å; N392-T395 PolarHBondContact O-N 3.01Å; N392-T395 VanDerWaalsContact O-N 3.1Å; Q393-T395 VanDerWaalsContact C-N 3.34Å; T395-K398 WeakPolarHBondContact O-CB 3.34Å; T395-K399 PolarHBondContact O-N 3.47Å; T395-K399 VanDerWaalsContact O-N 3.12Å
396	V	75.5	Confident	68.8	Low	78 Å²	78	66.6 Å²	66.6	47%	0.473	31%	0.305	S	S	.	.	H	α-helix	trans	-69.4	-44.2	174.6	171.8	0	0	0	0	111.2	Y324 N392 Q393 L394 K398 K399 Q400	Y324-V396 WeakPolarHBondContact OH-CB 3.28Å; Y324-V396 WeakPolarHBondContact OH-CG1 3.48Å; N392-V396 WeakPolarHBondContact O-CG2 3.16Å; N392-V396 PolarHBondContact O-N 3.47Å; Q393-V396 PolarHBondContact O-N 3.27Å; L394-V396 VanDerWaalsContact C-N 3.3Å; L394-V396 PolarHBondContact O-N 3.37Å; V396-K398 VanDerWaalsContact C-N 3.27Å; V396-K398 PolarHBondContact O-N 2.78Å; V396-K399 PolarHBondContact O-N 3Å; V396-Q400 PolarHBondContact O-N 3.28Å
397	A	72.7	Confident	69.4	Low	0 Å²	0	68.1 Å²	68.1	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-62.2	-36.5	175.8	0	0	0	0	0	111.8	Y324 F327 I328 I331 I347 Q393 L394 Q400 C401	Y324-A397 HydrophobicContact CE2-CB 4.25Å; F327-A397 HydrophobicContact CD1-CB 4.24Å; F327-A397 HydrophobicContact CE1-CB 3.8Å; I328-A397 HydrophobicContact CD1-CB 3.69Å; I331-A397 HydrophobicContact CD1-CB 3.9Å; I347-A397 HydrophobicContact CD1-CB 3.71Å; I347-A397 HydrophobicContact CG1-CB 4.48Å; I347-A397 HydrophobicContact CG2-CB 4.47Å; Q393-A397 WeakPolarHBondContact O-CB 3.18Å; Q393-A397 PolarHBondContact O-N 3.02Å; L394-A397 PolarHBondContact O-N 2.9Å; A397-Q400 PolarHBondContact O-N 3.39Å; A397-C401 WeakPolarHBondContact O-CB 3.18Å; A397-C401 PolarHBondContact O-N 3.4Å
398	K	77.3	Confident	69.8	Low	61 Å²	61	69.9 Å²	69.9	27%	0.265	32%	0.317	S	S	.	.	H	α-helix	trans	-60.1	-50.7	173.2	-177.8	-164.2	168.6	-171.4	0	111.1	R344 I347 V348 I351 L394 T395 V396 Q400 C401 E402	R344-K398 HydrophobicContact CG-CG 3.81Å; I347-K398 HydrophobicContact CG2-CB 3.71Å; V348-K398 HydrophobicContact CG2-CD 3.5Å; V348-K398 VanDerWaalsContact CG2-CE 3.48Å; V348-K398 HydrophobicContact CG2-CG 3.87Å; I351-K398 HydrophobicContact CD1-CB 4.49Å; I351-K398 HydrophobicContact CD1-CD 4.34Å; L394-K398 WeakPolarHBondContact O-CB 3.45Å; L394-K398 PolarHBondContact O-N 2.91Å; T395-K398 WeakPolarHBondContact O-CB 3.34Å; V396-K398 VanDerWaalsContact C-N 3.27Å; V396-K398 PolarHBondContact O-N 2.78Å; K398-Q400 VanDerWaalsContact C-N 3.35Å; K398-Q400 PolarHBondContact O-N 3.24Å; K398-C401 WeakPolarHBondContact O-CB 3.2Å; K398-C401 PolarHBondContact O-N 3.45Å; K398-E402 WeakPolarHBondContact CE-OE1 3.29Å; K398-E402 IonicContact NZ-OE1 2.81Å; K398-E402 WeakPolarHBondContact O-CG 3.13Å; K398-E402 PolarHBondContact O-N 3.47Å
399	K	73.9	Confident	69.2	Low	136 Å²	136	66.6 Å²	66.6	59%	0.591	32%	0.324	S	S	*	.	H	α-helix	trans	-62.6	-40.5	178.8	-75.7	-173.3	174.8	-169.3	0	112.2	T395 V396 E402 K403	T395-K399 PolarHBondContact O-N 3.47Å; T395-K399 VanDerWaalsContact O-N 3.12Å; V396-K399 PolarHBondContact O-N 3Å; K399-E402 PolarHBondContact O-N 3.33Å; K399-K403 WeakPolarHBondContact O-CB 3.44Å; K399-K403 PolarHBondContact O-N 3.05Å
400	Q	75.3	Confident	68.9	Low	82 Å²	82	63.1 Å²	63.1	38%	0.383	32%	0.316	S	S	.	.	H	α-helix	trans	-60.4	-45.8	173.4	-83.5	-91.7	-13	0	0	111.6	I331 V396 A397 K398 K403 R404	I331-Q400 HydrophobicContact CG2-CB 4.13Å; V396-Q400 PolarHBondContact O-N 3.28Å; A397-Q400 PolarHBondContact O-N 3.39Å; K398-Q400 VanDerWaalsContact C-N 3.35Å; K398-Q400 PolarHBondContact O-N 3.24Å; Q400-K403 PolarHBondContact O-N 3.01Å; Q400-R404 WeakPolarHBondContact O-CB 3.39Å; Q400-R404 PolarHBondContact O-N 3.15Å
401	C	70.2	Confident	68.2	Low	0 Å²	0	62 Å²	62	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-59.3	-47.7	172.3	-99.3	0	0	0	0	112.2	I331 L340 R344 A397 K398 K403 R404 I405	I331-C401 HydrophobicContact CG2-CB 4.34Å; L340-C401 PolarHBondContact O-SG 3.29Å; R344-C401 HydrophobicContact CB-CB 3.86Å; R344-C401 HydrophobicContact CG-CB 4.31Å; A397-C401 WeakPolarHBondContact O-CB 3.18Å; A397-C401 PolarHBondContact O-N 3.4Å; K398-C401 WeakPolarHBondContact O-CB 3.2Å; K398-C401 PolarHBondContact O-N 3.45Å; C401-K403 PolarHBondContact O-N 2.7Å; C401-R404 PolarHBondContact O-N 3.1Å; C401-I405 WeakPolarHBondContact O-CB 3.35Å; C401-I405 WeakPolarHBondContact O-CD1 3.4Å; C401-I405 WeakPolarHBondContact O-CG1 3.26Å; C401-I405 PolarHBondContact O-N 2.98Å
402	E	75.5	Confident	68.2	Low	29 Å²	29	65.1 Å²	65.1	14%	0.136	34%	0.336	C	S	.	.	H	α-helix	trans	-60.7	-43.3	179.8	-75.1	170.8	164.5	0	0	112.2	R344 K398 K399 R404 I405 R406 Y413	R344-E402 WeakPolarHBondContact CD-OE1 3.37Å; R344-E402 HydrophobicContact CG-CG 3.87Å; R344-E402 IonicContact CZ-OE1 3.66Å; R344-E402 IonicContact NE-OE1 3.66Å; R344-E402 IonicContact NH1-OE1 2.85Å; R344-E402 PolarHBondContact NH1-OE1 2.91Å; K398-E402 WeakPolarHBondContact CE-OE1 3.29Å; K398-E402 IonicContact NZ-OE1 2.81Å; K398-E402 WeakPolarHBondContact O-CG 3.13Å; K398-E402 PolarHBondContact O-N 3.47Å; K399-E402 PolarHBondContact O-N 3.33Å; E402-R404 PolarHBondContact O-N 3.32Å; E402-I405 PolarHBondContact O-N 3.25Å; E402-R406 PolarHBondContact O-N 2.85Å; E402-Y413 HydrophobicContact CB-CD2 4.44Å; E402-Y413 HydrophobicContact CG-CD2 3.91Å; E402-Y413 HydrophobicContact CG-CG 4.3Å
403	K	75.8	Confident	67.9	Low	143 Å²	143	64.6 Å²	64.6	62%	0.622	33%	0.327	S	S	*	.	H	α-helix	trans	-62.1	-42.7	174.5	-171.7	175.3	-178.9	177.6	0	111.6	K399 Q400 C401 R406 M407	K399-K403 WeakPolarHBondContact O-CB 3.44Å; K399-K403 PolarHBondContact O-N 3.05Å; Q400-K403 PolarHBondContact O-N 3.01Å; C401-K403 PolarHBondContact O-N 2.7Å; K403-R406 PolarHBondContact O-N 3.35Å; K403-M407 WeakPolarHBondContact O-CG 3.27Å; K403-M407 PolarHBondContact O-N 3.2Å; K403-M407 VanDerWaalsContact O-N 3.11Å
404	R	76.7	Confident	66.7	Low	50 Å²	50	66.6 Å²	66.6	19%	0.189	34%	0.337	C	S	.	.	H	α-helix	trans	-66.9	-38.7	177.8	-159	77.6	-179.1	104.2	-5.1	112.1	S332 S334 L340 Q400 C401 E402 M407 F408	S332-R404 PolarHBondContact O-NE 3.47Å; S332-R404 PolarHBondContact O-NH2 3.01Å; S334-R404 PolarHBondContact O-NE 3.12Å; L340-R404 HydrophobicContact CD1-CB 3.72Å; L340-R404 HydrophobicContact CD1-CG 3.34Å; L340-R404 HydrophobicContact CD2-CB 4.1Å; L340-R404 HydrophobicContact CD2-CG 4.03Å; L340-R404 HydrophobicContact CG-CB 4.5Å; L340-R404 HydrophobicContact CG-CG 4.33Å; Q400-R404 WeakPolarHBondContact O-CB 3.39Å; Q400-R404 PolarHBondContact O-N 3.15Å; C401-R404 PolarHBondContact O-N 3.1Å; E402-R404 PolarHBondContact O-N 3.32Å; R404-M407 PolarHBondContact O-N 3.36Å; R404-F408 HydrophobicContact CG-CE2 4.27Å; R404-F408 VanDerWaalsContact O-CD2 3.26Å; R404-F408 WeakPolarHBondContact O-CD2 3.36Å
405	I	67.6	Low	65.7	Low	0 Å²	0	72.4 Å²	72.4	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-62	-44.7	173.9	-69.4	159.5	0	0	0	110.9	V337 L340 K341 R344 C401 E402 F408 G410 Y413	V337-I405 HydrophobicContact CG1-CB 4.46Å; V337-I405 HydrophobicContact CG1-CG1 4.48Å; V337-I405 HydrophobicContact CG1-CG2 3.89Å; L340-I405 HydrophobicContact CB-CD1 4.06Å; L340-I405 HydrophobicContact CB-CG1 3.52Å; K341-I405 HydrophobicContact CB-CD1 4.26Å; K341-I405 HydrophobicContact CG-CD1 3.71Å; K341-I405 HydrophobicContact CG-CG1 4.09Å; K341-I405 HydrophobicContact CG-CG2 4.22Å; R344-I405 HydrophobicContact CB-CD1 4.41Å; C401-I405 WeakPolarHBondContact O-CB 3.35Å; C401-I405 WeakPolarHBondContact O-CD1 3.4Å; C401-I405 WeakPolarHBondContact O-CG1 3.26Å; C401-I405 PolarHBondContact O-N 2.98Å; E402-I405 PolarHBondContact O-N 3.25Å; I405-F408 PolarHBondContact O-N 3.47Å; I405-G410 WeakPolarHBondContact O-CA 3.23Å; I405-G410 PolarHBondContact O-N 2.98Å; I405-Y413 HydrophobicContact CD1-CE2 4.3Å; I405-Y413 HydrophobicContact CG2-CE2 4.07Å
406	R	72.4	Confident	64.1	Low	124 Å²	124	76 Å²	76	47%	0.468	40%	0.395	S	S	.	.	H	α-helix	trans	-62.8	-43.4	179.6	-171.6	-179.2	-177.7	174.3	-2.2	112	E402 K403 F408 G409 N412 E414	E402-R406 PolarHBondContact O-N 2.85Å; K403-R406 PolarHBondContact O-N 3.35Å; R406-F408 PolarHBondContact O-N 2.84Å; R406-F408 VanDerWaalsContact O-N 3.11Å; R406-G409 PolarHBondContact O-N 3.47Å; R406-G409 VanDerWaalsContact O-N 3.13Å; R406-N412 VanDerWaalsContact CD-OD1 3.31Å; R406-N412 WeakPolarHBondContact CD-OD1 3.43Å; R406-N412 VanDerWaalsContact CZ-ND2 3.34Å; R406-N412 PolarHBondContact NE-OD1 3.21Å; R406-N412 PolarHBondContact NH1-OD1 3.35Å; R406-N412 PolarHBondContact NH2-ND2 2.61Å; R406-E414 IonicContact NH1-OE2 2.93Å; R406-E414 PolarHBondContact NH1-OE2 2.9Å
407	M	69.5	Low	62.1	Low	116 Å²	116	80.6 Å²	80.6	57%	0.571	41%	0.411	S	S	*	.	H	α-helix	trans	-59.6	-22.7	178.5	-76	-167.9	-66.4	0	0	113.9	K403 R404	K403-M407 WeakPolarHBondContact O-CG 3.27Å; K403-M407 PolarHBondContact O-N 3.2Å; K403-M407 VanDerWaalsContact O-N 3.11Å; R404-M407 PolarHBondContact O-N 3.36Å
408	F	66.4	Low	60.3	Low	86 Å²	86	89.7 Å²	89.7	38%	0.377	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	23.5	-180	-69.5	-61.2	0	0	0	113.4	T335 V337 R404 I405 R406	T335-F408 HydrophobicContact CG2-CE2 4.42Å; T335-F408 HydrophobicContact CG2-CZ 3.89Å; V337-F408 HydrophobicContact CG2-CB 3.28Å; V337-F408 HydrophobicContact CG2-CD2 4.41Å; V337-F408 HydrophobicContact CG2-CG 4.17Å; R404-F408 HydrophobicContact CG-CE2 4.27Å; R404-F408 VanDerWaalsContact O-CD2 3.26Å; R404-F408 WeakPolarHBondContact O-CD2 3.36Å; I405-F408 PolarHBondContact O-N 3.47Å; R406-F408 PolarHBondContact O-N 2.84Å; R406-F408 VanDerWaalsContact O-N 3.11Å
409	G	48.1	Very low	58	Low	75 Å²	75	90.4 Å²	90.4	77%	0.773	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	19.7	174.3	0	0	0	0	0	114.8	R406	R406-G409 PolarHBondContact O-N 3.47Å; R406-G409 VanDerWaalsContact O-N 3.13Å
410	G	56.9	Low	55.9	Low	16 Å²	16	87.8 Å²	87.8	17%	0.165	49%	0.49	C	S	.	.			trans	-79.4	173.4	171.4	0	0	0	0	0	113.8	I405 N412	I405-G410 WeakPolarHBondContact O-CA 3.23Å; I405-G410 PolarHBondContact O-N 2.98Å; G410-N412 PolarHBondContact O-N 2.83Å
411	P	47.6	Very low	54	Low	61 Å²	61	88.8 Å²	88.8	40%	0.396	51%	0.512	S	S	.	.			trans	-57.2	136.4	-177.8	-17.3	27.9	0	0	0	111.1	Y413	P411-Y413 HydrophobicContact CB-CE1 4.28Å; P411-Y413 HydrophobicContact CB-CE2 4.1Å; P411-Y413 HydrophobicContact CG-CE2 4.44Å; P411-Y413 WeakPolarHBondContact O-CD2 3.45Å; P411-Y413 VanDerWaalsContact O-CE2 3.27Å; P411-Y413 WeakPolarHBondContact O-CE2 3.35Å; P411-Y413 PolarHBondContact O-N 3.18Å
412	N	61	Low	52.1	Low	85 Å²	85	96.2 Å²	96.2	46%	0.455	55%	0.552	S	S	.	*			trans	-81.5	113.3	174.7	-161.1	12.2	0	0	0	108.9	R406 G410 E414	R406-N412 VanDerWaalsContact CD-OD1 3.31Å; R406-N412 WeakPolarHBondContact CD-OD1 3.43Å; R406-N412 VanDerWaalsContact CZ-ND2 3.34Å; R406-N412 PolarHBondContact NE-OD1 3.21Å; R406-N412 PolarHBondContact NH1-OD1 3.35Å; R406-N412 PolarHBondContact NH2-ND2 2.61Å; G410-N412 PolarHBondContact O-N 2.83Å; N412-E414 VanDerWaalsContact C-N 3.34Å
413	Y	60.3	Low	50.3	Low	86 Å²	86	102.3 Å²	102.3	34%	0.337	59%	0.586	S	S	.	*			trans	-90.3	-1.6	-178.4	-61.9	-79.5	0	0	0	112.8	E402 I405 P411	E402-Y413 HydrophobicContact CB-CD2 4.44Å; E402-Y413 HydrophobicContact CG-CD2 3.91Å; E402-Y413 HydrophobicContact CG-CG 4.3Å; I405-Y413 HydrophobicContact CD1-CE2 4.3Å; I405-Y413 HydrophobicContact CG2-CE2 4.07Å; P411-Y413 HydrophobicContact CB-CE1 4.28Å; P411-Y413 HydrophobicContact CB-CE2 4.1Å; P411-Y413 HydrophobicContact CG-CE2 4.44Å; P411-Y413 WeakPolarHBondContact O-CD2 3.45Å; P411-Y413 VanDerWaalsContact O-CE2 3.27Å; P411-Y413 WeakPolarHBondContact O-CE2 3.35Å; P411-Y413 PolarHBondContact O-N 3.18Å
414	E	47.1	Very low	48.5	Very low	115 Å²	115	98.4 Å²	98.4	54%	0.537	59%	0.586	S	S	.	*			trans	-94.2	96.8	172.9	-68.1	-171.7	155	0	0	110	R406 N412	R406-E414 IonicContact NH1-OE2 2.93Å; R406-E414 PolarHBondContact NH1-OE2 2.9Å; N412-E414 VanDerWaalsContact C-N 3.34Å
415	N	44	Very low	46.2	Very low	130 Å²	130	103.8 Å²	103.8	70%	0.695	62%	0.619	S	S	*	*				163.7	102.1	125.9	-81.5	-3	0	0	0	112.9
416	S	33.2	Very low	45	Very low	123 Å²	123	113.2 Å²	113.2	86%	0.86	66%	0.663	S	S	*	*	S	Bend		-125.5	89	126	-64.2	0	0	0	0	102.6
417	E	32.5	Very low	43.3	Very low	174 Å²	174	112.6 Å²	112.6	81%	0.813	68%	0.675	S	S	*	*	S	Bend		-173.9	141.1	90.5	-83.4	169.2	172	0	0	107.9
418	E	34.4	Very low	41.8	Very low	191 Å²	191	115.7 Å²	115.7	89%	0.893	69%	0.688	S	S	*	*			trans	61.1	100.2	162.1	-67.8	-176.7	153.6	0	0	121.3
419	G	29.9	Very low	40.4	Very low	77 Å²	77	117.5 Å²	117.5	79%	0.794	71%	0.711	S	S	*	*				79.4	119.3	112	0	0	0	0	0	121.8
420	G	29.2	Very low	40.2	Very low	81 Å²	81	120.3 Å²	120.3	84%	0.835	70%	0.704	S	S	*	*			trans	113.1	134.9	140	0	0	0	0	0	118.1
421	A	35.1	Very low	40	Very low	102 Å²	102	126.2 Å²	126.2	84%	0.843	73%	0.725	S	S	*	*			trans	-54.7	164.6	177.5	0	0	0	0	0	114.4
422	D	31.3	Very low	40.6	Very low	157 Å²	157	128.6 Å²	128.6	84%	0.84	73%	0.733	S	S	*	*				-171	169.2	52	-170.6	20	0	0	0	110.5
423	D	38.3	Very low	41.2	Very low	156 Å²	156	125.3 Å²	125.3	83%	0.834	72%	0.716	S	S	*	*			trans	-65.5	159.2	-174.5	-119.8	-23.8	0	0	0	116.1
424	G	36.2	Very low	41.8	Very low	62 Å²	62	125.4 Å²	125.4	64%	0.639	72%	0.719	S	S	*	*			trans	86.3	91.4	148.1	0	0	0	0	0	119.2
425	D	29.8	Very low	43.3	Very low	162 Å²	162	120.3 Å²	120.3	87%	0.866	70%	0.695	S	S	*	*				-178.3	124.1	129.9	-96.9	-18.8	0	0	0	109.4	P427	D425-P427 WeakPolarHBondContact O-CD 3.07Å
426	E	42.6	Very low	45.1	Very low	198 Å²	198	117.9 Å²	117.9	93%	0.925	68%	0.682	S	S	*	*			trans	-64.8	142	161.1	-86.6	-175.2	146.4	0	0	109.3
427	P	37	Very low	47.3	Very low	112 Å²	112	116 Å²	116	73%	0.727	66%	0.663	S	S	*	*			trans	-133.6	141	142.5	20.2	0.6	0	0	0	114.3	D425	D425-P427 WeakPolarHBondContact O-CD 3.07Å
428	Q	37	Very low	49.8	Very low	181 Å²	181	107.8 Å²	107.8	85%	0.846	62%	0.624	S	S	*	*			trans	-51.9	153.3	174.5	-73.9	145.7	-39.7	0	0	113.7	Q430	Q428-Q430 PolarHBondContact O-N 3.44Å
429	S	36.3	Very low	52.2	Low	123 Å²	123	98.8 Å²	98.8	86%	0.86	58%	0.582	S	S	*	*			trans	-52.1	105.8	179.4	52	0	0	0	0	112.9	K431	S429-K431 PolarHBondContact O-N 2.77Å
430	Q	44.3	Very low	54.6	Low	134 Å²	134	99.7 Å²	99.7	63%	0.626	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-71.9	123	173.6	-74.4	178.4	-19.1	0	0	111	Q428	Q428-Q430 PolarHBondContact O-N 3.44Å
431	K	53.5	Low	57.2	Low	141 Å²	141	98.8 Å²	98.8	61%	0.613	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-72	120.9	171.5	-176.4	-176.5	176.4	-167.3	0	109.1	S429	S429-K431 PolarHBondContact O-N 2.77Å
432	I	60.6	Low	59.4	Low	110 Å²	110	98 Å²	98	56%	0.564	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-95.9	117.3	179.2	-58	175.2	0	0	0	109.3	L539 Y544	I432-L539 HydrophobicContact CG2-CD1 4.03Å; I432-L539 HydrophobicContact CG2-CD2 3.9Å; I432-Y544 WeakPolarHBondContact CA-OH 2.85Å
433	L	72.7	Confident	61.6	Low	16 Å²	16	92.3 Å²	92.3	8%	0.084	52%	0.516	C	S	.	.	P	Polyproline II helix	trans	-75.1	134.8	171.2	-62.2	178.6	0	0	0	111.5	I438 Y444 Y535 Y544 L547 I548	L433-I438 HydrophobicContact CB-CD1 4.15Å; L433-I438 HydrophobicContact CB-CG1 4.16Å; L433-Y444 HydrophobicContact CD1-CD2 4.23Å; L433-Y444 HydrophobicContact CD1-CE2 4.24Å; L433-Y444 HydrophobicContact CD1-CG 4.43Å; L433-Y535 PolarHBondContact O-OH 2.92Å; L433-Y544 PolarHBondContact N-OH 3.03Å; L433-L547 HydrophobicContact CD1-CD2 3.55Å; L433-I548 HydrophobicContact CD1-CD1 4.47Å; L433-I548 HydrophobicContact CG-CD1 4.39Å
434	H	73.7	Confident	63.8	Low	88 Å²	88	87.7 Å²	87.7	41%	0.407	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-68	151.4	177.9	-71.5	-99.4	0	0	0	112.3	E325 D436 D437 I438	E325-H434 IonicContact OE1-CE1 2.69Å; E325-H434 PolarHBondContact OE1-CE1 3.35Å; E325-H434 VanDerWaalsContact OE1-CE1 3.23Å; E325-H434 IonicContact OE1-ND1 2.98Å; E325-H434 PolarHBondContact OE1-ND1 2.76Å; E325-H434 IonicContact OE2-CE1 2.76Å; E325-H434 PolarHBondContact OE2-CE1 3.12Å; H434-D436 VanDerWaalsContact C-N 3.32Å; H434-D436 PolarHBondContact O-N 3.31Å; H434-D437 HydrophobicContact CB-CB 4.46Å; H434-D437 WeakPolarHBondContact CB-OD2 3.46Å; H434-D437 IonicContact CD2-OD2 2.95Å; H434-D437 WeakPolarHBondContact O-CB 3.35Å; H434-D437 PolarHBondContact O-N 3.32Å; H434-I438 WeakPolarHBondContact O-CG1 3.3Å; H434-I438 PolarHBondContact O-N 3.31Å
435	F	78.6	Confident	66.4	Low	8 Å²	8	87.1 Å²	87.1	4%	0.035	47%	0.466	C	S	.	.	H	α-helix	trans	-59.8	-40.4	179.9	178.9	-104	0	0	0	112.9	D437 I438 L439 F448 M530 R531 Y535	F435-D437 VanDerWaalsContact C-N 3.35Å; F435-I438 WeakPolarHBondContact O-CB 3.44Å; F435-I438 PolarHBondContact O-N 3.46Å; F435-L439 HydrophobicContact CD1-CD1 4.07Å; F435-L439 HydrophobicContact CD1-CG 4.42Å; F435-L439 HydrophobicContact CE1-CD1 3.28Å; F435-L439 HydrophobicContact CE1-CG 3.95Å; F435-L439 HydrophobicContact CE2-CD1 4.3Å; F435-L439 HydrophobicContact CE2-CG 4.27Å; F435-L439 HydrophobicContact CZ-CD1 3.43Å; F435-L439 VanDerWaalsContact CZ-CD1 3.43Å; F435-L439 HydrophobicContact CZ-CD2 4.35Å; F435-L439 HydrophobicContact CZ-CG 3.88Å; F435-L439 PolarHBondContact O-N 2.84Å; F435-F448 AromaticContact CE2-CE1 3.71Å; F435-F448 HydrophobicContact CE2-CE1 3.71Å; F435-F448 AromaticContact CE2-CZ 3.75Å; F435-F448 HydrophobicContact CE2-CZ 3.75Å; F435-F448 HydrophobicContact CZ-CE1 4.39Å; F435-M530 HydrophobicContact CE2-CB 4.18Å; F435-M530 HydrophobicContact CZ-CB 3.72Å; F435-R531 HydrophobicContact CB-CG 4.24Å; F435-R531 HydrophobicContact CD1-CB 3.74Å; F435-R531 HydrophobicContact CD1-CG 3.75Å; F435-R531 HydrophobicContact CD2-CB 4.44Å; F435-R531 HydrophobicContact CE1-CB 3.63Å; F435-R531 HydrophobicContact CE1-CG 4.19Å; F435-R531 HydrophobicContact CE2-CB 4.35Å; F435-R531 HydrophobicContact CG-CB 4.12Å; F435-R531 HydrophobicContact CG-CG 3.93Å; F435-R531 HydrophobicContact CZ-CB 3.95Å; F435-Y535 HydrophobicContact CB-CD1 4.02Å; F435-Y535 HydrophobicContact CB-CD2 4.04Å; F435-Y535 HydrophobicContact CB-CE1 3.96Å; F435-Y535 HydrophobicContact CB-CE2 3.98Å; F435-Y535 HydrophobicContact CB-CG 4.05Å; F435-Y535 HydrophobicContact CD2-CD1 4.29Å; F435-Y535 AromaticContact CD2-CD2 3.58Å; F435-Y535 HydrophobicContact CD2-CD2 3.58Å; F435-Y535 HydrophobicContact CD2-CE2 4.3Å; F435-Y535 AromaticContact CD2-CG 3.57Å; F435-Y535 HydrophobicContact CD2-CG 3.57Å; F435-Y535 HydrophobicContact CE2-CG 4.42Å; F435-Y535 HydrophobicContact CG-CD1 4.49Å; F435-Y535 HydrophobicContact CG-CD2 4.29Å; F435-Y535 HydrophobicContact CG-CG 4.18Å; F435-Y535 PolarHBondContact N-OH 3.01Å
436	D	80.8	Confident	69.1	Low	79 Å²	79	84 Å²	84	42%	0.422	45%	0.446	S	S	.	.	H	α-helix	trans	-70.4	-34.9	-179.9	-60.3	-35.3	0	0	0	110.9	H434 I438 L439 C440 R531	H434-D436 VanDerWaalsContact C-N 3.32Å; H434-D436 PolarHBondContact O-N 3.31Å; D436-I438 VanDerWaalsContact C-N 3.28Å; D436-I438 PolarHBondContact O-N 3.48Å; D436-L439 PolarHBondContact O-N 3.19Å; D436-C440 WeakPolarHBondContact O-CB 3.3Å; D436-C440 PolarHBondContact O-N 3.4Å; D436-C440 PolarHBondContact O-SG 3.42Å; D436-R531 IonicContact OD1-CZ 3.39Å; D436-R531 IonicContact OD1-NE 3.43Å; D436-R531 IonicContact OD1-NH2 3.32Å; D436-R531 PolarHBondContact OD1-NH2 3.38Å; D436-R531 IonicContact OD2-NH2 3.12Å
437	D	80.2	Confident	71	Confident	85 Å²	85	77.1 Å²	77.1	46%	0.455	41%	0.414	S	S	.	.	H	α-helix	trans	-63.1	-37.2	172	-61.8	-28.1	0	0	0	111.4	H434 F435 N441	H434-D437 HydrophobicContact CB-CB 4.46Å; H434-D437 WeakPolarHBondContact CB-OD2 3.46Å; H434-D437 IonicContact CD2-OD2 2.95Å; H434-D437 WeakPolarHBondContact O-CB 3.35Å; H434-D437 PolarHBondContact O-N 3.32Å; F435-D437 VanDerWaalsContact C-N 3.35Å; D437-N441 WeakPolarHBondContact O-CB 3.26Å; D437-N441 PolarHBondContact O-N 2.82Å
438	I	83.6	Confident	73.4	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-67.4	-41.1	176.2	-68.6	159.5	0	0	0	111.1	L433 H434 F435 D436 R445 F448 Y535 F538 Y544	L433-I438 HydrophobicContact CB-CD1 4.15Å; L433-I438 HydrophobicContact CB-CG1 4.16Å; H434-I438 WeakPolarHBondContact O-CG1 3.3Å; H434-I438 PolarHBondContact O-N 3.31Å; F435-I438 WeakPolarHBondContact O-CB 3.44Å; F435-I438 PolarHBondContact O-N 3.46Å; D436-I438 VanDerWaalsContact C-N 3.28Å; D436-I438 PolarHBondContact O-N 3.48Å; I438-R445 WeakPolarHBondContact O-CA 3.21Å; I438-R445 VanDerWaalsContact O-CB 3.27Å; I438-R445 WeakPolarHBondContact O-CB 3.35Å; I438-R445 PolarHBondContact O-N 2.94Å; I438-F448 HydrophobicContact CG2-CB 3.6Å; I438-F448 HydrophobicContact CG2-CD1 4.48Å; I438-F448 HydrophobicContact CG2-CG 4.04Å; I438-Y535 HydrophobicContact CD1-CD2 4.24Å; I438-Y535 HydrophobicContact CD1-CE2 3.6Å; I438-F538 HydrophobicContact CD1-CD1 4.49Å; I438-F538 HydrophobicContact CD1-CE1 4.09Å; I438-F538 HydrophobicContact CG2-CE1 4.48Å; I438-Y544 HydrophobicContact CD1-CE2 4.49Å
439	L	85	Confident	75.8	Confident	3 Å²	3	65 Å²	65	2%	0.016	35%	0.346	C	S	.	.	H	α-helix	trans	-77.3	-32	178.7	-71.8	-171.3	0	0	0	113.5	F435 D436 R445 F448 W464	F435-L439 HydrophobicContact CD1-CD1 4.07Å; F435-L439 HydrophobicContact CD1-CG 4.42Å; F435-L439 HydrophobicContact CE1-CD1 3.28Å; F435-L439 HydrophobicContact CE1-CG 3.95Å; F435-L439 HydrophobicContact CE2-CD1 4.3Å; F435-L439 HydrophobicContact CE2-CG 4.27Å; F435-L439 HydrophobicContact CZ-CD1 3.43Å; F435-L439 VanDerWaalsContact CZ-CD1 3.43Å; F435-L439 HydrophobicContact CZ-CD2 4.35Å; F435-L439 HydrophobicContact CZ-CG 3.88Å; F435-L439 PolarHBondContact O-N 2.84Å; D436-L439 PolarHBondContact O-N 3.19Å; L439-R445 HydrophobicContact CD2-CG 4.38Å; L439-R445 WeakPolarHBondContact O-CD 3.3Å; L439-R445 PolarHBondContact O-NH1 3.07Å; L439-F448 HydrophobicContact CD2-CD1 4.09Å; L439-F448 HydrophobicContact CD2-CE1 4.35Å; L439-W464 HydrophobicContact CB-CH2 4.24Å; L439-W464 HydrophobicContact CB-CZ2 4.39Å; L439-W464 HydrophobicContact CD1-CD2 4.46Å; L439-W464 HydrophobicContact CD1-CZ2 4.15Å
440	C	81.4	Confident	78.2	Confident	95 Å²	95	60.8 Å²	60.8	64%	0.642	32%	0.318	S	S	*	.	H	α-helix	trans	-78.2	-33.1	179.6	-71.6	0	0	0	0	112.1	D436 P442	D436-C440 WeakPolarHBondContact O-CB 3.3Å; D436-C440 PolarHBondContact O-N 3.4Å; D436-C440 PolarHBondContact O-SG 3.42Å; C440-P442 WeakPolarHBondContact O-CD 3.36Å
441	N	83.2	Confident	80.2	Confident	63 Å²	63	55.5 Å²	55.5	34%	0.337	29%	0.293	S	S	.	.	S	Bend	trans	-85.3	118.1	178	-172.6	-50.2	0	0	0	111.2	D437 G443 Y444 R445	D437-N441 WeakPolarHBondContact O-CB 3.26Å; D437-N441 PolarHBondContact O-N 2.82Å; N441-G443 VanDerWaalsContact C-N 3.26Å; N441-G443 PolarHBondContact O-N 3.17Å; N441-G443 PolarHBondContact OD1-N 2.91Å; N441-Y444 HydrophobicContact CB-CD2 3.5Å; N441-Y444 HydrophobicContact CB-CE2 4.12Å; N441-Y444 HydrophobicContact CB-CG 3.98Å; N441-Y444 PolarHBondContact O-N 3.38Å; N441-Y444 PolarHBondContact OD1-N 3.38Å; N441-R445 VanDerWaalsContact O-CB 3.27Å; N441-R445 WeakPolarHBondContact O-CB 3.28Å; N441-R445 PolarHBondContact O-N 3.46Å
442	P	80.5	Confident	81.7	Confident	85 Å²	85	48.8 Å²	48.8	55%	0.552	26%	0.263	S	S	*	.	H	α-helix	trans	-57.9	-34.3	-178.4	-24.3	33.8	0	0	0	114.2	C440 E446	C440-P442 WeakPolarHBondContact O-CD 3.36Å; P442-E446 PolarHBondContact O-N 2.88Å; P442-E446 VanDerWaalsContact O-N 3.13Å
443	G	79.1	Confident	82.9	Confident	37 Å²	37	47.4 Å²	47.4	38%	0.381	26%	0.255	S	S	.	.	H	α-helix	trans	-74.5	-39.6	-179.1	0	0	0	0	0	113.3	N441 E446 H447	N441-G443 VanDerWaalsContact C-N 3.26Å; N441-G443 PolarHBondContact O-N 3.17Å; N441-G443 PolarHBondContact OD1-N 2.91Å; G443-E446 WeakPolarHBondContact O-CB 3.48Å; G443-H447 PolarHBondContact O-ND1 3.43Å
444	Y	84.7	Confident	83.4	Confident	60 Å²	60	53.3 Å²	53.3	24%	0.235	28%	0.276	C	S	.	.	H	α-helix	trans	-73	-37.7	174.4	-56.5	-24.4	0	0	0	111.2	L433 N441 E446 H447 F448 L547	L433-Y444 HydrophobicContact CD1-CD2 4.23Å; L433-Y444 HydrophobicContact CD1-CE2 4.24Å; L433-Y444 HydrophobicContact CD1-CG 4.43Å; N441-Y444 HydrophobicContact CB-CD2 3.5Å; N441-Y444 HydrophobicContact CB-CE2 4.12Å; N441-Y444 HydrophobicContact CB-CG 3.98Å; N441-Y444 PolarHBondContact O-N 3.38Å; N441-Y444 PolarHBondContact OD1-N 3.38Å; Y444-E446 PolarHBondContact O-N 3.45Å; Y444-H447 PolarHBondContact O-N 3.17Å; Y444-H447 VanDerWaalsContact O-N 3.12Å; Y444-F448 PolarHBondContact O-N 2.84Å; Y444-F448 VanDerWaalsContact O-N 3.09Å; Y444-L547 HydrophobicContact CD1-CD1 4.05Å; Y444-L547 HydrophobicContact CG-CD1 4.49Å
445	R	89.9	Confident	83.6	Confident	50 Å²	50	51.9 Å²	51.9	19%	0.189	27%	0.27	C	S	.	.	H	α-helix	trans	-59.5	-35.3	175	-169.2	168.5	62	-139	2.6	111.6	I438 L439 N441 H447 F448 R449 I461 E465	I438-R445 WeakPolarHBondContact O-CA 3.21Å; I438-R445 VanDerWaalsContact O-CB 3.27Å; I438-R445 WeakPolarHBondContact O-CB 3.35Å; I438-R445 PolarHBondContact O-N 2.94Å; L439-R445 HydrophobicContact CD2-CG 4.38Å; L439-R445 WeakPolarHBondContact O-CD 3.3Å; L439-R445 PolarHBondContact O-NH1 3.07Å; N441-R445 VanDerWaalsContact O-CB 3.27Å; N441-R445 WeakPolarHBondContact O-CB 3.28Å; N441-R445 PolarHBondContact O-N 3.46Å; R445-H447 PolarHBondContact O-N 3.31Å; R445-F448 PolarHBondContact O-N 3.11Å; R445-R449 VanDerWaalsContact O-CB 3.3Å; R445-R449 WeakPolarHBondContact O-CB 3.06Å; R445-R449 PolarHBondContact O-N 3.24Å; R445-I461 HydrophobicContact CG-CD1 4Å; R445-E465 IonicContact NE-OE1 3.44Å; R445-E465 PolarHBondContact NE-OE1 3.19Å
446	E	85.8	Confident	83.7	Confident	97 Å²	97	57 Å²	57	45%	0.453	30%	0.298	S	S	.	.	H	α-helix	trans	-60.7	-43.3	175.5	-165.8	64.8	-120.1	0	0	112.4	P442 G443 Y444 R449 A450	P442-E446 PolarHBondContact O-N 2.88Å; P442-E446 VanDerWaalsContact O-N 3.13Å; G443-E446 WeakPolarHBondContact O-CB 3.48Å; Y444-E446 PolarHBondContact O-N 3.45Å; E446-R449 WeakPolarHBondContact O-CB 3.48Å; E446-R449 PolarHBondContact O-N 3.42Å; E446-R449 IonicContact OE1-CZ 2.99Å; E446-R449 IonicContact OE1-NH1 2.66Å; E446-R449 PolarHBondContact OE1-NH1 3.16Å; E446-R449 IonicContact OE2-CZ 3.68Å; E446-R449 IonicContact OE2-NH1 3.99Å; E446-R449 PolarHBondContact OE2-NH1 2.9Å; E446-A450 WeakPolarHBondContact O-CB 3.5Å; E446-A450 PolarHBondContact O-N 3.1Å
447	H	83.3	Confident	83.9	Confident	52 Å²	52	56.1 Å²	56.1	24%	0.241	29%	0.29	C	S	.	.	H	α-helix	trans	-70.8	-37.3	179.9	-67.8	75.1	0	0	0	111.5	G443 Y444 R445 A450 Y451 F538 L547	G443-H447 PolarHBondContact O-ND1 3.43Å; Y444-H447 PolarHBondContact O-N 3.17Å; Y444-H447 VanDerWaalsContact O-N 3.12Å; R445-H447 PolarHBondContact O-N 3.31Å; H447-A450 PolarHBondContact O-N 2.85Å; H447-Y451 PolarHBondContact O-N 3.35Å; H447-F538 HydrophobicContact CB-CZ 4.48Å; H447-L547 HydrophobicContact CB-CB 4.37Å; H447-L547 HydrophobicContact CB-CD1 3.5Å
448	F	86.8	Confident	84	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-67.7	-36.7	171.6	-171.5	-118.9	0	0	0	111.9	F435 I438 L439 Y444 R445 Y451 M452 I461 M530 F538	F435-F448 AromaticContact CE2-CE1 3.71Å; F435-F448 HydrophobicContact CE2-CE1 3.71Å; F435-F448 AromaticContact CE2-CZ 3.75Å; F435-F448 HydrophobicContact CE2-CZ 3.75Å; F435-F448 HydrophobicContact CZ-CE1 4.39Å; I438-F448 HydrophobicContact CG2-CB 3.6Å; I438-F448 HydrophobicContact CG2-CD1 4.48Å; I438-F448 HydrophobicContact CG2-CG 4.04Å; L439-F448 HydrophobicContact CD2-CD1 4.09Å; L439-F448 HydrophobicContact CD2-CE1 4.35Å; Y444-F448 PolarHBondContact O-N 2.84Å; Y444-F448 VanDerWaalsContact O-N 3.09Å; R445-F448 PolarHBondContact O-N 3.11Å; F448-Y451 HydrophobicContact CD2-CD1 4.29Å; F448-Y451 HydrophobicContact CE2-CD1 4.18Å; F448-Y451 WeakPolarHBondContact O-CB 3.45Å; F448-Y451 PolarHBondContact O-N 3.15Å; F448-M452 HydrophobicContact CD1-CG 4.24Å; F448-M452 HydrophobicContact CE1-CG 3.97Å; F448-M452 HydrophobicContact CE1-SD 4.33Å; F448-M452 HydrophobicContact CE2-CG 4.31Å; F448-M452 HydrophobicContact CE2-SD 4.36Å; F448-M452 HydrophobicContact CZ-CG 4.01Å; F448-M452 HydrophobicContact CZ-SD 3.92Å; F448-M452 WeakPolarHBondContact O-CB 3.45Å; F448-M452 WeakPolarHBondContact O-CG 3.34Å; F448-M452 PolarHBondContact O-N 2.72Å; F448-I461 HydrophobicContact CD1-CD1 4.06Å; F448-M530 HydrophobicContact CE1-CB 4.37Å; F448-M530 HydrophobicContact CE1-SD 4.44Å; F448-M530 HydrophobicContact CZ-CB 4.44Å; F448-F538 HydrophobicContact CB-CE1 4.1Å; F448-F538 HydrophobicContact CB-CZ 4.04Å; F448-F538 HydrophobicContact CD2-CB 4.02Å; F448-F538 AromaticContact CD2-CD1 3.43Å; F448-F538 HydrophobicContact CD2-CD1 3.43Å; F448-F538 VanDerWaalsContact CD2-CD1 3.43Å; F448-F538 AromaticContact CD2-CD2 3.96Å; F448-F538 HydrophobicContact CD2-CD2 3.96Å; F448-F538 AromaticContact CD2-CE1 3.71Å; F448-F538 HydrophobicContact CD2-CE1 3.71Å; F448-F538 HydrophobicContact CD2-CE2 4.22Å; F448-F538 AromaticContact CD2-CG 3.54Å; F448-F538 HydrophobicContact CD2-CG 3.54Å; F448-F538 HydrophobicContact CD2-CZ 4.1Å; F448-F538 HydrophobicContact CE2-CB 3.84Å; F448-F538 AromaticContact CE2-CD1 3.97Å; F448-F538 HydrophobicContact CE2-CD1 3.97Å; F448-F538 AromaticContact CE2-CG 3.91Å; F448-F538 HydrophobicContact CE2-CG 3.91Å; F448-F538 HydrophobicContact CG-CD1 4.43Å; F448-F538 HydrophobicContact CG-CE1 4.33Å
449	R	88.1	Confident	84	Confident	40 Å²	40	60.6 Å²	60.6	15%	0.151	30%	0.303	C	S	.	.	H	α-helix	trans	-61.3	-48.2	172.6	-170	-175.7	-59.2	118.7	-1.8	110.9	R445 E446 Y451 M452 E453 I461 E465	R445-R449 VanDerWaalsContact O-CB 3.3Å; R445-R449 WeakPolarHBondContact O-CB 3.06Å; R445-R449 PolarHBondContact O-N 3.24Å; E446-R449 WeakPolarHBondContact O-CB 3.48Å; E446-R449 PolarHBondContact O-N 3.42Å; E446-R449 IonicContact OE1-CZ 2.99Å; E446-R449 IonicContact OE1-NH1 2.66Å; E446-R449 PolarHBondContact OE1-NH1 3.16Å; E446-R449 IonicContact OE2-CZ 3.68Å; E446-R449 IonicContact OE2-NH1 3.99Å; E446-R449 PolarHBondContact OE2-NH1 2.9Å; R449-Y451 VanDerWaalsContact C-N 3.26Å; R449-Y451 PolarHBondContact O-N 2.89Å; R449-M452 CarbonylContact O-C 3.55Å; R449-M452 PolarHBondContact O-N 3.41Å; R449-M452 VanDerWaalsContact O-N 3.14Å; R449-E453 WeakPolarHBondContact O-CB 3.37Å; R449-E453 WeakPolarHBondContact O-CG 3.49Å; R449-E453 PolarHBondContact O-N 3.46Å; R449-I461 HydrophobicContact CB-CD1 3.89Å; R449-I461 HydrophobicContact CG-CD1 4.3Å; R449-I461 HydrophobicContact CG-CG2 4.03Å; R449-E465 IonicContact CZ-OE1 2.73Å; R449-E465 IonicContact NE-OE1 2.81Å; R449-E465 IonicContact NH2-OE1 3.54Å; R449-E465 PolarHBondContact NH2-OE1 3.45Å
450	A	86.8	Confident	84.1	Confident	33 Å²	33	61.1 Å²	61.1	27%	0.273	31%	0.306	S	S	.	.	H	α-helix	trans	-60.1	-37.3	177	0	0	0	0	0	111.8	E446 H447 R454	E446-A450 WeakPolarHBondContact O-CB 3.5Å; E446-A450 PolarHBondContact O-N 3.1Å; H447-A450 PolarHBondContact O-N 2.85Å; A450-R454 WeakPolarHBondContact O-CG 3.29Å; A450-R454 PolarHBondContact O-N 3.3Å
451	Y	86.8	Confident	84.4	Confident	24 Å²	24	56.6 Å²	56.6	9%	0.094	28%	0.276	C	S	.	.	H	α-helix	trans	-64.9	-49	172.1	172.6	-99.6	0	0	0	112.1	H447 F448 R449 E453 R454 I455 S537 F538 L543	H447-Y451 PolarHBondContact O-N 3.35Å; F448-Y451 HydrophobicContact CD2-CD1 4.29Å; F448-Y451 HydrophobicContact CE2-CD1 4.18Å; F448-Y451 WeakPolarHBondContact O-CB 3.45Å; F448-Y451 PolarHBondContact O-N 3.15Å; R449-Y451 VanDerWaalsContact C-N 3.26Å; R449-Y451 PolarHBondContact O-N 2.89Å; Y451-E453 PolarHBondContact O-N 3.22Å; Y451-R454 WeakPolarHBondContact O-CB 3.26Å; Y451-R454 PolarHBondContact O-N 3.25Å; Y451-I455 HydrophobicContact CD1-CD1 4.27Å; Y451-I455 HydrophobicContact CE1-CD1 3.67Å; Y451-I455 HydrophobicContact CE1-CG1 4.47Å; Y451-I455 HydrophobicContact CE2-CG2 4.15Å; Y451-I455 WeakPolarHBondContact O-CG1 3.47Å; Y451-I455 PolarHBondContact O-N 2.63Å; Y451-I455 VanDerWaalsContact O-N 3.12Å; Y451-S537 WeakPolarHBondContact OH-CB 3.26Å; Y451-F538 HydrophobicContact CD1-CB 3.8Å; Y451-F538 AromaticContact CD1-CD2 3.71Å; Y451-F538 HydrophobicContact CD1-CD2 3.71Å; Y451-F538 HydrophobicContact CD1-CG 4.1Å; Y451-F538 AromaticContact CD2-CD2 3.85Å; Y451-F538 HydrophobicContact CD2-CD2 3.85Å; Y451-F538 HydrophobicContact CE1-CB 3.71Å; Y451-F538 HydrophobicContact CE1-CD2 4.4Å; Y451-F538 HydrophobicContact CE1-CG 4.49Å; Y451-F538 HydrophobicContact CG-CB 4.27Å; Y451-F538 AromaticContact CG-CD2 3.4Å; Y451-F538 HydrophobicContact CG-CD2 3.4Å; Y451-F538 VanDerWaalsContact CG-CD2 3.4Å; Y451-F538 HydrophobicContact CG-CE2 4.12Å; Y451-F538 HydrophobicContact CG-CG 4.23Å; Y451-L543 HydrophobicContact CD2-CD1 4.1Å; Y451-L543 HydrophobicContact CG-CD1 4.37Å
452	M	84.1	Confident	84.6	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.9	-32.4	177.4	-69.4	-68.4	-73.6	0	0	112	F448 R449 I455 D456 K457 R458 L460 I461 M530 Y534	F448-M452 HydrophobicContact CD1-CG 4.24Å; F448-M452 HydrophobicContact CE1-CG 3.97Å; F448-M452 HydrophobicContact CE1-SD 4.33Å; F448-M452 HydrophobicContact CE2-CG 4.31Å; F448-M452 HydrophobicContact CE2-SD 4.36Å; F448-M452 HydrophobicContact CZ-CG 4.01Å; F448-M452 HydrophobicContact CZ-SD 3.92Å; F448-M452 WeakPolarHBondContact O-CB 3.45Å; F448-M452 WeakPolarHBondContact O-CG 3.34Å; F448-M452 PolarHBondContact O-N 2.72Å; R449-M452 CarbonylContact O-C 3.55Å; R449-M452 PolarHBondContact O-N 3.41Å; R449-M452 VanDerWaalsContact O-N 3.14Å; M452-I455 WeakPolarHBondContact O-CG1 2.79Å; M452-I455 HydrophobicContact SD-CD1 3.92Å; M452-D456 PolarHBondContact O-N 3.4Å; M452-K457 HydrophobicContact CE-CB 3.68Å; M452-K457 CarbonylContact O-C 3.51Å; M452-K457 WeakPolarHBondContact O-CA 3.46Å; M452-K457 PolarHBondContact O-N 2.92Å; M452-K457 HydrophobicContact SD-CB 4.4Å; M452-R458 PolarHBondContact O-N 3.44Å; M452-L460 HydrophobicContact CE-CB 4.09Å; M452-L460 HydrophobicContact CE-CD1 4.12Å; M452-I461 HydrophobicContact CB-CG2 4.47Å; M452-M530 HydrophobicContact CE-CG 3.8Å; M452-M530 HydrophobicContact CE-SD 4.02Å; M452-Y534 HydrophobicContact CE-CD2 3.65Å; M452-Y534 HydrophobicContact CE-CE2 4.23Å; M452-Y534 HydrophobicContact CE-CG 4.11Å; M452-Y534 VanDerWaalsContact SD-CB 3.53Å; M452-Y534 HydrophobicContact SD-CD2 3.94Å; M452-Y534 HydrophobicContact SD-CG 3.77Å
453	E	86.8	Confident	85.1	Confident	81 Å²	81	51 Å²	51	38%	0.379	24%	0.244	S	C	.	.	H	α-helix	trans	-68.4	-42.8	171.7	-77.2	179.3	178.9	0	0	111.9	R449 Y451 I455 D456 R458	R449-E453 WeakPolarHBondContact O-CB 3.37Å; R449-E453 WeakPolarHBondContact O-CG 3.49Å; R449-E453 PolarHBondContact O-N 3.46Å; Y451-E453 PolarHBondContact O-N 3.22Å; E453-I455 VanDerWaalsContact C-N 3.25Å; E453-I455 PolarHBondContact O-N 2.89Å; E453-D456 PolarHBondContact O-N 3.18Å; E453-D456 VanDerWaalsContact O-N 3.09Å; E453-R458 HydrophobicContact CG-CB 3.88Å; E453-R458 HydrophobicContact CG-CG 3.66Å; E453-R458 WeakPolarHBondContact OE1-CD 3.03Å; E453-R458 IonicContact OE1-CZ 3.13Å; E453-R458 IonicContact OE1-NE 2.76Å; E453-R458 PolarHBondContact OE1-NE 3.49Å; E453-R458 IonicContact OE1-NH2 2.76Å
454	R	82.8	Confident	85.7	Confident	140 Å²	140	50.8 Å²	50.8	53%	0.528	23%	0.231	S	C	.	.	H	α-helix	trans	-61.7	-32.4	176.5	-75.6	-171.6	-173.7	-174.7	-11.2	113.6	A450 Y451 D456 D542 L543 R546	A450-R454 WeakPolarHBondContact O-CG 3.29Å; A450-R454 PolarHBondContact O-N 3.3Å; Y451-R454 WeakPolarHBondContact O-CB 3.26Å; Y451-R454 PolarHBondContact O-N 3.25Å; R454-D456 VanDerWaalsContact C-N 3.32Å; R454-D542 IonicContact CZ-OD2 3.88Å; R454-D542 IonicContact NH1-OD1 3.19Å; R454-D542 PolarHBondContact NH1-OD1 3.15Å; R454-D542 IonicContact NH1-OD2 2.8Å; R454-D542 PolarHBondContact NH1-OD2 3.44Å; R454-L543 HydrophobicContact CG-CD1 4.33Å; R454-R546 VanDerWaalsContact CZ-NH2 3.26Å
455	I	77.8	Confident	85.9	Confident	58 Å²	58	50.3 Å²	50.3	30%	0.297	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	12.5	178.5	66.3	169.1	0	0	0	113	Y451 M452 E453 K457 Y534	Y451-I455 HydrophobicContact CD1-CD1 4.27Å; Y451-I455 HydrophobicContact CE1-CD1 3.67Å; Y451-I455 HydrophobicContact CE1-CG1 4.47Å; Y451-I455 HydrophobicContact CE2-CG2 4.15Å; Y451-I455 WeakPolarHBondContact O-CG1 3.47Å; Y451-I455 PolarHBondContact O-N 2.63Å; Y451-I455 VanDerWaalsContact O-N 3.12Å; M452-I455 WeakPolarHBondContact O-CG1 2.79Å; M452-I455 HydrophobicContact SD-CD1 3.92Å; E453-I455 VanDerWaalsContact C-N 3.25Å; E453-I455 PolarHBondContact O-N 2.89Å; I455-K457 HydrophobicContact CD1-CB 4.38Å; I455-K457 HydrophobicContact CD1-CG 4.23Å; I455-K457 HydrophobicContact CG1-CB 4.15Å; I455-K457 HydrophobicContact CG1-CG 4.1Å; I455-K457 PolarHBondContact O-N 2.83Å; I455-Y534 HydrophobicContact CD1-CD1 3.41Å; I455-Y534 VanDerWaalsContact CD1-CD1 3.41Å; I455-Y534 HydrophobicContact CD1-CE1 4Å; I455-Y534 HydrophobicContact CD1-CG 3.96Å
456	D	79.6	Confident	85.8	Confident	114 Å²	114	48.9 Å²	48.9	61%	0.61	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.5	46.8	177.4	-165.7	41.5	0	0	0	113.2	M452 E453 R454	M452-D456 PolarHBondContact O-N 3.4Å; E453-D456 PolarHBondContact O-N 3.18Å; E453-D456 VanDerWaalsContact O-N 3.09Å; R454-D456 VanDerWaalsContact C-N 3.32Å
457	K	84.8	Confident	85.9	Confident	61 Å²	61	44.2 Å²	44.2	27%	0.265	21%	0.205	S	C	.	.			trans	-131.3	25.4	-179.8	-63	-68.8	159.3	-101.4	0	113.5	M452 I455 T459 L460 Y534	M452-K457 HydrophobicContact CE-CB 3.68Å; M452-K457 CarbonylContact O-C 3.51Å; M452-K457 WeakPolarHBondContact O-CA 3.46Å; M452-K457 PolarHBondContact O-N 2.92Å; M452-K457 HydrophobicContact SD-CB 4.4Å; I455-K457 HydrophobicContact CD1-CB 4.38Å; I455-K457 HydrophobicContact CD1-CG 4.23Å; I455-K457 HydrophobicContact CG1-CB 4.15Å; I455-K457 HydrophobicContact CG1-CG 4.1Å; I455-K457 PolarHBondContact O-N 2.83Å; K457-T459 PolarHBondContact O-N 2.9Å; K457-L460 HydrophobicContact CB-CD1 4.33Å; K457-L460 HydrophobicContact CD-CD1 4.36Å; K457-L460 PolarHBondContact O-N 3.01Å; K457-Y534 HydrophobicContact CD-CE1 4.45Å; K457-Y534 WeakPolarHBondContact CD-OH 3.03Å; K457-Y534 HydrophobicContact CG-CE1 3.98Å; K457-Y534 HydrophobicContact CG-CE2 4.41Å
458	R	84.3	Confident	86.1	Confident	156 Å²	156	44.9 Å²	44.9	59%	0.589	21%	0.208	S	C	*	.	H	α-helix	trans	-55.3	-33.1	179.5	-169.2	-173.7	-167.1	-148.2	-2.5	113.8	M452 E453 L460 I461 S462	M452-R458 PolarHBondContact O-N 3.44Å; E453-R458 HydrophobicContact CG-CB 3.88Å; E453-R458 HydrophobicContact CG-CG 3.66Å; E453-R458 WeakPolarHBondContact OE1-CD 3.03Å; E453-R458 IonicContact OE1-CZ 3.13Å; E453-R458 IonicContact OE1-NE 2.76Å; E453-R458 PolarHBondContact OE1-NE 3.49Å; E453-R458 IonicContact OE1-NH2 2.76Å; R458-L460 PolarHBondContact O-N 2.68Å; R458-I461 VanDerWaalsContact O-CG2 3.22Å; R458-I461 WeakPolarHBondContact O-CG2 3.44Å; R458-I461 PolarHBondContact O-N 3.25Å; R458-S462 PolarHBondContact O-N 3.05Å; R458-S462 VanDerWaalsContact O-N 3.12Å
459	T	83.5	Confident	86	Confident	23 Å²	23	50 Å²	50	14%	0.141	23%	0.234	C	C	.	.	H	α-helix	trans	-62.8	-32	-176.9	-49.4	0	0	0	0	112.7	K457 S462 F463 F489 E495 I496	K457-T459 PolarHBondContact O-N 2.9Å; T459-S462 PolarHBondContact O-N 2.99Å; T459-F463 WeakPolarHBondContact O-CB 2.98Å; T459-F463 PolarHBondContact O-N 3.3Å; T459-F489 HydrophobicContact CG2-CD1 3.64Å; T459-F489 HydrophobicContact CG2-CE1 3.86Å; T459-E495 WeakPolarHBondContact CB-OE2 3.15Å; T459-E495 HydrophobicContact CG2-CB 4.19Å; T459-E495 PolarHBondContact OG1-OE1 3.16Å; T459-E495 PolarHBondContact OG1-OE2 3Å; T459-I496 HydrophobicContact CG2-CG1 4.49Å
460	L	85.6	Confident	85.9	Confident	14 Å²	14	48.4 Å²	48.4	7%	0.073	23%	0.228	C	C	.	.	H	α-helix	trans	-67	-45.5	-179.3	-64.1	178.7	0	0	0	111.8	M452 K457 R458 W464 I496 V526 T529 M530 Y534	M452-L460 HydrophobicContact CE-CB 4.09Å; M452-L460 HydrophobicContact CE-CD1 4.12Å; K457-L460 HydrophobicContact CB-CD1 4.33Å; K457-L460 HydrophobicContact CD-CD1 4.36Å; K457-L460 PolarHBondContact O-N 3.01Å; R458-L460 PolarHBondContact O-N 2.68Å; L460-W464 PolarHBondContact O-N 2.91Å; L460-I496 HydrophobicContact CD2-CG1 4.29Å; L460-V526 HydrophobicContact CB-CG1 4Å; L460-V526 HydrophobicContact CD2-CG1 4.13Å; L460-V526 HydrophobicContact CD2-CG2 4.47Å; L460-V526 WeakPolarHBondContact O-CG1 3.27Å; L460-T529 HydrophobicContact CD1-CG2 4.44Å; L460-M530 HydrophobicContact CB-CG 4Å; L460-M530 HydrophobicContact CB-SD 3.92Å; L460-M530 HydrophobicContact CD1-CG 4.47Å; L460-Y534 HydrophobicContact CD1-CD2 4.17Å; L460-Y534 HydrophobicContact CD1-CE2 3.43Å; L460-Y534 VanDerWaalsContact CD1-CE2 3.43Å
461	I	87.6	Confident	85.8	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-72.2	-34.8	178.8	-167.6	167.7	0	0	0	111.5	R445 F448 R449 M452 R458 W464 E465 M530	R445-I461 HydrophobicContact CG-CD1 4Å; F448-I461 HydrophobicContact CD1-CD1 4.06Å; R449-I461 HydrophobicContact CB-CD1 3.89Å; R449-I461 HydrophobicContact CG-CD1 4.3Å; R449-I461 HydrophobicContact CG-CG2 4.03Å; M452-I461 HydrophobicContact CB-CG2 4.47Å; R458-I461 VanDerWaalsContact O-CG2 3.22Å; R458-I461 WeakPolarHBondContact O-CG2 3.44Å; R458-I461 PolarHBondContact O-N 3.25Å; I461-W464 PolarHBondContact O-N 3Å; I461-E465 WeakPolarHBondContact O-CG 3.15Å; I461-E465 PolarHBondContact O-N 3.21Å; I461-E465 VanDerWaalsContact O-N 3.16Å; I461-M530 HydrophobicContact CB-SD 3.89Å; I461-M530 HydrophobicContact CG1-SD 4.45Å
462	S	88.1	Confident	85.5	Confident	30 Å²	30	56.3 Å²	56.3	21%	0.21	27%	0.267	C	S	.	.	H	α-helix	trans	-66.9	-36.5	175.5	-176	0	0	0	0	113.3	R458 T459 E465 L466	R458-S462 PolarHBondContact O-N 3.05Å; R458-S462 VanDerWaalsContact O-N 3.12Å; T459-S462 PolarHBondContact O-N 2.99Å; S462-E465 PolarHBondContact O-N 3.13Å; S462-L466 PolarHBondContact O-N 3.17Å
463	F	90.7	Very high	85.3	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-65.6	-42.5	173.8	175	-93.6	0	0	0	111.7	T459 E465 L466 V467 I485 F489 F490 I496 L522 Q523 V526	T459-F463 WeakPolarHBondContact O-CB 2.98Å; T459-F463 PolarHBondContact O-N 3.3Å; F463-E465 VanDerWaalsContact C-N 3.28Å; F463-E465 PolarHBondContact O-N 3.27Å; F463-L466 PolarHBondContact O-N 3.44Å; F463-V467 HydrophobicContact CD1-CG2 4.28Å; F463-V467 HydrophobicContact CD2-CG2 4.5Å; F463-V467 HydrophobicContact CE1-CG2 3.83Å; F463-V467 HydrophobicContact CE2-CG2 4.07Å; F463-V467 HydrophobicContact CZ-CG2 3.72Å; F463-V467 WeakPolarHBondContact O-CG2 3.43Å; F463-V467 PolarHBondContact O-N 3Å; F463-V467 VanDerWaalsContact O-N 3.14Å; F463-I485 HydrophobicContact CD2-CG2 4.22Å; F463-I485 HydrophobicContact CE2-CG2 3.71Å; F463-F489 HydrophobicContact CB-CD1 4.03Å; F463-F489 HydrophobicContact CB-CD2 4.45Å; F463-F489 HydrophobicContact CB-CE1 3.8Å; F463-F489 HydrophobicContact CB-CE2 4.19Å; F463-F489 HydrophobicContact CB-CG 4.34Å; F463-F489 HydrophobicContact CB-CZ 3.88Å; F463-F489 HydrophobicContact CD2-CB 4.02Å; F463-F489 HydrophobicContact CD2-CD1 4.23Å; F463-F489 AromaticContact CD2-CD2 3.61Å; F463-F489 HydrophobicContact CD2-CD2 3.61Å; F463-F489 AromaticContact CD2-CE2 3.99Å; F463-F489 HydrophobicContact CD2-CE2 3.99Å; F463-F489 AromaticContact CD2-CG 3.7Å; F463-F489 HydrophobicContact CD2-CG 3.7Å; F463-F489 HydrophobicContact CD2-CZ 4.5Å; F463-F489 HydrophobicContact CE2-CD2 4.42Å; F463-F490 AromaticContact CE2-CE2 3.95Å; F463-F490 HydrophobicContact CE2-CE2 3.95Å; F463-F490 AromaticContact CE2-CZ 4Å; F463-F490 HydrophobicContact CE2-CZ 4Å; F463-F490 HydrophobicContact CZ-CZ 4.48Å; F463-I496 HydrophobicContact CB-CD1 3.41Å; F463-I496 VanDerWaalsContact CB-CD1 3.41Å; F463-I496 HydrophobicContact CD1-CD1 3.9Å; F463-I496 HydrophobicContact CD2-CD1 3.38Å; F463-I496 HydrophobicContact CE2-CD1 4.09Å; F463-I496 HydrophobicContact CG-CD1 3.27Å; F463-L522 HydrophobicContact CE1-CB 3.94Å; F463-L522 HydrophobicContact CZ-CB 3.68Å; F463-Q523 HydrophobicContact CE1-CB 4.43Å; F463-V526 HydrophobicContact CD1-CB 3.91Å; F463-V526 HydrophobicContact CD1-CG1 4.02Å; F463-V526 HydrophobicContact CD1-CG2 3.63Å; F463-V526 HydrophobicContact CE1-CB 4.25Å; F463-V526 HydrophobicContact CE1-CG2 3.81Å
464	W	91.5	Very high	85	Confident	32 Å²	32	58.6 Å²	58.6	12%	0.121	29%	0.285	C	S	.	.	H	α-helix	trans	-58.8	-40.9	177.8	-173.7	90.2	0	0	0	112.1	L439 L460 I461 E468 Q523 M530	L439-W464 HydrophobicContact CB-CH2 4.24Å; L439-W464 HydrophobicContact CB-CZ2 4.39Å; L439-W464 HydrophobicContact CD1-CD2 4.46Å; L439-W464 HydrophobicContact CD1-CZ2 4.15Å; L460-W464 PolarHBondContact O-N 2.91Å; I461-W464 PolarHBondContact O-N 3Å; W464-E468 PolarHBondContact O-N 2.84Å; W464-Q523 HydrophobicContact CG-CG 4.07Å; W464-Q523 PolarHBondContact O-NE2 3.33Å; W464-M530 HydrophobicContact CB-CE 3.74Å; W464-M530 HydrophobicContact CG-CE 3.92Å
465	E	88.6	Confident	84.4	Confident	51 Å²	51	61.6 Å²	61.6	24%	0.238	30%	0.302	C	S	.	.	H	α-helix	trans	-66	-41.8	178.1	-70	174	153.8	0	0	113	R445 R449 I461 S462 F463 E468 M469	R445-E465 IonicContact NE-OE1 3.44Å; R445-E465 PolarHBondContact NE-OE1 3.19Å; R449-E465 IonicContact CZ-OE1 2.73Å; R449-E465 IonicContact NE-OE1 2.81Å; R449-E465 IonicContact NH2-OE1 3.54Å; R449-E465 PolarHBondContact NH2-OE1 3.45Å; I461-E465 WeakPolarHBondContact O-CG 3.15Å; I461-E465 PolarHBondContact O-N 3.21Å; I461-E465 VanDerWaalsContact O-N 3.16Å; S462-E465 PolarHBondContact O-N 3.13Å; F463-E465 VanDerWaalsContact C-N 3.28Å; F463-E465 PolarHBondContact O-N 3.27Å; E465-E468 PolarHBondContact O-N 3.25Å; E465-M469 PolarHBondContact O-N 2.99Å
466	L	88.1	Confident	84	Confident	19 Å²	19	63.6 Å²	63.6	10%	0.099	32%	0.321	C	S	.	.	H	α-helix	trans	-70.6	-32.4	-179.7	-76.6	-178.9	0	0	0	113.1	S462 F463 M469 L470 I485 K488 F489	S462-L466 PolarHBondContact O-N 3.17Å; F463-L466 PolarHBondContact O-N 3.44Å; L466-M469 HydrophobicContact CD2-CE 3.35Å; L466-M469 PolarHBondContact O-N 2.87Å; L466-L470 PolarHBondContact O-N 2.97Å; L466-I485 HydrophobicContact CB-CG1 4.2Å; L466-K488 HydrophobicContact CD1-CD 3.77Å; L466-F489 HydrophobicContact CB-CE2 4.23Å; L466-F489 HydrophobicContact CD1-CE2 3.38Å; L466-F489 HydrophobicContact CD1-CZ 3.75Å; L466-F489 HydrophobicContact CG-CE2 4.28Å
467	V	88.2	Confident	83.7	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-72.8	-31.6	173.7	-177.5	0	0	0	0	111.7	F463 M469 L470 K471 I485 F519 Q523	F463-V467 HydrophobicContact CD1-CG2 4.28Å; F463-V467 HydrophobicContact CD2-CG2 4.5Å; F463-V467 HydrophobicContact CE1-CG2 3.83Å; F463-V467 HydrophobicContact CE2-CG2 4.07Å; F463-V467 HydrophobicContact CZ-CG2 3.72Å; F463-V467 WeakPolarHBondContact O-CG2 3.43Å; F463-V467 PolarHBondContact O-N 3Å; F463-V467 VanDerWaalsContact O-N 3.14Å; V467-M469 PolarHBondContact O-N 3.41Å; V467-L470 WeakPolarHBondContact O-CB 3.23Å; V467-L470 PolarHBondContact O-N 2.79Å; V467-K471 PolarHBondContact O-N 3.4Å; V467-K471 VanDerWaalsContact O-N 3.15Å; V467-I485 HydrophobicContact CG2-CD1 4.18Å; V467-F519 HydrophobicContact CG1-CB 4.21Å; V467-F519 HydrophobicContact CG2-CB 4.33Å; V467-Q523 HydrophobicContact CB-CB 3.75Å; V467-Q523 HydrophobicContact CB-CG 3.9Å; V467-Q523 HydrophobicContact CG1-CB 3.56Å; V467-Q523 HydrophobicContact CG1-CG 4.02Å; V467-Q523 HydrophobicContact CG2-CB 4.12Å
468	E	87.6	Confident	83.4	Confident	65 Å²	65	60.7 Å²	60.7	30%	0.304	31%	0.307	S	S	.	.	H	α-helix	trans	-63.9	-34.7	175.4	-157	58.8	-152.6	0	0	111.1	W464 E465 K471 Q523	W464-E468 PolarHBondContact O-N 2.84Å; E465-E468 PolarHBondContact O-N 3.25Å; E468-K471 VanDerWaalsContact CD-NZ 3.3Å; E468-K471 PolarHBondContact O-N 2.97Å; E468-K471 IonicContact OE1-NZ 3.6Å; E468-K471 PolarHBondContact OE1-NZ 3.4Å; E468-K471 IonicContact OE2-NZ 3.81Å; E468-K471 PolarHBondContact OE2-NZ 3.44Å; E468-Q523 VanDerWaalsContact N-NE2 3.19Å; E468-Q523 PolarHBondContact OE2-NE2 3.5Å; E468-Q523 PolarHBondContact OE2-OE1 3.45Å
469	M	84.3	Confident	83.1	Confident	107 Å²	107	55.8 Å²	55.8	53%	0.527	30%	0.295	S	S	.	.	H	α-helix	trans	-68.5	-34.5	171	-60.3	-161.7	-45.4	0	0	113.3	E465 L466 V467 K471 T472 A473	E465-M469 PolarHBondContact O-N 2.99Å; L466-M469 HydrophobicContact CD2-CE 3.35Å; L466-M469 PolarHBondContact O-N 2.87Å; V467-M469 PolarHBondContact O-N 3.41Å; M469-K471 VanDerWaalsContact C-N 3.31Å; M469-K471 PolarHBondContact O-N 3.28Å; M469-T472 PolarHBondContact O-N 2.96Å; M469-T472 PolarHBondContact O-OG1 3.39Å; M469-A473 PolarHBondContact O-N 3.11Å
470	L	86.6	Confident	82.9	Confident	7 Å²	7	61.7 Å²	61.7	4%	0.037	32%	0.321	C	S	.	.	H	α-helix	trans	-63.5	-36	176.7	178	64.5	0	0	0	112.2	L466 V467 T472 A473 V478 I481 V482 I485 T516 F519	L466-L470 PolarHBondContact O-N 2.97Å; V467-L470 WeakPolarHBondContact O-CB 3.23Å; V467-L470 PolarHBondContact O-N 2.79Å; L470-T472 PolarHBondContact O-N 3.34Å; L470-A473 PolarHBondContact O-N 3.44Å; L470-V478 HydrophobicContact CD1-CG2 4.44Å; L470-I481 HydrophobicContact CB-CG2 3.8Å; L470-I481 HydrophobicContact CD1-CB 3.88Å; L470-I481 HydrophobicContact CD1-CG2 3.73Å; L470-I481 HydrophobicContact CG-CG2 4.3Å; L470-V482 HydrophobicContact CD1-CG2 4.03Å; L470-V482 HydrophobicContact CD2-CG2 4.23Å; L470-I485 HydrophobicContact CB-CD1 4.24Å; L470-I485 HydrophobicContact CD2-CD1 4.01Å; L470-T516 HydrophobicContact CD1-CG2 4.35Å; L470-T516 HydrophobicContact CD2-CG2 4.29Å; L470-F519 HydrophobicContact CD2-CB 3.71Å; L470-F519 HydrophobicContact CD2-CD2 3.94Å; L470-F519 HydrophobicContact CD2-CG 3.96Å
471	K	84.1	Confident	82.7	Confident	107 Å²	107	62.4 Å²	62.4	47%	0.465	33%	0.325	S	S	.	.	H	α-helix	trans	-64.8	-29.2	-179.1	-73.9	166.8	62.1	-160.2	0	112.9	V467 E468 M469 V520	V467-K471 PolarHBondContact O-N 3.4Å; V467-K471 VanDerWaalsContact O-N 3.15Å; E468-K471 VanDerWaalsContact CD-NZ 3.3Å; E468-K471 PolarHBondContact O-N 2.97Å; E468-K471 IonicContact OE1-NZ 3.6Å; E468-K471 PolarHBondContact OE1-NZ 3.4Å; E468-K471 IonicContact OE2-NZ 3.81Å; E468-K471 PolarHBondContact OE2-NZ 3.44Å; M469-K471 VanDerWaalsContact C-N 3.31Å; M469-K471 PolarHBondContact O-N 3.28Å; K471-V520 HydrophobicContact CD-CG2 4.29Å; K471-V520 HydrophobicContact CG-CG2 3.89Å
472	T	81.2	Confident	82.5	Confident	117 Å²	117	62.6 Å²	62.6	72%	0.718	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	7.2	-178.6	56.5	0	0	0	0	113.4	M469 L470	M469-T472 PolarHBondContact O-N 2.96Å; M469-T472 PolarHBondContact O-OG1 3.39Å; L470-T472 PolarHBondContact O-N 3.34Å
473	A	80.6	Confident	82.2	Confident	24 Å²	24	62.2 Å²	62.2	20%	0.198	33%	0.327	C	S	.	.			trans	-87.1	150.9	-174.4	0	0	0	0	0	113.8	M469 L470 E477 I481	M469-A473 PolarHBondContact O-N 3.11Å; L470-A473 PolarHBondContact O-N 3.44Å; A473-E477 HydrophobicContact CB-CB 4.43Å; A473-I481 HydrophobicContact CB-CD1 3.3Å
474	N	79.2	Confident	81.8	Confident	104 Å²	104	67 Å²	67	56%	0.556	35%	0.349	S	S	*	.			trans	-73.1	153.5	178.7	-62.5	-60.9	0	0	0	112	S476 E477 V478	N474-S476 PolarHBondContact O-N 3.46Å; N474-E477 HydrophobicContact CB-CG 4.38Å; N474-E477 WeakPolarHBondContact CB-OE2 3.39Å; N474-E477 PolarHBondContact N-OE2 3.22Å; N474-E477 VanDerWaalsContact N-OE2 3.11Å; N474-E477 PolarHBondContact ND2-OE2 3.32Å; N474-E477 PolarHBondContact O-N 2.94Å; N474-V478 PolarHBondContact O-N 3.3Å
475	K	70.2	Confident	81.4	Confident	203 Å²	203	65.5 Å²	65.5	88%	0.883	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-27.2	-177.9	-72.5	-174.9	179.9	178.6	0	114.3
476	S	69.9	Low	81.2	Confident	101 Å²	101	64.8 Å²	64.8	71%	0.706	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-24.5	176.1	51.2	0	0	0	0	114.2	N474	N474-S476 PolarHBondContact O-N 3.46Å
477	E	73.4	Confident	80.9	Confident	84 Å²	84	67.6 Å²	67.6	39%	0.393	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-19.6	-177	-62.9	170.8	148.9	0	0	111.9	A473 N474 Q480 I481	A473-E477 HydrophobicContact CB-CB 4.43Å; N474-E477 HydrophobicContact CB-CG 4.38Å; N474-E477 WeakPolarHBondContact CB-OE2 3.39Å; N474-E477 PolarHBondContact N-OE2 3.22Å; N474-E477 VanDerWaalsContact N-OE2 3.11Å; N474-E477 PolarHBondContact ND2-OE2 3.32Å; N474-E477 PolarHBondContact O-N 2.94Å; E477-Q480 WeakPolarHBondContact O-CB 3Å; E477-Q480 PolarHBondContact O-N 3.03Å; E477-Q480 VanDerWaalsContact O-N 3.08Å; E477-I481 HydrophobicContact CB-CD1 4.37Å; E477-I481 PolarHBondContact O-N 3.35Å; E477-I481 VanDerWaalsContact O-N 3.12Å
478	V	78.4	Confident	80.5	Confident	30 Å²	30	71.5 Å²	71.5	18%	0.182	37%	0.369	C	S	.	.	H	α-helix	trans	-51.6	-48.8	178.9	165	0	0	0	0	113.1	L470 N474 Q480 I481 V482 T516	L470-V478 HydrophobicContact CD1-CG2 4.44Å; N474-V478 PolarHBondContact O-N 3.3Å; V478-Q480 PolarHBondContact O-N 2.94Å; V478-I481 PolarHBondContact O-N 3.45Å; V478-V482 HydrophobicContact CG1-CG2 4.18Å; V478-V482 VanDerWaalsContact O-CB 3.26Å; V478-V482 WeakPolarHBondContact O-CB 3.48Å; V478-V482 WeakPolarHBondContact O-CG2 3.26Å; V478-V482 PolarHBondContact O-N 3.49Å; V478-T516 HydrophobicContact CG1-CG2 3.38Å
479	P	77.6	Confident	80.3	Confident	53 Å²	53	68.7 Å²	68.7	34%	0.344	36%	0.355	S	S	.	.	H	α-helix	trans	-62.6	-28.3	-179.7	-23	35	0	0	0	113.7	G483	P479-G483 PolarHBondContact O-N 3.07Å
480	Q	79.5	Confident	80.1	Confident	146 Å²	146	64.9 Å²	64.9	68%	0.682	34%	0.336	S	S	*	.	H	α-helix	trans	-78.2	-47.7	-179.5	-175.4	176.3	-6.2	0	0	111.6	E477 V478 V482 G483 E484	E477-Q480 WeakPolarHBondContact O-CB 3Å; E477-Q480 PolarHBondContact O-N 3.03Å; E477-Q480 VanDerWaalsContact O-N 3.08Å; V478-Q480 PolarHBondContact O-N 2.94Å; Q480-V482 VanDerWaalsContact C-N 3.33Å; Q480-V482 PolarHBondContact O-N 3.42Å; Q480-G483 WeakPolarHBondContact O-CA 3.48Å; Q480-G483 PolarHBondContact O-N 3.1Å; Q480-G483 VanDerWaalsContact O-N 3.12Å; Q480-E484 PolarHBondContact O-N 3.42Å
481	I	82.4	Confident	79.6	Confident	30 Å²	30	68 Å²	68	15%	0.154	36%	0.355	C	S	.	.	H	α-helix	trans	-65.7	-38.6	178.6	-61	168	0	0	0	110.5	L470 A473 E477 V478 G483 E484 I485	L470-I481 HydrophobicContact CB-CG2 3.8Å; L470-I481 HydrophobicContact CD1-CB 3.88Å; L470-I481 HydrophobicContact CD1-CG2 3.73Å; L470-I481 HydrophobicContact CG-CG2 4.3Å; A473-I481 HydrophobicContact CB-CD1 3.3Å; E477-I481 HydrophobicContact CB-CD1 4.37Å; E477-I481 PolarHBondContact O-N 3.35Å; E477-I481 VanDerWaalsContact O-N 3.12Å; V478-I481 PolarHBondContact O-N 3.45Å; I481-G483 VanDerWaalsContact C-N 3.3Å; I481-G483 PolarHBondContact O-N 3.07Å; I481-E484 PolarHBondContact O-N 3.43Å; I481-I485 HydrophobicContact CG2-CD1 3.92Å; I481-I485 HydrophobicContact CG2-CG1 4.44Å; I481-I485 WeakPolarHBondContact O-CG1 3.47Å; I481-I485 PolarHBondContact O-N 3.23Å
482	V	83	Confident	79.2	Confident	4 Å²	4	69.3 Å²	69.3	2%	0.024	36%	0.363	C	S	.	.	H	α-helix	trans	-60.4	-40.7	172.1	165.5	0	0	0	0	111.4	L470 V478 Q480 Y486 L510 T516 F519	L470-V482 HydrophobicContact CD1-CG2 4.03Å; L470-V482 HydrophobicContact CD2-CG2 4.23Å; V478-V482 HydrophobicContact CG1-CG2 4.18Å; V478-V482 VanDerWaalsContact O-CB 3.26Å; V478-V482 WeakPolarHBondContact O-CB 3.48Å; V478-V482 WeakPolarHBondContact O-CG2 3.26Å; V478-V482 PolarHBondContact O-N 3.49Å; Q480-V482 VanDerWaalsContact C-N 3.33Å; Q480-V482 PolarHBondContact O-N 3.42Å; V482-Y486 WeakPolarHBondContact O-CB 3.19Å; V482-Y486 PolarHBondContact O-N 3.3Å; V482-L510 HydrophobicContact CG1-CB 4.39Å; V482-L510 HydrophobicContact CG1-CD1 4.07Å; V482-T516 HydrophobicContact CG2-CG2 3.74Å; V482-F519 HydrophobicContact CB-CE2 4.13Å; V482-F519 HydrophobicContact CB-CZ 4.39Å; V482-F519 HydrophobicContact CG1-CE2 3.58Å; V482-F519 HydrophobicContact CG1-CZ 3.69Å; V482-F519 HydrophobicContact CG2-CD2 4.11Å; V482-F519 HydrophobicContact CG2-CE2 3.69Å; V482-F519 HydrophobicContact CG2-CZ 4.39Å
483	G	80.3	Confident	78.3	Confident	23 Å²	23	64.9 Å²	64.9	24%	0.237	34%	0.336	C	S	.	.	H	α-helix	trans	-62.5	-42.2	174.1	0	0	0	0	0	113.1	P479 Q480 I481 Y486 Q487	P479-G483 PolarHBondContact O-N 3.07Å; Q480-G483 WeakPolarHBondContact O-CA 3.48Å; Q480-G483 PolarHBondContact O-N 3.1Å; Q480-G483 VanDerWaalsContact O-N 3.12Å; I481-G483 VanDerWaalsContact C-N 3.3Å; I481-G483 PolarHBondContact O-N 3.07Å; G483-Y486 PolarHBondContact O-N 3.21Å; G483-Q487 WeakPolarHBondContact O-CB 3.29Å; G483-Q487 PolarHBondContact O-N 3.36Å
484	E	82.7	Confident	77.5	Confident	100 Å²	100	72.7 Å²	72.7	47%	0.467	37%	0.366	S	S	.	.	H	α-helix	trans	-67.8	-45.2	178.8	-170.3	179.8	165.2	0	0	112.4	Q480 I481 Y486 Q487 K488	Q480-E484 PolarHBondContact O-N 3.42Å; I481-E484 PolarHBondContact O-N 3.43Å; E484-Y486 VanDerWaalsContact C-N 3.31Å; E484-Y486 PolarHBondContact O-N 3.4Å; E484-Q487 PolarHBondContact O-N 3.38Å; E484-K488 VanDerWaalsContact O-CB 3.31Å; E484-K488 WeakPolarHBondContact O-CB 3.43Å; E484-K488 PolarHBondContact O-N 3.5Å
485	I	84.5	Confident	76.7	Confident	1 Å²	1	71.7 Å²	71.7	1%	0.005	36%	0.358	C	S	.	.	H	α-helix	trans	-61.3	-42.7	176	-65.1	167	0	0	0	110.1	F463 L466 V467 L470 I481 F489 F490 F519	F463-I485 HydrophobicContact CD2-CG2 4.22Å; F463-I485 HydrophobicContact CE2-CG2 3.71Å; L466-I485 HydrophobicContact CB-CG1 4.2Å; V467-I485 HydrophobicContact CG2-CD1 4.18Å; L470-I485 HydrophobicContact CB-CD1 4.24Å; L470-I485 HydrophobicContact CD2-CD1 4.01Å; I481-I485 HydrophobicContact CG2-CD1 3.92Å; I481-I485 HydrophobicContact CG2-CG1 4.44Å; I481-I485 WeakPolarHBondContact O-CG1 3.47Å; I481-I485 PolarHBondContact O-N 3.23Å; I485-F489 HydrophobicContact CG2-CD2 4.08Å; I485-F489 PolarHBondContact O-N 3.31Å; I485-F489 VanDerWaalsContact O-N 3.12Å; I485-F490 HydrophobicContact CG2-CE2 4.08Å; I485-F490 WeakPolarHBondContact O-CD2 3.3Å; I485-F519 HydrophobicContact CB-CD1 4.4Å; I485-F519 HydrophobicContact CB-CE1 4.19Å; I485-F519 HydrophobicContact CD1-CD1 4.49Å; I485-F519 HydrophobicContact CG2-CD1 3.64Å; I485-F519 HydrophobicContact CG2-CE1 3.65Å
486	Y	82.9	Confident	76.9	Confident	36 Å²	36	62.9 Å²	62.9	14%	0.141	32%	0.32	C	S	.	.	H	α-helix	trans	-58.5	-51.6	175.9	-177.3	-109.5	0	0	0	111.7	V482 G483 E484 F490 V491 I506 Q507 L510	V482-Y486 WeakPolarHBondContact O-CB 3.19Å; V482-Y486 PolarHBondContact O-N 3.3Å; G483-Y486 PolarHBondContact O-N 3.21Å; E484-Y486 VanDerWaalsContact C-N 3.31Å; E484-Y486 PolarHBondContact O-N 3.4Å; Y486-F490 HydrophobicContact CD2-CB 3.9Å; Y486-F490 HydrophobicContact CD2-CD2 4.41Å; Y486-F490 HydrophobicContact CD2-CG 4.4Å; Y486-F490 HydrophobicContact CE2-CB 4.1Å; Y486-F490 WeakPolarHBondContact O-CA 3.2Å; Y486-F490 VanDerWaalsContact O-CB 3.29Å; Y486-F490 WeakPolarHBondContact O-CB 3.13Å; Y486-F490 PolarHBondContact O-N 3.38Å; Y486-V491 HydrophobicContact CD1-CG2 3.99Å; Y486-V491 HydrophobicContact CE1-CG2 3.66Å; Y486-V491 PolarHBondContact O-N 2.93Å; Y486-I506 HydrophobicContact CD2-CG2 3.52Å; Y486-I506 HydrophobicContact CE2-CG2 4.12Å; Y486-I506 HydrophobicContact CG-CG2 4.5Å; Y486-Q507 HydrophobicContact CE2-CG 3.92Å; Y486-Q507 PolarHBondContact OH-NE2 3.37Å; Y486-L510 HydrophobicContact CD1-CD2 3.72Å; Y486-L510 HydrophobicContact CE1-CD2 3.92Å; Y486-L510 HydrophobicContact CG-CD2 4.1Å
487	Q	82.4	Confident	76.7	Confident	77 Å²	77	66.9 Å²	66.9	36%	0.36	33%	0.328	S	S	.	.	I	π-helix	trans	-63.8	-47.3	-176.9	-174	59.8	28.1	0	0	111.9	G483 E484 V491 E492	G483-Q487 WeakPolarHBondContact O-CB 3.29Å; G483-Q487 PolarHBondContact O-N 3.36Å; E484-Q487 PolarHBondContact O-N 3.38Å; Q487-V491 WeakPolarHBondContact O-CB 3.38Å; Q487-V491 PolarHBondContact O-N 3Å; Q487-E492 WeakPolarHBondContact CG-OE1 3.45Å; Q487-E492 PolarHBondContact NE2-OE1 3.34Å; Q487-E492 WeakPolarHBondContact O-CB 3.23Å; Q487-E492 WeakPolarHBondContact O-CG 3.48Å; Q487-E492 PolarHBondContact O-N 2.99Å
488	K	80.3	Confident	76.7	Confident	83 Å²	83	64.1 Å²	64.1	36%	0.361	32%	0.317	S	S	.	.	I	π-helix	trans	-73.2	-39	-173	-166.6	173.6	-176.6	176.8	0	113.7	L466 E484 S493	L466-K488 HydrophobicContact CD1-CD 3.77Å; E484-K488 VanDerWaalsContact O-CB 3.31Å; E484-K488 WeakPolarHBondContact O-CB 3.43Å; E484-K488 PolarHBondContact O-N 3.5Å; K488-S493 PolarHBondContact O-N 3.43Å
489	F	83.5	Confident	76.5	Confident	5 Å²	5	67.4 Å²	67.4	2%	0.022	33%	0.33	C	S	.	.	I	π-helix	trans	-110.6	-12.9	-170.8	-59.7	-74	0	0	0	115.4	T459 F463 L466 I485 S493 I496	T459-F489 HydrophobicContact CG2-CD1 3.64Å; T459-F489 HydrophobicContact CG2-CE1 3.86Å; F463-F489 HydrophobicContact CB-CD1 4.03Å; F463-F489 HydrophobicContact CB-CD2 4.45Å; F463-F489 HydrophobicContact CB-CE1 3.8Å; F463-F489 HydrophobicContact CB-CE2 4.19Å; F463-F489 HydrophobicContact CB-CG 4.34Å; F463-F489 HydrophobicContact CB-CZ 3.88Å; F463-F489 HydrophobicContact CD2-CB 4.02Å; F463-F489 HydrophobicContact CD2-CD1 4.23Å; F463-F489 AromaticContact CD2-CD2 3.61Å; F463-F489 HydrophobicContact CD2-CD2 3.61Å; F463-F489 AromaticContact CD2-CE2 3.99Å; F463-F489 HydrophobicContact CD2-CE2 3.99Å; F463-F489 AromaticContact CD2-CG 3.7Å; F463-F489 HydrophobicContact CD2-CG 3.7Å; F463-F489 HydrophobicContact CD2-CZ 4.5Å; F463-F489 HydrophobicContact CE2-CD2 4.42Å; L466-F489 HydrophobicContact CB-CE2 4.23Å; L466-F489 HydrophobicContact CD1-CE2 3.38Å; L466-F489 HydrophobicContact CD1-CZ 3.75Å; L466-F489 HydrophobicContact CG-CE2 4.28Å; I485-F489 HydrophobicContact CG2-CD2 4.08Å; I485-F489 PolarHBondContact O-N 3.31Å; I485-F489 VanDerWaalsContact O-N 3.12Å; F489-S493 CarbonylContact C-O 3.41Å; F489-I496 HydrophobicContact CB-CD1 4.18Å; F489-I496 HydrophobicContact CD1-CD1 4.13Å; F489-I496 HydrophobicContact CG-CD1 4.33Å
490	F	79.9	Confident	76	Confident	28 Å²	28	73.8 Å²	73.8	12%	0.123	35%	0.353	C	S	.	.	I	π-helix	trans	-121	-14.4	-179.2	-58	-78.4	0	0	0	113.6	F463 I485 Y486 V498 L503 I506 F519 L522	F463-F490 AromaticContact CE2-CE2 3.95Å; F463-F490 HydrophobicContact CE2-CE2 3.95Å; F463-F490 AromaticContact CE2-CZ 4Å; F463-F490 HydrophobicContact CE2-CZ 4Å; F463-F490 HydrophobicContact CZ-CZ 4.48Å; I485-F490 HydrophobicContact CG2-CE2 4.08Å; I485-F490 WeakPolarHBondContact O-CD2 3.3Å; Y486-F490 HydrophobicContact CD2-CB 3.9Å; Y486-F490 HydrophobicContact CD2-CD2 4.41Å; Y486-F490 HydrophobicContact CD2-CG 4.4Å; Y486-F490 HydrophobicContact CE2-CB 4.1Å; Y486-F490 WeakPolarHBondContact O-CA 3.2Å; Y486-F490 VanDerWaalsContact O-CB 3.29Å; Y486-F490 WeakPolarHBondContact O-CB 3.13Å; Y486-F490 PolarHBondContact O-N 3.38Å; F490-V498 HydrophobicContact CD1-CG2 4.45Å; F490-V498 HydrophobicContact CE1-CB 3.93Å; F490-V498 HydrophobicContact CE1-CG1 4.41Å; F490-V498 HydrophobicContact CE1-CG2 3.46Å; F490-V498 VanDerWaalsContact CE1-CG2 3.46Å; F490-V498 HydrophobicContact CZ-CG2 4.17Å; F490-L503 HydrophobicContact CB-CD1 4.42Å; F490-L503 HydrophobicContact CD1-CD1 3.99Å; F490-I506 HydrophobicContact CD1-CD1 3.98Å; F490-I506 HydrophobicContact CD2-CD1 4.43Å; F490-I506 HydrophobicContact CE1-CD1 3.55Å; F490-I506 HydrophobicContact CE2-CD1 3.99Å; F490-I506 HydrophobicContact CG-CD1 4.4Å; F490-I506 HydrophobicContact CZ-CD1 3.53Å; F490-F519 HydrophobicContact CE2-CE1 4.33Å; F490-L522 HydrophobicContact CZ-CD1 4.06Å
491	V	76.8	Confident	75.4	Confident	72 Å²	72	70.6 Å²	70.6	44%	0.436	34%	0.337	S	S	.	.	I	π-helix	trans	-109.9	-48.8	173.7	-175.5	0	0	0	0	111.2	Y486 Q487	Y486-V491 HydrophobicContact CD1-CG2 3.99Å; Y486-V491 HydrophobicContact CE1-CG2 3.66Å; Y486-V491 PolarHBondContact O-N 2.93Å; Q487-V491 WeakPolarHBondContact O-CB 3.38Å; Q487-V491 PolarHBondContact O-N 3Å
492	E	74.6	Confident	75	Confident	135 Å²	135	69.8 Å²	69.8	63%	0.631	33%	0.332	S	S	*	.	I	π-helix	trans	-88.3	-36.7	-174.8	-70.1	170.2	-166.6	0	0	113.9	Q487	Q487-E492 WeakPolarHBondContact CG-OE1 3.45Å; Q487-E492 PolarHBondContact NE2-OE1 3.34Å; Q487-E492 WeakPolarHBondContact O-CB 3.23Å; Q487-E492 WeakPolarHBondContact O-CG 3.48Å; Q487-E492 PolarHBondContact O-N 2.99Å
493	S	63.1	Low	74.7	Confident	23 Å²	23	72.1 Å²	72.1	16%	0.161	34%	0.344	C	S	.	.			trans	-110	149.5	172.5	-177.3	0	0	0	0	111.7	K488 F489 E495	K488-S493 PolarHBondContact O-N 3.43Å; F489-S493 CarbonylContact C-O 3.41Å; S493-E495 PolarHBondContact OG-N 3.26Å
494	K	62.3	Low	74.4	Confident	189 Å²	189	76.7 Å²	76.7	82%	0.822	36%	0.358	S	S	*	.			trans	-119.1	13.1	175	-66.2	-172.2	-177.8	177.3	0	113.5	I496	K494-I496 VanDerWaalsContact C-N 3.35Å
495	E	62.3	Low	74.2	Confident	83 Å²	83	73 Å²	73	39%	0.388	34%	0.341	S	S	.	.			trans	-73.5	-27.4	-175	-74.5	178.3	-154.2	0	0	113.3	T459 S493 Q497	T459-E495 WeakPolarHBondContact CB-OE2 3.15Å; T459-E495 HydrophobicContact CG2-CB 4.19Å; T459-E495 PolarHBondContact OG1-OE1 3.16Å; T459-E495 PolarHBondContact OG1-OE2 3Å; S493-E495 PolarHBondContact OG-N 3.26Å; E495-Q497 PolarHBondContact O-N 3.05Å
496	I	75.5	Confident	74	Confident	17 Å²	17	73 Å²	73	9%	0.087	34%	0.34	C	S	.	.	S	Bend	trans	-87.5	96.8	176.1	-49.1	-175.7	0	0	0	107.9	T459 L460 F463 F489 K494 V498 V526	T459-I496 HydrophobicContact CG2-CG1 4.49Å; L460-I496 HydrophobicContact CD2-CG1 4.29Å; F463-I496 HydrophobicContact CB-CD1 3.41Å; F463-I496 VanDerWaalsContact CB-CD1 3.41Å; F463-I496 HydrophobicContact CD1-CD1 3.9Å; F463-I496 HydrophobicContact CD2-CD1 3.38Å; F463-I496 HydrophobicContact CE2-CD1 4.09Å; F463-I496 HydrophobicContact CG-CD1 3.27Å; F489-I496 HydrophobicContact CB-CD1 4.18Å; F489-I496 HydrophobicContact CD1-CD1 4.13Å; F489-I496 HydrophobicContact CG-CD1 4.33Å; K494-I496 VanDerWaalsContact C-N 3.35Å; I496-V498 HydrophobicContact CG2-CG2 3.71Å; I496-V498 PolarHBondContact O-N 3.25Å; I496-V526 HydrophobicContact CD1-CG2 4.42Å; I496-V526 HydrophobicContact CG2-CG2 4.09Å
497	Q	65.3	Low	73.7	Confident	185 Å²	185	74 Å²	74	86%	0.864	35%	0.347	S	S	*	.			trans	-70.4	103.9	177.3	-66.7	-172.7	14.3	0	0	109.5	E495	E495-Q497 PolarHBondContact O-N 3.05Å
498	V	74	Confident	73.3	Confident	26 Å²	26	72.6 Å²	72.6	16%	0.158	34%	0.34	C	S	.	.			trans	-109.7	130	179	177	0	0	0	0	109.8	F490 I496 L502 I506 L522	F490-V498 HydrophobicContact CD1-CG2 4.45Å; F490-V498 HydrophobicContact CE1-CB 3.93Å; F490-V498 HydrophobicContact CE1-CG1 4.41Å; F490-V498 HydrophobicContact CE1-CG2 3.46Å; F490-V498 VanDerWaalsContact CE1-CG2 3.46Å; F490-V498 HydrophobicContact CZ-CG2 4.17Å; I496-V498 HydrophobicContact CG2-CG2 3.71Å; I496-V498 PolarHBondContact O-N 3.25Å; V498-L502 HydrophobicContact CG1-CB 3.23Å; V498-L502 HydrophobicContact CG1-CD1 4.17Å; V498-L502 HydrophobicContact CG1-CG 4.33Å; V498-I506 HydrophobicContact CG1-CD1 3.89Å; V498-L522 HydrophobicContact CG1-CD1 4.47Å; V498-L522 HydrophobicContact CG1-CD2 4.14Å; V498-L522 HydrophobicContact CG2-CD1 4.41Å; V498-L522 HydrophobicContact CG2-CD2 3.65Å
499	E	73.7	Confident	73.3	Confident	99 Å²	99	68.9 Å²	68.9	46%	0.463	33%	0.325	S	S	.	.			trans	-56.3	141.7	-179.3	-61.1	-177.1	100.9	0	0	109.7	K378 F501 L502 L503	K378-E499 IonicContact NZ-OE1 3.79Å; E499-F501 HydrophobicContact CB-CD1 3.61Å; E499-F501 HydrophobicContact CB-CE1 3.32Å; E499-F501 HydrophobicContact CB-CZ 4.24Å; E499-F501 HydrophobicContact CG-CE1 3.95Å; E499-F501 CarbonylContact O-C 3.58Å; E499-F501 PolarHBondContact O-N 3.43Å; E499-F501 WeakPolarHBondContact OE2-CE1 3.39Å; E499-F501 WeakPolarHBondContact OE2-CZ 3.37Å; E499-L502 HydrophobicContact CB-CD1 4.21Å; E499-L502 HydrophobicContact CB-CG 4.32Å; E499-L502 HydrophobicContact CG-CD1 4.41Å; E499-L502 WeakPolarHBondContact O-CA 3.26Å; E499-L502 WeakPolarHBondContact O-CB 3.42Å; E499-L502 PolarHBondContact O-N 3.03Å; E499-L503 PolarHBondContact O-N 2.92Å
500	K	67	Low	73.1	Confident	188 Å²	188	69.8 Å²	69.8	82%	0.817	33%	0.329	S	S	*	.	H	α-helix	trans	-55.3	-27.2	-172.2	-165.1	176.6	-177.4	177.7	0	113.7	K504	K500-K504 PolarHBondContact O-N 3.42Å
501	F	66.1	Low	72.7	Confident	79 Å²	79	68.9 Å²	68.9	35%	0.346	33%	0.326	S	S	.	.	H	α-helix	trans	-78.7	-38.2	173.4	78.3	-83.4	0	0	0	112.5	E499 L503 K504 E505	E499-F501 HydrophobicContact CB-CD1 3.61Å; E499-F501 HydrophobicContact CB-CE1 3.32Å; E499-F501 HydrophobicContact CB-CZ 4.24Å; E499-F501 HydrophobicContact CG-CE1 3.95Å; E499-F501 CarbonylContact O-C 3.58Å; E499-F501 PolarHBondContact O-N 3.43Å; E499-F501 WeakPolarHBondContact OE2-CE1 3.39Å; E499-F501 WeakPolarHBondContact OE2-CZ 3.37Å; F501-L503 VanDerWaalsContact C-N 3.28Å; F501-L503 PolarHBondContact O-N 2.78Å; F501-K504 CarbonylContact O-C 3.47Å; F501-K504 WeakPolarHBondContact O-CA 3.27Å; F501-K504 VanDerWaalsContact O-CB 3.3Å; F501-K504 WeakPolarHBondContact O-CB 3.37Å; F501-K504 PolarHBondContact O-N 2.83Å; F501-K504 VanDerWaalsContact O-N 3.1Å; F501-E505 VanDerWaalsContact O-CG 3.31Å; F501-E505 WeakPolarHBondContact O-CG 3.38Å; F501-E505 PolarHBondContact O-N 3.23Å
502	L	76	Confident	71.9	Confident	12 Å²	12	65.5 Å²	65.5	6%	0.063	31%	0.306	C	S	.	.	H	α-helix	trans	-64.9	-34.8	172.7	-70	174.6	0	0	0	110.7	V498 E499 K504 E505 I506 V518 L522	V498-L502 HydrophobicContact CG1-CB 3.23Å; V498-L502 HydrophobicContact CG1-CD1 4.17Å; V498-L502 HydrophobicContact CG1-CG 4.33Å; E499-L502 HydrophobicContact CB-CD1 4.21Å; E499-L502 HydrophobicContact CB-CG 4.32Å; E499-L502 HydrophobicContact CG-CD1 4.41Å; E499-L502 WeakPolarHBondContact O-CA 3.26Å; E499-L502 WeakPolarHBondContact O-CB 3.42Å; E499-L502 PolarHBondContact O-N 3.03Å; L502-K504 VanDerWaalsContact C-N 3.3Å; L502-K504 PolarHBondContact O-N 3.39Å; L502-E505 WeakPolarHBondContact CD2-OE2 3.47Å; L502-E505 CarbonylContact O-C 3.58Å; L502-E505 WeakPolarHBondContact O-CB 2.75Å; L502-E505 PolarHBondContact O-N 2.75Å; L502-I506 WeakPolarHBondContact O-CB 3.38Å; L502-I506 WeakPolarHBondContact O-CD1 3.47Å; L502-I506 WeakPolarHBondContact O-CG1 2.8Å; L502-I506 PolarHBondContact O-N 3.32Å; L502-V518 HydrophobicContact CD2-CG2 4.3Å; L502-L522 HydrophobicContact CD1-CD2 4.22Å
503	L	75.7	Confident	71.4	Confident	53 Å²	53	61.8 Å²	61.8	28%	0.277	29%	0.29	S	S	.	.	H	α-helix	trans	-63.3	-39.7	171.1	-163.9	99.6	0	0	0	111.2	F490 E499 F501 E505 I506 Q507	F490-L503 HydrophobicContact CB-CD1 4.42Å; F490-L503 HydrophobicContact CD1-CD1 3.99Å; E499-L503 PolarHBondContact O-N 2.92Å; F501-L503 VanDerWaalsContact C-N 3.28Å; F501-L503 PolarHBondContact O-N 2.78Å; L503-E505 VanDerWaalsContact C-N 3.34Å; L503-I506 PolarHBondContact O-N 3.28Å; L503-Q507 WeakPolarHBondContact O-CB 3.19Å; L503-Q507 VanDerWaalsContact O-CG 3.27Å; L503-Q507 WeakPolarHBondContact O-CG 3.27Å; L503-Q507 PolarHBondContact O-N 2.81Å
504	K	74.5	Confident	71.6	Confident	120 Å²	120	64.4 Å²	64.4	52%	0.522	30%	0.297	S	S	.	.	H	α-helix	trans	-66.9	-37.3	173.4	-161.3	-169.6	177.3	-126	0	111.2	K500 F501 L502 Q507 E508	K500-K504 PolarHBondContact O-N 3.42Å; F501-K504 CarbonylContact O-C 3.47Å; F501-K504 WeakPolarHBondContact O-CA 3.27Å; F501-K504 VanDerWaalsContact O-CB 3.3Å; F501-K504 WeakPolarHBondContact O-CB 3.37Å; F501-K504 PolarHBondContact O-N 2.83Å; F501-K504 VanDerWaalsContact O-N 3.1Å; L502-K504 VanDerWaalsContact C-N 3.3Å; L502-K504 PolarHBondContact O-N 3.39Å; K504-Q507 CarbonylContact O-C 3.59Å; K504-Q507 PolarHBondContact O-N 3.15Å; K504-E508 WeakPolarHBondContact CE-OE1 3.01Å; K504-E508 IonicContact NZ-OE1 3.38Å; K504-E508 PolarHBondContact NZ-OE1 3.01Å; K504-E508 VanDerWaalsContact O-CB 3.22Å; K504-E508 WeakPolarHBondContact O-CB 3.45Å; K504-E508 WeakPolarHBondContact O-CG 3.24Å; K504-E508 PolarHBondContact O-N 3.39Å
505	E	77.1	Confident	72	Confident	23 Å²	23	56.5 Å²	56.5	11%	0.107	27%	0.269	C	S	.	.	H	α-helix	trans	-67.5	-39.1	174.1	-70.3	177.9	175.5	0	0	111.7	F501 L502 L503 E508 S509 R514 V518	F501-E505 VanDerWaalsContact O-CG 3.31Å; F501-E505 WeakPolarHBondContact O-CG 3.38Å; F501-E505 PolarHBondContact O-N 3.23Å; L502-E505 WeakPolarHBondContact CD2-OE2 3.47Å; L502-E505 CarbonylContact O-C 3.58Å; L502-E505 WeakPolarHBondContact O-CB 2.75Å; L502-E505 PolarHBondContact O-N 2.75Å; L503-E505 VanDerWaalsContact C-N 3.34Å; E505-E508 CarbonylContact O-C 3.36Å; E505-E508 PolarHBondContact O-N 3.33Å; E505-S509 WeakPolarHBondContact O-CB 3.44Å; E505-S509 PolarHBondContact O-N 3.11Å; E505-S509 PolarHBondContact O-OG 3.16Å; E505-R514 VanDerWaalsContact CG-CZ 3.41Å; E505-R514 VanDerWaalsContact CG-NH1 3.33Å; E505-R514 IonicContact OE1-CZ 2.6Å; E505-R514 IonicContact OE1-NH1 2.68Å; E505-R514 PolarHBondContact OE1-NH1 3.42Å; E505-R514 VanDerWaalsContact OE1-NH1 3.11Å; E505-R514 IonicContact OE1-NH2 3.73Å; E505-R514 PolarHBondContact OE1-NH2 2.85Å; E505-R514 IonicContact OE2-CZ 2.92Å; E505-R514 IonicContact OE2-NH1 2.65Å; E505-R514 PolarHBondContact OE2-NH1 3.34Å; E505-R514 IonicContact OE2-NH2 3.65Å; E505-V518 HydrophobicContact CB-CG2 4Å
506	I	80.4	Confident	72.8	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.9	-44.5	171.6	-71	157.7	0	0	0	110.2	Y486 F490 V498 L502 L503 E508 S509 L510 V518 F519 L522	Y486-I506 HydrophobicContact CD2-CG2 3.52Å; Y486-I506 HydrophobicContact CE2-CG2 4.12Å; Y486-I506 HydrophobicContact CG-CG2 4.5Å; F490-I506 HydrophobicContact CD1-CD1 3.98Å; F490-I506 HydrophobicContact CD2-CD1 4.43Å; F490-I506 HydrophobicContact CE1-CD1 3.55Å; F490-I506 HydrophobicContact CE2-CD1 3.99Å; F490-I506 HydrophobicContact CG-CD1 4.4Å; F490-I506 HydrophobicContact CZ-CD1 3.53Å; V498-I506 HydrophobicContact CG1-CD1 3.89Å; L502-I506 WeakPolarHBondContact O-CB 3.38Å; L502-I506 WeakPolarHBondContact O-CD1 3.47Å; L502-I506 WeakPolarHBondContact O-CG1 2.8Å; L502-I506 PolarHBondContact O-N 3.32Å; L503-I506 PolarHBondContact O-N 3.28Å; I506-E508 VanDerWaalsContact C-N 3.34Å; I506-S509 PolarHBondContact O-N 3.25Å; I506-L510 WeakPolarHBondContact O-CB 3.08Å; I506-L510 PolarHBondContact O-N 2.89Å; I506-V518 HydrophobicContact CG1-CG1 4.04Å; I506-V518 HydrophobicContact CG1-CG2 3.9Å; I506-F519 HydrophobicContact CB-CZ 4.5Å; I506-F519 HydrophobicContact CG1-CE1 4.28Å; I506-F519 HydrophobicContact CG1-CZ 4.45Å; I506-F519 HydrophobicContact CG2-CE1 3.95Å; I506-F519 HydrophobicContact CG2-CZ 3.75Å; I506-L522 HydrophobicContact CD1-CD1 3.56Å; I506-L522 HydrophobicContact CG1-CD1 3.93Å
507	Q	77.3	Confident	73	Confident	58 Å²	58	58.1 Å²	58.1	27%	0.271	28%	0.279	S	S	.	.	H	α-helix	trans	-66.3	-37.2	175.5	-73.7	173.4	-11.4	0	0	111.6	Y486 L503 K504 L510 V511	Y486-Q507 HydrophobicContact CE2-CG 3.92Å; Y486-Q507 PolarHBondContact OH-NE2 3.37Å; L503-Q507 WeakPolarHBondContact O-CB 3.19Å; L503-Q507 VanDerWaalsContact O-CG 3.27Å; L503-Q507 WeakPolarHBondContact O-CG 3.27Å; L503-Q507 PolarHBondContact O-N 2.81Å; K504-Q507 CarbonylContact O-C 3.59Å; K504-Q507 PolarHBondContact O-N 3.15Å; Q507-L510 WeakPolarHBondContact O-CB 3.14Å; Q507-L510 PolarHBondContact O-N 3.48Å; Q507-V511 WeakPolarHBondContact O-CB 3.23Å; Q507-V511 WeakPolarHBondContact O-CG2 3.4Å; Q507-V511 PolarHBondContact O-N 3.35Å
508	E	73.2	Confident	73.8	Confident	46 Å²	46	49.3 Å²	49.3	22%	0.215	24%	0.238	C	C	.	.	H	α-helix	trans	-67.9	-36.5	173.4	-77.1	169.2	-170.1	0	0	110.7	K504 E505 I506 V511 G512 N513 R514	K504-E508 WeakPolarHBondContact CE-OE1 3.01Å; K504-E508 IonicContact NZ-OE1 3.38Å; K504-E508 PolarHBondContact NZ-OE1 3.01Å; K504-E508 VanDerWaalsContact O-CB 3.22Å; K504-E508 WeakPolarHBondContact O-CB 3.45Å; K504-E508 WeakPolarHBondContact O-CG 3.24Å; K504-E508 PolarHBondContact O-N 3.39Å; E505-E508 CarbonylContact O-C 3.36Å; E505-E508 PolarHBondContact O-N 3.33Å; I506-E508 VanDerWaalsContact C-N 3.34Å; E508-V511 CarbonylContact O-C 3.45Å; E508-V511 PolarHBondContact O-N 3.18Å; E508-G512 PolarHBondContact O-N 3.34Å; E508-N513 HydrophobicContact CB-CB 3.93Å; E508-N513 HydrophobicContact CG-CB 4.3Å; E508-N513 WeakPolarHBondContact O-CA 3.45Å; E508-N513 WeakPolarHBondContact O-CB 3.19Å; E508-N513 PolarHBondContact O-N 3.01Å; E508-R514 HydrophobicContact CB-CB 4.26Å; E508-R514 PolarHBondContact O-N 3.42Å
509	S	81.2	Confident	74.3	Confident	6 Å²	6	48.1 Å²	48.1	4%	0.042	23%	0.23	C	C	.	.	H	α-helix	trans	-68.1	-38.4	172.4	-63.1	0	0	0	0	112.2	E505 I506 V511 G512 R514 G515 V518	E505-S509 WeakPolarHBondContact O-CB 3.44Å; E505-S509 PolarHBondContact O-N 3.11Å; E505-S509 PolarHBondContact O-OG 3.16Å; I506-S509 PolarHBondContact O-N 3.25Å; S509-V511 VanDerWaalsContact C-N 3.28Å; S509-V511 PolarHBondContact O-N 3.39Å; S509-G512 PolarHBondContact O-N 2.97Å; S509-R514 VanDerWaalsContact CA-O 3.25Å; S509-R514 WeakPolarHBondContact CA-O 3.19Å; S509-R514 PolarHBondContact OG-O 3.31Å; S509-G515 WeakPolarHBondContact CB-O 3.39Å; S509-G515 PolarHBondContact OG-O 3.18Å; S509-V518 WeakPolarHBondContact OG-CG1 3.39Å
510	L	78.4	Confident	74.8	Confident	23 Å²	23	45.2 Å²	45.2	12%	0.12	22%	0.219	C	C	.	.	H	α-helix	trans	-63	-37.2	173.1	-176.8	69.2	0	0	0	111.5	V482 Y486 I506 Q507 G512 I613	V482-L510 HydrophobicContact CG1-CB 4.39Å; V482-L510 HydrophobicContact CG1-CD1 4.07Å; Y486-L510 HydrophobicContact CD1-CD2 3.72Å; Y486-L510 HydrophobicContact CE1-CD2 3.92Å; Y486-L510 HydrophobicContact CG-CD2 4.1Å; I506-L510 WeakPolarHBondContact O-CB 3.08Å; I506-L510 PolarHBondContact O-N 2.89Å; Q507-L510 WeakPolarHBondContact O-CB 3.14Å; Q507-L510 PolarHBondContact O-N 3.48Å; L510-G512 VanDerWaalsContact C-N 3.3Å; L510-I613 HydrophobicContact CD2-CD1 4.43Å; L510-I613 HydrophobicContact CG-CD1 4.05Å; L510-I613 HydrophobicContact CG-CG1 4.12Å
511	V	71.9	Confident	75.4	Confident	10 Å²	10	41.3 Å²	41.3	6%	0.061	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	3.5	-179.2	170.1	0	0	0	0	112.8	Q507 E508 S509 N513 A609 I613 I623 L627	Q507-V511 WeakPolarHBondContact O-CB 3.23Å; Q507-V511 WeakPolarHBondContact O-CG2 3.4Å; Q507-V511 PolarHBondContact O-N 3.35Å; E508-V511 CarbonylContact O-C 3.45Å; E508-V511 PolarHBondContact O-N 3.18Å; S509-V511 VanDerWaalsContact C-N 3.28Å; S509-V511 PolarHBondContact O-N 3.39Å; V511-N513 WeakPolarHBondContact CG1-ND2 2.97Å; V511-N513 PolarHBondContact O-N 3.45Å; V511-A609 WeakPolarHBondContact O-CB 3.12Å; V511-I613 HydrophobicContact CB-CD1 4.3Å; V511-I613 HydrophobicContact CG2-CD1 3.46Å; V511-I613 VanDerWaalsContact CG2-CD1 3.46Å; V511-I623 HydrophobicContact CG2-CG2 3.34Å; V511-L627 HydrophobicContact CB-CD1 4.17Å; V511-L627 HydrophobicContact CG1-CD1 3.27Å; V511-L627 HydrophobicContact CG1-CD2 3.7Å; V511-L627 HydrophobicContact CG1-CG 3.48Å; V511-L627 VanDerWaalsContact CG1-CG 3.48Å; V511-L627 HydrophobicContact CG2-CD1 3.95Å
512	G	61.5	Low	76.2	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.01	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	62	45.9	179.6	0	0	0	0	0	112.5	E508 S509 L510 Y605 A609	E508-G512 PolarHBondContact O-N 3.34Å; S509-G512 PolarHBondContact O-N 2.97Å; L510-G512 VanDerWaalsContact C-N 3.3Å; G512-Y605 VanDerWaalsContact CA-CD1 3.45Å; G512-Y605 CarbonylContact O-C 3.59Å; G512-Y605 WeakPolarHBondContact O-CD1 3.46Å; G512-Y605 VanDerWaalsContact O-CE1 3.23Å; G512-Y605 WeakPolarHBondContact O-CE1 3.32Å; G512-A609 VanDerWaalsContact N-CB 3.33Å
513	N	63	Low	76.8	Confident	57 Å²	57	37.4 Å²	37.4	31%	0.305	18%	0.182	S	C	.	.	S	Bend	trans	-111.9	-11.9	168.8	-66.3	-27.3	0	0	0	111.5	E508 V511 K606	E508-N513 HydrophobicContact CB-CB 3.93Å; E508-N513 HydrophobicContact CG-CB 4.3Å; E508-N513 WeakPolarHBondContact O-CA 3.45Å; E508-N513 WeakPolarHBondContact O-CB 3.19Å; E508-N513 PolarHBondContact O-N 3.01Å; V511-N513 WeakPolarHBondContact CG1-ND2 2.97Å; V511-N513 PolarHBondContact O-N 3.45Å; N513-K606 VanDerWaalsContact CG-NZ 3.32Å; N513-K606 PolarHBondContact ND2-NZ 2.9Å; N513-K606 WeakPolarHBondContact OD1-CE 3.27Å; N513-K606 WeakPolarHBondContact OD1-CG 3.46Å; N513-K606 PolarHBondContact OD1-NZ 3.43Å
514	R	67.9	Low	77.1	Confident	77 Å²	77	40.7 Å²	40.7	29%	0.291	20%	0.196	S	C	.	.	S	Bend	trans	-150.2	148.5	-174.6	-131	169.8	-169.7	-116.5	18	111.3	E505 E508 S509 Y605	E505-R514 VanDerWaalsContact CG-CZ 3.41Å; E505-R514 VanDerWaalsContact CG-NH1 3.33Å; E505-R514 IonicContact OE1-CZ 2.6Å; E505-R514 IonicContact OE1-NH1 2.68Å; E505-R514 PolarHBondContact OE1-NH1 3.42Å; E505-R514 VanDerWaalsContact OE1-NH1 3.11Å; E505-R514 IonicContact OE1-NH2 3.73Å; E505-R514 PolarHBondContact OE1-NH2 2.85Å; E505-R514 IonicContact OE2-CZ 2.92Å; E505-R514 IonicContact OE2-NH1 2.65Å; E505-R514 PolarHBondContact OE2-NH1 3.34Å; E505-R514 IonicContact OE2-NH2 3.65Å; E508-R514 HydrophobicContact CB-CB 4.26Å; E508-R514 PolarHBondContact O-N 3.42Å; S509-R514 VanDerWaalsContact CA-O 3.25Å; S509-R514 WeakPolarHBondContact CA-O 3.19Å; S509-R514 PolarHBondContact OG-O 3.31Å; R514-Y605 PolarHBondContact O-OH 3.36Å
515	G	70.3	Confident	77.3	Confident	23 Å²	23	39.2 Å²	39.2	24%	0.237	19%	0.191	C	C	.	.			trans	-69.4	-179.4	179.1	0	0	0	0	0	113.6	S509 E517	S509-G515 WeakPolarHBondContact CB-O 3.39Å; S509-G515 PolarHBondContact OG-O 3.18Å; G515-E517 WeakPolarHBondContact CA-OE2 3.43Å; G515-E517 PolarHBondContact O-N 3.03Å
516	T	79.5	Confident	77.7	Confident	39 Å²	39	38.3 Å²	38.3	24%	0.239	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	2.6	-179	53.2	0	0	0	0	113.6	L470 V478 V482 V518 F519 V520	L470-T516 HydrophobicContact CD1-CG2 4.35Å; L470-T516 HydrophobicContact CD2-CG2 4.29Å; V478-T516 HydrophobicContact CG1-CG2 3.38Å; V482-T516 HydrophobicContact CG2-CG2 3.74Å; T516-V518 PolarHBondContact O-N 2.91Å; T516-F519 WeakPolarHBondContact O-CB 3.15Å; T516-F519 PolarHBondContact O-N 2.98Å; T516-V520 PolarHBondContact O-N 2.69Å
517	E	79.9	Confident	77.9	Confident	96 Å²	96	38.7 Å²	38.7	45%	0.449	19%	0.19	S	C	.	.	H	α-helix	trans	-64.5	-19.9	-175.5	-45.5	80.8	-167.3	0	0	111.6	G515 F519 R521	G515-E517 WeakPolarHBondContact CA-OE2 3.43Å; G515-E517 PolarHBondContact O-N 3.03Å; E517-F519 VanDerWaalsContact C-N 3.3Å; E517-R521 VanDerWaalsContact O-CB 3.27Å; E517-R521 WeakPolarHBondContact O-CB 3.42Å; E517-R521 VanDerWaalsContact O-CG 3.23Å; E517-R521 WeakPolarHBondContact O-CG 3.47Å; E517-R521 PolarHBondContact O-N 3.06Å; E517-R521 PolarHBondContact O-NE 3.5Å; E517-R521 VanDerWaalsContact O-NE 3.15Å
518	V	82.2	Confident	77.9	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63	-37.9	172.7	71.1	0	0	0	0	111.3	L502 E505 I506 S509 T516 L522	L502-V518 HydrophobicContact CD2-CG2 4.3Å; E505-V518 HydrophobicContact CB-CG2 4Å; I506-V518 HydrophobicContact CG1-CG1 4.04Å; I506-V518 HydrophobicContact CG1-CG2 3.9Å; S509-V518 WeakPolarHBondContact OG-CG1 3.39Å; T516-V518 PolarHBondContact O-N 2.91Å; V518-L522 HydrophobicContact CG2-CD1 4.12Å; V518-L522 WeakPolarHBondContact O-CB 3.32Å; V518-L522 WeakPolarHBondContact O-CD1 3.49Å; V518-L522 WeakPolarHBondContact O-CG 3.34Å; V518-L522 PolarHBondContact O-N 2.94Å
519	F	84.6	Confident	78.2	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-73	-40.7	179.2	-63.5	-75.6	0	0	0	111.7	V467 L470 V482 I485 F490 I506 T516 E517 L522 Q523	V467-F519 HydrophobicContact CG1-CB 4.21Å; V467-F519 HydrophobicContact CG2-CB 4.33Å; L470-F519 HydrophobicContact CD2-CB 3.71Å; L470-F519 HydrophobicContact CD2-CD2 3.94Å; L470-F519 HydrophobicContact CD2-CG 3.96Å; V482-F519 HydrophobicContact CB-CE2 4.13Å; V482-F519 HydrophobicContact CB-CZ 4.39Å; V482-F519 HydrophobicContact CG1-CE2 3.58Å; V482-F519 HydrophobicContact CG1-CZ 3.69Å; V482-F519 HydrophobicContact CG2-CD2 4.11Å; V482-F519 HydrophobicContact CG2-CE2 3.69Å; V482-F519 HydrophobicContact CG2-CZ 4.39Å; I485-F519 HydrophobicContact CB-CD1 4.4Å; I485-F519 HydrophobicContact CB-CE1 4.19Å; I485-F519 HydrophobicContact CD1-CD1 4.49Å; I485-F519 HydrophobicContact CG2-CD1 3.64Å; I485-F519 HydrophobicContact CG2-CE1 3.65Å; F490-F519 HydrophobicContact CE2-CE1 4.33Å; I506-F519 HydrophobicContact CB-CZ 4.5Å; I506-F519 HydrophobicContact CG1-CE1 4.28Å; I506-F519 HydrophobicContact CG1-CZ 4.45Å; I506-F519 HydrophobicContact CG2-CE1 3.95Å; I506-F519 HydrophobicContact CG2-CZ 3.75Å; T516-F519 WeakPolarHBondContact O-CB 3.15Å; T516-F519 PolarHBondContact O-N 2.98Å; E517-F519 VanDerWaalsContact C-N 3.3Å; F519-L522 CarbonylContact O-C 3.12Å; F519-L522 PolarHBondContact O-N 3.34Å; F519-Q523 WeakPolarHBondContact O-CB 3.03Å; F519-Q523 PolarHBondContact O-N 3.27Å
520	V	82.5	Confident	78.3	Confident	38 Å²	38	37.8 Å²	37.8	23%	0.23	19%	0.188	C	C	.	.	H	α-helix	trans	-63.9	-43.6	174.8	-178.3	0	0	0	0	110.8	K471 T516 L522 Q523 E524	K471-V520 HydrophobicContact CD-CG2 4.29Å; K471-V520 HydrophobicContact CG-CG2 3.89Å; T516-V520 PolarHBondContact O-N 2.69Å; V520-L522 VanDerWaalsContact C-N 3.29Å; V520-L522 PolarHBondContact O-N 3.06Å; V520-Q523 WeakPolarHBondContact O-CB 3.41Å; V520-Q523 PolarHBondContact O-N 3.49Å; V520-Q523 VanDerWaalsContact O-N 3.13Å; V520-E524 PolarHBondContact O-N 3.23Å
521	R	81.2	Confident	78.3	Confident	106 Å²	106	40.3 Å²	40.3	40%	0.4	20%	0.196	S	C	.	.	H	α-helix	trans	-61.7	-37.6	173.6	-77.7	-178.6	-91.8	176.8	-11.9	112.4	E517 Q525	E517-R521 VanDerWaalsContact O-CB 3.27Å; E517-R521 WeakPolarHBondContact O-CB 3.42Å; E517-R521 VanDerWaalsContact O-CG 3.23Å; E517-R521 WeakPolarHBondContact O-CG 3.47Å; E517-R521 PolarHBondContact O-N 3.06Å; E517-R521 PolarHBondContact O-NE 3.5Å; E517-R521 VanDerWaalsContact O-NE 3.15Å; R521-Q525 WeakPolarHBondContact O-CG 3.29Å; R521-Q525 PolarHBondContact O-N 3.33Å
522	L	83.1	Confident	77.6	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-71.7	-34.5	174.9	-73	167.2	0	0	0	111.8	F463 F490 V498 L502 I506 V518 F519 V520 Q525 V526	F463-L522 HydrophobicContact CE1-CB 3.94Å; F463-L522 HydrophobicContact CZ-CB 3.68Å; F490-L522 HydrophobicContact CZ-CD1 4.06Å; V498-L522 HydrophobicContact CG1-CD1 4.47Å; V498-L522 HydrophobicContact CG1-CD2 4.14Å; V498-L522 HydrophobicContact CG2-CD1 4.41Å; V498-L522 HydrophobicContact CG2-CD2 3.65Å; L502-L522 HydrophobicContact CD1-CD2 4.22Å; I506-L522 HydrophobicContact CD1-CD1 3.56Å; I506-L522 HydrophobicContact CG1-CD1 3.93Å; V518-L522 HydrophobicContact CG2-CD1 4.12Å; V518-L522 WeakPolarHBondContact O-CB 3.32Å; V518-L522 WeakPolarHBondContact O-CD1 3.49Å; V518-L522 WeakPolarHBondContact O-CG 3.34Å; V518-L522 PolarHBondContact O-N 2.94Å; F519-L522 CarbonylContact O-C 3.12Å; F519-L522 PolarHBondContact O-N 3.34Å; V520-L522 VanDerWaalsContact C-N 3.29Å; V520-L522 PolarHBondContact O-N 3.06Å; L522-Q525 CarbonylContact O-C 3.58Å; L522-Q525 WeakPolarHBondContact O-CB 3.47Å; L522-Q525 PolarHBondContact O-N 2.88Å; L522-V526 WeakPolarHBondContact O-CB 3.47Å; L522-V526 VanDerWaalsContact O-CG2 3.24Å; L522-V526 WeakPolarHBondContact O-CG2 3.25Å; L522-V526 PolarHBondContact O-N 3.23Å
523	Q	87.2	Confident	77.8	Confident	7 Å²	7	51.8 Å²	51.8	3%	0.033	24%	0.242	C	C	.	.	H	α-helix	trans	-65.7	-42.5	174.8	-177.9	-167.7	35.7	0	0	111	F463 W464 V467 E468 F519 V520 Q525 V526 A527	F463-Q523 HydrophobicContact CE1-CB 4.43Å; W464-Q523 HydrophobicContact CG-CG 4.07Å; W464-Q523 PolarHBondContact O-NE2 3.33Å; V467-Q523 HydrophobicContact CB-CB 3.75Å; V467-Q523 HydrophobicContact CB-CG 3.9Å; V467-Q523 HydrophobicContact CG1-CB 3.56Å; V467-Q523 HydrophobicContact CG1-CG 4.02Å; V467-Q523 HydrophobicContact CG2-CB 4.12Å; E468-Q523 VanDerWaalsContact N-NE2 3.19Å; E468-Q523 PolarHBondContact OE2-NE2 3.5Å; E468-Q523 PolarHBondContact OE2-OE1 3.45Å; F519-Q523 WeakPolarHBondContact O-CB 3.03Å; F519-Q523 PolarHBondContact O-N 3.27Å; V520-Q523 WeakPolarHBondContact O-CB 3.41Å; V520-Q523 PolarHBondContact O-N 3.49Å; V520-Q523 VanDerWaalsContact O-N 3.13Å; Q523-Q525 VanDerWaalsContact C-N 3.34Å; Q523-V526 PolarHBondContact O-N 3.29Å; Q523-A527 VanDerWaalsContact O-CB 3.22Å; Q523-A527 WeakPolarHBondContact O-CB 3.47Å; Q523-A527 PolarHBondContact O-N 3.12Å
524	E	81.6	Confident	78.5	Confident	123 Å²	123	51 Å²	51	58%	0.575	24%	0.235	S	C	*	.	H	α-helix	trans	-61	-43.5	171	-73.6	174	-177.4	0	0	110.9	V520 V526 A527 E528	V520-E524 PolarHBondContact O-N 3.23Å; E524-V526 VanDerWaalsContact C-N 3.32Å; E524-V526 PolarHBondContact O-N 3.38Å; E524-A527 PolarHBondContact O-N 3.3Å; E524-E528 WeakPolarHBondContact O-CB 3.45Å; E524-E528 PolarHBondContact O-N 2.75Å
525	Q	80.4	Confident	78.9	Confident	88 Å²	88	48.7 Å²	48.7	41%	0.411	23%	0.226	S	C	.	.	H	α-helix	trans	-63.1	-38	175.4	-73.9	171.3	37.1	0	0	112.6	R521 L522 Q523 T529	R521-Q525 WeakPolarHBondContact O-CG 3.29Å; R521-Q525 PolarHBondContact O-N 3.33Å; L522-Q525 CarbonylContact O-C 3.58Å; L522-Q525 WeakPolarHBondContact O-CB 3.47Å; L522-Q525 PolarHBondContact O-N 2.88Å; Q523-Q525 VanDerWaalsContact C-N 3.34Å; Q525-T529 VanDerWaalsContact O-CB 3.25Å; Q525-T529 WeakPolarHBondContact O-CB 3.37Å; Q525-T529 PolarHBondContact O-N 3.01Å; Q525-T529 PolarHBondContact O-OG1 3.34Å
526	V	85.4	Confident	78.8	Confident	5 Å²	5	50.8 Å²	50.8	3%	0.03	24%	0.235	C	C	.	.	H	α-helix	trans	-74.1	-41.4	178.5	169.5	0	0	0	0	110.7	L460 F463 I496 L522 Q523 E524 T529 M530	L460-V526 HydrophobicContact CB-CG1 4Å; L460-V526 HydrophobicContact CD2-CG1 4.13Å; L460-V526 HydrophobicContact CD2-CG2 4.47Å; L460-V526 WeakPolarHBondContact O-CG1 3.27Å; F463-V526 HydrophobicContact CD1-CB 3.91Å; F463-V526 HydrophobicContact CD1-CG1 4.02Å; F463-V526 HydrophobicContact CD1-CG2 3.63Å; F463-V526 HydrophobicContact CE1-CB 4.25Å; F463-V526 HydrophobicContact CE1-CG2 3.81Å; I496-V526 HydrophobicContact CD1-CG2 4.42Å; I496-V526 HydrophobicContact CG2-CG2 4.09Å; L522-V526 WeakPolarHBondContact O-CB 3.47Å; L522-V526 VanDerWaalsContact O-CG2 3.24Å; L522-V526 WeakPolarHBondContact O-CG2 3.25Å; L522-V526 PolarHBondContact O-N 3.23Å; Q523-V526 PolarHBondContact O-N 3.29Å; E524-V526 VanDerWaalsContact C-N 3.32Å; E524-V526 PolarHBondContact O-N 3.38Å; V526-T529 PolarHBondContact O-N 3.28Å; V526-M530 HydrophobicContact CG1-CE 4.07Å; V526-M530 WeakPolarHBondContact O-CB 3.36Å; V526-M530 VanDerWaalsContact O-CG 3.29Å; V526-M530 WeakPolarHBondContact O-CG 3.3Å; V526-M530 PolarHBondContact O-N 2.96Å
527	A	83.6	Confident	78.2	Confident	7 Å²	7	51.6 Å²	51.6	6%	0.058	24%	0.243	C	C	.	.	H	α-helix	trans	-60.7	-45.9	172.2	0	0	0	0	0	111	Q523 E524 T529 M530 R531	Q523-A527 VanDerWaalsContact O-CB 3.22Å; Q523-A527 WeakPolarHBondContact O-CB 3.47Å; Q523-A527 PolarHBondContact O-N 3.12Å; E524-A527 PolarHBondContact O-N 3.3Å; A527-T529 VanDerWaalsContact C-N 3.35Å; A527-M530 PolarHBondContact O-N 2.82Å; A527-R531 VanDerWaalsContact O-CB 3.27Å; A527-R531 WeakPolarHBondContact O-CB 3.35Å; A527-R531 PolarHBondContact O-N 2.92Å
528	E	77.9	Confident	78.2	Confident	48 Å²	48	47 Å²	47	22%	0.224	22%	0.222	C	C	.	.	H	α-helix	trans	-64.6	-41	176	-164	63.8	-150.3	0	0	110.6	R389 E524 M530 R531 E532	R389-E528 IonicContact CZ-OE1 3.83Å; R389-E528 IonicContact NH1-OE1 3.09Å; R389-E528 IonicContact NH2-OE1 3.78Å; R389-E528 PolarHBondContact NH2-OE1 2.62Å; E524-E528 WeakPolarHBondContact O-CB 3.45Å; E524-E528 PolarHBondContact O-N 2.75Å; E528-M530 VanDerWaalsContact C-N 3.3Å; E528-M530 PolarHBondContact O-N 3.14Å; E528-R531 PolarHBondContact O-N 3.39Å; E528-R531 IonicContact OE2-CZ 2.68Å; E528-R531 IonicContact OE2-NH1 3.93Å; E528-R531 PolarHBondContact OE2-NH1 3.49Å; E528-E532 HydrophobicContact CG-CG 4.03Å; E528-E532 WeakPolarHBondContact O-CB 3.41Å; E528-E532 VanDerWaalsContact O-CG 3.24Å; E528-E532 WeakPolarHBondContact O-CG 3.22Å; E528-E532 PolarHBondContact O-N 3.08Å; E528-E532 WeakPolarHBondContact OE1-CG 3.49Å
529	T	78.6	Confident	77.6	Confident	44 Å²	44	49 Å²	49	27%	0.27	23%	0.232	S	C	.	.	H	α-helix	trans	-62.1	-40.1	174.4	-61	0	0	0	0	111	L460 Q525 V526 A527 R533 Y534	L460-T529 HydrophobicContact CD1-CG2 4.44Å; Q525-T529 VanDerWaalsContact O-CB 3.25Å; Q525-T529 WeakPolarHBondContact O-CB 3.37Å; Q525-T529 PolarHBondContact O-N 3.01Å; Q525-T529 PolarHBondContact O-OG1 3.34Å; V526-T529 PolarHBondContact O-N 3.28Å; A527-T529 VanDerWaalsContact C-N 3.35Å; T529-R533 HydrophobicContact CG2-CG 4.31Å; T529-R533 VanDerWaalsContact O-CB 3.24Å; T529-R533 WeakPolarHBondContact O-CB 3.38Å; T529-R533 PolarHBondContact O-N 3.44Å; T529-Y534 HydrophobicContact CG2-CE2 4.25Å
530	M	83.8	Confident	76.4	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.269	C	S	.	.	I	π-helix	trans	-66.6	-44.3	175.2	-70.5	-172.9	-61.8	0	0	112.4	F435 F448 M452 L460 I461 W464 V526 A527 E528 Y534 Y535	F435-M530 HydrophobicContact CE2-CB 4.18Å; F435-M530 HydrophobicContact CZ-CB 3.72Å; F448-M530 HydrophobicContact CE1-CB 4.37Å; F448-M530 HydrophobicContact CE1-SD 4.44Å; F448-M530 HydrophobicContact CZ-CB 4.44Å; M452-M530 HydrophobicContact CE-CG 3.8Å; M452-M530 HydrophobicContact CE-SD 4.02Å; L460-M530 HydrophobicContact CB-CG 4Å; L460-M530 HydrophobicContact CB-SD 3.92Å; L460-M530 HydrophobicContact CD1-CG 4.47Å; I461-M530 HydrophobicContact CB-SD 3.89Å; I461-M530 HydrophobicContact CG1-SD 4.45Å; W464-M530 HydrophobicContact CB-CE 3.74Å; W464-M530 HydrophobicContact CG-CE 3.92Å; V526-M530 HydrophobicContact CG1-CE 4.07Å; V526-M530 WeakPolarHBondContact O-CB 3.36Å; V526-M530 VanDerWaalsContact O-CG 3.29Å; V526-M530 WeakPolarHBondContact O-CG 3.3Å; V526-M530 PolarHBondContact O-N 2.96Å; A527-M530 PolarHBondContact O-N 2.82Å; E528-M530 VanDerWaalsContact C-N 3.3Å; E528-M530 PolarHBondContact O-N 3.14Å; M530-Y534 PolarHBondContact O-N 2.88Å; M530-Y534 VanDerWaalsContact O-N 3.13Å; M530-Y535 PolarHBondContact O-N 3.45Å
531	R	77.6	Confident	75.9	Confident	75 Å²	75	54 Å²	54	28%	0.283	26%	0.263	S	S	.	.	I	π-helix	trans	-65.5	-40.3	177.5	-170.6	-175.2	-69.4	126.8	-2.9	112.6	F435 D436 A527 E528 Y535 P536	F435-R531 HydrophobicContact CB-CG 4.24Å; F435-R531 HydrophobicContact CD1-CB 3.74Å; F435-R531 HydrophobicContact CD1-CG 3.75Å; F435-R531 HydrophobicContact CD2-CB 4.44Å; F435-R531 HydrophobicContact CE1-CB 3.63Å; F435-R531 HydrophobicContact CE1-CG 4.19Å; F435-R531 HydrophobicContact CE2-CB 4.35Å; F435-R531 HydrophobicContact CG-CB 4.12Å; F435-R531 HydrophobicContact CG-CG 3.93Å; F435-R531 HydrophobicContact CZ-CB 3.95Å; D436-R531 IonicContact OD1-CZ 3.39Å; D436-R531 IonicContact OD1-NE 3.43Å; D436-R531 IonicContact OD1-NH2 3.32Å; D436-R531 PolarHBondContact OD1-NH2 3.38Å; D436-R531 IonicContact OD2-NH2 3.12Å; A527-R531 VanDerWaalsContact O-CB 3.27Å; A527-R531 WeakPolarHBondContact O-CB 3.35Å; A527-R531 PolarHBondContact O-N 2.92Å; E528-R531 PolarHBondContact O-N 3.39Å; E528-R531 IonicContact OE2-CZ 2.68Å; E528-R531 IonicContact OE2-NH1 3.93Å; E528-R531 PolarHBondContact OE2-NH1 3.49Å; R531-Y535 WeakPolarHBondContact O-CB 3.16Å; R531-P536 WeakPolarHBondContact O-CD 3.46Å
532	E	57	Low	75.4	Confident	86 Å²	86	52.9 Å²	52.9	40%	0.402	27%	0.265	S	S	.	.	I	π-helix	trans	-84.6	-41.1	-175.7	-71.8	-171	137.2	0	0	112.6	R389 E528	R389-E532 IonicContact CZ-OE1 2.77Å; R389-E532 IonicContact NE-OE1 2.62Å; R389-E532 PolarHBondContact NE-OE1 3.37Å; R389-E532 VanDerWaalsContact NH2-CD 3.35Å; R389-E532 IonicContact NH2-OE1 3.31Å; R389-E532 PolarHBondContact NH2-OE1 3.4Å; E528-E532 HydrophobicContact CG-CG 4.03Å; E528-E532 WeakPolarHBondContact O-CB 3.41Å; E528-E532 VanDerWaalsContact O-CG 3.24Å; E528-E532 WeakPolarHBondContact O-CG 3.22Å; E528-E532 PolarHBondContact O-N 3.08Å; E528-E532 WeakPolarHBondContact OE1-CG 3.49Å
533	R	66.9	Low	75.1	Confident	166 Å²	166	53.2 Å²	53.2	63%	0.626	27%	0.267	S	S	*	.	I	π-helix	trans	-96.1	-36.8	-171.2	-61.8	-166.5	177.2	-140.8	1.9	114	T529	T529-R533 HydrophobicContact CG2-CG 4.31Å; T529-R533 VanDerWaalsContact O-CB 3.24Å; T529-R533 WeakPolarHBondContact O-CB 3.38Å; T529-R533 PolarHBondContact O-N 3.44Å
534	Y	76.9	Confident	74.6	Confident	41 Å²	41	53.3 Å²	53.3	16%	0.161	27%	0.267	C	S	.	.	I	π-helix	trans	-113	-32	-166.2	-54.8	-61.5	0	0	0	112.9	M452 I455 K457 L460 T529 M530 S537 F538	M452-Y534 HydrophobicContact CE-CD2 3.65Å; M452-Y534 HydrophobicContact CE-CE2 4.23Å; M452-Y534 HydrophobicContact CE-CG 4.11Å; M452-Y534 VanDerWaalsContact SD-CB 3.53Å; M452-Y534 HydrophobicContact SD-CD2 3.94Å; M452-Y534 HydrophobicContact SD-CG 3.77Å; I455-Y534 HydrophobicContact CD1-CD1 3.41Å; I455-Y534 VanDerWaalsContact CD1-CD1 3.41Å; I455-Y534 HydrophobicContact CD1-CE1 4Å; I455-Y534 HydrophobicContact CD1-CG 3.96Å; K457-Y534 HydrophobicContact CD-CE1 4.45Å; K457-Y534 WeakPolarHBondContact CD-OH 3.03Å; K457-Y534 HydrophobicContact CG-CE1 3.98Å; K457-Y534 HydrophobicContact CG-CE2 4.41Å; L460-Y534 HydrophobicContact CD1-CD2 4.17Å; L460-Y534 HydrophobicContact CD1-CE2 3.43Å; L460-Y534 VanDerWaalsContact CD1-CE2 3.43Å; T529-Y534 HydrophobicContact CG2-CE2 4.25Å; M530-Y534 PolarHBondContact O-N 2.88Å; M530-Y534 VanDerWaalsContact O-N 3.13Å; Y534-S537 PolarHBondContact O-N 3.48Å; Y534-F538 WeakPolarHBondContact O-CB 3.49Å; Y534-F538 PolarHBondContact O-N 3.38Å
535	Y	77.4	Confident	74.1	Confident	29 Å²	29	51.5 Å²	51.5	11%	0.114	26%	0.258	C	S	.	.	H	α-helix	trans	-61.3	-44.1	178.1	171.8	-112.7	0	0	0	114.3	L433 F435 I438 M530 R531 S537 F538 L539	L433-Y535 PolarHBondContact O-OH 2.92Å; F435-Y535 HydrophobicContact CB-CD1 4.02Å; F435-Y535 HydrophobicContact CB-CD2 4.04Å; F435-Y535 HydrophobicContact CB-CE1 3.96Å; F435-Y535 HydrophobicContact CB-CE2 3.98Å; F435-Y535 HydrophobicContact CB-CG 4.05Å; F435-Y535 HydrophobicContact CD2-CD1 4.29Å; F435-Y535 AromaticContact CD2-CD2 3.58Å; F435-Y535 HydrophobicContact CD2-CD2 3.58Å; F435-Y535 HydrophobicContact CD2-CE2 4.3Å; F435-Y535 AromaticContact CD2-CG 3.57Å; F435-Y535 HydrophobicContact CD2-CG 3.57Å; F435-Y535 HydrophobicContact CE2-CG 4.42Å; F435-Y535 HydrophobicContact CG-CD1 4.49Å; F435-Y535 HydrophobicContact CG-CD2 4.29Å; F435-Y535 HydrophobicContact CG-CG 4.18Å; F435-Y535 PolarHBondContact N-OH 3.01Å; I438-Y535 HydrophobicContact CD1-CD2 4.24Å; I438-Y535 HydrophobicContact CD1-CE2 3.6Å; M530-Y535 PolarHBondContact O-N 3.45Å; R531-Y535 WeakPolarHBondContact O-CB 3.16Å; Y535-S537 PolarHBondContact O-N 2.85Å; Y535-F538 HydrophobicContact CD2-CD1 4.41Å; Y535-F538 WeakPolarHBondContact O-CB 3.16Å; Y535-F538 PolarHBondContact O-N 3.17Å; Y535-F538 VanDerWaalsContact O-N 3.11Å; Y535-L539 HydrophobicContact CD2-CD2 4.45Å; Y535-L539 HydrophobicContact CD2-CG 4.42Å; Y535-L539 HydrophobicContact CE1-CD1 4.04Å; Y535-L539 HydrophobicContact CE2-CD1 4.37Å; Y535-L539 HydrophobicContact CE2-CD2 3.7Å; Y535-L539 HydrophobicContact CE2-CG 4.01Å; Y535-L539 WeakPolarHBondContact O-CG 3.34Å; Y535-L539 PolarHBondContact O-N 3.24Å
536	P	68.4	Low	74	Confident	66 Å²	66	52.9 Å²	52.9	43%	0.429	26%	0.26	S	S	.	.	H	α-helix	trans	-61.9	-34.8	176.5	-23.8	35	0	0	0	112.9	R531	R531-P536 WeakPolarHBondContact O-CD 3.46Å
537	S	66.7	Low	73.7	Confident	57 Å²	57	52.9 Å²	52.9	40%	0.399	26%	0.26	S	S	.	.	H	α-helix	trans	-76.2	-30.5	177.3	-55.2	0	0	0	0	112	Y451 Y534 Y535 V540 S541	Y451-S537 WeakPolarHBondContact OH-CB 3.26Å; Y534-S537 PolarHBondContact O-N 3.48Å; Y535-S537 PolarHBondContact O-N 2.85Å; S537-V540 VanDerWaalsContact O-CG2 3.32Å; S537-V540 WeakPolarHBondContact O-CG2 3.24Å; S537-V540 PolarHBondContact O-N 3.22Å; S537-S541 PolarHBondContact O-N 2.85Å
538	F	78.3	Confident	73.2	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-64	-43.7	171.7	176.5	-122.8	0	0	0	111.1	I438 H447 F448 Y451 Y534 Y535 V540 S541 L543 Y544	I438-F538 HydrophobicContact CD1-CD1 4.49Å; I438-F538 HydrophobicContact CD1-CE1 4.09Å; I438-F538 HydrophobicContact CG2-CE1 4.48Å; H447-F538 HydrophobicContact CB-CZ 4.48Å; F448-F538 HydrophobicContact CB-CE1 4.1Å; F448-F538 HydrophobicContact CB-CZ 4.04Å; F448-F538 HydrophobicContact CD2-CB 4.02Å; F448-F538 AromaticContact CD2-CD1 3.43Å; F448-F538 HydrophobicContact CD2-CD1 3.43Å; F448-F538 VanDerWaalsContact CD2-CD1 3.43Å; F448-F538 AromaticContact CD2-CD2 3.96Å; F448-F538 HydrophobicContact CD2-CD2 3.96Å; F448-F538 AromaticContact CD2-CE1 3.71Å; F448-F538 HydrophobicContact CD2-CE1 3.71Å; F448-F538 HydrophobicContact CD2-CE2 4.22Å; F448-F538 AromaticContact CD2-CG 3.54Å; F448-F538 HydrophobicContact CD2-CG 3.54Å; F448-F538 HydrophobicContact CD2-CZ 4.1Å; F448-F538 HydrophobicContact CE2-CB 3.84Å; F448-F538 AromaticContact CE2-CD1 3.97Å; F448-F538 HydrophobicContact CE2-CD1 3.97Å; F448-F538 AromaticContact CE2-CG 3.91Å; F448-F538 HydrophobicContact CE2-CG 3.91Å; F448-F538 HydrophobicContact CG-CD1 4.43Å; F448-F538 HydrophobicContact CG-CE1 4.33Å; Y451-F538 HydrophobicContact CD1-CB 3.8Å; Y451-F538 AromaticContact CD1-CD2 3.71Å; Y451-F538 HydrophobicContact CD1-CD2 3.71Å; Y451-F538 HydrophobicContact CD1-CG 4.1Å; Y451-F538 AromaticContact CD2-CD2 3.85Å; Y451-F538 HydrophobicContact CD2-CD2 3.85Å; Y451-F538 HydrophobicContact CE1-CB 3.71Å; Y451-F538 HydrophobicContact CE1-CD2 4.4Å; Y451-F538 HydrophobicContact CE1-CG 4.49Å; Y451-F538 HydrophobicContact CG-CB 4.27Å; Y451-F538 AromaticContact CG-CD2 3.4Å; Y451-F538 HydrophobicContact CG-CD2 3.4Å; Y451-F538 VanDerWaalsContact CG-CD2 3.4Å; Y451-F538 HydrophobicContact CG-CE2 4.12Å; Y451-F538 HydrophobicContact CG-CG 4.23Å; Y534-F538 WeakPolarHBondContact O-CB 3.49Å; Y534-F538 PolarHBondContact O-N 3.38Å; Y535-F538 HydrophobicContact CD2-CD1 4.41Å; Y535-F538 WeakPolarHBondContact O-CB 3.16Å; Y535-F538 PolarHBondContact O-N 3.17Å; Y535-F538 VanDerWaalsContact O-N 3.11Å; F538-V540 PolarHBondContact O-N 2.79Å; F538-S541 VanDerWaalsContact O-CB 3.3Å; F538-S541 WeakPolarHBondContact O-CB 3.15Å; F538-S541 PolarHBondContact O-N 3.25Å; F538-S541 PolarHBondContact O-OG 3.36Å; F538-L543 HydrophobicContact CE2-CB 4.26Å; F538-Y544 AromaticContact CD1-CD2 3.84Å; F538-Y544 HydrophobicContact CD1-CD2 3.84Å; F538-Y544 HydrophobicContact CD1-CE2 4.48Å; F538-Y544 AromaticContact CE1-CD2 3.53Å; F538-Y544 HydrophobicContact CE1-CD2 3.53Å; F538-Y544 HydrophobicContact CE1-CE2 4.18Å; F538-Y544 AromaticContact CZ-CD2 3.92Å; F538-Y544 HydrophobicContact CZ-CD2 3.92Å; F538-Y544 WeakPolarHBondContact O-CB 3.23Å
539	L	70.3	Confident	72.7	Confident	40 Å²	40	58.4 Å²	58.4	21%	0.209	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-25.1	-179.7	-68.7	-178.8	0	0	0	114.2	I432 Y535 Y544	I432-L539 HydrophobicContact CG2-CD1 4.03Å; I432-L539 HydrophobicContact CG2-CD2 3.9Å; Y535-L539 HydrophobicContact CD2-CD2 4.45Å; Y535-L539 HydrophobicContact CD2-CG 4.42Å; Y535-L539 HydrophobicContact CE1-CD1 4.04Å; Y535-L539 HydrophobicContact CE2-CD1 4.37Å; Y535-L539 HydrophobicContact CE2-CD2 3.7Å; Y535-L539 HydrophobicContact CE2-CG 4.01Å; Y535-L539 WeakPolarHBondContact O-CG 3.34Å; Y535-L539 PolarHBondContact O-N 3.24Å; L539-Y544 HydrophobicContact CD2-CD1 4.47Å; L539-Y544 HydrophobicContact CD2-CD2 4.13Å; L539-Y544 HydrophobicContact CD2-CE1 3.92Å; L539-Y544 HydrophobicContact CD2-CE2 3.52Å; L539-Y544 WeakPolarHBondContact CD2-OH 3.48Å; L539-Y544 WeakPolarHBondContact O-CD1 3.38Å
540	V	58.9	Low	71.9	Confident	128 Å²	128	63.9 Å²	63.9	78%	0.776	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	10	179.5	-61.2	0	0	0	0	113	S537 F538	S537-V540 VanDerWaalsContact O-CG2 3.32Å; S537-V540 WeakPolarHBondContact O-CG2 3.24Å; S537-V540 PolarHBondContact O-N 3.22Å; F538-V540 PolarHBondContact O-N 2.79Å
541	S	72.4	Confident	70.8	Confident	16 Å²	16	65.4 Å²	65.4	11%	0.112	30%	0.302	C	S	.	.	S	Bend	trans	-89.6	154.2	-178.1	73.9	0	0	0	0	113.2	S537 F538 L543 Y544 E545	S537-S541 PolarHBondContact O-N 2.85Å; F538-S541 VanDerWaalsContact O-CB 3.3Å; F538-S541 WeakPolarHBondContact O-CB 3.15Å; F538-S541 PolarHBondContact O-N 3.25Å; F538-S541 PolarHBondContact O-OG 3.36Å; S541-L543 PolarHBondContact O-N 3.3Å; S541-L543 VanDerWaalsContact O-N 3.15Å; S541-Y544 PolarHBondContact O-N 3.4Å; S541-Y544 PolarHBondContact OG-N 3.37Å; S541-E545 PolarHBondContact O-N 2.55Å
542	D	69.9	Low	69.6	Low	83 Å²	83	67.4 Å²	67.4	44%	0.444	32%	0.315	S	S	.	.	H	α-helix	trans	-58.7	-24.2	172.3	72.5	-54.9	0	0	0	113	R454 R546	R454-D542 IonicContact CZ-OD2 3.88Å; R454-D542 IonicContact NH1-OD1 3.19Å; R454-D542 PolarHBondContact NH1-OD1 3.15Å; R454-D542 IonicContact NH1-OD2 2.8Å; R454-D542 PolarHBondContact NH1-OD2 3.44Å; D542-R546 WeakPolarHBondContact O-CB 2.95Å; D542-R546 WeakPolarHBondContact O-CG 2.97Å; D542-R546 PolarHBondContact O-N 2.66Å; D542-R546 PolarHBondContact O-NE 3.36Å; D542-R546 IonicContact OD2-CZ 2.7Å; D542-R546 IonicContact OD2-NE 3.79Å; D542-R546 IonicContact OD2-NH2 2.77Å; D542-R546 PolarHBondContact OD2-NH2 2.85Å
543	L	77.9	Confident	69.2	Low	9 Å²	9	66.4 Å²	66.4	5%	0.047	32%	0.317	C	S	.	.	H	α-helix	trans	-75.4	-38.1	175.8	-80.9	170.5	0	0	0	112.4	Y451 R454 F538 S541 L547	Y451-L543 HydrophobicContact CD2-CD1 4.1Å; Y451-L543 HydrophobicContact CG-CD1 4.37Å; R454-L543 HydrophobicContact CG-CD1 4.33Å; F538-L543 HydrophobicContact CE2-CB 4.26Å; S541-L543 PolarHBondContact O-N 3.3Å; S541-L543 VanDerWaalsContact O-N 3.15Å; L543-L547 WeakPolarHBondContact O-CB 3.19Å; L543-L547 PolarHBondContact O-N 2.98Å
544	Y	77.5	Confident	68.4	Low	9 Å²	9	63 Å²	63	4%	0.035	31%	0.311	C	S	.	.	H	α-helix	trans	-71.4	-40.3	173.9	-173.6	-99	0	0	0	111	I432 L433 I438 F538 L539 S541 R546 L547 I548	I432-Y544 WeakPolarHBondContact CA-OH 2.85Å; L433-Y544 PolarHBondContact N-OH 3.03Å; I438-Y544 HydrophobicContact CD1-CE2 4.49Å; F538-Y544 AromaticContact CD1-CD2 3.84Å; F538-Y544 HydrophobicContact CD1-CD2 3.84Å; F538-Y544 HydrophobicContact CD1-CE2 4.48Å; F538-Y544 AromaticContact CE1-CD2 3.53Å; F538-Y544 HydrophobicContact CE1-CD2 3.53Å; F538-Y544 HydrophobicContact CE1-CE2 4.18Å; F538-Y544 AromaticContact CZ-CD2 3.92Å; F538-Y544 HydrophobicContact CZ-CD2 3.92Å; F538-Y544 WeakPolarHBondContact O-CB 3.23Å; L539-Y544 HydrophobicContact CD2-CD1 4.47Å; L539-Y544 HydrophobicContact CD2-CD2 4.13Å; L539-Y544 HydrophobicContact CD2-CE1 3.92Å; L539-Y544 HydrophobicContact CD2-CE2 3.52Å; L539-Y544 WeakPolarHBondContact CD2-OH 3.48Å; L539-Y544 WeakPolarHBondContact O-CD1 3.38Å; S541-Y544 PolarHBondContact O-N 3.4Å; S541-Y544 PolarHBondContact OG-N 3.37Å; Y544-R546 VanDerWaalsContact C-N 3.29Å; Y544-R546 PolarHBondContact O-N 2.7Å; Y544-L547 HydrophobicContact CD2-CD2 4.19Å; Y544-L547 HydrophobicContact CE2-CD2 4.16Å; Y544-L547 CarbonylContact O-C 3.52Å; Y544-L547 WeakPolarHBondContact O-CA 3.3Å; Y544-L547 WeakPolarHBondContact O-CB 3.39Å; Y544-L547 PolarHBondContact O-N 3.28Å; Y544-I548 HydrophobicContact CD1-CG1 3.94Å; Y544-I548 HydrophobicContact CE1-CD1 4.02Å; Y544-I548 HydrophobicContact CE1-CG1 3.62Å; Y544-I548 WeakPolarHBondContact O-CG1 3.4Å; Y544-I548 PolarHBondContact O-N 2.99Å
545	E	69.9	Low	66.7	Low	84 Å²	84	65.4 Å²	65.4	39%	0.393	33%	0.334	S	S	.	.	H	α-helix	trans	-61.4	-39.7	174	-163	-177.7	175.5	0	0	111.6	S541 I548 R549	S541-E545 PolarHBondContact O-N 2.55Å; E545-I548 PolarHBondContact O-N 3.37Å; E545-R549 WeakPolarHBondContact O-CB 3.25Å; E545-R549 VanDerWaalsContact O-CG 3.26Å; E545-R549 WeakPolarHBondContact O-CG 3.24Å; E545-R549 PolarHBondContact O-N 3.26Å; E545-R549 IonicContact OE1-CZ 3.53Å; E545-R549 IonicContact OE1-NE 3.09Å; E545-R549 PolarHBondContact OE1-NE 2.99Å; E545-R549 IonicContact OE1-NH2 3.83Å; E545-R549 PolarHBondContact OE1-NH2 3.09Å
546	R	77.4	Confident	64.8	Low	117 Å²	117	72.7 Å²	72.7	44%	0.442	37%	0.369	S	S	.	.	H	α-helix	trans	-66.4	-36.4	171.2	-81.4	-175.6	-71.4	158.4	-4.4	113.3	R454 D542 Y544 R550	R454-R546 VanDerWaalsContact CZ-NH2 3.26Å; D542-R546 WeakPolarHBondContact O-CB 2.95Å; D542-R546 WeakPolarHBondContact O-CG 2.97Å; D542-R546 PolarHBondContact O-N 2.66Å; D542-R546 PolarHBondContact O-NE 3.36Å; D542-R546 IonicContact OD2-CZ 2.7Å; D542-R546 IonicContact OD2-NE 3.79Å; D542-R546 IonicContact OD2-NH2 2.77Å; D542-R546 PolarHBondContact OD2-NH2 2.85Å; Y544-R546 VanDerWaalsContact C-N 3.29Å; Y544-R546 PolarHBondContact O-N 2.7Å; R546-R550 WeakPolarHBondContact O-CB 3Å; R546-R550 PolarHBondContact O-N 3.45Å
547	L	79.6	Confident	63.4	Low	6 Å²	6	72.9 Å²	72.9	3%	0.031	37%	0.372	C	S	.	.	H	α-helix	trans	-63	-44.8	173.8	171.3	141.4	0	0	0	110.9	L433 Y444 H447 L543 Y544 R550 D551	L433-L547 HydrophobicContact CD1-CD2 3.55Å; Y444-L547 HydrophobicContact CD1-CD1 4.05Å; Y444-L547 HydrophobicContact CG-CD1 4.49Å; H447-L547 HydrophobicContact CB-CB 4.37Å; H447-L547 HydrophobicContact CB-CD1 3.5Å; L543-L547 WeakPolarHBondContact O-CB 3.19Å; L543-L547 PolarHBondContact O-N 2.98Å; Y544-L547 HydrophobicContact CD2-CD2 4.19Å; Y544-L547 HydrophobicContact CE2-CD2 4.16Å; Y544-L547 CarbonylContact O-C 3.52Å; Y544-L547 WeakPolarHBondContact O-CA 3.3Å; Y544-L547 WeakPolarHBondContact O-CB 3.39Å; Y544-L547 PolarHBondContact O-N 3.28Å; L547-R550 PolarHBondContact O-N 2.77Å; L547-D551 WeakPolarHBondContact O-CB 3.19Å; L547-D551 PolarHBondContact O-N 3.03Å
548	I	73.4	Confident	61.7	Low	17 Å²	17	79.4 Å²	79.4	9%	0.087	40%	0.396	C	S	.	.	H	α-helix	trans	-68.6	-44.9	178.1	-63.8	-62.8	0	0	0	111.2	L433 Y544 E545 R550 D551 E552	L433-I548 HydrophobicContact CD1-CD1 4.47Å; L433-I548 HydrophobicContact CG-CD1 4.39Å; Y544-I548 HydrophobicContact CD1-CG1 3.94Å; Y544-I548 HydrophobicContact CE1-CD1 4.02Å; Y544-I548 HydrophobicContact CE1-CG1 3.62Å; Y544-I548 WeakPolarHBondContact O-CG1 3.4Å; Y544-I548 PolarHBondContact O-N 2.99Å; E545-I548 PolarHBondContact O-N 3.37Å; I548-R550 VanDerWaalsContact C-N 3.25Å; I548-R550 PolarHBondContact O-N 2.85Å; I548-D551 PolarHBondContact O-N 3.42Å; I548-E552 HydrophobicContact CG2-CG 4.47Å; I548-E552 WeakPolarHBondContact O-CB 3.3Å; I548-E552 WeakPolarHBondContact O-CG 3.32Å; I548-E552 PolarHBondContact O-N 3.08Å
549	R	66.7	Low	59.1	Low	154 Å²	154	85.3 Å²	85.3	58%	0.581	44%	0.436	S	S	*	.	H	α-helix	trans	-61.7	-34.6	175	-72.4	179.3	-172.9	-160.2	4	112.2	E545 S553	E545-R549 WeakPolarHBondContact O-CB 3.25Å; E545-R549 VanDerWaalsContact O-CG 3.26Å; E545-R549 WeakPolarHBondContact O-CG 3.24Å; E545-R549 PolarHBondContact O-N 3.26Å; E545-R549 IonicContact OE1-CZ 3.53Å; E545-R549 IonicContact OE1-NE 3.09Å; E545-R549 PolarHBondContact OE1-NE 2.99Å; E545-R549 IonicContact OE1-NH2 3.83Å; E545-R549 PolarHBondContact OE1-NH2 3.09Å; R549-S553 WeakPolarHBondContact O-CB 3.3Å; R549-S553 PolarHBondContact O-N 3.47Å; R549-S553 PolarHBondContact O-OG 3.3Å
550	R	62	Low	57	Low	159 Å²	159	88.9 Å²	88.9	60%	0.6	46%	0.464	S	S	*	.	H	α-helix	trans	-74.1	-38	176.5	-162.2	176.2	-168	125.8	2	111.6	R546 L547 I548 S553 N554	R546-R550 WeakPolarHBondContact O-CB 3Å; R546-R550 PolarHBondContact O-N 3.45Å; L547-R550 PolarHBondContact O-N 2.77Å; I548-R550 VanDerWaalsContact C-N 3.25Å; I548-R550 PolarHBondContact O-N 2.85Å; R550-S553 VanDerWaalsContact CA-OG 3.32Å; R550-S553 WeakPolarHBondContact CA-OG 3.46Å; R550-S553 PolarHBondContact O-N 3.32Å; R550-S553 PolarHBondContact O-OG 3.44Å; R550-N554 WeakPolarHBondContact O-CB 3.39Å; R550-N554 PolarHBondContact O-N 3.06Å
551	D	61.4	Low	55.9	Low	32 Å²	32	88.4 Å²	88.4	17%	0.171	46%	0.464	C	S	.	.	H	α-helix	trans	-64.1	-40.3	172.5	-162.3	45.5	0	0	0	111.3	L547 I548 N554 S555	L547-D551 WeakPolarHBondContact O-CB 3.19Å; L547-D551 PolarHBondContact O-N 3.03Å; I548-D551 PolarHBondContact O-N 3.42Å; D551-N554 PolarHBondContact O-N 3.09Å; D551-S555 VanDerWaalsContact O-CB 3.25Å; D551-S555 WeakPolarHBondContact O-CB 3.33Å; D551-S555 PolarHBondContact O-N 3.25Å; D551-S555 PolarHBondContact O-OG 3.16Å
552	E	52.2	Low	53.8	Low	117 Å²	117	96.6 Å²	96.6	55%	0.547	50%	0.5	S	S	.	.	H	α-helix	trans	-67.2	-38.6	173.7	-73.4	177.3	169	0	0	112.2	I548 S555	I548-E552 HydrophobicContact CG2-CG 4.47Å; I548-E552 WeakPolarHBondContact O-CB 3.3Å; I548-E552 WeakPolarHBondContact O-CG 3.32Å; I548-E552 PolarHBondContact O-N 3.08Å; E552-S555 PolarHBondContact O-N 3.06Å
553	S	48.7	Very low	51.7	Low	64 Å²	64	99.5 Å²	99.5	45%	0.448	51%	0.511	S	S	.	.	H	α-helix	trans	-70.6	-34.4	174.3	69.9	0	0	0	0	113.3	R549 R550 Q556	R549-S553 WeakPolarHBondContact O-CB 3.3Å; R549-S553 PolarHBondContact O-N 3.47Å; R549-S553 PolarHBondContact O-OG 3.3Å; R550-S553 VanDerWaalsContact CA-OG 3.32Å; R550-S553 WeakPolarHBondContact CA-OG 3.46Å; R550-S553 PolarHBondContact O-N 3.32Å; R550-S553 PolarHBondContact O-OG 3.44Å; S553-Q556 PolarHBondContact O-N 3.13Å
554	N	49.4	Very low	49.4	Very low	95 Å²	95	107.4 Å²	107.4	51%	0.508	55%	0.545	S	S	.	.	H	α-helix	trans	-76.3	-27.6	175.3	-84.5	-0.1	0	0	0	111.9	R550 D551 Q556 S557	R550-N554 WeakPolarHBondContact O-CB 3.39Å; R550-N554 PolarHBondContact O-N 3.06Å; D551-N554 PolarHBondContact O-N 3.09Å; N554-Q556 PolarHBondContact O-N 3.48Å; N554-S557 CarbonylContact O-C 3.56Å; N554-S557 PolarHBondContact O-N 3.1Å; N554-S557 VanDerWaalsContact O-N 3.07Å
555	S	43.1	Very low	46.9	Very low	92 Å²	92	110.3 Å²	110.3	64%	0.643	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	-13.4	175	-62.8	0	0	0	0	113.3	D551 E552	D551-S555 VanDerWaalsContact O-CB 3.25Å; D551-S555 WeakPolarHBondContact O-CB 3.33Å; D551-S555 PolarHBondContact O-N 3.25Å; D551-S555 PolarHBondContact O-OG 3.16Å; E552-S555 PolarHBondContact O-N 3.06Å
556	Q	36.1	Very low	44.8	Very low	182 Å²	182	114.7 Å²	114.7	85%	0.85	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	0.3	169.2	-72.8	-175.7	-7.2	0	0	113.7	S553 N554	S553-Q556 PolarHBondContact O-N 3.13Å; N554-Q556 PolarHBondContact O-N 3.48Å
557	S	39.4	Very low	42.3	Very low	69 Å²	69	112.4 Å²	112.4	48%	0.483	62%	0.617	S	S	.	*	S	Bend	trans	-138	71.6	176.3	68.1	0	0	0	0	111.6	N554	N554-S557 CarbonylContact O-C 3.56Å; N554-S557 PolarHBondContact O-N 3.1Å; N554-S557 VanDerWaalsContact O-N 3.07Å
558	Q	30.8	Very low	39.6	Very low	194 Å²	194	117.4 Å²	117.4	91%	0.907	65%	0.651	S	S	*	*			trans	-175.1	100.2	139.9	-102.3	165	21.8	0	0	110.2
559	C	23.2	Very low	37.3	Very low	125 Å²	125	125.6 Å²	125.6	85%	0.845	69%	0.689	S	S	*	*			trans	-91.8	122.6	158.3	-171.4	0	0	0	0	107
560	S	26.7	Very low	35.3	Very low	114 Å²	114	121.6 Å²	121.6	80%	0.797	70%	0.696	S	S	*	*			trans	168.4	134.8	138.3	-69.7	0	0	0	0	110.5
561	P	36.8	Very low	33.5	Very low	119 Å²	119	122.4 Å²	122.4	77%	0.773	71%	0.711	S	S	*	*			trans	-102	132.3	178.4	35.1	-25	0	0	0	111.5
562	E	27	Very low	31.8	Very low	188 Å²	188	128.6 Å²	128.6	88%	0.879	74%	0.744	S	S	*	*			trans	-140.9	114	156.8	-75.3	-164.6	160.1	0	0	112.5
563	E	27.4	Very low	30.6	Very low	143 Å²	143	127.4 Å²	127.4	67%	0.668	75%	0.754	S	S	*	*			trans	50.8	124.2	132.9	-62.1	-148.2	143.5	0	0	123.7
564	K	28.4	Very low	29.4	Very low	176 Å²	176	128 Å²	128	77%	0.765	77%	0.771	S	S	*	*				65.4	132.9	128.4	-68.6	176.3	-174.5	140.3	0	120.4
565	G	25.1	Very low	28.4	Very low	70 Å²	70	131.9 Å²	131.9	72%	0.722	79%	0.786	S	S	*	*				144.1	106	124.8	0	0	0	0	0	117.4
566	N	25.7	Very low	27.5	Very low	175 Å²	175	134.9 Å²	134.9	94%	0.936	79%	0.79	S	S	*	*			trans	41.1	135.1	134.9	-82.6	9.3	0	0	0	122.7
567	G	24.5	Very low	27.2	Very low	70 Å²	70	132.1 Å²	132.1	72%	0.722	79%	0.785	S	S	*	*				136.5	101.4	113.2	0	0	0	0	0	119.9
568	C	23.3	Very low	26.5	Very low	110 Å²	110	134.1 Å²	134.1	74%	0.743	80%	0.798	S	S	*	*				67.3	127.7	125.8	-76	0	0	0	0	126.1
569	Q	25.1	Very low	26.3	Very low	189 Å²	189	131.7 Å²	131.7	88%	0.883	79%	0.791	S	S	*	*				69.8	141.9	129.4	-63.9	170.6	2.4	0	0	119.6
570	G	24.4	Very low	26.5	Very low	70 Å²	70	134.4 Å²	134.4	72%	0.722	79%	0.792	S	S	*	*			cis	163.5	164.7	2	0	0	0	0	0	111.5
571	L	24.7	Very low	27.3	Very low	176 Å²	176	132.4 Å²	132.4	92%	0.921	79%	0.789	S	S	*	*			trans	89	94.2	153	-61	161.8	0	0	0	122.9
572	D	25.9	Very low	27	Very low	162 Å²	162	133 Å²	133	87%	0.866	79%	0.79	S	S	*	*				54.6	157	98.4	-142.2	16.3	0	0	0	126.4
573	A	26.2	Very low	28.1	Very low	92 Å²	92	133.6 Å²	133.6	76%	0.76	79%	0.79	S	S	*	*			trans	98.3	120.3	169.4	0	0	0	0	0	115.9
574	G	24.7	Very low	29.3	Very low	78 Å²	78	129.3 Å²	129.3	80%	0.804	78%	0.784	S	S	*	*			cis	112.3	147.2	33.8	0	0	0	0	0	107.3
575	E	27.5	Very low	30.1	Very low	176 Å²	176	123.4 Å²	123.4	82%	0.822	76%	0.761	S	S	*	*			cis	-175.1	172.9	-9.2	-159.4	178.9	-165.3	0	0	105.9
576	E	25.8	Very low	31	Very low	154 Å²	154	125.3 Å²	125.3	72%	0.72	75%	0.754	S	S	*	*			trans	86.2	107.3	152	-60.3	-159	149.3	0	0	123.8
577	V	28.3	Very low	32.1	Very low	125 Å²	125	123.9 Å²	123.9	76%	0.758	74%	0.742	S	S	*	*				53.9	140.1	92.4	-176.6	0	0	0	0	116.1
578	C	25.9	Very low	33.3	Very low	111 Å²	111	124.5 Å²	124.5	75%	0.75	73%	0.726	S	S	*	*			cis	-165.8	156.5	31.9	-131.3	0	0	0	0	112.2
579	D	26.6	Very low	34.5	Very low	143 Å²	143	120 Å²	120	77%	0.765	70%	0.697	S	S	*	*			trans	47.4	155.4	130.1	-138	9.7	0	0	0	127.6
580	E	27.5	Very low	35.7	Very low	182 Å²	182	113.9 Å²	113.9	85%	0.85	68%	0.675	S	S	*	*			trans	98.8	131	150.1	-87.2	-172.1	169.4	0	0	121.4
581	G	42.7	Very low	37.3	Very low	71 Å²	71	117.8 Å²	117.8	73%	0.732	67%	0.669	S	S	*	*			trans	-108.6	140.6	-176.9	0	0	0	0	0	113.9
582	T	31.3	Very low	38.8	Very low	132 Å²	132	109.6 Å²	109.6	81%	0.81	63%	0.626	S	S	*	*			trans	-160.7	121.4	148.5	-19.6	0	0	0	0	108.8
583	K	49.3	Very low	40.1	Very low	200 Å²	200	104.3 Å²	104.3	87%	0.87	61%	0.606	S	S	*	*			trans	-85.9	144.2	-173.5	-74	175.7	174.2	175.4	0	112
584	G	52.2	Low	41.8	Very low	53 Å²	53	103.7 Å²	103.7	55%	0.546	59%	0.592	S	S	.	*	S	Bend	trans	144.1	-43.3	149.7	0	0	0	0	0	116.4
585	I	44.6	Very low	43.8	Very low	53 Å²	53	103 Å²	103	27%	0.272	57%	0.567	S	S	.	*	S	Bend	trans	-136.7	-16.6	-176.3	-57.3	174.9	0	0	0	112.1	T648 C652	I585-T648 HydrophobicContact CG2-CG2 4.33Å; I585-C652 VanDerWaalsContact CG2-SG 3.58Å
586	N	45.7	Very low	45.8	Very low	110 Å²	110	96.3 Å²	96.3	59%	0.588	54%	0.537	S	S	*	.	H	α-helix	trans	-78.3	-20.3	-175.4	-159.4	12.2	0	0	0	114.9	S590	N586-S590 WeakPolarHBondContact O-CB 3.3Å; N586-S590 PolarHBondContact O-N 2.88Å; N586-S590 VanDerWaalsContact O-N 3.11Å; N586-S590 PolarHBondContact O-OG 3.13Å
587	E	47	Very low	47.7	Very low	145 Å²	145	98.8 Å²	98.8	68%	0.678	54%	0.539	S	S	*	.	H	α-helix	trans	-71.8	-30.1	-178.1	-74	178.7	177.7	0	0	112.8	S590 Y591	E587-S590 PolarHBondContact O-OG 3.35Å; E587-Y591 WeakPolarHBondContact O-CB 3.27Å; E587-Y591 PolarHBondContact O-N 3.15Å
588	Q	50	Low	49.6	Very low	83 Å²	83	98.3 Å²	98.3	39%	0.388	53%	0.529	S	S	.	.	H	α-helix	trans	-78.5	-33.4	178.2	-164	159.6	3	0	0	112.3	A592	Q588-A592 PolarHBondContact O-N 2.92Å
589	A	48.8	Very low	51.9	Low	16 Å²	16	93.9 Å²	93.9	13%	0.132	50%	0.498	C	S	.	.	H	α-helix	trans	-74.6	-42.4	177	0	0	0	0	0	112.9	Y591 A592 A593	A589-Y591 PolarHBondContact O-N 2.97Å; A589-A592 PolarHBondContact O-N 3.29Å; A589-A593 PolarHBondContact O-N 3.09Å; A589-A593 VanDerWaalsContact O-N 3.15Å
590	S	50.1	Low	54	Low	59 Å²	59	95 Å²	95	41%	0.413	49%	0.493	S	S	.	.	H	α-helix	trans	-66.7	-34	176.8	55.2	0	0	0	0	113.4	N586 E587 T594	N586-S590 WeakPolarHBondContact O-CB 3.3Å; N586-S590 PolarHBondContact O-N 2.88Å; N586-S590 VanDerWaalsContact O-N 3.11Å; N586-S590 PolarHBondContact O-OG 3.13Å; E587-S590 PolarHBondContact O-OG 3.35Å; S590-T594 PolarHBondContact O-N 3.12Å; S590-T594 VanDerWaalsContact O-N 3.1Å; S590-T594 PolarHBondContact O-OG1 3.16Å
591	Y	58.3	Low	56	Low	152 Å²	152	91.7 Å²	91.7	60%	0.596	48%	0.481	S	S	*	.	H	α-helix	trans	-65.3	-43.8	173.4	179.3	-101.1	0	0	0	112.2	E587 A589 A593 T594 K595	E587-Y591 WeakPolarHBondContact O-CB 3.27Å; E587-Y591 PolarHBondContact O-N 3.15Å; A589-Y591 PolarHBondContact O-N 2.97Å; Y591-A593 PolarHBondContact O-N 3.11Å; Y591-T594 PolarHBondContact O-N 2.8Å; Y591-K595 HydrophobicContact CE1-CD 4.38Å; Y591-K595 WeakPolarHBondContact O-CB 3.29Å; Y591-K595 PolarHBondContact O-N 3.45Å; Y591-K595 VanDerWaalsContact O-N 3.11Å
592	A	56.8	Low	57.5	Low	4 Å²	4	94.3 Å²	94.3	3%	0.033	47%	0.472	C	S	.	.	H	α-helix	trans	-63.2	-41.3	177.6	0	0	0	0	0	112	Q588 A589 L596 L641 I645	Q588-A592 PolarHBondContact O-N 2.92Å; A589-A592 PolarHBondContact O-N 3.29Å; A592-L596 PolarHBondContact O-N 3.09Å; A592-L641 HydrophobicContact CB-CD1 3.8Å; A592-L641 HydrophobicContact CB-CD2 4.46Å; A592-L641 HydrophobicContact CB-CG 4.04Å; A592-L641 WeakPolarHBondContact O-CD2 2.81Å; A592-I645 HydrophobicContact CB-CD1 3.66Å; A592-I645 HydrophobicContact CB-CG1 3.62Å
593	A	53.2	Low	59.7	Low	52 Å²	52	89 Å²	89	43%	0.43	44%	0.439	S	S	.	.	H	α-helix	trans	-67.1	-40.6	177.9	0	0	0	0	0	113.5	A589 Y591 L596 I645	A589-A593 PolarHBondContact O-N 3.09Å; A589-A593 VanDerWaalsContact O-N 3.15Å; Y591-A593 PolarHBondContact O-N 3.11Å; A593-L596 WeakPolarHBondContact O-CB 3.47Å; A593-L596 PolarHBondContact O-N 3.48Å; A593-I645 HydrophobicContact CB-CD1 4.41Å
594	T	60.9	Low	60.8	Low	79 Å²	79	83.7 Å²	83.7	49%	0.485	42%	0.417	S	S	.	.	H	α-helix	trans	-68.7	-38.4	179.4	-53.9	0	0	0	0	111.9	S590 Y591 L596 R597 Q598	S590-T594 PolarHBondContact O-N 3.12Å; S590-T594 VanDerWaalsContact O-N 3.1Å; S590-T594 PolarHBondContact O-OG1 3.16Å; Y591-T594 PolarHBondContact O-N 2.8Å; T594-L596 VanDerWaalsContact C-N 3.26Å; T594-L596 PolarHBondContact O-N 3.03Å; T594-R597 PolarHBondContact O-N 2.87Å; T594-Q598 PolarHBondContact O-N 3.39Å
595	K	66.3	Low	61.9	Low	64 Å²	64	85.5 Å²	85.5	28%	0.278	41%	0.408	S	S	.	.	H	α-helix	trans	-64.7	-32.1	177.8	-167.5	178.5	177.7	-156	0	112.1	Y591 L599 E637 L641	Y591-K595 HydrophobicContact CE1-CD 4.38Å; Y591-K595 WeakPolarHBondContact O-CB 3.29Å; Y591-K595 PolarHBondContact O-N 3.45Å; Y591-K595 VanDerWaalsContact O-N 3.11Å; K595-L599 PolarHBondContact O-N 2.68Å; K595-E637 WeakPolarHBondContact CE-OE1 3.27Å; K595-E637 IonicContact NZ-OE1 3.15Å; K595-E637 PolarHBondContact NZ-OE1 3Å; K595-L641 HydrophobicContact CB-CD2 4.05Å; K595-L641 HydrophobicContact CD-CD2 4.29Å; K595-L641 HydrophobicContact CG-CD2 4.33Å
596	L	70.3	Confident	63.5	Low	35 Å²	35	83.6 Å²	83.6	18%	0.183	40%	0.398	C	S	.	.	H	α-helix	trans	-63.6	-43.7	177.3	-161.2	74.4	0	0	0	112.4	A592 A593 T594 L599 H638	A592-L596 PolarHBondContact O-N 3.09Å; A593-L596 WeakPolarHBondContact O-CB 3.47Å; A593-L596 PolarHBondContact O-N 3.48Å; T594-L596 VanDerWaalsContact C-N 3.26Å; T594-L596 PolarHBondContact O-N 3.03Å; L596-L599 PolarHBondContact O-N 3.48Å; L596-H638 HydrophobicContact CD1-CB 4.24Å; L596-H638 WeakPolarHBondContact CD1-CD2 3.46Å; L596-H638 WeakPolarHBondContact CD1-NE2 3.2Å; L596-H638 VanDerWaalsContact CD1-O 3.26Å; L596-H638 WeakPolarHBondContact CD1-O 3.3Å; L596-H638 WeakPolarHBondContact CG-NE2 3.05Å
597	R	65.5	Low	65.1	Low	205 Å²	205	84.2 Å²	84.2	77%	0.774	39%	0.392	S	S	*	.	H	α-helix	trans	-68	-40.8	-178.8	-159.1	175.9	-146.3	166.5	6	112.8	T594 L599 Y600	T594-R597 PolarHBondContact O-N 2.87Å; R597-L599 VanDerWaalsContact C-N 3.26Å; R597-L599 PolarHBondContact O-N 3.16Å; R597-Y600 PolarHBondContact O-N 3.2Å
598	Q	69.6	Low	66.4	Low	115 Å²	115	83.5 Å²	83.5	54%	0.537	39%	0.388	S	S	.	.	H	α-helix	trans	-67.6	-24.7	178.8	-67	179.5	-1.5	0	0	113.6	T594	T594-Q598 PolarHBondContact O-N 3.39Å
599	L	72.7	Confident	67.4	Low	19 Å²	19	79.9 Å²	79.9	10%	0.099	37%	0.372	C	S	.	.	H	α-helix	trans	-68.1	-35	174.9	-86.8	161.2	0	0	0	111.7	K595 L596 R597 M634	K595-L599 PolarHBondContact O-N 2.68Å; L596-L599 PolarHBondContact O-N 3.48Å; R597-L599 VanDerWaalsContact C-N 3.26Å; R597-L599 PolarHBondContact O-N 3.16Å; L599-M634 HydrophobicContact CD2-CB 4.17Å; L599-M634 HydrophobicContact CD2-CE 3.63Å; L599-M634 HydrophobicContact CD2-CG 4.22Å
600	Y	71.4	Confident	68.8	Low	167 Å²	167	80.2 Å²	80.2	66%	0.655	37%	0.372	S	S	*	.	H	α-helix	trans	-70.2	-50.2	-176	-169.5	-93.7	0	0	0	113	R597 K602 L603	R597-Y600 PolarHBondContact O-N 3.2Å; Y600-K602 VanDerWaalsContact C-N 3.32Å; Y600-K602 PolarHBondContact O-N 3.33Å; Y600-L603 VanDerWaalsContact O-CB 3.31Å; Y600-L603 WeakPolarHBondContact O-CB 3.3Å; Y600-L603 PolarHBondContact O-N 3.22Å; Y600-L603 VanDerWaalsContact O-N 3.09Å
601	D	70.1	Confident	69.8	Low	111 Å²	111	79 Å²	79	59%	0.594	37%	0.368	S	S	*	.	H	α-helix	trans	-65.1	-34.4	-176.5	-65.1	-24.8	0	0	0	113.1	L603 E604	D601-L603 PolarHBondContact O-N 3.22Å; D601-E604 PolarHBondContact O-N 2.91Å
602	K	73.2	Confident	70.5	Confident	127 Å²	127	73.7 Å²	73.7	55%	0.552	35%	0.354	S	S	*	.	H	α-helix	trans	-66.7	-26.9	175.9	-78.8	-179.8	178.6	172.4	0	113	Y600 E604 K606 M634	Y600-K602 VanDerWaalsContact C-N 3.32Å; Y600-K602 PolarHBondContact O-N 3.33Å; K602-E604 VanDerWaalsContact C-N 3.33Å; K602-K606 WeakPolarHBondContact O-CG 3.22Å; K602-M634 HydrophobicContact CB-CE 3.93Å
603	L	77.1	Confident	71.2	Confident	21 Å²	21	74.1 Å²	74.1	11%	0.11	36%	0.356	C	S	.	.	H	α-helix	trans	-70.5	-33.8	-178.4	-158.3	152.1	0	0	0	110.8	Y600 D601 R607 I631 E635	Y600-L603 VanDerWaalsContact O-CB 3.31Å; Y600-L603 WeakPolarHBondContact O-CB 3.3Å; Y600-L603 PolarHBondContact O-N 3.22Å; Y600-L603 VanDerWaalsContact O-N 3.09Å; D601-L603 PolarHBondContact O-N 3.22Å; L603-R607 VanDerWaalsContact CD2-NH2 3.3Å; L603-I631 HydrophobicContact CD1-CG2 4.49Å; L603-I631 HydrophobicContact CD2-CG2 4.1Å; L603-I631 HydrophobicContact CG-CG2 4.19Å; L603-E635 HydrophobicContact CD1-CG 3.75Å
604	E	74.1	Confident	72.4	Confident	88 Å²	88	76.8 Å²	76.8	41%	0.411	36%	0.359	S	S	.	.	H	α-helix	trans	-77.6	-40.2	-177.1	-166.6	55.1	-149.3	0	0	113.5	D601 K602 K606 R607	D601-E604 PolarHBondContact O-N 2.91Å; K602-E604 VanDerWaalsContact C-N 3.33Å; E604-K606 VanDerWaalsContact C-N 3.33Å; E604-K606 PolarHBondContact O-N 2.93Å; E604-R607 WeakPolarHBondContact O-CB 3.08Å; E604-R607 PolarHBondContact O-N 3.36Å; E604-R607 VanDerWaalsContact O-N 3.16Å; E604-R607 IonicContact OE2-CZ 3.68Å; E604-R607 IonicContact OE2-NH1 2.79Å; E604-R607 PolarHBondContact OE2-NH1 3.19Å
605	Y	74.3	Confident	72.8	Confident	90 Å²	90	79.8 Å²	79.8	35%	0.353	37%	0.372	S	S	.	.	H	α-helix	trans	-63	-38.4	177.2	-168.9	-143.5	0	0	0	112.2	G512 R514 R607 Q608 A609	G512-Y605 VanDerWaalsContact CA-CD1 3.45Å; G512-Y605 CarbonylContact O-C 3.59Å; G512-Y605 WeakPolarHBondContact O-CD1 3.46Å; G512-Y605 VanDerWaalsContact O-CE1 3.23Å; G512-Y605 WeakPolarHBondContact O-CE1 3.32Å; R514-Y605 PolarHBondContact O-OH 3.36Å; Y605-R607 VanDerWaalsContact C-N 3.31Å; Y605-R607 PolarHBondContact O-N 2.9Å; Y605-Q608 PolarHBondContact O-N 2.72Å; Y605-A609 PolarHBondContact O-N 2.69Å
606	K	78.1	Confident	72.8	Confident	14 Å²	14	78.8 Å²	78.8	6%	0.061	38%	0.376	C	S	.	.	H	α-helix	trans	-60.6	-34.1	174.1	-79.8	176.5	-178.4	-75.4	0	113.1	N513 K602 E604 L610 L627 E630 I631 M634	N513-K606 VanDerWaalsContact CG-NZ 3.32Å; N513-K606 PolarHBondContact ND2-NZ 2.9Å; N513-K606 WeakPolarHBondContact OD1-CE 3.27Å; N513-K606 WeakPolarHBondContact OD1-CG 3.46Å; N513-K606 PolarHBondContact OD1-NZ 3.43Å; K602-K606 WeakPolarHBondContact O-CG 3.22Å; E604-K606 VanDerWaalsContact C-N 3.33Å; E604-K606 PolarHBondContact O-N 2.93Å; K606-L610 PolarHBondContact O-N 2.98Å; K606-L627 HydrophobicContact CB-CD2 3.86Å; K606-L627 HydrophobicContact CG-CD2 4.13Å; K606-L627 VanDerWaalsContact O-CD2 3.28Å; K606-L627 WeakPolarHBondContact O-CD2 3.41Å; K606-E630 IonicContact NZ-OE2 2.75Å; K606-E630 PolarHBondContact NZ-OE2 3.09Å; K606-I631 HydrophobicContact CB-CD1 4.2Å; K606-I631 HydrophobicContact CB-CG1 4.28Å; K606-I631 HydrophobicContact CD-CG1 4.34Å; K606-M634 HydrophobicContact CD-SD 4.44Å
607	R	79.1	Confident	72	Confident	123 Å²	123	83.7 Å²	83.7	46%	0.464	41%	0.41	S	S	.	.	H	α-helix	trans	-67.9	-40.9	178.9	-72.2	174.2	175	162.1	-3.5	112.3	L603 E604 Y605 I631	L603-R607 VanDerWaalsContact CD2-NH2 3.3Å; E604-R607 WeakPolarHBondContact O-CB 3.08Å; E604-R607 PolarHBondContact O-N 3.36Å; E604-R607 VanDerWaalsContact O-N 3.16Å; E604-R607 IonicContact OE2-CZ 3.68Å; E604-R607 IonicContact OE2-NH1 2.79Å; E604-R607 PolarHBondContact OE2-NH1 3.19Å; Y605-R607 VanDerWaalsContact C-N 3.31Å; Y605-R607 PolarHBondContact O-N 2.9Å; R607-I631 HydrophobicContact CG-CD1 4.33Å
608	Q	74	Confident	71.6	Confident	129 Å²	129	82.9 Å²	82.9	60%	0.603	41%	0.412	S	S	*	.	H	α-helix	trans	-71.4	-40.7	-178	-65.9	-178.8	-2.1	0	0	112.3	Y605 L610 G611 S612	Y605-Q608 PolarHBondContact O-N 2.72Å; Q608-L610 VanDerWaalsContact C-N 3.35Å; Q608-L610 PolarHBondContact O-N 3.12Å; Q608-G611 PolarHBondContact O-N 3.36Å; Q608-G611 VanDerWaalsContact O-N 3.14Å; Q608-S612 PolarHBondContact O-N 2.78Å
609	A	71.6	Confident	71.6	Confident	7 Å²	7	80.1 Å²	80.1	6%	0.058	40%	0.404	C	S	.	.	H	α-helix	trans	-69.7	-31	177.9	0	0	0	0	0	113.7	V511 G512 Y605 G611 S612 I613	V511-A609 WeakPolarHBondContact O-CB 3.12Å; G512-A609 VanDerWaalsContact N-CB 3.33Å; Y605-A609 PolarHBondContact O-N 2.69Å; A609-G611 PolarHBondContact O-N 2.9Å; A609-S612 PolarHBondContact O-N 3.41Å; A609-I613 WeakPolarHBondContact O-CG1 3.39Å; A609-I613 PolarHBondContact O-N 2.87Å; A609-I613 VanDerWaalsContact O-N 3.14Å
610	L	79.4	Confident	71.5	Confident	23 Å²	23	82.7 Å²	82.7	12%	0.12	42%	0.418	C	S	.	.	H	α-helix	trans	-56.4	-40	169.2	-173.5	63.7	0	0	0	111.2	K606 Q608 Q614 V624 L627 K628	K606-L610 PolarHBondContact O-N 2.98Å; Q608-L610 VanDerWaalsContact C-N 3.35Å; Q608-L610 PolarHBondContact O-N 3.12Å; L610-Q614 VanDerWaalsContact O-CB 3.29Å; L610-Q614 WeakPolarHBondContact O-CB 3.3Å; L610-Q614 PolarHBondContact O-N 3.03Å; L610-V624 HydrophobicContact CD1-CB 4.23Å; L610-V624 HydrophobicContact CD1-CG1 3.84Å; L610-V624 HydrophobicContact CD1-CG2 4.32Å; L610-L627 HydrophobicContact CB-CD2 4.42Å; L610-L627 HydrophobicContact CD1-CB 3.95Å; L610-L627 HydrophobicContact CD1-CD1 4.14Å; L610-K628 HydrophobicContact CD2-CG 4.06Å
611	G	71	Confident	71.7	Confident	33 Å²	33	83.3 Å²	83.3	34%	0.34	42%	0.424	S	S	.	.	H	α-helix	trans	-66	-41.2	176.7	0	0	0	0	0	114	Q608 A609 N615	Q608-G611 PolarHBondContact O-N 3.36Å; Q608-G611 VanDerWaalsContact O-N 3.14Å; A609-G611 PolarHBondContact O-N 2.9Å; G611-N615 PolarHBondContact O-ND2 3.05Å; G611-N615 VanDerWaalsContact O-ND2 3.16Å
612	S	72.2	Confident	71.8	Confident	42 Å²	42	85.8 Å²	85.8	29%	0.294	43%	0.429	S	S	.	.	H	α-helix	trans	-66	-47.8	179.6	-175.3	0	0	0	0	112.3	Q608 A609 Q614 N615	Q608-S612 PolarHBondContact O-N 2.78Å; A609-S612 PolarHBondContact O-N 3.41Å; S612-Q614 VanDerWaalsContact C-N 3.3Å; S612-Q614 PolarHBondContact O-N 3.12Å; S612-N615 PolarHBondContact O-N 3.2Å
613	I	72.1	Confident	71.9	Confident	13 Å²	13	81.2 Å²	81.2	7%	0.067	41%	0.41	C	S	.	.	H	α-helix	trans	-67.1	-32.7	-177.4	-65.2	170.7	0	0	0	111.6	L510 V511 A609 N615 A616 P619 I623 V624	L510-I613 HydrophobicContact CD2-CD1 4.43Å; L510-I613 HydrophobicContact CG-CD1 4.05Å; L510-I613 HydrophobicContact CG-CG1 4.12Å; V511-I613 HydrophobicContact CB-CD1 4.3Å; V511-I613 HydrophobicContact CG2-CD1 3.46Å; V511-I613 VanDerWaalsContact CG2-CD1 3.46Å; A609-I613 WeakPolarHBondContact O-CG1 3.39Å; A609-I613 PolarHBondContact O-N 2.87Å; A609-I613 VanDerWaalsContact O-N 3.14Å; I613-N615 VanDerWaalsContact C-N 3.27Å; I613-N615 PolarHBondContact O-N 3.34Å; I613-A616 PolarHBondContact O-N 3.44Å; I613-P619 WeakPolarHBondContact O-CB 3.42Å; I613-I623 HydrophobicContact CD1-CG2 4.1Å; I613-V624 HydrophobicContact CG2-CG2 4.14Å
614	Q	77.1	Confident	71.9	Confident	108 Å²	108	81.3 Å²	81.3	51%	0.505	41%	0.412	S	S	.	.	H	α-helix	trans	-70.9	-22.8	-178.3	-168.3	166.8	-10	0	0	113.2	L610 S612	L610-Q614 VanDerWaalsContact O-CB 3.29Å; L610-Q614 WeakPolarHBondContact O-CB 3.3Å; L610-Q614 PolarHBondContact O-N 3.03Å; S612-Q614 VanDerWaalsContact C-N 3.3Å; S612-Q614 PolarHBondContact O-N 3.12Å
615	N	69.8	Low	72	Confident	141 Å²	141	80.4 Å²	80.4	75%	0.754	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-0.7	-178.7	-66.9	-25.3	0	0	0	114	G611 S612 I613	G611-N615 PolarHBondContact O-ND2 3.05Å; G611-N615 VanDerWaalsContact O-ND2 3.16Å; S612-N615 PolarHBondContact O-N 3.2Å; I613-N615 VanDerWaalsContact C-N 3.27Å; I613-N615 PolarHBondContact O-N 3.34Å
616	A	66.9	Low	72	Confident	43 Å²	43	82.3 Å²	82.3	36%	0.355	43%	0.426	S	S	.	.	S	Bend	trans	-74.6	157.5	-179.2	0	0	0	0	0	113	I613 K618 P619	I613-A616 PolarHBondContact O-N 3.44Å; A616-K618 PolarHBondContact O-N 2.75Å; A616-K618 VanDerWaalsContact O-N 3.12Å; A616-P619 WeakPolarHBondContact O-CD 3.27Å
617	P	53.5	Low	71.9	Confident	139 Å²	139	81.8 Å²	81.8	90%	0.903	42%	0.423	S	S	*	.	S	Bend	trans	-61.2	-25.8	-176.2	-20.8	30.4	0	0	0	114.6
618	K	56.6	Low	71.9	Confident	188 Å²	188	82 Å²	82	82%	0.817	43%	0.428	S	S	*	.	S	Bend	trans	-137.9	84.8	173.5	-72.7	-177.2	-179.6	173.2	0	109.6	A616	A616-K618 PolarHBondContact O-N 2.75Å; A616-K618 VanDerWaalsContact O-N 3.12Å
619	P	68.4	Low	72.2	Confident	56 Å²	56	82.6 Å²	82.6	36%	0.364	43%	0.43	S	S	.	.			trans	-73.2	133.9	-176.8	29.1	-32.1	0	0	0	111	I613 A616 K621	I613-P619 WeakPolarHBondContact O-CB 3.42Å; A616-P619 WeakPolarHBondContact O-CD 3.27Å; P619-K621 PolarHBondContact O-N 2.92Å; P619-K621 VanDerWaalsContact O-N 3.13Å
620	D	70.6	Confident	72.5	Confident	74 Å²	74	86 Å²	86	40%	0.396	45%	0.445	S	S	.	.			trans	-77.2	99.6	176.2	-170.7	-28.5	0	0	0	110.6	K622 I623 V624	D620-K622 PolarHBondContact O-N 3.32Å; D620-K622 WeakPolarHBondContact OD1-CB 3.5Å; D620-K622 PolarHBondContact OD1-N 2.87Å; D620-I623 HydrophobicContact CB-CB 4.18Å; D620-I623 HydrophobicContact CB-CD1 3.91Å; D620-I623 HydrophobicContact CB-CG1 4.07Å; D620-I623 PolarHBondContact O-N 3.26Å; D620-I623 VanDerWaalsContact O-N 3.14Å; D620-I623 PolarHBondContact OD1-N 3.44Å; D620-I623 WeakPolarHBondContact OD2-CD1 3.31Å; D620-V624 WeakPolarHBondContact O-CG2 3.24Å; D620-V624 PolarHBondContact O-N 3.24Å
621	K	76.6	Confident	72.6	Confident	180 Å²	180	85.8 Å²	85.8	78%	0.783	44%	0.444	S	S	*	.	H	α-helix	trans	-59.6	-26.6	-177.6	-63.5	-174.3	179.6	-177.7	0	113.7	P619 S625	P619-K621 PolarHBondContact O-N 2.92Å; P619-K621 VanDerWaalsContact O-N 3.13Å; K621-S625 PolarHBondContact O-N 3.3Å; K621-S625 PolarHBondContact O-OG 2.95Å
622	K	73	Confident	72.7	Confident	163 Å²	163	86.1 Å²	86.1	71%	0.709	45%	0.447	S	S	*	.	H	α-helix	trans	-76.2	-34.9	178.4	-80.5	-178.3	174.7	176.2	0	112.1	D620 S625 K626	D620-K622 PolarHBondContact O-N 3.32Å; D620-K622 WeakPolarHBondContact OD1-CB 3.5Å; D620-K622 PolarHBondContact OD1-N 2.87Å; K622-S625 PolarHBondContact O-OG 2.79Å; K622-S625 VanDerWaalsContact O-OG 3.08Å; K622-K626 WeakPolarHBondContact O-CG 3.29Å; K622-K626 PolarHBondContact O-N 2.65Å
623	I	73.5	Confident	72.9	Confident	30 Å²	30	88.1 Å²	88.1	15%	0.154	46%	0.458	C	S	.	.	H	α-helix	trans	-70.7	-41.8	178.1	-66.6	178.8	0	0	0	109.7	V511 I613 D620 S625 K626 L627	V511-I623 HydrophobicContact CG2-CG2 3.34Å; I613-I623 HydrophobicContact CD1-CG2 4.1Å; D620-I623 HydrophobicContact CB-CB 4.18Å; D620-I623 HydrophobicContact CB-CD1 3.91Å; D620-I623 HydrophobicContact CB-CG1 4.07Å; D620-I623 PolarHBondContact O-N 3.26Å; D620-I623 VanDerWaalsContact O-N 3.14Å; D620-I623 PolarHBondContact OD1-N 3.44Å; D620-I623 WeakPolarHBondContact OD2-CD1 3.31Å; I623-S625 PolarHBondContact O-N 3.37Å; I623-K626 PolarHBondContact O-N 2.98Å; I623-L627 HydrophobicContact CG2-CD1 3.95Å; I623-L627 WeakPolarHBondContact O-CD1 3.27Å; I623-L627 PolarHBondContact O-N 2.98Å; I623-L627 VanDerWaalsContact O-N 3.09Å
624	V	78.2	Confident	73.1	Confident	24 Å²	24	88.9 Å²	88.9	15%	0.145	46%	0.461	C	S	.	.	H	α-helix	trans	-60.6	-44.1	176.1	171.9	0	0	0	0	112.3	L610 I613 D620 K628	L610-V624 HydrophobicContact CD1-CB 4.23Å; L610-V624 HydrophobicContact CD1-CG1 3.84Å; L610-V624 HydrophobicContact CD1-CG2 4.32Å; I613-V624 HydrophobicContact CG2-CG2 4.14Å; D620-V624 WeakPolarHBondContact O-CG2 3.24Å; D620-V624 PolarHBondContact O-N 3.24Å; V624-K628 PolarHBondContact O-N 3.45Å
625	S	76.4	Confident	73.1	Confident	68 Å²	68	88.7 Å²	88.7	48%	0.476	46%	0.46	S	S	.	.	H	α-helix	trans	-67.7	-40.5	179.8	64.6	0	0	0	0	112.5	K621 K622 I623 K628 E629	K621-S625 PolarHBondContact O-N 3.3Å; K621-S625 PolarHBondContact O-OG 2.95Å; K622-S625 PolarHBondContact O-OG 2.79Å; K622-S625 VanDerWaalsContact O-OG 3.08Å; I623-S625 PolarHBondContact O-N 3.37Å; S625-K628 PolarHBondContact O-N 2.96Å; S625-E629 PolarHBondContact O-N 3.18Å
626	K	74.3	Confident	73.4	Confident	131 Å²	131	88.7 Å²	88.7	57%	0.57	45%	0.454	S	S	*	.	H	α-helix	trans	-64.3	-41.9	178.4	-80.9	-175.9	173.8	-172.6	0	112.8	K622 I623 K628 E629 E630	K622-K626 WeakPolarHBondContact O-CG 3.29Å; K622-K626 PolarHBondContact O-N 2.65Å; I623-K626 PolarHBondContact O-N 2.98Å; K626-K628 VanDerWaalsContact C-N 3.28Å; K626-K628 PolarHBondContact O-N 3.37Å; K626-E629 PolarHBondContact O-N 3.23Å; K626-E630 WeakPolarHBondContact O-CB 3.47Å; K626-E630 WeakPolarHBondContact O-CG 3.23Å; K626-E630 PolarHBondContact O-N 3.39Å
627	L	76.3	Confident	73.7	Confident	3 Å²	3	90.1 Å²	90.1	2%	0.016	45%	0.453	C	S	.	.	H	α-helix	trans	-55.6	-42.1	176.1	-105	140.1	0	0	0	112.6	V511 K606 L610 I623 I631	V511-L627 HydrophobicContact CB-CD1 4.17Å; V511-L627 HydrophobicContact CG1-CD1 3.27Å; V511-L627 HydrophobicContact CG1-CD2 3.7Å; V511-L627 HydrophobicContact CG1-CG 3.48Å; V511-L627 VanDerWaalsContact CG1-CG 3.48Å; V511-L627 HydrophobicContact CG2-CD1 3.95Å; K606-L627 HydrophobicContact CB-CD2 3.86Å; K606-L627 HydrophobicContact CG-CD2 4.13Å; K606-L627 VanDerWaalsContact O-CD2 3.28Å; K606-L627 WeakPolarHBondContact O-CD2 3.41Å; L610-L627 HydrophobicContact CB-CD2 4.42Å; L610-L627 HydrophobicContact CD1-CB 3.95Å; L610-L627 HydrophobicContact CD1-CD1 4.14Å; I623-L627 HydrophobicContact CG2-CD1 3.95Å; I623-L627 WeakPolarHBondContact O-CD1 3.27Å; I623-L627 PolarHBondContact O-N 2.98Å; I623-L627 VanDerWaalsContact O-N 3.09Å; L627-I631 WeakPolarHBondContact O-CD1 3.45Å; L627-I631 VanDerWaalsContact O-CG1 3.3Å; L627-I631 WeakPolarHBondContact O-CG1 3.11Å; L627-I631 PolarHBondContact O-N 2.92Å
628	K	78.9	Confident	74.7	Confident	127 Å²	127	86.2 Å²	86.2	55%	0.552	42%	0.423	S	S	*	.	H	α-helix	trans	-68.7	-41.1	-179.9	-72.5	-174.9	175.2	-175.4	0	112.8	L610 V624 S625 K626 G632	L610-K628 HydrophobicContact CD2-CG 4.06Å; V624-K628 PolarHBondContact O-N 3.45Å; S625-K628 PolarHBondContact O-N 2.96Å; K626-K628 VanDerWaalsContact C-N 3.28Å; K626-K628 PolarHBondContact O-N 3.37Å; K628-G632 PolarHBondContact O-N 2.95Å
629	E	78.8	Confident	75.4	Confident	141 Å²	141	80.4 Å²	80.4	66%	0.659	41%	0.406	S	S	*	.	H	α-helix	trans	-67.1	-43.7	178.2	-172	178.6	-177.2	0	0	111.5	S625 K626 I631 G632 T633	S625-E629 PolarHBondContact O-N 3.18Å; K626-E629 PolarHBondContact O-N 3.23Å; E629-I631 VanDerWaalsContact C-N 3.34Å; E629-I631 PolarHBondContact O-N 3.12Å; E629-G632 PolarHBondContact O-N 3.5Å; E629-T633 PolarHBondContact O-N 2.97Å; E629-T633 VanDerWaalsContact O-N 3.15Å
630	E	78.5	Confident	75.5	Confident	78 Å²	78	82.1 Å²	82.1	36%	0.364	41%	0.409	S	S	.	.	H	α-helix	trans	-59.5	-42.4	177.6	-75.7	177.8	-168.6	0	0	112.1	K606 K626 G632 T633 M634	K606-E630 IonicContact NZ-OE2 2.75Å; K606-E630 PolarHBondContact NZ-OE2 3.09Å; K626-E630 WeakPolarHBondContact O-CB 3.47Å; K626-E630 WeakPolarHBondContact O-CG 3.23Å; K626-E630 PolarHBondContact O-N 3.39Å; E630-G632 PolarHBondContact O-N 3.44Å; E630-T633 PolarHBondContact O-N 3.03Å; E630-T633 PolarHBondContact O-OG1 3.43Å; E630-M634 WeakPolarHBondContact O-CG 3.36Å; E630-M634 PolarHBondContact O-N 2.84Å
631	I	81.8	Confident	75.3	Confident	20 Å²	20	79 Å²	79	10%	0.103	39%	0.392	C	S	.	.	H	α-helix	trans	-58.4	-47.4	176.9	-70.3	166.8	0	0	0	110.9	L603 K606 R607 L627 E629 T633 M634 E635	L603-I631 HydrophobicContact CD1-CG2 4.49Å; L603-I631 HydrophobicContact CD2-CG2 4.1Å; L603-I631 HydrophobicContact CG-CG2 4.19Å; K606-I631 HydrophobicContact CB-CD1 4.2Å; K606-I631 HydrophobicContact CB-CG1 4.28Å; K606-I631 HydrophobicContact CD-CG1 4.34Å; R607-I631 HydrophobicContact CG-CD1 4.33Å; L627-I631 WeakPolarHBondContact O-CD1 3.45Å; L627-I631 VanDerWaalsContact O-CG1 3.3Å; L627-I631 WeakPolarHBondContact O-CG1 3.11Å; L627-I631 PolarHBondContact O-N 2.92Å; E629-I631 VanDerWaalsContact C-N 3.34Å; E629-I631 PolarHBondContact O-N 3.12Å; I631-T633 PolarHBondContact O-N 3.24Å; I631-M634 PolarHBondContact O-N 2.95Å; I631-E635 PolarHBondContact O-N 3.13Å
632	G	73.3	Confident	75	Confident	39 Å²	39	75.6 Å²	75.6	40%	0.402	38%	0.379	S	S	.	.	H	α-helix	trans	-65.6	-34.3	-179.2	0	0	0	0	0	114	K628 E629 E630	K628-G632 PolarHBondContact O-N 2.95Å; E629-G632 PolarHBondContact O-N 3.5Å; E630-G632 PolarHBondContact O-N 3.44Å
633	T	76.8	Confident	74.8	Confident	85 Å²	85	73.2 Å²	73.2	52%	0.521	37%	0.37	S	S	.	.	H	α-helix	trans	-68.5	-37.9	176.3	58.3	0	0	0	0	113.1	E629 E630 I631 E635 K636 E637	E629-T633 PolarHBondContact O-N 2.97Å; E629-T633 VanDerWaalsContact O-N 3.15Å; E630-T633 PolarHBondContact O-N 3.03Å; E630-T633 PolarHBondContact O-OG1 3.43Å; I631-T633 PolarHBondContact O-N 3.24Å; T633-E635 VanDerWaalsContact C-N 3.31Å; T633-E635 PolarHBondContact O-N 3.43Å; T633-K636 PolarHBondContact O-N 2.85Å; T633-E637 PolarHBondContact O-N 3.44Å
634	M	75.6	Confident	74.5	Confident	29 Å²	29	72.4 Å²	72.4	14%	0.143	37%	0.366	C	S	.	.	H	α-helix	trans	-67.5	-30.9	-179.3	-71.1	176.7	70.7	0	0	112.3	L599 K602 K606 E630 I631 H638	L599-M634 HydrophobicContact CD2-CB 4.17Å; L599-M634 HydrophobicContact CD2-CE 3.63Å; L599-M634 HydrophobicContact CD2-CG 4.22Å; K602-M634 HydrophobicContact CB-CE 3.93Å; K606-M634 HydrophobicContact CD-SD 4.44Å; E630-M634 WeakPolarHBondContact O-CG 3.36Å; E630-M634 PolarHBondContact O-N 2.84Å; I631-M634 PolarHBondContact O-N 2.95Å; M634-H638 PolarHBondContact O-N 3.48Å
635	E	77.5	Confident	73.8	Confident	103 Å²	103	72.9 Å²	72.9	48%	0.481	37%	0.367	S	S	.	.	H	α-helix	trans	-67	-36.9	176.7	-69.7	177.1	163.1	0	0	112.6	L603 I631 T633	L603-E635 HydrophobicContact CD1-CG 3.75Å; I631-E635 PolarHBondContact O-N 3.13Å; T633-E635 VanDerWaalsContact C-N 3.31Å; T633-E635 PolarHBondContact O-N 3.43Å
636	K	75.1	Confident	73.3	Confident	141 Å²	141	73.9 Å²	73.9	61%	0.613	37%	0.371	S	S	*	.	H	α-helix	trans	-69.8	-44.2	178.8	-173.4	-178.8	174.4	-172.8	0	112.3	T633 H638 S639 E640	T633-K636 PolarHBondContact O-N 2.85Å; K636-H638 PolarHBondContact O-N 2.97Å; K636-S639 PolarHBondContact O-N 3.14Å; K636-S639 VanDerWaalsContact O-N 3.13Å; K636-E640 VanDerWaalsContact CE-OE1 3.27Å; K636-E640 WeakPolarHBondContact CE-OE1 3Å; K636-E640 PolarHBondContact O-N 3.36Å
637	E	73.4	Confident	72.9	Confident	73 Å²	73	73.1 Å²	73.1	34%	0.341	36%	0.364	S	S	.	.	H	α-helix	trans	-60.7	-35.1	179.4	-172.4	179	176.1	0	0	111.9	K595 T633 S639 L641	K595-E637 WeakPolarHBondContact CE-OE1 3.27Å; K595-E637 IonicContact NZ-OE1 3.15Å; K595-E637 PolarHBondContact NZ-OE1 3Å; T633-E637 PolarHBondContact O-N 3.44Å; E637-S639 VanDerWaalsContact C-N 3.31Å; E637-S639 PolarHBondContact O-N 3.47Å; E637-L641 PolarHBondContact O-N 3.27Å
638	H	75.1	Confident	72.4	Confident	58 Å²	58	73.5 Å²	73.5	27%	0.269	37%	0.367	S	S	.	.	H	α-helix	trans	-59.1	-39.9	175.9	-176.1	-74.8	0	0	0	112.3	L596 M634 K636	L596-H638 HydrophobicContact CD1-CB 4.24Å; L596-H638 WeakPolarHBondContact CD1-CD2 3.46Å; L596-H638 WeakPolarHBondContact CD1-NE2 3.2Å; L596-H638 VanDerWaalsContact CD1-O 3.26Å; L596-H638 WeakPolarHBondContact CD1-O 3.3Å; L596-H638 WeakPolarHBondContact CG-NE2 3.05Å; M634-H638 PolarHBondContact O-N 3.48Å; K636-H638 PolarHBondContact O-N 2.97Å
639	S	71.6	Confident	71.6	Confident	66 Å²	66	71.1 Å²	71.1	46%	0.462	36%	0.36	S	S	.	.	H	α-helix	trans	-72.1	-41	-176.9	-172.4	0	0	0	0	113.5	K636 E637 Q642	K636-S639 PolarHBondContact O-N 3.14Å; K636-S639 VanDerWaalsContact O-N 3.13Å; E637-S639 VanDerWaalsContact C-N 3.31Å; E637-S639 PolarHBondContact O-N 3.47Å; S639-Q642 PolarHBondContact O-N 3.45Å
640	E	70.1	Confident	71	Confident	91 Å²	91	68 Å²	68	43%	0.425	34%	0.342	S	S	.	.	H	α-helix	trans	-68.1	-38	-177	-68.2	175	179.5	0	0	112.3	K636 Q642 Q643	K636-E640 VanDerWaalsContact CE-OE1 3.27Å; K636-E640 WeakPolarHBondContact CE-OE1 3Å; K636-E640 PolarHBondContact O-N 3.36Å; E640-Q642 VanDerWaalsContact C-N 3.31Å; E640-Q642 PolarHBondContact O-N 2.82Å; E640-Q643 PolarHBondContact O-N 3.27Å
641	L	66.1	Low	70.5	Confident	10 Å²	10	64.6 Å²	64.6	5%	0.052	33%	0.326	C	S	.	.	H	α-helix	trans	-66.3	-34.3	-179.4	-166.7	62.9	0	0	0	112.3	A592 K595 E637 Q643 H644	A592-L641 HydrophobicContact CB-CD1 3.8Å; A592-L641 HydrophobicContact CB-CD2 4.46Å; A592-L641 HydrophobicContact CB-CG 4.04Å; A592-L641 WeakPolarHBondContact O-CD2 2.81Å; K595-L641 HydrophobicContact CB-CD2 4.05Å; K595-L641 HydrophobicContact CD-CD2 4.29Å; K595-L641 HydrophobicContact CG-CD2 4.33Å; E637-L641 PolarHBondContact O-N 3.27Å; L641-Q643 PolarHBondContact O-N 3.5Å; L641-H644 PolarHBondContact O-N 3.09Å
642	Q	71.7	Confident	69.6	Low	107 Å²	107	65.7 Å²	65.7	50%	0.5	34%	0.335	S	S	.	.	H	α-helix	trans	-65.1	-37.6	179.7	-171.3	168.5	-9.7	0	0	112.5	S639 E640 H644 T646	S639-Q642 PolarHBondContact O-N 3.45Å; E640-Q642 VanDerWaalsContact C-N 3.31Å; E640-Q642 PolarHBondContact O-N 2.82Å; Q642-H644 PolarHBondContact O-N 2.98Å; Q642-T646 PolarHBondContact O-OG1 3.27Å
643	Q	68.2	Low	69.1	Low	113 Å²	113	70.5 Å²	70.5	53%	0.528	35%	0.347	S	S	.	.	H	α-helix	trans	-71.9	-27.1	-180	-63.8	-176.9	-2.5	0	0	113.7	E640 L641	E640-Q643 PolarHBondContact O-N 3.27Å; L641-Q643 PolarHBondContact O-N 3.5Å
644	H	66.8	Low	68.5	Low	14 Å²	14	68.6 Å²	68.6	7%	0.065	33%	0.334	C	S	.	.	H	α-helix	trans	-71.2	-38.5	179.8	176	62.6	0	0	0	112.3	L641 Q642 R647 T648	L641-H644 PolarHBondContact O-N 3.09Å; Q642-H644 PolarHBondContact O-N 2.98Å; H644-R647 PolarHBondContact O-N 3.48Å; H644-T648 PolarHBondContact O-N 2.98Å; H644-T648 PolarHBondContact O-OG1 2.8Å
645	I	63.9	Low	68.1	Low	33 Å²	33	69.9 Å²	69.9	17%	0.169	34%	0.341	C	S	.	.	H	α-helix	trans	-59.3	-51.7	179.9	-64	171.4	0	0	0	109.8	A592 A593 R647 T648 D649	A592-I645 HydrophobicContact CB-CD1 3.66Å; A592-I645 HydrophobicContact CB-CG1 3.62Å; A593-I645 HydrophobicContact CB-CD1 4.41Å; I645-R647 VanDerWaalsContact C-N 3.25Å; I645-R647 PolarHBondContact O-N 3.43Å; I645-R647 VanDerWaalsContact O-N 3.11Å; I645-T648 PolarHBondContact O-N 3.47Å; I645-D649 PolarHBondContact O-N 3.36Å
646	T	64.9	Low	67.4	Low	89 Å²	89	65.9 Å²	65.9	55%	0.546	33%	0.328	S	S	.	.	H	α-helix	trans	-56.6	-32.9	-177.7	-49.4	0	0	0	0	114.3	Q642	Q642-T646 PolarHBondContact O-OG1 3.27Å
647	R	67.6	Low	67.4	Low	115 Å²	115	65.1 Å²	65.1	43%	0.434	33%	0.326	S	S	.	.	H	α-helix	trans	-78.3	-28.8	179.9	-62.9	-174.4	-145.8	108.5	5.5	113.3	H644 I645 W651	H644-R647 PolarHBondContact O-N 3.48Å; I645-R647 VanDerWaalsContact C-N 3.25Å; I645-R647 PolarHBondContact O-N 3.43Å; I645-R647 VanDerWaalsContact O-N 3.11Å; R647-W651 PolarHBondContact O-N 3.08Å
648	T	65.9	Low	67.7	Low	11 Å²	11	62 Å²	62	7%	0.067	31%	0.311	C	S	.	.	H	α-helix	trans	-70.6	-40.1	-179.9	-54.5	0	0	0	0	110.2	I585 H644 I645 W650 W651 C652 Y766	I585-T648 HydrophobicContact CG2-CG2 4.33Å; H644-T648 PolarHBondContact O-N 2.98Å; H644-T648 PolarHBondContact O-OG1 2.8Å; I645-T648 PolarHBondContact O-N 3.47Å; T648-W650 VanDerWaalsContact C-N 3.32Å; T648-W650 PolarHBondContact O-N 3.3Å; T648-W651 PolarHBondContact O-N 3.47Å; T648-C652 PolarHBondContact O-N 2.82Å; T648-C652 PolarHBondContact O-SG 3.27Å; T648-Y766 HydrophobicContact CG2-CE1 4.48Å
649	D	61.4	Low	68.1	Low	77 Å²	77	63.7 Å²	63.7	41%	0.412	32%	0.315	S	S	.	.	H	α-helix	trans	-58.8	-45.7	176.5	-61.1	-24.4	0	0	0	110.9	I645 W651 C652 E653	I645-D649 PolarHBondContact O-N 3.36Å; D649-W651 PolarHBondContact O-N 2.9Å; D649-C652 PolarHBondContact O-N 3.36Å; D649-C652 VanDerWaalsContact O-N 3.15Å; D649-E653 WeakPolarHBondContact O-CG 3.02Å; D649-E653 PolarHBondContact O-N 2.93Å; D649-E653 VanDerWaalsContact O-N 3.17Å
650	W	65.4	Low	68.8	Low	77 Å²	77	60.6 Å²	60.6	29%	0.292	29%	0.293	S	S	.	.	H	α-helix	trans	-64	-33.8	-178.2	-134.6	68.1	0	0	0	114.5	T648 N654 W658 L684 N692	T648-W650 VanDerWaalsContact C-N 3.32Å; T648-W650 PolarHBondContact O-N 3.3Å; W650-N654 PolarHBondContact O-ND2 3.42Å; W650-W658 AromaticContact CE3-CH2 3.92Å; W650-W658 HydrophobicContact CE3-CH2 3.92Å; W650-W658 HydrophobicContact CE3-CZ2 4.18Å; W650-W658 AromaticContact CZ3-CH2 3.82Å; W650-W658 HydrophobicContact CZ3-CH2 3.82Å; W650-W658 HydrophobicContact CZ3-CZ2 4.37Å; W650-L684 HydrophobicContact CH2-CD1 4.36Å; W650-L684 HydrophobicContact CZ3-CD1 3.98Å; W650-N692 VanDerWaalsContact CZ3-O 3.24Å; W650-N692 WeakPolarHBondContact CZ3-O 3.37Å
651	W	69.2	Low	69.6	Low	5 Å²	5	58.7 Å²	58.7	2%	0.019	29%	0.29	C	S	.	.	H	α-helix	trans	-66.1	-43.6	174.5	174	-89.3	0	0	0	111.6	R647 T648 D649 E653 N654 W658 V682 W695 Y766 L769	R647-W651 PolarHBondContact O-N 3.08Å; T648-W651 PolarHBondContact O-N 3.47Å; D649-W651 PolarHBondContact O-N 2.9Å; W651-E653 VanDerWaalsContact C-N 3.32Å; W651-E653 PolarHBondContact O-N 3.28Å; W651-N654 PolarHBondContact O-N 3.37Å; W651-W658 HydrophobicContact CE3-CD2 4.2Å; W651-W658 AromaticContact CE3-CE2 3.93Å; W651-W658 HydrophobicContact CE3-CG 4.37Å; W651-W658 HydrophobicContact CE3-CZ2 4.41Å; W651-W658 AromaticContact CE3-NE1 3.87Å; W651-W658 HydrophobicContact CH2-CG 4.39Å; W651-W658 HydrophobicContact CZ3-CD2 4.11Å; W651-W658 HydrophobicContact CZ3-CG 4.05Å; W651-W658 PolarHBondContact O-NE1 3.43Å; W651-V682 HydrophobicContact CZ3-CG1 4.24Å; W651-W695 AromaticContact CE3-CH2 3.72Å; W651-W695 HydrophobicContact CE3-CH2 3.72Å; W651-W695 AromaticContact CE3-CZ2 3.73Å; W651-W695 HydrophobicContact CE3-CZ2 3.73Å; W651-W695 HydrophobicContact CZ3-CH2 4.01Å; W651-W695 AromaticContact CZ3-CZ2 3.7Å; W651-W695 HydrophobicContact CZ3-CZ2 3.7Å; W651-Y766 HydrophobicContact CB-CD2 4.22Å; W651-Y766 HydrophobicContact CB-CE2 3.55Å; W651-Y766 AromaticContact CD1-CD2 3.54Å; W651-Y766 AromaticContact CD1-CE2 3.74Å; W651-Y766 AromaticContact CD2-CD2 3.17Å; W651-Y766 HydrophobicContact CD2-CD2 3.17Å; W651-Y766 AromaticContact CD2-CE2 3.35Å; W651-Y766 HydrophobicContact CD2-CE2 3.35Å; W651-Y766 HydrophobicContact CD2-CG 4.28Å; W651-Y766 AromaticContact CE2-CD2 3.22Å; W651-Y766 AromaticContact CE2-CE2 3.93Å; W651-Y766 AromaticContact CE2-CG 3.99Å; W651-Y766 AromaticContact CE3-CD2 3.68Å; W651-Y766 HydrophobicContact CE3-CD2 3.68Å; W651-Y766 AromaticContact CE3-CE2 3.72Å; W651-Y766 HydrophobicContact CE3-CE2 3.72Å; W651-Y766 AromaticContact CG-CD2 3.4Å; W651-Y766 HydrophobicContact CG-CD2 3.4Å; W651-Y766 AromaticContact CG-CE2 3.24Å; W651-Y766 HydrophobicContact CG-CE2 3.24Å; W651-Y766 HydrophobicContact CG-CG 4.35Å; W651-Y766 HydrophobicContact CH2-CD2 4.22Å; W651-Y766 AromaticContact CZ2-CD2 3.77Å; W651-Y766 HydrophobicContact CZ2-CD2 3.77Å; W651-Y766 HydrophobicContact CZ2-CG 4.46Å; W651-Y766 HydrophobicContact CZ3-CD2 4.18Å; W651-Y766 AromaticContact NE1-CD2 3.45Å; W651-Y766 AromaticContact NE1-CG 3.87Å; W651-L769 HydrophobicContact CH2-CB 4.24Å; W651-L769 HydrophobicContact CH2-CD1 4.07Å
652	C	62.3	Low	70.7	Confident	44 Å²	44	58.5 Å²	58.5	30%	0.297	29%	0.289	S	S	.	.	H	α-helix	trans	-66.2	-35.6	-177.3	-62.6	0	0	0	0	112.1	I585 T648 D649 N654 L655	I585-C652 VanDerWaalsContact CG2-SG 3.58Å; T648-C652 PolarHBondContact O-N 2.82Å; T648-C652 PolarHBondContact O-SG 3.27Å; D649-C652 PolarHBondContact O-N 3.36Å; D649-C652 VanDerWaalsContact O-N 3.15Å; C652-N654 PolarHBondContact O-N 2.71Å; C652-L655 WeakPolarHBondContact O-CG 3.19Å
653	E	63.4	Low	71.3	Confident	139 Å²	139	56.6 Å²	56.6	65%	0.65	29%	0.285	S	S	*	.	H	α-helix	trans	-66.3	-23.9	179	-71.5	175	172.2	0	0	113.4	D649 W651	D649-E653 WeakPolarHBondContact O-CG 3.02Å; D649-E653 PolarHBondContact O-N 2.93Å; D649-E653 VanDerWaalsContact O-N 3.17Å; W651-E653 VanDerWaalsContact C-N 3.32Å; W651-E653 PolarHBondContact O-N 3.28Å
654	N	64.5	Low	72.1	Confident	46 Å²	46	54.2 Å²	54.2	25%	0.246	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	26.4	-170.3	-64.7	-78.9	0	0	0	114.3	W650 W651 C652 H657 W658 L684	W650-N654 PolarHBondContact O-ND2 3.42Å; W651-N654 PolarHBondContact O-N 3.37Å; C652-N654 PolarHBondContact O-N 2.71Å; N654-H657 PolarHBondContact O-N 2.95Å; N654-W658 HydrophobicContact CB-CZ2 3.96Å; N654-W658 PolarHBondContact O-NE1 3.15Å; N654-L684 HydrophobicContact CB-CD1 4.42Å; N654-L684 HydrophobicContact CB-CD2 3.97Å
655	L	66.3	Low	73.1	Confident	55 Å²	55	54.1 Å²	54.1	29%	0.288	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	140.6	-178.3	-70.1	169.2	0	0	0	112.4	C652 H657 Q761	C652-L655 WeakPolarHBondContact O-CG 3.19Å; L655-H657 PolarHBondContact O-N 3.22Å; L655-H657 PolarHBondContact O-ND1 2.7Å; L655-Q761 HydrophobicContact CD1-CG 4.42Å
656	G	63.1	Low	74.2	Confident	20 Å²	20	58.1 Å²	58.1	21%	0.206	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.5	-17.2	-179.5	0	0	0	0	0	115.9	R659	G656-R659 PolarHBondContact O-NH1 2.65Å
657	H	73.8	Confident	75	Confident	125 Å²	125	56.3 Å²	56.3	58%	0.579	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-14.6	-178.3	-62.6	79.2	0	0	0	113.2	N654 L655 L684 T685	N654-H657 PolarHBondContact O-N 2.95Å; L655-H657 PolarHBondContact O-N 3.22Å; L655-H657 PolarHBondContact O-ND1 2.7Å; H657-L684 HydrophobicContact CB-CD2 3.48Å; H657-L684 VanDerWaalsContact CB-CD2 3.48Å; H657-T685 PolarHBondContact O-OG1 3.49Å
658	W	80.8	Confident	75.5	Confident	6 Å²	6	52.4 Å²	52.4	2%	0.023	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	141.7	175.9	-63.3	103.4	0	0	0	112.2	W650 W651 N654 V682 L684 W695	W650-W658 AromaticContact CE3-CH2 3.92Å; W650-W658 HydrophobicContact CE3-CH2 3.92Å; W650-W658 HydrophobicContact CE3-CZ2 4.18Å; W650-W658 AromaticContact CZ3-CH2 3.82Å; W650-W658 HydrophobicContact CZ3-CH2 3.82Å; W650-W658 HydrophobicContact CZ3-CZ2 4.37Å; W651-W658 HydrophobicContact CE3-CD2 4.2Å; W651-W658 AromaticContact CE3-CE2 3.93Å; W651-W658 HydrophobicContact CE3-CG 4.37Å; W651-W658 HydrophobicContact CE3-CZ2 4.41Å; W651-W658 AromaticContact CE3-NE1 3.87Å; W651-W658 HydrophobicContact CH2-CG 4.39Å; W651-W658 HydrophobicContact CZ3-CD2 4.11Å; W651-W658 HydrophobicContact CZ3-CG 4.05Å; W651-W658 PolarHBondContact O-NE1 3.43Å; N654-W658 HydrophobicContact CB-CZ2 3.96Å; N654-W658 PolarHBondContact O-NE1 3.15Å; W658-V682 HydrophobicContact CE3-CG1 3.96Å; W658-L684 HydrophobicContact CD2-CD2 4.13Å; W658-L684 HydrophobicContact CD2-CG 4.1Å; W658-L684 HydrophobicContact CE3-CD1 4.32Å; W658-L684 HydrophobicContact CE3-CD2 4.31Å; W658-L684 HydrophobicContact CE3-CG 3.78Å; W658-L684 HydrophobicContact CH2-CD1 3.61Å; W658-L684 HydrophobicContact CH2-CG 4.01Å; W658-L684 HydrophobicContact CZ2-CD1 3.98Å; W658-L684 HydrophobicContact CZ2-CG 4.33Å; W658-L684 HydrophobicContact CZ3-CD1 3.81Å; W658-L684 HydrophobicContact CZ3-CG 3.74Å; W658-W695 HydrophobicContact CD2-CH2 4.44Å; W658-W695 AromaticContact CE3-CH2 3.97Å; W658-W695 HydrophobicContact CE3-CH2 3.97Å; W658-W695 HydrophobicContact CE3-CZ3 4.36Å; W658-W695 AromaticContact CH2-CH2 3.41Å; W658-W695 HydrophobicContact CH2-CH2 3.41Å; W658-W695 VanDerWaalsContact CH2-CH2 3.41Å; W658-W695 AromaticContact CH2-CZ3 3.33Å; W658-W695 HydrophobicContact CH2-CZ3 3.33Å; W658-W695 AromaticContact CZ2-CH2 3.92Å; W658-W695 HydrophobicContact CZ2-CH2 3.92Å; W658-W695 HydrophobicContact CZ2-CZ3 4.21Å; W658-W695 HydrophobicContact CZ3-CE3 4.42Å; W658-W695 AromaticContact CZ3-CH2 3.43Å; W658-W695 HydrophobicContact CZ3-CH2 3.43Å; W658-W695 VanDerWaalsContact CZ3-CH2 3.43Å; W658-W695 HydrophobicContact CZ3-CZ2 4.48Å; W658-W695 AromaticContact CZ3-CZ3 3.41Å; W658-W695 HydrophobicContact CZ3-CZ3 3.41Å; W658-W695 VanDerWaalsContact CZ3-CZ3 3.41Å
659	R	82.8	Confident	75.9	Confident	94 Å²	94	59.6 Å²	59.6	36%	0.355	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	142.2	171.9	-60.9	-65.2	-172	-97.9	-3	108.5	G656 V682 S683 T685	G656-R659 PolarHBondContact O-NH1 2.65Å; R659-V682 WeakPolarHBondContact O-CA 2.76Å; R659-S683 PolarHBondContact N-O 3.41Å; R659-S683 PolarHBondContact O-N 3.35Å; R659-T685 HydrophobicContact CG-CG2 3.87Å; R659-T685 VanDerWaalsContact CG-OG1 3.29Å; R659-T685 WeakPolarHBondContact CG-OG1 3.22Å; R659-T685 PolarHBondContact NE-OG1 3.23Å
660	A	86.6	Confident	75.9	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.008	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	131.7	173.1	0	0	0	0	0	110	V680 C681 V682 L750 Q751 L754 L769	A660-V680 HydrophobicContact CB-CG1 3.97Å; A660-C681 VanDerWaalsContact CA-O 3.3Å; A660-C681 WeakPolarHBondContact CA-O 3.44Å; A660-V682 HydrophobicContact CB-CG2 4.25Å; A660-L750 HydrophobicContact CB-CD1 4.25Å; A660-Q751 PolarHBondContact O-NE2 3.37Å; A660-L754 HydrophobicContact CB-CD1 3.4Å; A660-L769 HydrophobicContact CB-CD2 4.18Å
661	S	86.9	Confident	75.6	Confident	52 Å²	52	61.4 Å²	61.4	36%	0.364	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	140.6	175	67.2	0	0	0	0	110.5	T663 C681	S661-T663 PolarHBondContact O-N 3.37Å; S661-C681 PolarHBondContact N-O 3.36Å; S661-C681 PolarHBondContact O-N 3.43Å
662	I	88.9	Confident	75.2	Confident	6 Å²	6	64.6 Å²	64.6	3%	0.031	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	115.6	174.6	-62.3	167.5	0	0	0	107.7	T664 Y678 S679 V680 F704 K743 L746 N747 L750	I662-T664 WeakPolarHBondContact CG2-O 3.48Å; I662-Y678 HydrophobicContact CD1-CD1 4.39Å; I662-Y678 HydrophobicContact CD1-CG 4.38Å; I662-Y678 HydrophobicContact CG2-CD1 3.86Å; I662-Y678 HydrophobicContact CG2-CG 4.28Å; I662-S679 VanDerWaalsContact CA-O 3.31Å; I662-S679 WeakPolarHBondContact CA-O 3.06Å; I662-V680 HydrophobicContact CG1-CG2 4.2Å; I662-F704 HydrophobicContact CD1-CE1 4.48Å; I662-F704 HydrophobicContact CD1-CZ 4.13Å; I662-K743 HydrophobicContact CB-CG 4.29Å; I662-K743 HydrophobicContact CG2-CD 4.35Å; I662-K743 HydrophobicContact CG2-CG 3.92Å; I662-K743 WeakPolarHBondContact O-CE 3.44Å; I662-L746 HydrophobicContact CD1-CB 3.39Å; I662-L746 HydrophobicContact CD1-CD1 4.24Å; I662-L746 HydrophobicContact CD1-CG 4.48Å; I662-N747 VanDerWaalsContact CB-OD1 3.29Å; I662-N747 WeakPolarHBondContact CB-OD1 3.19Å; I662-N747 WeakPolarHBondContact CG1-OD1 3.38Å; I662-N747 PolarHBondContact N-OD1 3.3Å; I662-L750 HydrophobicContact CD1-CD1 4.23Å; I662-L750 HydrophobicContact CG1-CD1 3.99Å
663	T	84.9	Confident	75.6	Confident	66 Å²	66	69.5 Å²	69.5	41%	0.405	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-50.8	-178.1	53.2	0	0	0	0	110.7	S661 S679 C681 K743	S661-T663 PolarHBondContact O-N 3.37Å; T663-S679 PolarHBondContact N-O 3.15Å; T663-S679 PolarHBondContact OG1-O 2.9Å; T663-C681 HydrophobicContact CG2-CB 3.69Å; T663-K743 PolarHBondContact O-NZ 2.82Å
664	T	84.9	Confident	76.1	Confident	63 Å²	63	66.2 Å²	66.2	39%	0.387	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	149.3	179.3	63.4	0	0	0	0	112.1	I662 Y678 S679	I662-T664 WeakPolarHBondContact CG2-O 3.48Å; T664-Y678 WeakPolarHBondContact O-CA 3.03Å; T664-S679 PolarHBondContact O-N 2.62Å; T664-S679 WeakPolarHBondContact OG1-CB 3.43Å
665	A	87.3	Confident	76.9	Confident	13 Å²	13	65.4 Å²	65.4	11%	0.107	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	118.4	175.6	0	0	0	0	0	108.4	Y678 L739 K743	A665-Y678 HydrophobicContact CB-CD1 3.62Å; A665-Y678 HydrophobicContact CB-CE1 3.61Å; A665-L739 HydrophobicContact CB-CB 4.35Å; A665-K743 HydrophobicContact CB-CB 4.17Å; A665-K743 HydrophobicContact CB-CD 4.1Å
666	E	86.6	Confident	77.9	Confident	116 Å²	116	62.9 Å²	62.9	54%	0.542	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	147.8	-172.2	-68.6	172.4	-159.1	0	0	110.2	C677	E666-C677 PolarHBondContact N-O 2.96Å; E666-C677 PolarHBondContact O-N 3.17Å
667	A	83.1	Confident	79	Confident	52 Å²	52	62.4 Å²	62.4	43%	0.43	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	115.1	167.4	0	0	0	0	0	108.1	I734 L739	A667-I734 HydrophobicContact CB-CB 4.4Å; A667-I734 HydrophobicContact CB-CG2 3.93Å; A667-L739 HydrophobicContact CB-CD1 4.32Å
668	A	76.6	Confident	79.7	Confident	33 Å²	33	56.4 Å²	56.4	27%	0.273	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	136.1	176	0	0	0	0	0	109.7	V675 C677	A668-V675 PolarHBondContact N-O 2.77Å; A668-V675 PolarHBondContact O-N 2.93Å; A668-C677 HydrophobicContact CB-CB 4.38Å
669	E	74.2	Confident	80.1	Confident	161 Å²	161	57.6 Å²	57.6	75%	0.752	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	121.2	169.3	-80.5	-167.4	160.5	0	0	110	T674	E669-T674 HydrophobicContact CG-CG2 3.97Å
670	E	62.7	Low	80.3	Confident	102 Å²	102	53.1 Å²	53.1	48%	0.477	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	114.9	178.8	-158.5	-177	-175.1	0	0	108.6	G672 E673 K700	E670-G672 VanDerWaalsContact C-N 3.26Å; E670-G672 PolarHBondContact O-N 3.27Å; E670-E673 PolarHBondContact N-O 3.3Å; E670-E673 PolarHBondContact O-N 3.13Å; E670-K700 IonicContact OE1-NZ 3.92Å; E670-K700 PolarHBondContact OE1-NZ 2.85Å; E670-K700 WeakPolarHBondContact OE2-CE 3.35Å; E670-K700 IonicContact OE2-NZ 3.51Å; E670-K700 PolarHBondContact OE2-NZ 3.23Å
671	G	58.4	Low	80.4	Confident	91 Å²	91	54 Å²	54	94%	0.938	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.7	23.3	-178.9	0	0	0	0	0	115.1
672	G	62	Low	80.3	Confident	72 Å²	72	51.6 Å²	51.6	74%	0.742	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.8	1.9	-179.7	0	0	0	0	0	114.9	E670	E670-G672 VanDerWaalsContact C-N 3.26Å; E670-G672 PolarHBondContact O-N 3.27Å
673	E	70.1	Confident	80.2	Confident	146 Å²	146	53.1 Å²	53.1	68%	0.682	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.4	135.8	171.5	-67.9	-172.7	164.5	0	0	110.4	E670 V675	E670-E673 PolarHBondContact N-O 3.3Å; E670-E673 PolarHBondContact O-N 3.13Å; E673-V675 PolarHBondContact O-N 3.12Å
674	T	74.8	Confident	79.9	Confident	71 Å²	71	52.2 Å²	52.2	44%	0.436	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	119	171	54.2	0	0	0	0	109.2	E669 I734	E669-T674 HydrophobicContact CG-CG2 3.97Å; T674-I734 WeakPolarHBondContact O-CD1 3.4Å
675	V	81.3	Confident	78.7	Confident	29 Å²	29	53.2 Å²	53.2	18%	0.176	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	138.2	-179.7	-173.5	0	0	0	0	110	A668 E673 C677 K700	A668-V675 PolarHBondContact N-O 2.77Å; A668-V675 PolarHBondContact O-N 2.93Å; E673-V675 PolarHBondContact O-N 3.12Å; V675-C677 PolarHBondContact O-N 3.08Å; V675-K700 HydrophobicContact CG1-CB 4.15Å; V675-K700 HydrophobicContact CG1-CD 4.29Å; V675-K700 HydrophobicContact CG1-CG 4.27Å
676	A	85.3	Confident	77	Confident	2 Å²	2	62 Å²	62	2%	0.017	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	115.6	174	0	0	0	0	0	110.4	Y678 L701 I734 L739	A676-Y678 HydrophobicContact CB-CE2 3.99Å; A676-Y678 WeakPolarHBondContact CB-OH 2.95Å; A676-L701 HydrophobicContact CB-CB 4.34Å; A676-L701 PolarHBondContact O-N 2.95Å; A676-I734 HydrophobicContact CB-CD1 4.22Å; A676-I734 HydrophobicContact CB-CG2 4.42Å; A676-L739 HydrophobicContact CB-CD2 3.72Å
677	C	86.9	Confident	75.4	Confident	9 Å²	9	60 Å²	60	6%	0.061	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	139.4	179.6	-71.1	0	0	0	0	110.6	E666 A668 V675	E666-C677 PolarHBondContact N-O 2.96Å; E666-C677 PolarHBondContact O-N 3.17Å; A668-C677 HydrophobicContact CB-CB 4.38Å; V675-C677 PolarHBondContact O-N 3.08Å
678	Y	88.9	Confident	73.7	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	127.7	-176.9	-57.9	-78	0	0	0	109.2	I662 T664 A665 A676 V680 R699 L701 F704 S742 K743 L746	I662-Y678 HydrophobicContact CD1-CD1 4.39Å; I662-Y678 HydrophobicContact CD1-CG 4.38Å; I662-Y678 HydrophobicContact CG2-CD1 3.86Å; I662-Y678 HydrophobicContact CG2-CG 4.28Å; T664-Y678 WeakPolarHBondContact O-CA 3.03Å; A665-Y678 HydrophobicContact CB-CD1 3.62Å; A665-Y678 HydrophobicContact CB-CE1 3.61Å; A676-Y678 HydrophobicContact CB-CE2 3.99Å; A676-Y678 WeakPolarHBondContact CB-OH 2.95Å; Y678-V680 PolarHBondContact O-N 3.23Å; Y678-R699 PolarHBondContact N-O 3.01Å; Y678-R699 PolarHBondContact O-N 2.83Å; Y678-L701 HydrophobicContact CE2-CB 4.05Å; Y678-L701 HydrophobicContact CE2-CD1 4.29Å; Y678-F704 HydrophobicContact CD2-CD2 4.32Å; Y678-F704 AromaticContact CD2-CE2 3.94Å; Y678-F704 HydrophobicContact CD2-CE2 3.94Å; Y678-F704 HydrophobicContact CG-CE2 4.36Å; Y678-S742 WeakPolarHBondContact OH-CB 3.2Å; Y678-S742 PolarHBondContact OH-OG 2.7Å; Y678-K743 HydrophobicContact CE1-CB 4.37Å; Y678-L746 HydrophobicContact CD1-CD1 4.26Å; Y678-L746 HydrophobicContact CD2-CD1 3.7Å; Y678-L746 HydrophobicContact CE1-CD1 4.01Å; Y678-L746 HydrophobicContact CE2-CD1 3.4Å; Y678-L746 VanDerWaalsContact CE2-CD1 3.4Å; Y678-L746 HydrophobicContact CG-CD1 4.12Å
679	S	88.1	Confident	72.5	Confident	30 Å²	30	73.6 Å²	73.6	21%	0.21	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	112.6	170.1	-168.6	0	0	0	0	108.6	I662 T663 T664	I662-S679 VanDerWaalsContact CA-O 3.31Å; I662-S679 WeakPolarHBondContact CA-O 3.06Å; T663-S679 PolarHBondContact N-O 3.15Å; T663-S679 PolarHBondContact OG1-O 2.9Å; T664-S679 PolarHBondContact O-N 2.62Å; T664-S679 WeakPolarHBondContact OG1-CB 3.43Å
680	V	88.7	Confident	71.7	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	112.5	179.9	-171	0	0	0	0	108.1	A660 I662 Y678 V682 S696 V697 R699 F704 L750 L769	A660-V680 HydrophobicContact CB-CG1 3.97Å; I662-V680 HydrophobicContact CG1-CG2 4.2Å; Y678-V680 PolarHBondContact O-N 3.23Å; V680-V682 HydrophobicContact CG1-CG2 4.31Å; V680-S696 WeakPolarHBondContact O-CA 3.16Å; V680-V697 HydrophobicContact CB-CG2 4.08Å; V680-V697 PolarHBondContact N-O 2.84Å; V680-V697 PolarHBondContact O-N 2.85Å; V680-R699 HydrophobicContact CG2-CB 4.25Å; V680-R699 HydrophobicContact CG2-CG 4.23Å; V680-F704 HydrophobicContact CG2-CE2 4.41Å; V680-F704 HydrophobicContact CG2-CZ 3.64Å; V680-L750 HydrophobicContact CG1-CD1 3.87Å; V680-L769 HydrophobicContact CG1-CD2 4.05Å
681	C	87.8	Confident	71.4	Confident	21 Å²	21	69.4 Å²	69.4	14%	0.142	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	126.9	172.1	-174.3	0	0	0	0	109	A660 S661 T663 C694	A660-C681 VanDerWaalsContact CA-O 3.3Å; A660-C681 WeakPolarHBondContact CA-O 3.44Å; S661-C681 PolarHBondContact N-O 3.36Å; S661-C681 PolarHBondContact O-N 3.43Å; T663-C681 HydrophobicContact CG2-CB 3.69Å; C681-C694 PolarHBondContact SG-SG 3.36Å
682	V	85.8	Confident	71.5	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	119.6	178.9	-173	0	0	0	0	108.1	W651 W658 R659 A660 V680 C694 W695 L769	W651-V682 HydrophobicContact CZ3-CG1 4.24Å; W658-V682 HydrophobicContact CE3-CG1 3.96Å; R659-V682 WeakPolarHBondContact O-CA 2.76Å; A660-V682 HydrophobicContact CB-CG2 4.25Å; V680-V682 HydrophobicContact CG1-CG2 4.31Å; V682-C694 WeakPolarHBondContact O-CA 3.22Å; V682-W695 HydrophobicContact CB-CZ2 4.25Å; V682-W695 HydrophobicContact CG1-CH2 4.42Å; V682-W695 HydrophobicContact CG1-CZ2 3.91Å; V682-W695 PolarHBondContact N-O 2.91Å; V682-W695 PolarHBondContact O-N 2.71Å; V682-W695 VanDerWaalsContact O-N 3.11Å; V682-L769 HydrophobicContact CG2-CB 4.12Å; V682-L769 HydrophobicContact CG2-CD2 3.93Å; V682-L769 HydrophobicContact CG2-CG 4.46Å
683	S	85	Confident	71.5	Confident	38 Å²	38	67.5 Å²	67.5	27%	0.266	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	161	-175.1	67.8	0	0	0	0	111.9	R659	R659-S683 PolarHBondContact N-O 3.41Å; R659-S683 PolarHBondContact O-N 3.35Å
684	L	79.5	Confident	71.9	Confident	47 Å²	47	63.4 Å²	63.4	25%	0.246	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	146	172.6	-75.5	150.3	0	0	0	111	W650 N654 H657 W658 E686	W650-L684 HydrophobicContact CH2-CD1 4.36Å; W650-L684 HydrophobicContact CZ3-CD1 3.98Å; N654-L684 HydrophobicContact CB-CD1 4.42Å; N654-L684 HydrophobicContact CB-CD2 3.97Å; H657-L684 HydrophobicContact CB-CD2 3.48Å; H657-L684 VanDerWaalsContact CB-CD2 3.48Å; W658-L684 HydrophobicContact CD2-CD2 4.13Å; W658-L684 HydrophobicContact CD2-CG 4.1Å; W658-L684 HydrophobicContact CE3-CD1 4.32Å; W658-L684 HydrophobicContact CE3-CD2 4.31Å; W658-L684 HydrophobicContact CE3-CG 3.78Å; W658-L684 HydrophobicContact CH2-CD1 3.61Å; W658-L684 HydrophobicContact CH2-CG 4.01Å; W658-L684 HydrophobicContact CZ2-CD1 3.98Å; W658-L684 HydrophobicContact CZ2-CG 4.33Å; W658-L684 HydrophobicContact CZ3-CD1 3.81Å; W658-L684 HydrophobicContact CZ3-CG 3.74Å; L684-E686 PolarHBondContact O-N 3.44Å
685	T	59.3	Low	72.1	Confident	84 Å²	84	62.6 Å²	62.6	52%	0.515	36%	0.363	S	S	.	.	S	Bend	trans	-84.5	107.8	-179.5	0.7	0	0	0	0	112	H657 R659	H657-T685 PolarHBondContact O-OG1 3.49Å; R659-T685 HydrophobicContact CG-CG2 3.87Å; R659-T685 VanDerWaalsContact CG-OG1 3.29Å; R659-T685 WeakPolarHBondContact CG-OG1 3.22Å; R659-T685 PolarHBondContact NE-OG1 3.23Å
686	E	52.8	Low	72.2	Confident	199 Å²	199	64.7 Å²	64.7	93%	0.93	38%	0.379	S	S	*	.	S	Bend	trans	63.2	119.9	173.1	-72.1	-173.4	172.9	0	0	119.8	L684	L684-E686 PolarHBondContact O-N 3.44Å
687	G	51.5	Low	72.1	Confident	73 Å²	73	65 Å²	65	75%	0.753	38%	0.381	S	S	*	.	S	Bend	trans	116.3	94.2	160.7	0	0	0	0	0	115.1
688	E	48.1	Very low	72	Confident	173 Å²	173	70.8 Å²	70.8	81%	0.808	41%	0.407	S	S	*	.			trans	80.3	104.5	173.5	-59.5	-173.2	167.4	0	0	118	T690	E688-T690 PolarHBondContact O-N 3.4Å; E688-T690 VanDerWaalsContact O-N 3.08Å
689	E	50.7	Low	72	Confident	198 Å²	198	72.2 Å²	72.2	93%	0.925	41%	0.413	S	S	*	.			trans	-70.7	95.7	168.3	-68.6	-175.9	166.6	0	0	110.3
690	T	57.5	Low	72	Confident	74 Å²	74	73.6 Å²	73.6	45%	0.454	42%	0.415	S	S	.	.			trans	-97.5	149.7	161.9	52.6	0	0	0	0	109.1	E688 N692 S693	E688-T690 PolarHBondContact O-N 3.4Å; E688-T690 VanDerWaalsContact O-N 3.08Å; T690-N692 PolarHBondContact O-N 3.41Å; T690-S693 PolarHBondContact N-OG 3.1Å; T690-S693 PolarHBondContact O-N 2.93Å; T690-S693 PolarHBondContact O-OG 3.16Å
691	A	56.4	Low	71.9	Confident	101 Å²	101	74 Å²	74	84%	0.835	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-14.8	-171.8	0	0	0	0	0	115.4
692	N	60	Low	71.6	Confident	106 Å²	106	76.5 Å²	76.5	57%	0.567	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-2.9	179	-65.5	-7.6	0	0	0	113.8	W650 T690 C694	W650-N692 VanDerWaalsContact CZ3-O 3.24Å; W650-N692 WeakPolarHBondContact CZ3-O 3.37Å; T690-N692 PolarHBondContact O-N 3.41Å; N692-C694 VanDerWaalsContact C-N 3.32Å; N692-C694 PolarHBondContact O-N 2.9Å
693	S	63.8	Low	71.5	Confident	17 Å²	17	79.3 Å²	79.3	12%	0.119	45%	0.445	C	S	.	.	S	Bend	trans	-84	-2.6	-176.5	71.4	0	0	0	0	115.1	T690	T690-S693 PolarHBondContact N-OG 3.1Å; T690-S693 PolarHBondContact O-N 2.93Å; T690-S693 PolarHBondContact O-OG 3.16Å
694	C	76.9	Confident	71.6	Confident	60 Å²	60	77.5 Å²	77.5	41%	0.405	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	137.5	177.4	-179.8	0	0	0	0	111.3	C681 V682 N692	C681-C694 PolarHBondContact SG-SG 3.36Å; V682-C694 WeakPolarHBondContact O-CA 3.22Å; N692-C694 VanDerWaalsContact C-N 3.32Å; N692-C694 PolarHBondContact O-N 2.9Å
695	W	80.8	Confident	71.9	Confident	53 Å²	53	78.7 Å²	78.7	20%	0.201	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	158.8	166	62.8	86.7	0	0	0	110.7	W651 W658 V682 L769	W651-W695 AromaticContact CE3-CH2 3.72Å; W651-W695 HydrophobicContact CE3-CH2 3.72Å; W651-W695 AromaticContact CE3-CZ2 3.73Å; W651-W695 HydrophobicContact CE3-CZ2 3.73Å; W651-W695 HydrophobicContact CZ3-CH2 4.01Å; W651-W695 AromaticContact CZ3-CZ2 3.7Å; W651-W695 HydrophobicContact CZ3-CZ2 3.7Å; W658-W695 HydrophobicContact CD2-CH2 4.44Å; W658-W695 AromaticContact CE3-CH2 3.97Å; W658-W695 HydrophobicContact CE3-CH2 3.97Å; W658-W695 HydrophobicContact CE3-CZ3 4.36Å; W658-W695 AromaticContact CH2-CH2 3.41Å; W658-W695 HydrophobicContact CH2-CH2 3.41Å; W658-W695 VanDerWaalsContact CH2-CH2 3.41Å; W658-W695 AromaticContact CH2-CZ3 3.33Å; W658-W695 HydrophobicContact CH2-CZ3 3.33Å; W658-W695 AromaticContact CZ2-CH2 3.92Å; W658-W695 HydrophobicContact CZ2-CH2 3.92Å; W658-W695 HydrophobicContact CZ2-CZ3 4.21Å; W658-W695 HydrophobicContact CZ3-CE3 4.42Å; W658-W695 AromaticContact CZ3-CH2 3.43Å; W658-W695 HydrophobicContact CZ3-CH2 3.43Å; W658-W695 VanDerWaalsContact CZ3-CH2 3.43Å; W658-W695 HydrophobicContact CZ3-CZ2 4.48Å; W658-W695 AromaticContact CZ3-CZ3 3.41Å; W658-W695 HydrophobicContact CZ3-CZ3 3.41Å; W658-W695 VanDerWaalsContact CZ3-CZ3 3.41Å; V682-W695 HydrophobicContact CB-CZ2 4.25Å; V682-W695 HydrophobicContact CG1-CH2 4.42Å; V682-W695 HydrophobicContact CG1-CZ2 3.91Å; V682-W695 PolarHBondContact N-O 2.91Å; V682-W695 PolarHBondContact O-N 2.71Å; V682-W695 VanDerWaalsContact O-N 3.11Å; W695-L769 PolarHBondContact NE1-O 2.93Å
696	S	82.3	Confident	73	Confident	73 Å²	73	79.4 Å²	79.4	51%	0.51	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	137.3	177.3	-68.2	0	0	0	0	110.8	V680	V680-S696 WeakPolarHBondContact O-CA 3.16Å
697	V	84.3	Confident	74.5	Confident	8 Å²	8	70.3 Å²	70.3	5%	0.048	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	138.5	173.1	-67.2	0	0	0	0	110.6	V680 R699 P771	V680-V697 HydrophobicContact CB-CG2 4.08Å; V680-V697 PolarHBondContact N-O 2.84Å; V680-V697 PolarHBondContact O-N 2.85Å; V697-R699 HydrophobicContact CG2-CG 4.26Å; V697-P771 HydrophobicContact CG1-CB 4.34Å
698	Q	83.8	Confident	76	Confident	132 Å²	132	68.3 Å²	68.3	62%	0.617	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	129	175.7	-161.6	172.1	19.4	0	0	109.9
699	R	89	Confident	77.6	Confident	30 Å²	30	67.7 Å²	67.7	11%	0.113	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	141.4	-177.3	-65.6	-64.7	177.7	-101.4	0.2	112.6	Y678 V680 V697 E703 F704 F768 S770	Y678-R699 PolarHBondContact N-O 3.01Å; Y678-R699 PolarHBondContact O-N 2.83Å; V680-R699 HydrophobicContact CG2-CB 4.25Å; V680-R699 HydrophobicContact CG2-CG 4.23Å; V697-R699 HydrophobicContact CG2-CG 4.26Å; R699-E703 VanDerWaalsContact CA-OE2 3.3Å; R699-E703 WeakPolarHBondContact CA-OE2 3.46Å; R699-E703 WeakPolarHBondContact CD-OE2 3.18Å; R699-F704 HydrophobicContact CB-CD2 4.25Å; R699-F704 HydrophobicContact CB-CE2 3.53Å; R699-F704 HydrophobicContact CB-CZ 4.09Å; R699-F768 HydrophobicContact CB-CE2 4.21Å; R699-F768 HydrophobicContact CB-CZ 3.81Å; R699-F768 HydrophobicContact CG-CE1 4.04Å; R699-F768 HydrophobicContact CG-CE2 3.89Å; R699-F768 HydrophobicContact CG-CZ 3.58Å; R699-F768 PolarHBondContact NE-O 3.05Å; R699-F768 PolarHBondContact NH2-O 2.77Å; R699-S770 PolarHBondContact NH2-O 2.09Å
700	K	88.1	Confident	78.9	Confident	58 Å²	58	64.2 Å²	64.2	25%	0.252	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	151.5	-179.6	-55.5	175.4	-170.3	178.8	0	110.7	E670 V675 T702 E703 F704	E670-K700 IonicContact OE1-NZ 3.92Å; E670-K700 PolarHBondContact OE1-NZ 2.85Å; E670-K700 WeakPolarHBondContact OE2-CE 3.35Å; E670-K700 IonicContact OE2-NZ 3.51Å; E670-K700 PolarHBondContact OE2-NZ 3.23Å; V675-K700 HydrophobicContact CG1-CB 4.15Å; V675-K700 HydrophobicContact CG1-CD 4.29Å; V675-K700 HydrophobicContact CG1-CG 4.27Å; K700-T702 PolarHBondContact O-N 2.9Å; K700-T702 VanDerWaalsContact O-N 3.13Å; K700-E703 HydrophobicContact CB-CG 4.18Å; K700-E703 PolarHBondContact N-OE2 3.36Å; K700-E703 WeakPolarHBondContact O-CB 3.27Å; K700-E703 PolarHBondContact O-N 3.33Å; K700-F704 VanDerWaalsContact O-CD2 3.32Å; K700-F704 WeakPolarHBondContact O-CD2 3.27Å; K700-F704 PolarHBondContact O-N 3.29Å
701	L	85.5	Confident	79.8	Confident	9 Å²	9	60.9 Å²	60.9	5%	0.047	32%	0.315	C	S	.	.	H	α-helix	trans	-52.3	-37.9	177.4	-176	59.5	0	0	0	113.1	A676 Y678 E703 F704 Q705 P724 F738 L746	A676-L701 HydrophobicContact CB-CB 4.34Å; A676-L701 PolarHBondContact O-N 2.95Å; Y678-L701 HydrophobicContact CE2-CB 4.05Å; Y678-L701 HydrophobicContact CE2-CD1 4.29Å; L701-E703 VanDerWaalsContact C-N 3.31Å; L701-E703 PolarHBondContact O-N 3.11Å; L701-F704 WeakPolarHBondContact O-CB 3.38Å; L701-F704 PolarHBondContact O-N 3.42Å; L701-Q705 WeakPolarHBondContact O-CG 3.3Å; L701-Q705 PolarHBondContact O-N 3.21Å; L701-Q705 VanDerWaalsContact O-N 3.1Å; L701-P724 HydrophobicContact CD1-CB 4.19Å; L701-P724 HydrophobicContact CD1-CG 4.36Å; L701-F738 HydrophobicContact CD2-CE1 4.41Å; L701-F738 HydrophobicContact CD2-CZ 4.08Å; L701-L746 HydrophobicContact CD1-CD1 3.9Å; L701-L746 HydrophobicContact CD1-CD2 4.18Å; L701-L746 HydrophobicContact CD1-CG 4.47Å
702	T	82.3	Confident	80.8	Confident	73 Å²	73	56.8 Å²	56.8	45%	0.448	28%	0.28	S	S	.	.	H	α-helix	trans	-64.8	-33.3	178.1	50.3	0	0	0	0	112.6	K700 Q705 M706	K700-T702 PolarHBondContact O-N 2.9Å; K700-T702 VanDerWaalsContact O-N 3.13Å; T702-Q705 PolarHBondContact O-N 2.93Å; T702-M706 WeakPolarHBondContact O-CG 3.46Å; T702-M706 PolarHBondContact O-N 2.87Å
703	E	84.6	Confident	81.5	Confident	60 Å²	60	58.8 Å²	58.8	28%	0.28	29%	0.286	S	S	.	.	H	α-helix	trans	-71.3	-37.8	176.9	-59.8	177.8	131.4	0	0	111.5	R699 K700 L701 Q705 M706 L707 F768	R699-E703 VanDerWaalsContact CA-OE2 3.3Å; R699-E703 WeakPolarHBondContact CA-OE2 3.46Å; R699-E703 WeakPolarHBondContact CD-OE2 3.18Å; K700-E703 HydrophobicContact CB-CG 4.18Å; K700-E703 PolarHBondContact N-OE2 3.36Å; K700-E703 WeakPolarHBondContact O-CB 3.27Å; K700-E703 PolarHBondContact O-N 3.33Å; L701-E703 VanDerWaalsContact C-N 3.31Å; L701-E703 PolarHBondContact O-N 3.11Å; E703-Q705 VanDerWaalsContact C-N 3.33Å; E703-Q705 PolarHBondContact O-N 2.95Å; E703-M706 HydrophobicContact CB-CE 4.36Å; E703-M706 HydrophobicContact CG-CE 4.01Å; E703-M706 PolarHBondContact O-N 3.47Å; E703-L707 WeakPolarHBondContact O-CB 3.27Å; E703-L707 PolarHBondContact O-N 3.34Å; E703-F768 HydrophobicContact CB-CE2 3.86Å
704	F	87	Confident	81.3	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-61	-41.8	170.5	-76.3	-87.7	0	0	0	112	I662 Y678 V680 R699 K700 L701 L707 H708 L746 F749 L750 F768	I662-F704 HydrophobicContact CD1-CE1 4.48Å; I662-F704 HydrophobicContact CD1-CZ 4.13Å; Y678-F704 HydrophobicContact CD2-CD2 4.32Å; Y678-F704 AromaticContact CD2-CE2 3.94Å; Y678-F704 HydrophobicContact CD2-CE2 3.94Å; Y678-F704 HydrophobicContact CG-CE2 4.36Å; V680-F704 HydrophobicContact CG2-CE2 4.41Å; V680-F704 HydrophobicContact CG2-CZ 3.64Å; R699-F704 HydrophobicContact CB-CD2 4.25Å; R699-F704 HydrophobicContact CB-CE2 3.53Å; R699-F704 HydrophobicContact CB-CZ 4.09Å; K700-F704 VanDerWaalsContact O-CD2 3.32Å; K700-F704 WeakPolarHBondContact O-CD2 3.27Å; K700-F704 PolarHBondContact O-N 3.29Å; L701-F704 WeakPolarHBondContact O-CB 3.38Å; L701-F704 PolarHBondContact O-N 3.42Å; F704-L707 PolarHBondContact O-N 3.47Å; F704-H708 WeakPolarHBondContact O-CB 3.46Å; F704-H708 PolarHBondContact O-N 3.37Å; F704-L746 HydrophobicContact CB-CD2 3.85Å; F704-L746 HydrophobicContact CD1-CD2 3.91Å; F704-L746 HydrophobicContact CD2-CD1 4.32Å; F704-L746 HydrophobicContact CD2-CD2 4.47Å; F704-L746 HydrophobicContact CE2-CD1 4.48Å; F704-L746 HydrophobicContact CG-CD1 4.48Å; F704-L746 HydrophobicContact CG-CD2 3.85Å; F704-F749 HydrophobicContact CD1-CD1 4.42Å; F704-L750 HydrophobicContact CE1-CD1 3.89Å; F704-L750 HydrophobicContact CE1-CD2 3.9Å; F704-L750 HydrophobicContact CE1-CG 3.92Å; F704-L750 HydrophobicContact CZ-CD1 4.38Å; F704-F768 HydrophobicContact CD1-CE1 4.15Å; F704-F768 AromaticContact CD1-CZ 3.69Å; F704-F768 HydrophobicContact CD1-CZ 3.69Å; F704-F768 AromaticContact CD2-CZ 3.99Å; F704-F768 HydrophobicContact CD2-CZ 3.99Å; F704-F768 AromaticContact CE1-CE1 3.82Å; F704-F768 HydrophobicContact CE1-CE1 3.82Å; F704-F768 AromaticContact CE1-CZ 3.64Å; F704-F768 HydrophobicContact CE1-CZ 3.64Å; F704-F768 AromaticContact CE2-CZ 3.92Å; F704-F768 HydrophobicContact CE2-CZ 3.92Å; F704-F768 AromaticContact CG-CZ 3.88Å; F704-F768 HydrophobicContact CG-CZ 3.88Å; F704-F768 HydrophobicContact CZ-CE1 4.12Å; F704-F768 AromaticContact CZ-CZ 3.76Å; F704-F768 HydrophobicContact CZ-CZ 3.76Å
705	Q	85.1	Confident	81.1	Confident	72 Å²	72	61.7 Å²	61.7	34%	0.336	30%	0.3	S	S	.	.	H	α-helix	trans	-66.1	-38.4	176.6	-69.2	170.7	-10.2	0	0	112.1	L701 T702 E703 H708 R709 L723 P724	L701-Q705 WeakPolarHBondContact O-CG 3.3Å; L701-Q705 PolarHBondContact O-N 3.21Å; L701-Q705 VanDerWaalsContact O-N 3.1Å; T702-Q705 PolarHBondContact O-N 2.93Å; E703-Q705 VanDerWaalsContact C-N 3.33Å; E703-Q705 PolarHBondContact O-N 2.95Å; Q705-H708 PolarHBondContact O-N 3.29Å; Q705-R709 PolarHBondContact O-N 2.9Å; Q705-L723 HydrophobicContact CG-CD1 4.17Å; Q705-P724 PolarHBondContact NE2-O 2.99Å
706	M	82.5	Confident	80.8	Confident	98 Å²	98	63 Å²	63	48%	0.483	32%	0.315	S	S	.	.	H	α-helix	trans	-66.4	-43.3	174.6	-74.9	-171.1	-71	0	0	112.2	T702 E703 R709 K710	T702-M706 WeakPolarHBondContact O-CG 3.46Å; T702-M706 PolarHBondContact O-N 2.87Å; E703-M706 HydrophobicContact CB-CE 4.36Å; E703-M706 HydrophobicContact CG-CE 4.01Å; E703-M706 PolarHBondContact O-N 3.47Å; M706-R709 PolarHBondContact O-N 3.08Å; M706-K710 WeakPolarHBondContact O-CG 3.47Å; M706-K710 PolarHBondContact O-N 2.97Å
707	L	84.6	Confident	80.2	Confident	9 Å²	9	63.4 Å²	63.4	5%	0.047	32%	0.317	C	S	.	.	H	α-helix	trans	-59.4	-47.9	174.2	179.1	67	0	0	0	110.4	E703 F704 R709 K710 L711 L753 A764 L765 F768	E703-L707 WeakPolarHBondContact O-CB 3.27Å; E703-L707 PolarHBondContact O-N 3.34Å; F704-L707 PolarHBondContact O-N 3.47Å; L707-R709 PolarHBondContact O-N 3.28Å; L707-K710 PolarHBondContact O-N 3.44Å; L707-L711 HydrophobicContact CD1-CD1 3.8Å; L707-L711 HydrophobicContact CD1-CG 4.01Å; L707-L711 HydrophobicContact CD2-CD1 4.46Å; L707-L711 HydrophobicContact CG-CD1 3.86Å; L707-L711 HydrophobicContact CG-CG 4.33Å; L707-L711 WeakPolarHBondContact O-CB 3.34Å; L707-L711 WeakPolarHBondContact O-CG 3.2Å; L707-L711 PolarHBondContact O-N 2.95Å; L707-L753 HydrophobicContact CD2-CD1 4.12Å; L707-A764 HydrophobicContact CD1-CB 4.35Å; L707-A764 WeakPolarHBondContact CD1-O 3.45Å; L707-L765 HydrophobicContact CD2-CD1 4.06Å; L707-F768 HydrophobicContact CB-CD2 4.3Å; L707-F768 HydrophobicContact CD1-CB 4.18Å; L707-F768 HydrophobicContact CD2-CB 4.12Å; L707-F768 HydrophobicContact CD2-CD1 3.65Å; L707-F768 HydrophobicContact CD2-CD2 4.07Å; L707-F768 HydrophobicContact CD2-CE1 4.03Å; L707-F768 HydrophobicContact CD2-CE2 4.4Å; L707-F768 HydrophobicContact CD2-CG 3.68Å; L707-F768 HydrophobicContact CD2-CZ 4.38Å; L707-F768 HydrophobicContact CG-CG 4.5Å
708	H	83.3	Confident	79.7	Confident	30 Å²	30	63.3 Å²	63.3	14%	0.139	32%	0.317	C	S	.	.	H	α-helix	trans	-59.1	-44.6	177	177.6	-101.7	0	0	0	112.1	F704 Q705 K710 L711 T712 L718 L721 L723 F749	F704-H708 WeakPolarHBondContact O-CB 3.46Å; F704-H708 PolarHBondContact O-N 3.37Å; Q705-H708 PolarHBondContact O-N 3.29Å; H708-K710 PolarHBondContact O-N 2.88Å; H708-L711 PolarHBondContact O-N 3.27Å; H708-T712 PolarHBondContact NE2-OG1 2.89Å; H708-T712 WeakPolarHBondContact O-CB 3.31Å; H708-T712 PolarHBondContact O-N 3.11Å; H708-T712 PolarHBondContact O-OG1 3.39Å; H708-L718 PolarHBondContact NE2-O 3.18Å; H708-L721 PolarHBondContact NE2-O 3.31Å; H708-L723 HydrophobicContact CB-CD1 3.44Å; H708-L723 VanDerWaalsContact CB-CD1 3.44Å; H708-L723 HydrophobicContact CB-CG 4.38Å; H708-F749 HydrophobicContact CB-CE1 4.32Å; H708-F749 HydrophobicContact CB-CE2 4.32Å; H708-F749 HydrophobicContact CB-CZ 3.71Å; H708-F749 AromaticContact CD2-CE2 3.5Å; H708-F749 VanDerWaalsContact CD2-CE2 3.5Å; H708-F749 WeakPolarHBondContact CD2-CE2 3.28Å; H708-F749 AromaticContact CD2-CZ 3.81Å
709	R	82.2	Confident	79.3	Confident	161 Å²	161	64.1 Å²	64.1	61%	0.608	32%	0.318	S	S	*	.	H	α-helix	trans	-59.2	-49.5	176.4	-171.7	177.6	72.3	-179.6	0.9	111.7	Q705 M706 L707 T712 E713	Q705-R709 PolarHBondContact O-N 2.9Å; M706-R709 PolarHBondContact O-N 3.08Å; L707-R709 PolarHBondContact O-N 3.28Å; R709-T712 PolarHBondContact O-N 3.12Å; R709-E713 PolarHBondContact O-N 3.32Å; R709-E713 VanDerWaalsContact O-N 3.15Å
710	K	77.5	Confident	78.4	Confident	124 Å²	124	72 Å²	72	54%	0.539	35%	0.353	S	S	.	.	H	α-helix	trans	-61.2	-47.4	179.9	-75.9	-175.4	175.7	-174.8	0	111.9	M706 L707 H708 T712 E713	M706-K710 WeakPolarHBondContact O-CG 3.47Å; M706-K710 PolarHBondContact O-N 2.97Å; L707-K710 PolarHBondContact O-N 3.44Å; H708-K710 PolarHBondContact O-N 2.88Å; K710-T712 VanDerWaalsContact C-N 3.29Å; K710-T712 PolarHBondContact O-N 2.91Å; K710-E713 PolarHBondContact O-N 3.07Å
711	L	76.1	Confident	77.8	Confident	4 Å²	4	72.2 Å²	72.2	2%	0.021	36%	0.357	C	S	.	.	H	α-helix	trans	-69	-30.5	179	-64.7	-179.9	0	0	0	111.7	L707 H708 C714 F715 L718 L753 L759 S762 A764	L707-L711 HydrophobicContact CD1-CD1 3.8Å; L707-L711 HydrophobicContact CD1-CG 4.01Å; L707-L711 HydrophobicContact CD2-CD1 4.46Å; L707-L711 HydrophobicContact CG-CD1 3.86Å; L707-L711 HydrophobicContact CG-CG 4.33Å; L707-L711 WeakPolarHBondContact O-CB 3.34Å; L707-L711 WeakPolarHBondContact O-CG 3.2Å; L707-L711 PolarHBondContact O-N 2.95Å; H708-L711 PolarHBondContact O-N 3.27Å; L711-C714 PolarHBondContact O-N 2.64Å; L711-F715 WeakPolarHBondContact O-CA 3.5Å; L711-F715 WeakPolarHBondContact O-CB 3.42Å; L711-F715 WeakPolarHBondContact O-CD2 3.14Å; L711-F715 PolarHBondContact O-N 2.71Å; L711-L718 HydrophobicContact CB-CD1 3.65Å; L711-L753 HydrophobicContact CD1-CD1 3.83Å; L711-L753 HydrophobicContact CD1-CD2 3.77Å; L711-L753 HydrophobicContact CD1-CG 4.44Å; L711-L759 HydrophobicContact CD2-CD2 4.32Å; L711-S762 WeakPolarHBondContact CD2-OG 3.49Å; L711-A764 HydrophobicContact CD2-CB 4.42Å
712	T	78	Confident	77.3	Confident	16 Å²	16	80.3 Å²	80.3	10%	0.098	39%	0.394	C	S	.	.	H	α-helix	trans	-70.3	-30.2	178.2	-63.5	0	0	0	0	113.2	H708 R709 K710 C714 F715 K719	H708-T712 PolarHBondContact NE2-OG1 2.89Å; H708-T712 WeakPolarHBondContact O-CB 3.31Å; H708-T712 PolarHBondContact O-N 3.11Å; H708-T712 PolarHBondContact O-OG1 3.39Å; R709-T712 PolarHBondContact O-N 3.12Å; K710-T712 VanDerWaalsContact C-N 3.29Å; K710-T712 PolarHBondContact O-N 2.91Å; T712-C714 VanDerWaalsContact C-N 3.29Å; T712-F715 CarbonylContact O-C 3.54Å; T712-K719 HydrophobicContact CG2-CB 4.27Å; T712-K719 HydrophobicContact CG2-CD 4.19Å; T712-K719 HydrophobicContact CG2-CG 3.2Å
713	E	72.9	Confident	77.3	Confident	147 Å²	147	78.1 Å²	78.1	69%	0.687	38%	0.38	S	S	*	.	H	α-helix	trans	-61.8	-40.1	172.2	-74.6	174.9	-166.2	0	0	111.2	R709 K710	R709-E713 PolarHBondContact O-N 3.32Å; R709-E713 VanDerWaalsContact O-N 3.15Å; K710-E713 PolarHBondContact O-N 3.07Å
714	C	60.8	Low	77.1	Confident	92 Å²	92	75.6 Å²	75.6	62%	0.622	37%	0.368	S	S	*	.	H	α-helix	trans	-86.9	-30.1	179.8	-58	0	0	0	0	113.2	L711 T712	L711-C714 PolarHBondContact O-N 2.64Å; T712-C714 VanDerWaalsContact C-N 3.29Å
715	F	72.3	Confident	76.4	Confident	46 Å²	46	79.9 Å²	79.9	20%	0.202	40%	0.398	C	S	.	.			trans	-129.8	85.5	-174.3	-60.1	-89.3	0	0	0	110.4	L711 T712 C717 L718 R758 L759	L711-F715 WeakPolarHBondContact O-CA 3.5Å; L711-F715 WeakPolarHBondContact O-CB 3.42Å; L711-F715 WeakPolarHBondContact O-CD2 3.14Å; L711-F715 PolarHBondContact O-N 2.71Å; T712-F715 CarbonylContact O-C 3.54Å; F715-C717 PolarHBondContact O-N 2.89Å; F715-L718 HydrophobicContact CB-CD1 4.02Å; F715-L718 HydrophobicContact CB-CG 4.24Å; F715-L718 WeakPolarHBondContact O-CB 3.41Å; F715-L718 PolarHBondContact O-N 2.79Å; F715-R758 HydrophobicContact CE1-CB 4.45Å; F715-L759 HydrophobicContact CB-CD2 4.35Å; F715-L759 HydrophobicContact CD1-CD2 4.04Å; F715-L759 HydrophobicContact CD2-CD2 3.28Å; F715-L759 HydrophobicContact CE1-CD2 4.12Å; F715-L759 HydrophobicContact CE2-CD2 3.41Å; F715-L759 VanDerWaalsContact CE2-CD2 3.41Å; F715-L759 HydrophobicContact CG-CD2 3.62Å; F715-L759 HydrophobicContact CZ-CD2 3.83Å
716	P	73.8	Confident	75.7	Confident	81 Å²	81	80.4 Å²	80.4	53%	0.526	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-60.4	-20.1	-174.4	-25.5	34.3	0	0	0	114.9	L718 K719	P716-L718 PolarHBondContact O-N 3.32Å; P716-K719 WeakPolarHBondContact O-CB 3.5Å; P716-K719 WeakPolarHBondContact O-CG 3.35Å; P716-K719 PolarHBondContact O-N 2.86Å; P716-K719 VanDerWaalsContact O-N 3.12Å
717	C	69.9	Low	74.6	Confident	82 Å²	82	78.4 Å²	78.4	55%	0.554	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-59.9	-23.3	174.9	57.5	0	0	0	0	112.9	F715 K719	F715-C717 PolarHBondContact O-N 2.89Å; C717-K719 VanDerWaalsContact C-N 3.29Å; C717-K719 PolarHBondContact O-N 3.25Å
718	L	74	Confident	73.3	Confident	6 Å²	6	88.3 Å²	88.3	3%	0.031	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-75.3	-13.2	177.8	-60.7	176.8	0	0	0	113.5	H708 L711 F715 P716 K720 L721 L753 L759	H708-L718 PolarHBondContact NE2-O 3.18Å; L711-L718 HydrophobicContact CB-CD1 3.65Å; F715-L718 HydrophobicContact CB-CD1 4.02Å; F715-L718 HydrophobicContact CB-CG 4.24Å; F715-L718 WeakPolarHBondContact O-CB 3.41Å; F715-L718 PolarHBondContact O-N 2.79Å; P716-L718 PolarHBondContact O-N 3.32Å; L718-K720 PolarHBondContact O-N 2.79Å; L718-L721 HydrophobicContact CD2-CD1 3.96Å; L718-L721 PolarHBondContact O-N 3.36Å; L718-L721 VanDerWaalsContact O-N 3.16Å; L718-L753 HydrophobicContact CD1-CD2 3.84Å; L718-L753 HydrophobicContact CD2-CD2 3.96Å; L718-L759 HydrophobicContact CD1-CD1 4.29Å; L718-L759 HydrophobicContact CD1-CD2 4.49Å; L718-L759 HydrophobicContact CD2-CD1 4.42Å
719	K	75.1	Confident	72.1	Confident	149 Å²	149	93 Å²	93	65%	0.648	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-59.6	-28.1	177.1	-71.6	-175	179.8	-179.8	0	113.6	T712 P716 C717 L721	T712-K719 HydrophobicContact CG2-CB 4.27Å; T712-K719 HydrophobicContact CG2-CD 4.19Å; T712-K719 HydrophobicContact CG2-CG 3.2Å; P716-K719 WeakPolarHBondContact O-CB 3.5Å; P716-K719 WeakPolarHBondContact O-CG 3.35Å; P716-K719 PolarHBondContact O-N 2.86Å; P716-K719 VanDerWaalsContact O-N 3.12Å; C717-K719 VanDerWaalsContact C-N 3.29Å; C717-K719 PolarHBondContact O-N 3.25Å; K719-L721 VanDerWaalsContact C-N 3.28Å; K719-L721 PolarHBondContact O-N 3.34Å
720	K	71.7	Confident	70.5	Confident	194 Å²	194	90.8 Å²	90.8	84%	0.843	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-76.6	-15	-177.9	-64.7	-175.6	-179.4	-178.7	0	113	L718	L718-K720 PolarHBondContact O-N 2.79Å
721	L	75.2	Confident	69.2	Low	63 Å²	63	94.4 Å²	94.4	33%	0.33	49%	0.489	S	S	.	.			trans	-89.3	115.4	178.3	-68.9	160.1	0	0	0	108.9	H708 L718 K719 F749 R752	H708-L721 PolarHBondContact NE2-O 3.31Å; L718-L721 HydrophobicContact CD2-CD1 3.96Å; L718-L721 PolarHBondContact O-N 3.36Å; L718-L721 VanDerWaalsContact O-N 3.16Å; K719-L721 VanDerWaalsContact C-N 3.28Å; K719-L721 PolarHBondContact O-N 3.34Å; L721-F749 HydrophobicContact CD1-CD2 4.46Å; L721-R752 HydrophobicContact CD1-CG 4.03Å
722	Q	74	Confident	68.3	Low	179 Å²	179	101.9 Å²	101.9	84%	0.836	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-88.8	128.1	174.6	-67.3	-173.1	2.1	0	0	109.9
723	L	81.8	Confident	67.7	Low	27 Å²	27	105.3 Å²	105.3	14%	0.141	55%	0.546	C	S	.	.	P	Polyproline II helix	trans	-87.8	154.9	172.2	-72.2	-175.5	0	0	0	111.4	Q705 H708 S725 L746 F749	Q705-L723 HydrophobicContact CG-CD1 4.17Å; H708-L723 HydrophobicContact CB-CD1 3.44Å; H708-L723 VanDerWaalsContact CB-CD1 3.44Å; H708-L723 HydrophobicContact CB-CG 4.38Å; L723-S725 PolarHBondContact O-N 2.68Å; L723-L746 HydrophobicContact CD2-CD2 3.8Å; L723-F749 HydrophobicContact CD2-CB 3.97Å; L723-F749 HydrophobicContact CD2-CD1 3.93Å; L723-F749 HydrophobicContact CD2-CD2 4.29Å; L723-F749 HydrophobicContact CD2-CE1 4.49Å; L723-F749 HydrophobicContact CD2-CG 3.79Å
724	P	81.4	Confident	67.7	Low	7 Å²	7	99.4 Å²	99.4	5%	0.045	52%	0.519	C	S	.	.	P	Polyproline II helix	trans	-53.9	135.6	172.4	-19.2	27.1	0	0	0	111.1	L701 Q705 F738 S742 Q745 L746	L701-P724 HydrophobicContact CD1-CB 4.19Å; L701-P724 HydrophobicContact CD1-CG 4.36Å; Q705-P724 PolarHBondContact NE2-O 2.99Å; P724-F738 HydrophobicContact CB-CZ 4.32Å; P724-S742 WeakPolarHBondContact CB-OG 3.33Å; P724-S742 WeakPolarHBondContact CG-OG 3.45Å; P724-Q745 HydrophobicContact CG-CB 3.9Å; P724-Q745 VanDerWaalsContact CG-OE1 3.29Å; P724-L746 HydrophobicContact CG-CD2 4.45Å; P724-L746 HydrophobicContact CG-CG 4.17Å
725	S	73.3	Confident	68.5	Low	90 Å²	90	98.5 Å²	98.5	63%	0.629	51%	0.508	S	S	*	.			trans	-130.3	140.9	172.7	63.8	0	0	0	0	110.2	L723	L723-S725 PolarHBondContact O-N 2.68Å
726	L	69.1	Low	68.9	Low	84 Å²	84	102 Å²	102	44%	0.44	53%	0.525	S	S	.	.			trans	-79.7	127.6	172.2	-69.5	169.4	0	0	0	108.7	I734 F738	L726-I734 HydrophobicContact CD1-CD1 4.16Å; L726-I734 HydrophobicContact CD1-CG1 4.19Å; L726-I734 HydrophobicContact CD2-CG1 4.07Å; L726-F738 HydrophobicContact CD2-CD1 4.06Å; L726-F738 HydrophobicContact CD2-CD2 4.2Å; L726-F738 HydrophobicContact CD2-CE1 3.56Å; L726-F738 HydrophobicContact CD2-CE2 3.72Å; L726-F738 HydrophobicContact CD2-CG 4.36Å; L726-F738 HydrophobicContact CD2-CZ 3.38Å; L726-F738 HydrophobicContact CG-CE1 4.27Å; L726-F738 HydrophobicContact CG-CE2 4.43Å; L726-F738 HydrophobicContact CG-CZ 3.87Å
727	S	60.6	Low	69.3	Low	55 Å²	55	106.5 Å²	106.5	39%	0.385	54%	0.536	S	S	.	.			trans	-69.5	134.4	175.9	56.1	0	0	0	0	110.3	L729 K732	S727-L729 PolarHBondContact O-N 2.6Å; S727-K732 WeakPolarHBondContact OG-CD 3.34Å
728	K	57.2	Low	70	Confident	218 Å²	218	104.5 Å²	104.5	95%	0.948	52%	0.518	S	S	*	.	S	Bend	trans	-68.9	18.4	-177.8	-60.1	-173.9	178	-176.1	0	115.7
729	L	57.8	Low	70.4	Confident	129 Å²	129	104.4 Å²	104.4	68%	0.675	52%	0.518	S	S	*	.	S	Bend	trans	-95	137.5	-178.9	-72.6	167.8	0	0	0	110.4	S727 F731	S727-L729 PolarHBondContact O-N 2.6Å; L729-F731 PolarHBondContact O-N 3.16Å
730	P	48.6	Very low	70.9	Confident	113 Å²	113	101.5 Å²	101.5	73%	0.734	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	3.8	-162.6	28	-34.8	0	0	0	116.3
731	F	48.8	Very low	71.5	Confident	200 Å²	200	98.8 Å²	98.8	88%	0.877	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122	15.2	-176.9	-62.4	-73.6	0	0	0	114.3	L729	L729-F731 PolarHBondContact O-N 3.16Å
732	K	58.2	Low	72	Confident	162 Å²	162	95.9 Å²	95.9	70%	0.704	48%	0.48	S	S	*	.			trans	-107.6	91.8	172.2	-111.7	177	177.6	175	0	110	S727	S727-K732 WeakPolarHBondContact OG-CD 3.34Å
733	S	64.9	Low	72.7	Confident	88 Å²	88	89.4 Å²	89.4	62%	0.615	45%	0.449	S	S	*	.			trans	-70	154.8	168.4	53.5	0	0	0	0	110.4	D735	S733-D735 VanDerWaalsContact C-N 3.28Å; S733-D735 PolarHBondContact O-N 2.68Å
734	I	74.3	Confident	72.9	Confident	22 Å²	22	92.6 Å²	92.6	11%	0.113	47%	0.47	C	S	.	.			trans	-64.2	92.7	170.1	-62	176.3	0	0	0	107.4	A667 T674 A676 L726 F738 L739	A667-I734 HydrophobicContact CB-CB 4.4Å; A667-I734 HydrophobicContact CB-CG2 3.93Å; T674-I734 WeakPolarHBondContact O-CD1 3.4Å; A676-I734 HydrophobicContact CB-CD1 4.22Å; A676-I734 HydrophobicContact CB-CG2 4.42Å; L726-I734 HydrophobicContact CD1-CD1 4.16Å; L726-I734 HydrophobicContact CD1-CG1 4.19Å; L726-I734 HydrophobicContact CD2-CG1 4.07Å; I734-F738 HydrophobicContact CG2-CD1 4.15Å; I734-L739 HydrophobicContact CG2-CD1 4.02Å; I734-L739 HydrophobicContact CG2-CD2 3.54Å; I734-L739 HydrophobicContact CG2-CG 3.64Å
735	D	77.7	Confident	73.2	Confident	74 Å²	74	95.8 Å²	95.8	40%	0.396	48%	0.484	S	S	.	.			trans	-93.5	162.4	179.3	70	-14.9	0	0	0	110.9	S733 K737 F738 L739	S733-D735 VanDerWaalsContact C-N 3.28Å; S733-D735 PolarHBondContact O-N 2.68Å; D735-K737 PolarHBondContact O-N 2.68Å; D735-K737 VanDerWaalsContact O-N 3.14Å; D735-F738 PolarHBondContact O-N 2.67Å; D735-F738 WeakPolarHBondContact OD1-CB 3.39Å; D735-F738 PolarHBondContact OD1-N 3.41Å; D735-L739 PolarHBondContact O-N 3.23Å
736	Q	80	Confident	74	Confident	118 Å²	118	91.5 Å²	91.5	55%	0.551	45%	0.454	S	S	*	.	H	α-helix	trans	-57.1	-33.5	-179	-166.5	64	23.8	0	0	111.8	L739 E740	Q736-L739 PolarHBondContact O-N 2.89Å; Q736-E740 PolarHBondContact NE2-OE1 3.35Å; Q736-E740 WeakPolarHBondContact O-CG 3.5Å; Q736-E740 PolarHBondContact O-N 3.38Å
737	K	81.9	Confident	74.9	Confident	176 Å²	176	89.2 Å²	89.2	77%	0.765	44%	0.442	S	S	*	.	H	α-helix	trans	-65.3	-40.8	177	-73	-177.2	179	176.8	0	112.3	D735 K741	D735-K737 PolarHBondContact O-N 2.68Å; D735-K737 VanDerWaalsContact O-N 3.14Å; K737-K741 WeakPolarHBondContact O-CB 3.46Å; K737-K741 PolarHBondContact O-N 2.65Å
738	F	84.6	Confident	76.1	Confident	40 Å²	40	89.6 Å²	89.6	18%	0.175	45%	0.448	C	S	.	.	H	α-helix	trans	-65.4	-45.5	173.2	174.2	-93.7	0	0	0	111.5	L701 P724 L726 I734 D735 E740 K741 S742	L701-F738 HydrophobicContact CD2-CE1 4.41Å; L701-F738 HydrophobicContact CD2-CZ 4.08Å; P724-F738 HydrophobicContact CB-CZ 4.32Å; L726-F738 HydrophobicContact CD2-CD1 4.06Å; L726-F738 HydrophobicContact CD2-CD2 4.2Å; L726-F738 HydrophobicContact CD2-CE1 3.56Å; L726-F738 HydrophobicContact CD2-CE2 3.72Å; L726-F738 HydrophobicContact CD2-CG 4.36Å; L726-F738 HydrophobicContact CD2-CZ 3.38Å; L726-F738 HydrophobicContact CG-CE1 4.27Å; L726-F738 HydrophobicContact CG-CE2 4.43Å; L726-F738 HydrophobicContact CG-CZ 3.87Å; I734-F738 HydrophobicContact CG2-CD1 4.15Å; D735-F738 PolarHBondContact O-N 2.67Å; D735-F738 WeakPolarHBondContact OD1-CB 3.39Å; D735-F738 PolarHBondContact OD1-N 3.41Å; F738-E740 PolarHBondContact O-N 3.02Å; F738-K741 PolarHBondContact O-N 3.48Å; F738-S742 WeakPolarHBondContact O-CB 3.38Å; F738-S742 PolarHBondContact O-N 2.98Å
739	L	83.4	Confident	77.6	Confident	4 Å²	4	79.3 Å²	79.3	2%	0.021	40%	0.404	C	S	.	.	H	α-helix	trans	-60.1	-44.5	-179.5	-72.4	175.4	0	0	0	112.2	A665 A667 A676 I734 D735 Q736 S742 K743	A665-L739 HydrophobicContact CB-CB 4.35Å; A667-L739 HydrophobicContact CB-CD1 4.32Å; A676-L739 HydrophobicContact CB-CD2 3.72Å; I734-L739 HydrophobicContact CG2-CD1 4.02Å; I734-L739 HydrophobicContact CG2-CD2 3.54Å; I734-L739 HydrophobicContact CG2-CG 3.64Å; D735-L739 PolarHBondContact O-N 3.23Å; Q736-L739 PolarHBondContact O-N 2.89Å; L739-S742 PolarHBondContact O-N 2.65Å; L739-K743 VanDerWaalsContact O-CB 3.23Å; L739-K743 WeakPolarHBondContact O-CB 3.15Å; L739-K743 PolarHBondContact O-N 2.71Å
740	E	84.4	Confident	78.9	Confident	88 Å²	88	73.2 Å²	73.2	41%	0.411	37%	0.372	S	S	.	.	H	α-helix	trans	-65.5	-42.5	177.6	-70.8	-58.2	154.2	0	0	112.5	Q736 F738 T744	Q736-E740 PolarHBondContact NE2-OE1 3.35Å; Q736-E740 WeakPolarHBondContact O-CG 3.5Å; Q736-E740 PolarHBondContact O-N 3.38Å; F738-E740 PolarHBondContact O-N 3.02Å; E740-T744 PolarHBondContact O-N 3.43Å; E740-T744 VanDerWaalsContact O-N 3.11Å; E740-T744 PolarHBondContact O-OG1 3.41Å
741	K	84.2	Confident	80.7	Confident	138 Å²	138	71.1 Å²	71.1	60%	0.6	35%	0.352	S	S	*	.	H	α-helix	trans	-65	-41.8	176	-172	177.5	-178.7	179.4	0	111.6	K737 F738 T744 Q745	K737-K741 WeakPolarHBondContact O-CB 3.46Å; K737-K741 PolarHBondContact O-N 2.65Å; F738-K741 PolarHBondContact O-N 3.48Å; K741-T744 PolarHBondContact O-N 3.35Å; K741-Q745 WeakPolarHBondContact O-CG 3.19Å; K741-Q745 PolarHBondContact O-N 3.31Å; K741-Q745 VanDerWaalsContact O-N 3.17Å
742	S	86.6	Confident	82.3	Confident	1 Å²	1	68.8 Å²	68.8	1%	0.007	34%	0.338	C	S	.	.	H	α-helix	trans	-66.3	-46.3	179.2	-175.6	0	0	0	0	111.4	Y678 P724 F738 L739 T744 Q745 L746	Y678-S742 WeakPolarHBondContact OH-CB 3.2Å; Y678-S742 PolarHBondContact OH-OG 2.7Å; P724-S742 WeakPolarHBondContact CB-OG 3.33Å; P724-S742 WeakPolarHBondContact CG-OG 3.45Å; F738-S742 WeakPolarHBondContact O-CB 3.38Å; F738-S742 PolarHBondContact O-N 2.98Å; L739-S742 PolarHBondContact O-N 2.65Å; S742-T744 VanDerWaalsContact C-N 3.28Å; S742-T744 PolarHBondContact O-N 2.68Å; S742-Q745 PolarHBondContact O-N 3.03Å; S742-Q745 VanDerWaalsContact O-N 3.16Å; S742-L746 WeakPolarHBondContact O-CB 3.29Å; S742-L746 VanDerWaalsContact O-CG 3.3Å; S742-L746 WeakPolarHBondContact O-CG 3.41Å; S742-L746 PolarHBondContact O-N 2.93Å
743	K	87.3	Confident	83.5	Confident	44 Å²	44	61.1 Å²	61.1	19%	0.191	30%	0.304	C	S	.	.	H	α-helix	trans	-53.4	-45.6	173.8	177.2	178.4	173.7	-179.6	0	111.4	I662 T663 A665 Y678 L739 L746 N747	I662-K743 HydrophobicContact CB-CG 4.29Å; I662-K743 HydrophobicContact CG2-CD 4.35Å; I662-K743 HydrophobicContact CG2-CG 3.92Å; I662-K743 WeakPolarHBondContact O-CE 3.44Å; T663-K743 PolarHBondContact O-NZ 2.82Å; A665-K743 HydrophobicContact CB-CB 4.17Å; A665-K743 HydrophobicContact CB-CD 4.1Å; Y678-K743 HydrophobicContact CE1-CB 4.37Å; L739-K743 VanDerWaalsContact O-CB 3.23Å; L739-K743 WeakPolarHBondContact O-CB 3.15Å; L739-K743 PolarHBondContact O-N 2.71Å; K743-L746 PolarHBondContact O-N 3.46Å; K743-N747 WeakPolarHBondContact O-CB 3.44Å; K743-N747 PolarHBondContact O-N 2.82Å
744	T	87.1	Confident	84.3	Confident	94 Å²	94	57.1 Å²	57.1	58%	0.577	28%	0.276	S	S	*	.	H	α-helix	trans	-63	-44.4	179.3	-52.6	0	0	0	0	112	E740 K741 S742 A748	E740-T744 PolarHBondContact O-N 3.43Å; E740-T744 VanDerWaalsContact O-N 3.11Å; E740-T744 PolarHBondContact O-OG1 3.41Å; K741-T744 PolarHBondContact O-N 3.35Å; S742-T744 VanDerWaalsContact C-N 3.28Å; S742-T744 PolarHBondContact O-N 2.68Å; T744-A748 PolarHBondContact O-N 3.26Å
745	Q	87.9	Confident	84.5	Confident	73 Å²	73	60.6 Å²	60.6	34%	0.341	30%	0.298	S	S	.	.	H	α-helix	trans	-68.2	-40.2	178.6	-70.7	-178.8	-7.9	0	0	112.6	P724 K741 S742 A748 F749	P724-Q745 HydrophobicContact CG-CB 3.9Å; P724-Q745 VanDerWaalsContact CG-OE1 3.29Å; K741-Q745 WeakPolarHBondContact O-CG 3.19Å; K741-Q745 PolarHBondContact O-N 3.31Å; K741-Q745 VanDerWaalsContact O-N 3.17Å; S742-Q745 PolarHBondContact O-N 3.03Å; S742-Q745 VanDerWaalsContact O-N 3.16Å; Q745-A748 PolarHBondContact O-N 3.29Å; Q745-F749 PolarHBondContact O-N 3.24Å
746	L	88.8	Confident	84.3	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-70.5	-35.4	178.7	-67.9	173.1	0	0	0	112.4	I662 Y678 L701 F704 L723 P724 S742 K743 F749 L750	I662-L746 HydrophobicContact CD1-CB 3.39Å; I662-L746 HydrophobicContact CD1-CD1 4.24Å; I662-L746 HydrophobicContact CD1-CG 4.48Å; Y678-L746 HydrophobicContact CD1-CD1 4.26Å; Y678-L746 HydrophobicContact CD2-CD1 3.7Å; Y678-L746 HydrophobicContact CE1-CD1 4.01Å; Y678-L746 HydrophobicContact CE2-CD1 3.4Å; Y678-L746 VanDerWaalsContact CE2-CD1 3.4Å; Y678-L746 HydrophobicContact CG-CD1 4.12Å; L701-L746 HydrophobicContact CD1-CD1 3.9Å; L701-L746 HydrophobicContact CD1-CD2 4.18Å; L701-L746 HydrophobicContact CD1-CG 4.47Å; F704-L746 HydrophobicContact CB-CD2 3.85Å; F704-L746 HydrophobicContact CD1-CD2 3.91Å; F704-L746 HydrophobicContact CD2-CD1 4.32Å; F704-L746 HydrophobicContact CD2-CD2 4.47Å; F704-L746 HydrophobicContact CE2-CD1 4.48Å; F704-L746 HydrophobicContact CG-CD1 4.48Å; F704-L746 HydrophobicContact CG-CD2 3.85Å; L723-L746 HydrophobicContact CD2-CD2 3.8Å; P724-L746 HydrophobicContact CG-CD2 4.45Å; P724-L746 HydrophobicContact CG-CG 4.17Å; S742-L746 WeakPolarHBondContact O-CB 3.29Å; S742-L746 VanDerWaalsContact O-CG 3.3Å; S742-L746 WeakPolarHBondContact O-CG 3.41Å; S742-L746 PolarHBondContact O-N 2.93Å; K743-L746 PolarHBondContact O-N 3.46Å; L746-F749 WeakPolarHBondContact O-CB 3.3Å; L746-F749 PolarHBondContact O-N 3.41Å; L746-L750 PolarHBondContact O-N 3.19Å
747	N	89.4	Confident	83.7	Confident	37 Å²	37	60.1 Å²	60.1	20%	0.198	30%	0.295	C	S	.	.	H	α-helix	trans	-62.5	-45.3	171.5	-89.3	-25.6	0	0	0	111.6	I662 K743 F749 L750 Q751	I662-N747 VanDerWaalsContact CB-OD1 3.29Å; I662-N747 WeakPolarHBondContact CB-OD1 3.19Å; I662-N747 WeakPolarHBondContact CG1-OD1 3.38Å; I662-N747 PolarHBondContact N-OD1 3.3Å; K743-N747 WeakPolarHBondContact O-CB 3.44Å; K743-N747 PolarHBondContact O-N 2.82Å; N747-F749 PolarHBondContact O-N 3.48Å; N747-L750 PolarHBondContact O-N 3.03Å; N747-Q751 WeakPolarHBondContact O-CB 3.37Å; N747-Q751 VanDerWaalsContact O-CG 3.25Å; N747-Q751 WeakPolarHBondContact O-CG 3.46Å; N747-Q751 PolarHBondContact O-N 2.85Å
748	A	85.7	Confident	83.1	Confident	62 Å²	62	59.1 Å²	59.1	51%	0.512	29%	0.286	S	S	.	.	H	α-helix	trans	-60.5	-36.9	174.9	0	0	0	0	0	112	T744 Q745 R752	T744-A748 PolarHBondContact O-N 3.26Å; Q745-A748 PolarHBondContact O-N 3.29Å; A748-R752 WeakPolarHBondContact O-CB 3.37Å; A748-R752 PolarHBondContact O-N 3Å
749	F	87.7	Confident	82.3	Confident	3 Å²	3	57.3 Å²	57.3	1%	0.013	28%	0.278	C	S	.	.	H	α-helix	trans	-64.8	-51.2	175.1	174.9	-118.2	0	0	0	112.6	F704 H708 L721 L723 Q745 L746 N747 Q751 R752 L753	F704-F749 HydrophobicContact CD1-CD1 4.42Å; H708-F749 HydrophobicContact CB-CE1 4.32Å; H708-F749 HydrophobicContact CB-CE2 4.32Å; H708-F749 HydrophobicContact CB-CZ 3.71Å; H708-F749 AromaticContact CD2-CE2 3.5Å; H708-F749 VanDerWaalsContact CD2-CE2 3.5Å; H708-F749 WeakPolarHBondContact CD2-CE2 3.28Å; H708-F749 AromaticContact CD2-CZ 3.81Å; L721-F749 HydrophobicContact CD1-CD2 4.46Å; L723-F749 HydrophobicContact CD2-CB 3.97Å; L723-F749 HydrophobicContact CD2-CD1 3.93Å; L723-F749 HydrophobicContact CD2-CD2 4.29Å; L723-F749 HydrophobicContact CD2-CE1 4.49Å; L723-F749 HydrophobicContact CD2-CG 3.79Å; Q745-F749 PolarHBondContact O-N 3.24Å; L746-F749 WeakPolarHBondContact O-CB 3.3Å; L746-F749 PolarHBondContact O-N 3.41Å; N747-F749 PolarHBondContact O-N 3.48Å; F749-Q751 PolarHBondContact O-N 2.89Å; F749-R752 PolarHBondContact O-N 2.94Å; F749-L753 HydrophobicContact CD1-CD1 4.25Å; F749-L753 HydrophobicContact CD2-CG 4.25Å; F749-L753 HydrophobicContact CE1-CD1 3.64Å; F749-L753 HydrophobicContact CE1-CG 4.38Å; F749-L753 HydrophobicContact CE2-CD1 3.89Å; F749-L753 HydrophobicContact CE2-CD2 3.79Å; F749-L753 HydrophobicContact CE2-CG 3.8Å; F749-L753 HydrophobicContact CZ-CD1 3.44Å; F749-L753 VanDerWaalsContact CZ-CD1 3.44Å; F749-L753 HydrophobicContact CZ-CD2 4.06Å; F749-L753 HydrophobicContact CZ-CG 3.92Å; F749-L753 WeakPolarHBondContact O-CG 3.31Å; F749-L753 PolarHBondContact O-N 2.93Å
750	L	86.4	Confident	81.7	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-60.3	-44	178.7	-75.4	177.4	0	0	0	112.3	A660 I662 V680 F704 L746 N747 R752 L753 L754 F768	A660-L750 HydrophobicContact CB-CD1 4.25Å; I662-L750 HydrophobicContact CD1-CD1 4.23Å; I662-L750 HydrophobicContact CG1-CD1 3.99Å; V680-L750 HydrophobicContact CG1-CD1 3.87Å; F704-L750 HydrophobicContact CE1-CD1 3.89Å; F704-L750 HydrophobicContact CE1-CD2 3.9Å; F704-L750 HydrophobicContact CE1-CG 3.92Å; F704-L750 HydrophobicContact CZ-CD1 4.38Å; L746-L750 PolarHBondContact O-N 3.19Å; N747-L750 PolarHBondContact O-N 3.03Å; L750-R752 VanDerWaalsContact C-N 3.32Å; L750-R752 PolarHBondContact O-N 3.4Å; L750-L753 PolarHBondContact O-N 3.25Å; L750-L754 WeakPolarHBondContact O-CG 3.36Å; L750-L754 PolarHBondContact O-N 2.99Å; L750-F768 HydrophobicContact CD2-CE1 4.37Å
751	Q	85.8	Confident	80.7	Confident	70 Å²	70	59.1 Å²	59.1	33%	0.327	29%	0.287	S	S	.	.	H	α-helix	trans	-60.2	-45	176.3	-69.6	-63.8	-33.3	0	0	110.5	A660 N747 F749 L753 L754 T755	A660-Q751 PolarHBondContact O-NE2 3.37Å; N747-Q751 WeakPolarHBondContact O-CB 3.37Å; N747-Q751 VanDerWaalsContact O-CG 3.25Å; N747-Q751 WeakPolarHBondContact O-CG 3.46Å; N747-Q751 PolarHBondContact O-N 2.85Å; F749-Q751 PolarHBondContact O-N 2.89Å; Q751-L753 VanDerWaalsContact C-N 3.34Å; Q751-L753 PolarHBondContact O-N 3.14Å; Q751-L754 PolarHBondContact O-N 3.49Å; Q751-T755 PolarHBondContact O-N 2.93Å; Q751-T755 PolarHBondContact O-OG1 3.39Å
752	R	82.6	Confident	79.9	Confident	151 Å²	151	53.8 Å²	53.8	57%	0.57	27%	0.268	S	S	*	.	H	α-helix	trans	-63	-37.9	178.5	-171.9	56.9	173.5	153.2	0.6	113.1	L721 A748 F749 L750	L721-R752 HydrophobicContact CD1-CG 4.03Å; A748-R752 WeakPolarHBondContact O-CB 3.37Å; A748-R752 PolarHBondContact O-N 3Å; F749-R752 PolarHBondContact O-N 2.94Å; L750-R752 VanDerWaalsContact C-N 3.32Å; L750-R752 PolarHBondContact O-N 3.4Å
753	L	83.2	Confident	79.1	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-65.1	-45.8	175.5	-68.7	-176.8	0	0	0	111.7	L707 L711 L718 F749 L750 Q751 T755 D756 L759 L765	L707-L753 HydrophobicContact CD2-CD1 4.12Å; L711-L753 HydrophobicContact CD1-CD1 3.83Å; L711-L753 HydrophobicContact CD1-CD2 3.77Å; L711-L753 HydrophobicContact CD1-CG 4.44Å; L718-L753 HydrophobicContact CD1-CD2 3.84Å; L718-L753 HydrophobicContact CD2-CD2 3.96Å; F749-L753 HydrophobicContact CD1-CD1 4.25Å; F749-L753 HydrophobicContact CD2-CG 4.25Å; F749-L753 HydrophobicContact CE1-CD1 3.64Å; F749-L753 HydrophobicContact CE1-CG 4.38Å; F749-L753 HydrophobicContact CE2-CD1 3.89Å; F749-L753 HydrophobicContact CE2-CD2 3.79Å; F749-L753 HydrophobicContact CE2-CG 3.8Å; F749-L753 HydrophobicContact CZ-CD1 3.44Å; F749-L753 VanDerWaalsContact CZ-CD1 3.44Å; F749-L753 HydrophobicContact CZ-CD2 4.06Å; F749-L753 HydrophobicContact CZ-CG 3.92Å; F749-L753 WeakPolarHBondContact O-CG 3.31Å; F749-L753 PolarHBondContact O-N 2.93Å; L750-L753 PolarHBondContact O-N 3.25Å; Q751-L753 VanDerWaalsContact C-N 3.34Å; Q751-L753 PolarHBondContact O-N 3.14Å; L753-T755 VanDerWaalsContact C-N 3.27Å; L753-T755 PolarHBondContact O-N 2.93Å; L753-D756 PolarHBondContact O-N 2.85Å; L753-L759 HydrophobicContact CD2-CD1 3.78Å; L753-L759 WeakPolarHBondContact O-CB 3.22Å; L753-L765 HydrophobicContact CB-CD2 4.42Å; L753-L765 HydrophobicContact CD1-CD1 4.04Å
754	L	81.1	Confident	78.2	Confident	5 Å²	5	59.1 Å²	59.1	3%	0.026	30%	0.299	C	S	.	.	H	α-helix	trans	-78.2	-10.4	-176.1	-68.5	171.8	0	0	0	114	A660 L750 Q751 C760 L765 L769	A660-L754 HydrophobicContact CB-CD1 3.4Å; L750-L754 WeakPolarHBondContact O-CG 3.36Å; L750-L754 PolarHBondContact O-N 2.99Å; Q751-L754 PolarHBondContact O-N 3.49Å; L754-C760 PolarHBondContact O-SG 3.19Å; L754-L765 HydrophobicContact CD2-CD2 4.01Å; L754-L769 HydrophobicContact CD1-CD1 4.39Å; L754-L769 HydrophobicContact CD2-CD1 4Å
755	T	78.9	Confident	77.7	Confident	95 Å²	95	54.7 Å²	54.7	58%	0.583	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-18.2	173.1	-42.9	0	0	0	0	112.4	Q751 L753	Q751-T755 PolarHBondContact O-N 2.93Å; Q751-T755 PolarHBondContact O-OG1 3.39Å; L753-T755 VanDerWaalsContact C-N 3.27Å; L753-T755 PolarHBondContact O-N 2.93Å
756	D	72.5	Confident	77.2	Confident	38 Å²	38	52.5 Å²	52.5	20%	0.203	26%	0.26	C	S	.	.	S	Bend	trans	-97	109.1	176	-168.7	-34.7	0	0	0	109.4	L753 R758 L759 C760	L753-D756 PolarHBondContact O-N 2.85Å; D756-R758 PolarHBondContact O-N 2.86Å; D756-R758 VanDerWaalsContact O-N 3.08Å; D756-R758 WeakPolarHBondContact OD1-CB 3.04Å; D756-R758 IonicContact OD1-CZ 2.64Å; D756-R758 PolarHBondContact OD1-N 3.49Å; D756-R758 VanDerWaalsContact OD1-N 3.12Å; D756-R758 IonicContact OD1-NE 3.87Å; D756-R758 PolarHBondContact OD1-NE 3.16Å; D756-R758 VanDerWaalsContact OD1-NE 3.09Å; D756-R758 IonicContact OD1-NH2 3.73Å; D756-R758 IonicContact OD2-CZ 3.07Å; D756-R758 IonicContact OD2-NE 3.11Å; D756-R758 IonicContact OD2-NH2 3.85Å; D756-R758 PolarHBondContact OD2-NH2 3.47Å; D756-L759 HydrophobicContact CB-CB 4.28Å; D756-L759 HydrophobicContact CB-CD1 3.92Å; D756-L759 HydrophobicContact CB-CG 4.13Å; D756-L759 WeakPolarHBondContact O-CB 3.39Å; D756-L759 PolarHBondContact O-N 2.67Å; D756-C760 PolarHBondContact O-N 2.81Å
757	E	68	Low	76.4	Confident	143 Å²	143	54.3 Å²	54.3	67%	0.668	28%	0.275	S	S	*	.	H	α-helix	trans	-54.9	-30.9	-177.2	-68.8	-177.7	165.6	0	0	113.4	L759 C760 Q761	E757-L759 VanDerWaalsContact C-N 3.32Å; E757-L759 PolarHBondContact O-N 3.1Å; E757-C760 WeakPolarHBondContact O-CB 3.37Å; E757-C760 PolarHBondContact O-N 3.18Å; E757-Q761 PolarHBondContact O-N 2.76Å
758	R	69.3	Low	76.1	Confident	155 Å²	155	53.4 Å²	53.4	59%	0.585	27%	0.27	S	S	*	.	H	α-helix	trans	-71.8	-30	179	-57.9	171.3	-62.8	176.7	2.9	111.9	F715 D756	F715-R758 HydrophobicContact CE1-CB 4.45Å; D756-R758 PolarHBondContact O-N 2.86Å; D756-R758 VanDerWaalsContact O-N 3.08Å; D756-R758 WeakPolarHBondContact OD1-CB 3.04Å; D756-R758 IonicContact OD1-CZ 2.64Å; D756-R758 PolarHBondContact OD1-N 3.49Å; D756-R758 VanDerWaalsContact OD1-N 3.12Å; D756-R758 IonicContact OD1-NE 3.87Å; D756-R758 PolarHBondContact OD1-NE 3.16Å; D756-R758 VanDerWaalsContact OD1-NE 3.09Å; D756-R758 IonicContact OD1-NH2 3.73Å; D756-R758 IonicContact OD2-CZ 3.07Å; D756-R758 IonicContact OD2-NE 3.11Å; D756-R758 IonicContact OD2-NH2 3.85Å; D756-R758 PolarHBondContact OD2-NH2 3.47Å
759	L	68.6	Low	75.9	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-76.1	-31.8	174.6	-70.9	174.8	0	0	0	111.3	L711 F715 L718 L753 D756 E757 Q761 S762 L765	L711-L759 HydrophobicContact CD2-CD2 4.32Å; F715-L759 HydrophobicContact CB-CD2 4.35Å; F715-L759 HydrophobicContact CD1-CD2 4.04Å; F715-L759 HydrophobicContact CD2-CD2 3.28Å; F715-L759 HydrophobicContact CE1-CD2 4.12Å; F715-L759 HydrophobicContact CE2-CD2 3.41Å; F715-L759 VanDerWaalsContact CE2-CD2 3.41Å; F715-L759 HydrophobicContact CG-CD2 3.62Å; F715-L759 HydrophobicContact CZ-CD2 3.83Å; L718-L759 HydrophobicContact CD1-CD1 4.29Å; L718-L759 HydrophobicContact CD1-CD2 4.49Å; L718-L759 HydrophobicContact CD2-CD1 4.42Å; L753-L759 HydrophobicContact CD2-CD1 3.78Å; L753-L759 WeakPolarHBondContact O-CB 3.22Å; D756-L759 HydrophobicContact CB-CB 4.28Å; D756-L759 HydrophobicContact CB-CD1 3.92Å; D756-L759 HydrophobicContact CB-CG 4.13Å; D756-L759 WeakPolarHBondContact O-CB 3.39Å; D756-L759 PolarHBondContact O-N 2.67Å; E757-L759 VanDerWaalsContact C-N 3.32Å; E757-L759 PolarHBondContact O-N 3.1Å; L759-Q761 PolarHBondContact O-N 3.32Å; L759-S762 WeakPolarHBondContact O-CB 3.28Å; L759-S762 PolarHBondContact O-N 3.38Å; L759-L765 VanDerWaalsContact O-CD2 3.28Å; L759-L765 WeakPolarHBondContact O-CD2 3.44Å
760	C	69.6	Low	75.4	Confident	6 Å²	6	50.6 Å²	50.6	4%	0.041	25%	0.247	C	C	.	.	H	α-helix	trans	-63.5	-25	174.8	-65.8	0	0	0	0	113.5	L754 D756 E757 S762	L754-C760 PolarHBondContact O-SG 3.19Å; D756-C760 PolarHBondContact O-N 2.81Å; E757-C760 WeakPolarHBondContact O-CB 3.37Å; E757-C760 PolarHBondContact O-N 3.18Å; C760-S762 VanDerWaalsContact C-N 3.27Å
761	Q	63.8	Low	74.5	Confident	125 Å²	125	53.6 Å²	53.6	58%	0.584	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-4.7	172.4	-64	177.2	9.8	0	0	113.2	L655 E757 L759 E763	L655-Q761 HydrophobicContact CD1-CG 4.42Å; E757-Q761 PolarHBondContact O-N 2.76Å; L759-Q761 PolarHBondContact O-N 3.32Å; Q761-E763 PolarHBondContact O-N 3.03Å
762	S	68.6	Low	73.3	Confident	26 Å²	26	51.3 Å²	51.3	18%	0.182	26%	0.258	C	S	.	.			trans	-72.2	122.1	-179.6	-177.7	0	0	0	0	111.2	L711 L759 C760 A764 L765 Y766	L711-S762 WeakPolarHBondContact CD2-OG 3.49Å; L759-S762 WeakPolarHBondContact O-CB 3.28Å; L759-S762 PolarHBondContact O-N 3.38Å; C760-S762 VanDerWaalsContact C-N 3.27Å; S762-A764 PolarHBondContact O-N 3.12Å; S762-A764 PolarHBondContact OG-N 3.07Å; S762-L765 WeakPolarHBondContact O-CB 3.21Å; S762-L765 PolarHBondContact O-N 3.33Å; S762-Y766 PolarHBondContact O-N 2.95Å
763	E	68.6	Low	71.9	Confident	122 Å²	122	46.8 Å²	46.8	57%	0.57	25%	0.248	S	C	*	.	H	α-helix	trans	-53.9	-40.7	172.7	-171.4	-163.3	156.3	0	0	111.7	Q761 L765 Y766 A767	Q761-E763 PolarHBondContact O-N 3.03Å; E763-L765 VanDerWaalsContact C-N 3.25Å; E763-L765 PolarHBondContact O-N 2.96Å; E763-Y766 PolarHBondContact O-N 3.32Å; E763-A767 VanDerWaalsContact O-CB 3.31Å; E763-A767 WeakPolarHBondContact O-CB 3.33Å; E763-A767 PolarHBondContact O-N 3.36Å
764	A	69.8	Low	70.3	Confident	35 Å²	35	54.6 Å²	54.6	29%	0.289	29%	0.285	S	S	.	.	H	α-helix	trans	-63.6	-32.6	179.5	0	0	0	0	0	112.4	L707 L711 S762 F768	L707-A764 HydrophobicContact CD1-CB 4.35Å; L707-A764 WeakPolarHBondContact CD1-O 3.45Å; L711-A764 HydrophobicContact CD2-CB 4.42Å; S762-A764 PolarHBondContact O-N 3.12Å; S762-A764 PolarHBondContact OG-N 3.07Å; A764-F768 WeakPolarHBondContact O-CB 3.42Å; A764-F768 PolarHBondContact O-N 3.26Å
765	L	74.9	Confident	69.1	Low	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-76.3	-43.4	175.8	-175.7	59	0	0	0	111.2	L707 L753 L754 L759 S762 E763 F768 L769	L707-L765 HydrophobicContact CD2-CD1 4.06Å; L753-L765 HydrophobicContact CB-CD2 4.42Å; L753-L765 HydrophobicContact CD1-CD1 4.04Å; L754-L765 HydrophobicContact CD2-CD2 4.01Å; L759-L765 VanDerWaalsContact O-CD2 3.28Å; L759-L765 WeakPolarHBondContact O-CD2 3.44Å; S762-L765 WeakPolarHBondContact O-CB 3.21Å; S762-L765 PolarHBondContact O-N 3.33Å; E763-L765 VanDerWaalsContact C-N 3.25Å; E763-L765 PolarHBondContact O-N 2.96Å; L765-F768 PolarHBondContact O-N 3.47Å; L765-L769 HydrophobicContact CD1-CD1 3.93Å; L765-L769 HydrophobicContact CD1-CG 4.29Å; L765-L769 HydrophobicContact CG-CD1 4.14Å; L765-L769 PolarHBondContact O-N 3.05Å
766	Y	77.3	Confident	67.7	Low	27 Å²	27	58.3 Å²	58.3	11%	0.106	29%	0.292	C	S	.	.	H	α-helix	trans	-60.3	-49.5	175.3	174.9	-120.5	0	0	0	111.9	T648 W651 S762 E763 F768 L769 S770	T648-Y766 HydrophobicContact CG2-CE1 4.48Å; W651-Y766 HydrophobicContact CB-CD2 4.22Å; W651-Y766 HydrophobicContact CB-CE2 3.55Å; W651-Y766 AromaticContact CD1-CD2 3.54Å; W651-Y766 AromaticContact CD1-CE2 3.74Å; W651-Y766 AromaticContact CD2-CD2 3.17Å; W651-Y766 HydrophobicContact CD2-CD2 3.17Å; W651-Y766 AromaticContact CD2-CE2 3.35Å; W651-Y766 HydrophobicContact CD2-CE2 3.35Å; W651-Y766 HydrophobicContact CD2-CG 4.28Å; W651-Y766 AromaticContact CE2-CD2 3.22Å; W651-Y766 AromaticContact CE2-CE2 3.93Å; W651-Y766 AromaticContact CE2-CG 3.99Å; W651-Y766 AromaticContact CE3-CD2 3.68Å; W651-Y766 HydrophobicContact CE3-CD2 3.68Å; W651-Y766 AromaticContact CE3-CE2 3.72Å; W651-Y766 HydrophobicContact CE3-CE2 3.72Å; W651-Y766 AromaticContact CG-CD2 3.4Å; W651-Y766 HydrophobicContact CG-CD2 3.4Å; W651-Y766 AromaticContact CG-CE2 3.24Å; W651-Y766 HydrophobicContact CG-CE2 3.24Å; W651-Y766 HydrophobicContact CG-CG 4.35Å; W651-Y766 HydrophobicContact CH2-CD2 4.22Å; W651-Y766 AromaticContact CZ2-CD2 3.77Å; W651-Y766 HydrophobicContact CZ2-CD2 3.77Å; W651-Y766 HydrophobicContact CZ2-CG 4.46Å; W651-Y766 HydrophobicContact CZ3-CD2 4.18Å; W651-Y766 AromaticContact NE1-CD2 3.45Å; W651-Y766 AromaticContact NE1-CG 3.87Å; S762-Y766 PolarHBondContact O-N 2.95Å; E763-Y766 PolarHBondContact O-N 3.32Å; Y766-F768 PolarHBondContact O-N 2.71Å; Y766-L769 CarbonylContact O-C 3.59Å; Y766-L769 PolarHBondContact O-N 3.33Å; Y766-S770 WeakPolarHBondContact O-CB 3.35Å; Y766-S770 PolarHBondContact O-N 3.5Å
767	A	72.5	Confident	66.8	Low	38 Å²	38	61.6 Å²	61.6	31%	0.314	30%	0.304	S	S	.	.	H	α-helix	trans	-62	-29.7	178.3	0	0	0	0	0	112.7	E763	E763-A767 VanDerWaalsContact O-CB 3.31Å; E763-A767 WeakPolarHBondContact O-CB 3.33Å; E763-A767 PolarHBondContact O-N 3.36Å
768	F	82.8	Confident	65.5	Low	18 Å²	18	60.8 Å²	60.8	8%	0.079	31%	0.309	C	S	.	.	H	α-helix	trans	-73.2	-37.3	173.7	-178.7	-94	0	0	0	112.1	R699 E703 F704 L707 L750 A764 L765 Y766	R699-F768 HydrophobicContact CB-CE2 4.21Å; R699-F768 HydrophobicContact CB-CZ 3.81Å; R699-F768 HydrophobicContact CG-CE1 4.04Å; R699-F768 HydrophobicContact CG-CE2 3.89Å; R699-F768 HydrophobicContact CG-CZ 3.58Å; R699-F768 PolarHBondContact NE-O 3.05Å; R699-F768 PolarHBondContact NH2-O 2.77Å; E703-F768 HydrophobicContact CB-CE2 3.86Å; F704-F768 HydrophobicContact CD1-CE1 4.15Å; F704-F768 AromaticContact CD1-CZ 3.69Å; F704-F768 HydrophobicContact CD1-CZ 3.69Å; F704-F768 AromaticContact CD2-CZ 3.99Å; F704-F768 HydrophobicContact CD2-CZ 3.99Å; F704-F768 AromaticContact CE1-CE1 3.82Å; F704-F768 HydrophobicContact CE1-CE1 3.82Å; F704-F768 AromaticContact CE1-CZ 3.64Å; F704-F768 HydrophobicContact CE1-CZ 3.64Å; F704-F768 AromaticContact CE2-CZ 3.92Å; F704-F768 HydrophobicContact CE2-CZ 3.92Å; F704-F768 AromaticContact CG-CZ 3.88Å; F704-F768 HydrophobicContact CG-CZ 3.88Å; F704-F768 HydrophobicContact CZ-CE1 4.12Å; F704-F768 AromaticContact CZ-CZ 3.76Å; F704-F768 HydrophobicContact CZ-CZ 3.76Å; L707-F768 HydrophobicContact CB-CD2 4.3Å; L707-F768 HydrophobicContact CD1-CB 4.18Å; L707-F768 HydrophobicContact CD2-CB 4.12Å; L707-F768 HydrophobicContact CD2-CD1 3.65Å; L707-F768 HydrophobicContact CD2-CD2 4.07Å; L707-F768 HydrophobicContact CD2-CE1 4.03Å; L707-F768 HydrophobicContact CD2-CE2 4.4Å; L707-F768 HydrophobicContact CD2-CG 3.68Å; L707-F768 HydrophobicContact CD2-CZ 4.38Å; L707-F768 HydrophobicContact CG-CG 4.5Å; L750-F768 HydrophobicContact CD2-CE1 4.37Å; A764-F768 WeakPolarHBondContact O-CB 3.42Å; A764-F768 PolarHBondContact O-N 3.26Å; L765-F768 PolarHBondContact O-N 3.47Å; Y766-F768 PolarHBondContact O-N 2.71Å
769	L	81.8	Confident	63.7	Low	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-90.2	-15.8	-177.5	-66.2	177	0	0	0	113.9	W651 A660 V680 V682 W695 L754 L765 Y766	W651-L769 HydrophobicContact CH2-CB 4.24Å; W651-L769 HydrophobicContact CH2-CD1 4.07Å; A660-L769 HydrophobicContact CB-CD2 4.18Å; V680-L769 HydrophobicContact CG1-CD2 4.05Å; V682-L769 HydrophobicContact CG2-CB 4.12Å; V682-L769 HydrophobicContact CG2-CD2 3.93Å; V682-L769 HydrophobicContact CG2-CG 4.46Å; W695-L769 PolarHBondContact NE1-O 2.93Å; L754-L769 HydrophobicContact CD1-CD1 4.39Å; L754-L769 HydrophobicContact CD2-CD1 4Å; L765-L769 HydrophobicContact CD1-CD1 3.93Å; L765-L769 HydrophobicContact CD1-CG 4.29Å; L765-L769 HydrophobicContact CG-CD1 4.14Å; L765-L769 PolarHBondContact O-N 3.05Å; Y766-L769 CarbonylContact O-C 3.59Å; Y766-L769 PolarHBondContact O-N 3.33Å
770	S	77.1	Confident	62	Low	6 Å²	6	68 Å²	68	4%	0.042	36%	0.364	C	S	.	.	S	Bend	trans	-95	145.3	-176.6	-177.4	0	0	0	0	114.1	R699 Y766 S772	R699-S770 PolarHBondContact NH2-O 2.09Å; Y766-S770 WeakPolarHBondContact O-CB 3.35Å; Y766-S770 PolarHBondContact O-N 3.5Å; S770-S772 PolarHBondContact O-N 2.93Å
771	P	68.8	Low	60.1	Low	64 Å²	64	74.7 Å²	74.7	42%	0.416	40%	0.404	S	S	.	.			trans	-82	91.5	170.3	31.7	-31	0	0	0	110.9	V697	V697-P771 HydrophobicContact CG1-CB 4.34Å
772	S	59.6	Low	58.6	Low	22 Å²	22	78.1 Å²	78.1	15%	0.154	42%	0.42	C	S	.	.			trans	-114.9	137.4	175.4	-68.3	0	0	0	0	112.8	S770	S770-S772 PolarHBondContact O-N 2.93Å
773	P	54.4	Low	56.8	Low	55 Å²	55	86.8 Å²	86.8	36%	0.357	46%	0.455	S	S	.	.			trans	-58.3	144.5	175.8	-21.1	30.9	0	0	0	113	Y775 L776	P773-Y775 HydrophobicContact CB-CD1 3.7Å; P773-Y775 HydrophobicContact CB-CE1 3.39Å; P773-Y775 HydrophobicContact CG-CE1 4.05Å; P773-Y775 PolarHBondContact O-N 2.98Å; P773-Y775 VanDerWaalsContact O-N 3.1Å; P773-L776 PolarHBondContact O-N 3.41Å
774	E	48.8	Very low	55.1	Low	164 Å²	164	90.7 Å²	90.7	77%	0.766	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-55.7	-31.9	-174.3	-92.7	100	-161.6	0	0	114.7	L776 K777	E774-L776 PolarHBondContact O-N 3.37Å; E774-K777 PolarHBondContact O-N 3.1Å
775	Y	55.7	Low	53.2	Low	136 Å²	136	94.3 Å²	94.3	53%	0.533	49%	0.493	S	S	.	.	G	3₁₀ helix	trans	-72	-9	-173.3	68.7	-93.4	0	0	0	114.6	P773	P773-Y775 HydrophobicContact CB-CD1 3.7Å; P773-Y775 HydrophobicContact CB-CE1 3.39Å; P773-Y775 HydrophobicContact CG-CE1 4.05Å; P773-Y775 PolarHBondContact O-N 2.98Å; P773-Y775 VanDerWaalsContact O-N 3.1Å
776	L	50.7	Low	51.1	Low	43 Å²	43	99.7 Å²	99.7	23%	0.225	53%	0.531	C	S	.	.	G	3₁₀ helix	trans	-98.3	2.8	178.2	-68	171.6	0	0	0	113.9	P773 E774	P773-L776 PolarHBondContact O-N 3.41Å; E774-L776 PolarHBondContact O-N 3.37Å
777	K	52.5	Low	48.9	Very low	107 Å²	107	106.4 Å²	106.4	47%	0.465	56%	0.561	S	S	.	*	S	Bend	trans	-101.8	8.7	-169.6	-70	-178	179.5	172.5	0	117.2	E774	E774-K777 PolarHBondContact O-N 3.1Å
778	V	41.2	Very low	46.9	Very low	126 Å²	126	107.9 Å²	107.9	76%	0.764	57%	0.569	S	S	*	*			trans	-127.7	84.5	-168	-172.2	0	0	0	0	113.5
779	M	31.8	Very low	44.5	Very low	192 Å²	192	113.5 Å²	113.5	95%	0.946	60%	0.599	S	S	*	*			trans	-156.2	93.1	156.4	-69.8	-163.9	69.5	0	0	112.7
780	S	31.6	Very low	42.1	Very low	117 Å²	117	116.4 Å²	116.4	82%	0.818	62%	0.623	S	S	*	*			trans	-159.8	144.3	145.4	54.3	0	0	0	0	110.9
781	V	31.2	Very low	40.1	Very low	145 Å²	145	118.1 Å²	118.1	88%	0.879	64%	0.635	S	S	*	*			trans	113.9	87.2	172.9	-172.4	0	0	0	0	114.2
782	Q	31.8	Very low	38.6	Very low	198 Å²	198	121.5 Å²	121.5	93%	0.925	64%	0.643	S	S	*	*			trans	-115.5	143	148.6	-90.5	-172.6	-20.9	0	0	108.5
783	K	29.8	Very low	37.5	Very low	207 Å²	207	126.6 Å²	126.6	90%	0.9	67%	0.668	S	S	*	*			trans	-140.6	125.5	165.8	-113.7	-176	179.9	179.5	0	111.9
784	K	33.1	Very low	36.7	Very low	204 Å²	204	131.9 Å²	131.9	89%	0.887	69%	0.688	S	S	*	*			trans	-77.6	162.7	151.4	-63	175.8	175.6	176.2	0	107.4
785	S	30.6	Very low	36.3	Very low	111 Å²	111	132.7 Å²	132.7	78%	0.776	68%	0.684	S	S	*	*			cis	-169.6	179.1	30.2	73.5	0	0	0	0	111.1
786	S	29.6	Very low	35.3	Very low	113 Å²	113	130.3 Å²	130.3	79%	0.79	68%	0.68	S	S	*	*			trans	121.4	121.8	145.4	80	0	0	0	0	117
787	F	31.6	Very low	34.4	Very low	168 Å²	168	132.1 Å²	132.1	74%	0.737	70%	0.695	S	S	*	*			trans	-98.8	127	166.2	-178.5	-97	0	0	0	107.1
788	S	31	Very low	33.4	Very low	70 Å²	70	129.7 Å²	129.7	49%	0.49	70%	0.7	S	S	.	*			trans	-116	126.8	179.6	174.7	0	0	0	0	110.2	A790 S791	S788-A790 PolarHBondContact O-N 3.45Å; S788-A790 VanDerWaalsContact O-N 3.15Å; S788-A790 PolarHBondContact OG-N 2.96Å; S788-S791 PolarHBondContact O-N 2.92Å; S788-S791 VanDerWaalsContact O-N 3.12Å; S788-S791 PolarHBondContact O-OG 3.4Å
789	L	31.5	Very low	33.2	Very low	136 Å²	136	130.7 Å²	130.7	71%	0.712	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	-17.6	177.7	-80.9	161.3	0	0	0	113.8	S791 F792	L789-S791 PolarHBondContact O-N 3.5Å; L789-F792 PolarHBondContact O-N 3.45Å
790	A	32.4	Very low	33.2	Very low	60 Å²	60	129.1 Å²	129.1	50%	0.496	69%	0.689	S	S	.	*	H	α-helix	trans	-61.3	-32.9	173.3	0	0	0	0	0	112.5	S788 F792 L793 E794	S788-A790 PolarHBondContact O-N 3.45Å; S788-A790 VanDerWaalsContact O-N 3.15Å; S788-A790 PolarHBondContact OG-N 2.96Å; A790-F792 VanDerWaalsContact C-N 3.27Å; A790-F792 PolarHBondContact O-N 3.01Å; A790-L793 PolarHBondContact O-N 2.99Å; A790-E794 PolarHBondContact O-N 3.3Å
791	S	35	Very low	33.3	Very low	42 Å²	42	128.6 Å²	128.6	29%	0.294	67%	0.672	S	S	.	*	H	α-helix	trans	-77	-7.8	-178.1	69.4	0	0	0	0	115.1	S788 L789 R795	S788-S791 PolarHBondContact O-N 2.92Å; S788-S791 VanDerWaalsContact O-N 3.12Å; S788-S791 PolarHBondContact O-OG 3.4Å; L789-S791 PolarHBondContact O-N 3.5Å; S791-R795 PolarHBondContact O-NH1 2.63Å
792	F	36.8	Very low	33.5	Very low	136 Å²	136	125.4 Å²	125.4	60%	0.596	66%	0.656	S	S	*	*	H	α-helix	trans	-90.5	-35.2	175	-173.7	-100.5	0	0	0	111.4	L789 A790 R795	L789-F792 PolarHBondContact O-N 3.45Å; A790-F792 VanDerWaalsContact C-N 3.27Å; A790-F792 PolarHBondContact O-N 3.01Å; F792-R795 PolarHBondContact O-N 3.4Å
793	L	36.4	Very low	33.5	Very low	129 Å²	129	125 Å²	125	68%	0.675	65%	0.654	S	S	*	*	H	α-helix	trans	-73.3	-28.9	178.1	-67	173.3	0	0	0	112.5	A790 R795	A790-L793 PolarHBondContact O-N 2.99Å; L793-R795 PolarHBondContact O-N 3.32Å
794	E	38.6	Very low	33.6	Very low	166 Å²	166	121 Å²	121	78%	0.776	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-5.2	173.5	-74.7	179.2	159.3	0	0	114.4	A790	A790-E794 PolarHBondContact O-N 3.3Å
795	R	38.8	Very low	33.4	Very low	180 Å²	180	118.8 Å²	118.8	68%	0.679	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	2.2	-175.4	-83.1	-175.2	170.4	114	-0.4	115.3	S791 F792 L793	S791-R795 PolarHBondContact O-NH1 2.63Å; F792-R795 PolarHBondContact O-N 3.4Å; L793-R795 PolarHBondContact O-N 3.32Å
796	L	34.3	Very low	33.4	Very low	86 Å²	86	122.9 Å²	122.9	45%	0.45	65%	0.647	S	S	.	*	S	Bend	trans	-82.3	135.3	173.7	-68.7	169.6	0	0	0	110	G798	L796-G798 PolarHBondContact O-N 3.42Å
797	P	32.9	Very low	33.7	Very low	82 Å²	82	125.5 Å²	125.5	53%	0.532	65%	0.651	S	S	.	*			trans	-62.5	134	178	22.7	-29.8	0	0	0	110.9	D799	P797-D799 PolarHBondContact O-N 3.46Å; P797-D799 VanDerWaalsContact O-N 3.1Å
798	G	31.9	Very low	33.6	Very low	55 Å²	55	120.9 Å²	120.9	57%	0.567	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-62.6	-15	-173	0	0	0	0	0	115.6	L796 F800 F801	L796-G798 PolarHBondContact O-N 3.42Å; G798-F800 PolarHBondContact O-N 3.03Å; G798-F800 VanDerWaalsContact O-N 3.15Å; G798-F801 PolarHBondContact O-N 3.48Å
799	D	35.6	Very low	34.1	Very low	147 Å²	147	125.6 Å²	125.6	79%	0.786	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-73.3	-3.4	-176.7	-60.5	-13.9	0	0	0	113.8	P797	P797-D799 PolarHBondContact O-N 3.46Å; P797-D799 VanDerWaalsContact O-N 3.1Å
800	F	31.7	Very low	34.1	Very low	160 Å²	160	126.9 Å²	126.9	70%	0.702	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-81.6	-12.3	172.3	-103.6	-90.9	0	0	0	113.9	G798	G798-F800 PolarHBondContact O-N 3.03Å; G798-F800 VanDerWaalsContact O-N 3.15Å
801	F	35.5	Very low	34.5	Very low	106 Å²	106	131 Å²	131	47%	0.465	69%	0.693	S	S	.	*	S	Bend	trans	-111.5	9.9	-169.2	-64.5	-74.5	0	0	0	114.8	G798 W848	G798-F801 PolarHBondContact O-N 3.48Å; F801-W848 AromaticContact CD1-CH2 3.64Å; F801-W848 HydrophobicContact CD1-CH2 3.64Å; F801-W848 AromaticContact CD1-CZ2 3.95Å; F801-W848 HydrophobicContact CD1-CZ2 3.95Å; F801-W848 AromaticContact CE1-CH2 3.52Å; F801-W848 HydrophobicContact CE1-CH2 3.52Å; F801-W848 HydrophobicContact CE1-CZ2 4.14Å; F801-W848 HydrophobicContact CE1-CZ3 4.36Å
802	S	34.3	Very low	34.6	Very low	77 Å²	77	134.4 Å²	134.4	54%	0.538	72%	0.716	S	S	.	*			trans	-95.5	17.6	-172.8	64.9	0	0	0	0	116.4
803	H	31	Very low	34.6	Very low	191 Å²	191	134.8 Å²	134.8	88%	0.884	72%	0.724	S	S	*	*			trans	-109.2	81.5	164.2	-71.9	-61.1	0	0	0	109.3
804	T	33.1	Very low	34.4	Very low	122 Å²	122	137 Å²	137	75%	0.748	74%	0.736	S	S	*	*			trans	-57.2	143.4	173.1	-42	0	0	0	0	111.1
805	E	29.6	Very low	34.4	Very low	157 Å²	157	133.8 Å²	133.8	73%	0.734	73%	0.732	S	S	*	*			trans	-35.9	133.9	160.2	-58.2	169.2	160.1	0	0	113.4
806	E	30	Very low	34.5	Very low	198 Å²	198	132 Å²	132	93%	0.925	74%	0.736	S	S	*	*			trans	-130.2	112.1	138.9	-83.4	-171.2	158.5	0	0	107.4
807	D	34.8	Very low	34.4	Very low	167 Å²	167	139.3 Å²	139.3	89%	0.893	76%	0.759	S	S	*	*			trans	-69.4	134.1	162.7	-85.2	-37.2	0	0	0	108.7
808	G	30.5	Very low	34.2	Very low	71 Å²	71	138.5 Å²	138.5	73%	0.732	77%	0.765	S	S	*	*			trans	175.2	111.3	169.1	0	0	0	0	0	110.4	D810	G808-D810 PolarHBondContact O-N 2.99Å
809	D	40.9	Very low	34.4	Very low	170 Å²	170	143 Å²	143	91%	0.909	78%	0.777	S	S	*	*			trans	-46.1	122.3	165.8	-69.4	-46	0	0	0	110.7
810	D	33	Very low	34.2	Very low	162 Å²	162	144.4 Å²	144.4	87%	0.866	78%	0.778	S	S	*	*			trans	-167.5	145.7	133.7	-125.4	-19.9	0	0	0	111.4	G808	G808-D810 PolarHBondContact O-N 2.99Å
811	D	40.3	Very low	34.3	Very low	148 Å²	148	140.1 Å²	140.1	79%	0.791	77%	0.773	S	S	*	*			trans	-62.3	162.6	170.4	-88.6	-45.9	0	0	0	111.9
812	S	35.8	Very low	34.4	Very low	112 Å²	112	141.3 Å²	141.3	78%	0.783	78%	0.784	S	S	*	*			trans	89.8	128.7	155.9	77.8	0	0	0	0	120
813	D	38.6	Very low	34.6	Very low	145 Å²	145	140 Å²	140	78%	0.775	78%	0.782	S	S	*	*			trans	46.8	109.6	155.2	-84.1	-16.1	0	0	0	119.6
814	L	30.8	Very low	35.2	Very low	175 Å²	175	141.8 Å²	141.8	92%	0.916	78%	0.781	S	S	*	*			trans	-151.2	83.2	136.3	-101.7	165.7	0	0	0	109.5
815	S	39.1	Very low	35.6	Very low	98 Å²	98	146.3 Å²	146.3	69%	0.685	79%	0.785	S	S	*	*			trans	-63.8	150.5	147.4	55.2	0	0	0	0	110
816	D	40.2	Very low	36.6	Very low	143 Å²	143	142.1 Å²	142.1	77%	0.765	77%	0.768	S	S	*	*			trans	99.2	79.5	168.7	-155.4	23.9	0	0	0	115.9
817	Y	32.2	Very low	38.1	Very low	239 Å²	239	133.6 Å²	133.6	94%	0.937	73%	0.731	S	S	*	*	S	Bend	trans	-150	114.5	131.1	-103	-79.7	0	0	0	108.9
818	G	28.9	Very low	39.6	Very low	65 Å²	65	126.4 Å²	126.4	67%	0.67	69%	0.692	S	S	*	*			trans	71.2	97.3	143.6	0	0	0	0	0	117.4	E820	G818-E820 PolarHBondContact O-N 3.46Å
819	D	36.2	Very low	41.2	Very low	151 Å²	151	123.1 Å²	123.1	81%	0.807	66%	0.658	S	S	*	*			trans	-44.1	97.9	158.3	-172.3	19.3	0	0	0	113.2
820	E	32.9	Very low	42.6	Very low	175 Å²	175	120 Å²	120	82%	0.818	64%	0.638	S	S	*	*			trans	-129	71.3	150.5	-76.6	-143.6	173.3	0	0	109	G818 D822	G818-E820 PolarHBondContact O-N 3.46Å; E820-D822 PolarHBondContact O-N 3.25Å
821	A	33	Very low	44.3	Very low	71 Å²	71	113.2 Å²	113.2	59%	0.587	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	-4	180	0	0	0	0	0	115.2
822	D	37.6	Very low	45.7	Very low	130 Å²	130	106.6 Å²	106.6	70%	0.695	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	-15.6	-175	-141.9	10.3	0	0	0	114.2	E820 N826	E820-D822 PolarHBondContact O-N 3.25Å; D822-N826 PolarHBondContact O-ND2 2.88Å; D822-N826 VanDerWaalsContact O-ND2 3.12Å
823	G	39.5	Very low	47.3	Very low	49 Å²	49	103.1 Å²	103.1	51%	0.505	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-33.5	178.7	0	0	0	0	0	114.3	N826	G823-N826 PolarHBondContact O-N 2.98Å
824	R	42	Very low	48.8	Very low	229 Å²	229	101.5 Å²	101.5	86%	0.864	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-75.9	-31.6	-170.9	-145.5	176.2	-164.9	173.2	4.8	113.5	N826	R824-N826 PolarHBondContact O-N 3.47Å
825	R	42.3	Very low	50.9	Low	217 Å²	217	93.2 Å²	93.2	82%	0.819	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-71.7	-8	176.7	-74.5	-175.8	-175.9	167.2	2.5	114
826	N	49.4	Very low	52.4	Low	70 Å²	70	89.1 Å²	89.1	37%	0.374	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-100.7	-3.8	-176.8	-80.2	-55.8	0	0	0	114.5	D822 G823 R824 L828 N866 R870	D822-N826 PolarHBondContact O-ND2 2.88Å; D822-N826 VanDerWaalsContact O-ND2 3.12Å; G823-N826 PolarHBondContact O-N 2.98Å; R824-N826 PolarHBondContact O-N 3.47Å; N826-L828 VanDerWaalsContact C-N 3.31Å; N826-L828 PolarHBondContact O-N 3.14Å; N826-N866 PolarHBondContact O-ND2 3.4Å; N826-R870 PolarHBondContact OD1-NH2 3.35Å
827	A	63	Low	53.7	Low	19 Å²	19	83.1 Å²	83.1	16%	0.157	43%	0.427	C	S	.	.			trans	-83.3	60.1	-178	0	0	0	0	0	113.6	A829 E830	A827-A829 PolarHBondContact O-N 3.45Å; A827-E830 HydrophobicContact CB-CB 4.31Å; A827-E830 PolarHBondContact O-N 2.96Å
828	L	66.1	Low	55.8	Low	15 Å²	15	72.7 Å²	72.7	8%	0.079	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-26.9	179.3	-61.5	176.9	0	0	0	113.6	V200 C204 N826 N866 I869 R870	V200-L828 HydrophobicContact CG1-CD1 3.57Å; V200-L828 HydrophobicContact CG1-CD2 3.82Å; V200-L828 HydrophobicContact CG1-CG 4.36Å; C204-L828 HydrophobicContact CB-CB 4.35Å; C204-L828 HydrophobicContact CB-CD2 4.13Å; N826-L828 VanDerWaalsContact C-N 3.31Å; N826-L828 PolarHBondContact O-N 3.14Å; L828-N866 HydrophobicContact CD1-CB 4.47Å; L828-N866 PolarHBondContact N-OD1 2.66Å; L828-I869 HydrophobicContact CB-CD1 4.34Å; L828-I869 HydrophobicContact CB-CG2 4.26Å; L828-I869 HydrophobicContact CD1-CG2 4.11Å; L828-R870 HydrophobicContact CD1-CG 3.64Å
829	A	64.4	Low	58.1	Low	2 Å²	2	69.6 Å²	69.6	2%	0.017	36%	0.355	C	S	.	.	H	α-helix	trans	-78.4	-22	-177.6	0	0	0	0	0	113.9	A827 C832 F833 I865 N866 I869	A827-A829 PolarHBondContact O-N 3.45Å; A829-C832 WeakPolarHBondContact O-CA 2.99Å; A829-C832 VanDerWaalsContact O-CB 3.26Å; A829-C832 WeakPolarHBondContact O-CB 3.05Å; A829-C832 PolarHBondContact O-N 3.33Å; A829-C832 VanDerWaalsContact O-N 3.13Å; A829-F833 HydrophobicContact CB-CD2 4.03Å; A829-F833 HydrophobicContact CB-CE2 3.51Å; A829-F833 HydrophobicContact CB-CZ 4.27Å; A829-F833 WeakPolarHBondContact O-CD2 3.29Å; A829-F833 WeakPolarHBondContact O-CG 3.38Å; A829-F833 PolarHBondContact O-N 3.28Å; A829-I865 HydrophobicContact CB-CG2 3.83Å; A829-N866 PolarHBondContact N-OD1 3.35Å; A829-N866 VanDerWaalsContact N-OD1 3.16Å; A829-I869 HydrophobicContact CB-CD1 4.07Å
830	E	70.1	Confident	59.7	Low	104 Å²	104	62.5 Å²	62.5	49%	0.486	32%	0.317	S	S	.	.	H	α-helix	trans	-63.5	-50.8	-173.6	172.4	178.2	-168.3	0	0	113.3	A827 C832 F833 M834	A827-E830 HydrophobicContact CB-CB 4.31Å; A827-E830 PolarHBondContact O-N 2.96Å; E830-C832 PolarHBondContact O-N 2.81Å; E830-C832 VanDerWaalsContact O-N 3.16Å; E830-F833 PolarHBondContact O-N 3.48Å; E830-F833 VanDerWaalsContact O-N 3.15Å; E830-M834 PolarHBondContact O-N 2.96Å; E830-M834 VanDerWaalsContact O-N 3.11Å
831	P	69.1	Low	61.2	Low	21 Å²	21	55.7 Å²	55.7	14%	0.136	29%	0.285	C	S	.	.	H	α-helix	trans	-55.8	-35.4	173.1	-24.5	33.5	0	0	0	112	Y205 V208 M834 L835	Y205-P831 HydrophobicContact CD2-CG 3.73Å; Y205-P831 HydrophobicContact CE2-CG 4.28Å; V208-P831 HydrophobicContact CB-CB 4.11Å; V208-P831 HydrophobicContact CG1-CB 3.56Å; V208-P831 WeakPolarHBondContact CG1-O 3.39Å; P831-M834 PolarHBondContact O-N 2.93Å; P831-L835 PolarHBondContact O-N 2.88Å; P831-L835 VanDerWaalsContact O-N 3.1Å
832	C	69	Low	62.4	Low	8 Å²	8	53.7 Å²	53.7	5%	0.054	26%	0.264	C	S	.	.	H	α-helix	trans	-67.3	-41.5	-179.2	-67.1	0	0	0	0	112.5	T69 A829 E830 L835 I836	T69-C832 VanDerWaalsContact CB-SG 3.5Å; T69-C832 HydrophobicContact CG2-CB 3.29Å; T69-C832 WeakPolarHBondContact CG2-SG 3.17Å; T69-C832 PolarHBondContact OG1-SG 3.4Å; T69-C832 VanDerWaalsContact OG1-SG 3.39Å; A829-C832 WeakPolarHBondContact O-CA 2.99Å; A829-C832 VanDerWaalsContact O-CB 3.26Å; A829-C832 WeakPolarHBondContact O-CB 3.05Å; A829-C832 PolarHBondContact O-N 3.33Å; A829-C832 VanDerWaalsContact O-N 3.13Å; E830-C832 PolarHBondContact O-N 2.81Å; E830-C832 VanDerWaalsContact O-N 3.16Å; C832-L835 PolarHBondContact O-N 3.04Å; C832-I836 VanDerWaalsContact O-CG1 3.3Å; C832-I836 WeakPolarHBondContact O-CG1 3.38Å; C832-I836 PolarHBondContact O-N 3.42Å; C832-I836 VanDerWaalsContact O-N 3.08Å
833	F	68.1	Low	62.8	Low	40 Å²	40	54.7 Å²	54.7	18%	0.175	26%	0.258	C	S	.	.	H	α-helix	trans	-67.4	-37.1	176.3	-69.8	-57.1	0	0	0	112.7	A829 E830 I836 G837 I854 V857	A829-F833 HydrophobicContact CB-CD2 4.03Å; A829-F833 HydrophobicContact CB-CE2 3.51Å; A829-F833 HydrophobicContact CB-CZ 4.27Å; A829-F833 WeakPolarHBondContact O-CD2 3.29Å; A829-F833 WeakPolarHBondContact O-CG 3.38Å; A829-F833 PolarHBondContact O-N 3.28Å; E830-F833 PolarHBondContact O-N 3.48Å; E830-F833 VanDerWaalsContact O-N 3.15Å; F833-I836 PolarHBondContact O-N 2.68Å; F833-G837 PolarHBondContact O-N 3.29Å; F833-I854 HydrophobicContact CB-CD1 3.96Å; F833-I854 HydrophobicContact CB-CG1 4.4Å; F833-I854 HydrophobicContact CB-CG2 4.03Å; F833-I854 HydrophobicContact CD1-CG1 4.22Å; F833-I854 HydrophobicContact CD1-CG2 4.39Å; F833-I854 HydrophobicContact CD2-CG2 3.54Å; F833-I854 HydrophobicContact CE2-CG2 4.04Å; F833-I854 HydrophobicContact CG-CD1 4.35Å; F833-I854 HydrophobicContact CG-CG1 4.26Å; F833-I854 HydrophobicContact CG-CG2 3.75Å; F833-V857 HydrophobicContact CZ-CG1 4.38Å
834	M	71.4	Confident	63.2	Low	111 Å²	111	55.1 Å²	55.1	55%	0.547	26%	0.263	S	S	.	.	H	α-helix	trans	-60.1	-48.3	174.3	-71.4	-66.8	-70.1	0	0	111.2	E830 P831 I836 G837 E838	E830-M834 PolarHBondContact O-N 2.96Å; E830-M834 VanDerWaalsContact O-N 3.11Å; P831-M834 PolarHBondContact O-N 2.93Å; M834-I836 VanDerWaalsContact C-N 3.34Å; M834-I836 PolarHBondContact O-N 3.36Å; M834-G837 PolarHBondContact O-N 2.94Å; M834-G837 VanDerWaalsContact O-N 3.16Å; M834-E838 WeakPolarHBondContact O-CB 3.44Å; M834-E838 PolarHBondContact O-N 3.27Å
835	L	74.6	Confident	62.9	Low	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61	-40.3	177.4	-177	51.4	0	0	0	112.6	L68 T69 L72 V208 L211 H212 F215 P831 C832 E838 I839	L68-L835 HydrophobicContact CD2-CD1 4.46Å; L68-L835 HydrophobicContact CD2-CG 3.9Å; L68-L835 WeakPolarHBondContact CD2-O 3.31Å; T69-L835 HydrophobicContact CG2-CB 4.36Å; T69-L835 HydrophobicContact CG2-CD2 4.01Å; T69-L835 HydrophobicContact CG2-CG 4.49Å; L72-L835 HydrophobicContact CD1-CD1 3.96Å; L72-L835 HydrophobicContact CD1-CD2 3.42Å; L72-L835 VanDerWaalsContact CD1-CD2 3.42Å; L72-L835 HydrophobicContact CD1-CG 3.77Å; V208-L835 HydrophobicContact CB-CD2 4.43Å; V208-L835 HydrophobicContact CG1-CB 4.09Å; V208-L835 HydrophobicContact CG1-CD2 3.75Å; L211-L835 HydrophobicContact CB-CD1 4.21Å; L211-L835 HydrophobicContact CB-CD2 3.83Å; L211-L835 HydrophobicContact CD1-CD2 4.36Å; H212-L835 HydrophobicContact CB-CD1 4.2Å; F215-L835 HydrophobicContact CD2-CD1 4.23Å; P831-L835 PolarHBondContact O-N 2.88Å; P831-L835 VanDerWaalsContact O-N 3.1Å; C832-L835 PolarHBondContact O-N 3.04Å; L835-E838 PolarHBondContact O-N 3.42Å; L835-I839 HydrophobicContact CD1-CD1 4.07Å; L835-I839 HydrophobicContact CD1-CG1 4.1Å; L835-I839 WeakPolarHBondContact O-CG1 3.34Å; L835-I839 PolarHBondContact O-N 3.47Å
836	I	71.3	Confident	63	Low	12 Å²	12	47.8 Å²	47.8	6%	0.062	25%	0.248	C	C	.	.	H	α-helix	trans	-62.7	-47.4	173.3	-68.4	165	0	0	0	110.9	T67 L68 C832 F833 M834 E838 I839 F840 V934	T67-I836 HydrophobicContact CG2-CD1 4.04Å; L68-I836 HydrophobicContact CB-CG1 3.67Å; L68-I836 HydrophobicContact CD2-CB 4.41Å; L68-I836 HydrophobicContact CD2-CG1 4Å; C832-I836 VanDerWaalsContact O-CG1 3.3Å; C832-I836 WeakPolarHBondContact O-CG1 3.38Å; C832-I836 PolarHBondContact O-N 3.42Å; C832-I836 VanDerWaalsContact O-N 3.08Å; F833-I836 PolarHBondContact O-N 2.68Å; M834-I836 VanDerWaalsContact C-N 3.34Å; M834-I836 PolarHBondContact O-N 3.36Å; I836-E838 PolarHBondContact O-N 3.21Å; I836-I839 PolarHBondContact O-N 2.9Å; I836-F840 HydrophobicContact CG2-CD2 3.84Å; I836-F840 HydrophobicContact CG2-CE2 4.29Å; I836-F840 VanDerWaalsContact O-CD2 3.3Å; I836-F840 WeakPolarHBondContact O-CD2 3.5Å; I836-F840 PolarHBondContact O-N 2.95Å; I836-F840 VanDerWaalsContact O-N 3.11Å; I836-V934 HydrophobicContact CG2-CG1 4.47Å
837	G	66.3	Low	62.9	Low	17 Å²	17	50.8 Å²	50.8	18%	0.175	26%	0.258	C	S	.	.	H	α-helix	trans	-56.4	-39.5	177.1	0	0	0	0	0	112.3	F833 M834 E841	F833-G837 PolarHBondContact O-N 3.29Å; M834-G837 PolarHBondContact O-N 2.94Å; M834-G837 VanDerWaalsContact O-N 3.16Å; G837-E841 PolarHBondContact O-N 3.3Å
838	E	77	Confident	62	Low	21 Å²	21	57 Å²	57	10%	0.098	28%	0.277	C	S	.	.	H	α-helix	trans	-68.4	-53.6	178.8	-173.2	59.8	-155.1	0	0	111.6	F215 T216 R219 M834 L835 I836 F840 E841 K945	F215-E838 HydrophobicContact CB-CG 4.14Å; T216-E838 VanDerWaalsContact CA-OE1 3.24Å; T216-E838 WeakPolarHBondContact CA-OE1 3.5Å; T216-E838 PolarHBondContact OG1-OE1 3.11Å; R219-E838 IonicContact CZ-OE1 3.53Å; R219-E838 IonicContact CZ-OE2 3.7Å; R219-E838 IonicContact NE-OE1 2.76Å; R219-E838 VanDerWaalsContact NH1-CD 3.25Å; R219-E838 IonicContact NH1-OE1 3.17Å; R219-E838 PolarHBondContact NH1-OE1 2.7Å; R219-E838 IonicContact NH1-OE2 3.35Å; R219-E838 PolarHBondContact NH1-OE2 3.07Å; R219-E838 PolarHBondContact NH2-O 3.02Å; R219-E838 IonicContact NH2-OE1 3.42Å; R219-E838 PolarHBondContact NH2-OE1 3.05Å; R219-E838 IonicContact NH2-OE2 3.65Å; R219-E838 PolarHBondContact NH2-OE2 2.8Å; M834-E838 WeakPolarHBondContact O-CB 3.44Å; M834-E838 PolarHBondContact O-N 3.27Å; L835-E838 PolarHBondContact O-N 3.42Å; I836-E838 PolarHBondContact O-N 3.21Å; E838-F840 PolarHBondContact O-N 3.36Å; E838-E841 PolarHBondContact O-N 2.68Å; E838-K945 PolarHBondContact O-NZ 3.11Å
839	I	76.4	Confident	61.2	Low	0 Å²	0	59.7 Å²	59.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-67.5	-37.2	-174.9	-65.3	-157.8	0	0	0	113.3	L68 L72 F215 L835 I836 E841 K945 I946	L68-I839 HydrophobicContact CD1-CB 4.2Å; L68-I839 HydrophobicContact CD1-CD1 3.82Å; L68-I839 HydrophobicContact CD1-CG1 4.48Å; L68-I839 HydrophobicContact CD1-CG2 3.8Å; L68-I839 HydrophobicContact CD2-CB 3.51Å; L68-I839 HydrophobicContact CD2-CD1 3.45Å; L68-I839 VanDerWaalsContact CD2-CD1 3.45Å; L68-I839 HydrophobicContact CD2-CG1 3.53Å; L68-I839 HydrophobicContact CD2-CG2 4.11Å; L68-I839 HydrophobicContact CG-CB 4.43Å; L68-I839 HydrophobicContact CG-CD1 3.88Å; L68-I839 HydrophobicContact CG-CG1 4.45Å; L72-I839 HydrophobicContact CD1-CD1 3.84Å; F215-I839 HydrophobicContact CB-CG1 4.31Å; F215-I839 HydrophobicContact CD1-CD1 3.77Å; F215-I839 HydrophobicContact CD1-CG1 3.92Å; F215-I839 HydrophobicContact CD2-CD1 3.46Å; F215-I839 VanDerWaalsContact CD2-CD1 3.46Å; F215-I839 HydrophobicContact CD2-CG1 4.05Å; F215-I839 HydrophobicContact CE1-CD1 3.66Å; F215-I839 HydrophobicContact CE1-CG1 4.25Å; F215-I839 HydrophobicContact CE2-CD1 3.36Å; F215-I839 HydrophobicContact CE2-CG1 4.38Å; F215-I839 HydrophobicContact CG-CD1 3.69Å; F215-I839 HydrophobicContact CG-CG1 3.82Å; F215-I839 HydrophobicContact CZ-CD1 3.46Å; F215-I839 VanDerWaalsContact CZ-CD1 3.46Å; F215-I839 HydrophobicContact CZ-CG1 4.48Å; L835-I839 HydrophobicContact CD1-CD1 4.07Å; L835-I839 HydrophobicContact CD1-CG1 4.1Å; L835-I839 WeakPolarHBondContact O-CG1 3.34Å; L835-I839 PolarHBondContact O-N 3.47Å; I836-I839 PolarHBondContact O-N 2.9Å; I839-E841 VanDerWaalsContact C-N 3.33Å; I839-E841 PolarHBondContact O-N 3.39Å; I839-K945 WeakPolarHBondContact O-CD 2.95Å; I839-I946 HydrophobicContact CD1-CG1 4.01Å; I839-I946 HydrophobicContact CG2-CD1 3.81Å; I839-I946 HydrophobicContact CG2-CG1 3.51Å
840	F	70.1	Confident	60.6	Low	1 Å²	1	61.8 Å²	61.8	0%	0.004	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	5.8	-176.3	-65.1	-80.9	0	0	0	114.1	L68 I836 E838 L842 L930 V934 N938	L68-F840 HydrophobicContact CB-CE2 4.05Å; L68-F840 HydrophobicContact CD1-CE2 3.71Å; L68-F840 HydrophobicContact CD1-CZ 3.91Å; L68-F840 HydrophobicContact CD2-CE2 4.03Å; L68-F840 HydrophobicContact CG-CE2 4.17Å; I836-F840 HydrophobicContact CG2-CD2 3.84Å; I836-F840 HydrophobicContact CG2-CE2 4.29Å; I836-F840 VanDerWaalsContact O-CD2 3.3Å; I836-F840 WeakPolarHBondContact O-CD2 3.5Å; I836-F840 PolarHBondContact O-N 2.95Å; I836-F840 VanDerWaalsContact O-N 3.11Å; E838-F840 PolarHBondContact O-N 3.36Å; F840-L842 HydrophobicContact CB-CD1 4.44Å; F840-L842 HydrophobicContact CB-CD2 4.27Å; F840-L842 HydrophobicContact CB-CG 4.01Å; F840-L842 PolarHBondContact O-N 2.92Å; F840-L930 HydrophobicContact CE1-CD1 4.13Å; F840-L930 HydrophobicContact CE1-CD2 3.95Å; F840-L930 HydrophobicContact CE1-CG 4.3Å; F840-L930 HydrophobicContact CE2-CD1 3.89Å; F840-L930 HydrophobicContact CZ-CD1 3.62Å; F840-L930 HydrophobicContact CZ-CD2 3.65Å; F840-L930 HydrophobicContact CZ-CG 4.1Å; F840-V934 HydrophobicContact CB-CG1 4.45Å; F840-V934 HydrophobicContact CD1-CG2 3.96Å; F840-V934 HydrophobicContact CE1-CG2 4.39Å; F840-V934 HydrophobicContact CG-CG1 4.33Å; F840-V934 HydrophobicContact CG-CG2 4.3Å; F840-N938 WeakPolarHBondContact CD1-O 3.32Å
841	E	64.2	Low	59.7	Low	33 Å²	33	63.9 Å²	63.9	15%	0.154	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	42.1	45.7	174.2	-68.4	-171	-172	0	0	114.2	R219 G837 E838 I839 R843 F941 K945	R219-E841 IonicContact NE-OE1 2.83Å; G837-E841 PolarHBondContact O-N 3.3Å; E838-E841 PolarHBondContact O-N 2.68Å; I839-E841 VanDerWaalsContact C-N 3.33Å; I839-E841 PolarHBondContact O-N 3.39Å; E841-R843 VanDerWaalsContact C-N 3.3Å; E841-R843 PolarHBondContact O-N 3.03Å; E841-F941 HydrophobicContact CB-CE1 4.22Å; E841-F941 HydrophobicContact CG-CE1 4.25Å; E841-K945 WeakPolarHBondContact OE1-CE 3.04Å; E841-K945 IonicContact OE1-NZ 3.14Å; E841-K945 PolarHBondContact OE1-NZ 3.35Å
842	L	58.6	Low	58.8	Low	28 Å²	28	65.4 Å²	65.4	15%	0.147	32%	0.318	C	S	.	.			trans	-71.4	86.9	-176.2	-58.4	167.9	0	0	0	108.8	F840 R850 V934 N938	F840-L842 HydrophobicContact CB-CD1 4.44Å; F840-L842 HydrophobicContact CB-CD2 4.27Å; F840-L842 HydrophobicContact CB-CG 4.01Å; F840-L842 PolarHBondContact O-N 2.92Å; L842-R850 VanDerWaalsContact CD1-NE 3.31Å; L842-R850 PolarHBondContact O-NH1 3.19Å; L842-R850 PolarHBondContact O-NH2 3.46Å; L842-V934 HydrophobicContact CD1-CG1 4.18Å; L842-V934 HydrophobicContact CD2-CB 4.12Å; L842-V934 HydrophobicContact CD2-CG1 4.44Å; L842-N938 HydrophobicContact CD2-CB 4.1Å
843	R	46.1	Very low	58	Low	151 Å²	151	69.3 Å²	69.3	57%	0.57	34%	0.338	S	S	*	.			trans	-89.5	162.9	-176.2	-71.6	-177.1	178	-169.9	-0.6	113	E841	E841-R843 VanDerWaalsContact C-N 3.3Å; E841-R843 PolarHBondContact O-N 3.03Å
844	G	47.1	Very low	57.3	Low	59 Å²	59	69.4 Å²	69.4	61%	0.608	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	83	-156.4	172.5	0	0	0	0	0	115.8	F846 K847	G844-F846 PolarHBondContact O-N 2.93Å; G844-K847 PolarHBondContact O-N 3.45Å
845	M	36.3	Very low	56.5	Low	158 Å²	158	66.5 Å²	66.5	78%	0.778	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.1	-19.2	177.1	52.5	172.2	49.2	0	0	114.8	V849	M845-V849 WeakPolarHBondContact O-CG2 3.05Å
846	F	44.1	Very low	55.4	Low	133 Å²	133	69.8 Å²	69.8	58%	0.583	35%	0.351	S	S	*	.	H	α-helix	trans	-72.6	-17.1	173.1	-72.8	-83.9	0	0	0	115.1	G844 R850	G844-F846 PolarHBondContact O-N 2.93Å; F846-R850 WeakPolarHBondContact O-CB 2.73Å; F846-R850 PolarHBondContact O-N 2.86Å; F846-R850 PolarHBondContact O-NH2 2.95Å
847	K	47.6	Very low	54.7	Low	133 Å²	133	71.1 Å²	71.1	58%	0.578	36%	0.36	S	S	*	.	H	α-helix	trans	-68.1	-42.6	178.6	-171.5	-177.5	179.3	-174.4	0	111.5	G844 K851	G844-K847 PolarHBondContact O-N 3.45Å; K847-K851 PolarHBondContact O-N 3.32Å
848	W	45.1	Very low	54.2	Low	149 Å²	149	72.9 Å²	72.9	56%	0.564	36%	0.363	S	S	*	.	H	α-helix	trans	-70.5	-51.4	176	-177.3	87	0	0	0	111.2	F801 R850 K851 T852	F801-W848 AromaticContact CD1-CH2 3.64Å; F801-W848 HydrophobicContact CD1-CH2 3.64Å; F801-W848 AromaticContact CD1-CZ2 3.95Å; F801-W848 HydrophobicContact CD1-CZ2 3.95Å; F801-W848 AromaticContact CE1-CH2 3.52Å; F801-W848 HydrophobicContact CE1-CH2 3.52Å; F801-W848 HydrophobicContact CE1-CZ2 4.14Å; F801-W848 HydrophobicContact CE1-CZ3 4.36Å; W848-R850 PolarHBondContact O-N 3.36Å; W848-R850 VanDerWaalsContact O-N 3.13Å; W848-K851 PolarHBondContact O-N 2.94Å; W848-K851 VanDerWaalsContact O-N 3.08Å; W848-T852 PolarHBondContact O-N 3.48Å; W848-T852 PolarHBondContact O-OG1 2.94Å; W848-T852 VanDerWaalsContact O-OG1 3.06Å
849	V	47.6	Very low	53.1	Low	72 Å²	72	77.6 Å²	77.6	44%	0.436	39%	0.393	S	S	.	.	H	α-helix	trans	-55.6	-34.8	175.4	176.7	0	0	0	0	111.8	M845 L853	M845-V849 WeakPolarHBondContact O-CG2 3.05Å; V849-L853 WeakPolarHBondContact O-CB 3.04Å; V849-L853 PolarHBondContact O-N 3.5Å
850	R	52.1	Low	51.6	Low	46 Å²	46	81.4 Å²	81.4	17%	0.174	42%	0.416	C	S	.	.	H	α-helix	trans	-72.3	-44.2	175.9	178.4	-169.5	-39.9	116.5	33	113.4	L842 F846 W848 T852 L853 I854	L842-R850 VanDerWaalsContact CD1-NE 3.31Å; L842-R850 PolarHBondContact O-NH1 3.19Å; L842-R850 PolarHBondContact O-NH2 3.46Å; F846-R850 WeakPolarHBondContact O-CB 2.73Å; F846-R850 PolarHBondContact O-N 2.86Å; F846-R850 PolarHBondContact O-NH2 2.95Å; W848-R850 PolarHBondContact O-N 3.36Å; W848-R850 VanDerWaalsContact O-N 3.13Å; R850-T852 PolarHBondContact O-N 2.97Å; R850-L853 PolarHBondContact O-N 3.32Å; R850-I854 HydrophobicContact CG-CD1 3.43Å; R850-I854 VanDerWaalsContact CG-CD1 3.43Å; R850-I854 HydrophobicContact CG-CG1 4.11Å; R850-I854 VanDerWaalsContact O-CB 3.29Å; R850-I854 WeakPolarHBondContact O-CB 3.23Å; R850-I854 WeakPolarHBondContact O-CD1 3.3Å; R850-I854 WeakPolarHBondContact O-CG1 3.4Å; R850-I854 PolarHBondContact O-N 2.94Å
851	K	51.9	Low	50.6	Low	149 Å²	149	87.1 Å²	87.1	65%	0.648	44%	0.442	S	S	*	.	H	α-helix	trans	-58.8	-42.9	175	-82.1	-171.8	173.5	-172	0	110	K847 W848 A855	K847-K851 PolarHBondContact O-N 3.32Å; W848-K851 PolarHBondContact O-N 2.94Å; W848-K851 VanDerWaalsContact O-N 3.08Å; K851-A855 WeakPolarHBondContact O-CB 3.35Å; K851-A855 PolarHBondContact O-N 3.04Å
852	T	50.2	Low	50.3	Low	52 Å²	52	85.7 Å²	85.7	32%	0.319	44%	0.436	S	S	.	.	H	α-helix	trans	-68.7	-40.8	177.3	-46.4	0	0	0	0	112.4	W848 R850 L856	W848-T852 PolarHBondContact O-N 3.48Å; W848-T852 PolarHBondContact O-OG1 2.94Å; W848-T852 VanDerWaalsContact O-OG1 3.06Å; R850-T852 PolarHBondContact O-N 2.97Å; T852-L856 WeakPolarHBondContact O-CB 3.48Å; T852-L856 PolarHBondContact O-N 2.73Å
853	L	51.4	Low	50.2	Low	90 Å²	90	95.4 Å²	95.4	47%	0.471	47%	0.47	S	S	.	.	H	α-helix	trans	-70.4	-40.7	177.7	-175.1	67.8	0	0	0	112.5	V849 R850 L856 V857	V849-L853 WeakPolarHBondContact O-CB 3.04Å; V849-L853 PolarHBondContact O-N 3.5Å; R850-L853 PolarHBondContact O-N 3.32Å; L853-L856 PolarHBondContact O-N 3.24Å; L853-V857 HydrophobicContact CD1-CG2 4.46Å; L853-V857 HydrophobicContact CG-CG2 4.46Å; L853-V857 WeakPolarHBondContact O-CB 3.42Å; L853-V857 WeakPolarHBondContact O-CG2 2.93Å; L853-V857 PolarHBondContact O-N 3.04Å
854	I	54.3	Low	50.7	Low	42 Å²	42	92.2 Å²	92.2	22%	0.215	47%	0.467	C	S	.	.	H	α-helix	trans	-65.2	-46.6	175	-68.7	164.9	0	0	0	109.5	F833 R850 L856 V857 Q858	F833-I854 HydrophobicContact CB-CD1 3.96Å; F833-I854 HydrophobicContact CB-CG1 4.4Å; F833-I854 HydrophobicContact CB-CG2 4.03Å; F833-I854 HydrophobicContact CD1-CG1 4.22Å; F833-I854 HydrophobicContact CD1-CG2 4.39Å; F833-I854 HydrophobicContact CD2-CG2 3.54Å; F833-I854 HydrophobicContact CE2-CG2 4.04Å; F833-I854 HydrophobicContact CG-CD1 4.35Å; F833-I854 HydrophobicContact CG-CG1 4.26Å; F833-I854 HydrophobicContact CG-CG2 3.75Å; R850-I854 HydrophobicContact CG-CD1 3.43Å; R850-I854 VanDerWaalsContact CG-CD1 3.43Å; R850-I854 HydrophobicContact CG-CG1 4.11Å; R850-I854 VanDerWaalsContact O-CB 3.29Å; R850-I854 WeakPolarHBondContact O-CB 3.23Å; R850-I854 WeakPolarHBondContact O-CD1 3.3Å; R850-I854 WeakPolarHBondContact O-CG1 3.4Å; R850-I854 PolarHBondContact O-N 2.94Å; I854-L856 VanDerWaalsContact C-N 3.31Å; I854-L856 PolarHBondContact O-N 3.24Å; I854-V857 PolarHBondContact O-N 2.99Å; I854-Q858 WeakPolarHBondContact O-CB 3.28Å; I854-Q858 PolarHBondContact O-N 3.19Å
855	A	54.8	Low	51.3	Low	51 Å²	51	91.7 Å²	91.7	42%	0.421	45%	0.45	S	S	.	.	H	α-helix	trans	-58.9	-44	174.9	0	0	0	0	0	111	K851 Q858 V859	K851-A855 WeakPolarHBondContact O-CB 3.35Å; K851-A855 PolarHBondContact O-N 3.04Å; A855-Q858 PolarHBondContact O-N 2.68Å; A855-V859 WeakPolarHBondContact O-CB 3.09Å; A855-V859 WeakPolarHBondContact O-CG2 3.48Å; A855-V859 PolarHBondContact O-N 3.1Å
856	L	52.1	Low	52.7	Low	68 Å²	68	84.8 Å²	84.8	36%	0.356	42%	0.416	S	S	.	.	H	α-helix	trans	-61.8	-47.5	175.9	-176	72.6	0	0	0	111.9	T852 L853 I854 Q858 V859 T860	T852-L856 WeakPolarHBondContact O-CB 3.48Å; T852-L856 PolarHBondContact O-N 2.73Å; L853-L856 PolarHBondContact O-N 3.24Å; I854-L856 VanDerWaalsContact C-N 3.31Å; I854-L856 PolarHBondContact O-N 3.24Å; L856-Q858 VanDerWaalsContact C-N 3.31Å; L856-Q858 PolarHBondContact O-N 3.49Å; L856-V859 PolarHBondContact O-N 3.26Å; L856-T860 HydrophobicContact CD1-CG2 4.25Å; L856-T860 HydrophobicContact CG-CG2 4.47Å; L856-T860 WeakPolarHBondContact O-CB 3.32Å; L856-T860 WeakPolarHBondContact O-CG2 3.11Å; L856-T860 PolarHBondContact O-N 3.48Å; L856-T860 PolarHBondContact O-OG1 2.93Å
857	V	54.9	Low	53.9	Low	41 Å²	41	84.8 Å²	84.8	25%	0.248	42%	0.416	C	S	.	.	H	α-helix	trans	-65.1	-36.1	177.9	168.8	0	0	0	0	111.1	F833 L853 I854 T860 F861 G862 I865	F833-V857 HydrophobicContact CZ-CG1 4.38Å; L853-V857 HydrophobicContact CD1-CG2 4.46Å; L853-V857 HydrophobicContact CG-CG2 4.46Å; L853-V857 WeakPolarHBondContact O-CB 3.42Å; L853-V857 WeakPolarHBondContact O-CG2 2.93Å; L853-V857 PolarHBondContact O-N 3.04Å; I854-V857 PolarHBondContact O-N 2.99Å; V857-T860 WeakPolarHBondContact CA-OG1 3.15Å; V857-F861 CarbonylContact O-C 3.57Å; V857-F861 VanDerWaalsContact O-CA 3.3Å; V857-F861 WeakPolarHBondContact O-CA 3.25Å; V857-F861 WeakPolarHBondContact O-CB 3.48Å; V857-F861 PolarHBondContact O-N 3.5Å; V857-G862 PolarHBondContact O-N 3.2Å; V857-I865 HydrophobicContact CG1-CD1 3.59Å
858	Q	55.8	Low	54.6	Low	54 Å²	54	82.3 Å²	82.3	25%	0.252	41%	0.407	S	S	.	.	H	α-helix	trans	-71.9	-37.2	177.4	-170.5	156.4	-20.2	0	0	111.6	I854 A855 L856 G862	I854-Q858 WeakPolarHBondContact O-CB 3.28Å; I854-Q858 PolarHBondContact O-N 3.19Å; A855-Q858 PolarHBondContact O-N 2.68Å; L856-Q858 VanDerWaalsContact C-N 3.31Å; L856-Q858 PolarHBondContact O-N 3.49Å; Q858-G862 WeakPolarHBondContact O-CA 3.19Å; Q858-G862 PolarHBondContact O-N 2.96Å
859	V	54	Low	55.4	Low	120 Å²	120	76.7 Å²	76.7	73%	0.727	39%	0.388	S	S	*	.	H	α-helix	trans	-71.7	-39.9	174.6	170.7	0	0	0	0	111.7	A855 L856	A855-V859 WeakPolarHBondContact O-CB 3.09Å; A855-V859 WeakPolarHBondContact O-CG2 3.48Å; A855-V859 PolarHBondContact O-N 3.1Å; L856-V859 PolarHBondContact O-N 3.26Å
860	T	44.9	Very low	56.4	Low	79 Å²	79	76.9 Å²	76.9	49%	0.485	38%	0.38	S	S	.	.	H	α-helix	trans	-87.3	-36.2	-175.2	52.5	0	0	0	0	113.8	L856 V857	L856-T860 HydrophobicContact CD1-CG2 4.25Å; L856-T860 HydrophobicContact CG-CG2 4.47Å; L856-T860 WeakPolarHBondContact O-CB 3.32Å; L856-T860 WeakPolarHBondContact O-CG2 3.11Å; L856-T860 PolarHBondContact O-N 3.48Å; L856-T860 PolarHBondContact O-OG1 2.93Å; V857-T860 WeakPolarHBondContact CA-OG1 3.15Å
861	F	50.5	Low	57	Low	122 Å²	122	78.1 Å²	78.1	54%	0.535	39%	0.391	S	S	.	.	H	α-helix	trans	-127.9	0.5	-173.8	-60.1	-75.5	0	0	0	114.1	V857 R863 T864 I865	V857-F861 CarbonylContact O-C 3.57Å; V857-F861 VanDerWaalsContact O-CA 3.3Å; V857-F861 WeakPolarHBondContact O-CA 3.25Å; V857-F861 WeakPolarHBondContact O-CB 3.48Å; V857-F861 PolarHBondContact O-N 3.5Å; F861-R863 VanDerWaalsContact C-N 3.3Å; F861-R863 PolarHBondContact O-N 3.2Å; F861-T864 WeakPolarHBondContact O-CB 3.43Å; F861-T864 PolarHBondContact O-N 3.29Å; F861-I865 HydrophobicContact CB-CD1 3.98Å; F861-I865 HydrophobicContact CB-CG1 4.3Å; F861-I865 WeakPolarHBondContact O-CG1 3.47Å; F861-I865 PolarHBondContact O-N 2.93Å
862	G	57.3	Low	57.4	Low	3 Å²	3	72.7 Å²	72.7	3%	0.031	37%	0.37	C	S	.	.	H	α-helix	trans	-55.1	-41.4	-174.9	0	0	0	0	0	113.4	V857 Q858 T864 I865 N866	V857-G862 PolarHBondContact O-N 3.2Å; Q858-G862 WeakPolarHBondContact O-CA 3.19Å; Q858-G862 PolarHBondContact O-N 2.96Å; G862-T864 PolarHBondContact O-N 3.38Å; G862-I865 PolarHBondContact O-N 3.32Å; G862-N866 VanDerWaalsContact O-CB 3.27Å; G862-N866 WeakPolarHBondContact O-CB 3.11Å; G862-N866 PolarHBondContact O-N 3.13Å; G862-N866 PolarHBondContact O-ND2 3.3Å
863	R	56.7	Low	57.9	Low	232 Å²	232	70.2 Å²	70.2	88%	0.875	36%	0.355	S	S	*	.	H	α-helix	trans	-59.8	-43.8	175.8	-69	-175.8	-176.3	169.8	1.2	112.5	F861 K867	F861-R863 VanDerWaalsContact C-N 3.3Å; F861-R863 PolarHBondContact O-N 3.2Å; R863-K867 WeakPolarHBondContact O-CB 3.22Å; R863-K867 PolarHBondContact O-N 2.82Å
864	T	55.4	Low	58.6	Low	83 Å²	83	70.6 Å²	70.6	51%	0.509	36%	0.357	S	S	.	.	H	α-helix	trans	-68.4	-43.7	178.7	-53.5	0	0	0	0	111.2	F861 G862 K867 Q868	F861-T864 WeakPolarHBondContact O-CB 3.43Å; F861-T864 PolarHBondContact O-N 3.29Å; G862-T864 PolarHBondContact O-N 3.38Å; T864-K867 PolarHBondContact O-N 3.4Å; T864-Q868 WeakPolarHBondContact O-CB 3.49Å; T864-Q868 VanDerWaalsContact O-CG 3.29Å; T864-Q868 WeakPolarHBondContact O-CG 3.38Å; T864-Q868 PolarHBondContact O-N 3.04Å
865	I	59.7	Low	59.3	Low	48 Å²	48	70.8 Å²	70.8	25%	0.246	36%	0.355	C	S	.	.	H	α-helix	trans	-63.4	-48.3	178.3	-66.2	168.4	0	0	0	110.3	A829 V857 F861 G862 K867 Q868 I869	A829-I865 HydrophobicContact CB-CG2 3.83Å; V857-I865 HydrophobicContact CG1-CD1 3.59Å; F861-I865 HydrophobicContact CB-CD1 3.98Å; F861-I865 HydrophobicContact CB-CG1 4.3Å; F861-I865 WeakPolarHBondContact O-CG1 3.47Å; F861-I865 PolarHBondContact O-N 2.93Å; G862-I865 PolarHBondContact O-N 3.32Å; I865-K867 VanDerWaalsContact C-N 3.3Å; I865-K867 PolarHBondContact O-N 2.72Å; I865-Q868 PolarHBondContact O-N 3.37Å; I865-I869 HydrophobicContact CG2-CD1 3.77Å; I865-I869 HydrophobicContact CG2-CG1 4.32Å; I865-I869 WeakPolarHBondContact O-CB 3.46Å; I865-I869 VanDerWaalsContact O-CG1 3.27Å; I865-I869 WeakPolarHBondContact O-CG1 3.42Å; I865-I869 PolarHBondContact O-N 3Å
866	N	67	Low	59.1	Low	13 Å²	13	68.4 Å²	68.4	7%	0.07	34%	0.335	C	S	.	.	H	α-helix	trans	-64.7	-34.6	179.4	-65.9	-31.6	0	0	0	112.1	N826 L828 A829 G862 R870	N826-N866 PolarHBondContact O-ND2 3.4Å; L828-N866 HydrophobicContact CD1-CB 4.47Å; L828-N866 PolarHBondContact N-OD1 2.66Å; A829-N866 PolarHBondContact N-OD1 3.35Å; A829-N866 VanDerWaalsContact N-OD1 3.16Å; G862-N866 VanDerWaalsContact O-CB 3.27Å; G862-N866 WeakPolarHBondContact O-CB 3.11Å; G862-N866 PolarHBondContact O-N 3.13Å; G862-N866 PolarHBondContact O-ND2 3.3Å; N866-R870 PolarHBondContact O-N 2.97Å
867	K	69.1	Low	59.7	Low	134 Å²	134	69 Å²	69	58%	0.583	34%	0.335	S	S	*	.	H	α-helix	trans	-64.2	-48.8	171.1	-177.2	178.4	177.5	179.9	0	111.3	R863 T864 I865 I869 R870 D871	R863-K867 WeakPolarHBondContact O-CB 3.22Å; R863-K867 PolarHBondContact O-N 2.82Å; T864-K867 PolarHBondContact O-N 3.4Å; I865-K867 VanDerWaalsContact C-N 3.3Å; I865-K867 PolarHBondContact O-N 2.72Å; K867-I869 VanDerWaalsContact C-N 3.32Å; K867-I869 PolarHBondContact O-N 3.32Å; K867-R870 PolarHBondContact O-N 3.46Å; K867-D871 WeakPolarHBondContact O-CB 3.43Å; K867-D871 VanDerWaalsContact O-CG 3.26Å; K867-D871 PolarHBondContact O-N 3.03Å
868	Q	62.7	Low	60.3	Low	81 Å²	81	68.4 Å²	68.4	38%	0.379	33%	0.333	S	S	.	.	H	α-helix	trans	-62	-38.9	178.2	-73.7	-67.5	-8.3	0	0	112.6	T864 I865 D871 T872	T864-Q868 WeakPolarHBondContact O-CB 3.49Å; T864-Q868 VanDerWaalsContact O-CG 3.29Å; T864-Q868 WeakPolarHBondContact O-CG 3.38Å; T864-Q868 PolarHBondContact O-N 3.04Å; I865-Q868 PolarHBondContact O-N 3.37Å; Q868-D871 PolarHBondContact O-N 2.6Å; Q868-T872 VanDerWaalsContact O-CB 3.28Å; Q868-T872 WeakPolarHBondContact O-CB 3.21Å; Q868-T872 PolarHBondContact O-N 2.71Å; Q868-T872 PolarHBondContact O-OG1 3.38Å
869	I	61.7	Low	61	Low	31 Å²	31	69.1 Å²	69.1	16%	0.159	34%	0.336	C	S	.	.	H	α-helix	trans	-59.1	-52.5	173.2	-72.2	170.8	0	0	0	109.5	C204 L828 A829 I865 K867 D871 T872 V873	C204-I869 HydrophobicContact CB-CG2 4.38Å; C204-I869 WeakPolarHBondContact SG-CG2 3.49Å; L828-I869 HydrophobicContact CB-CD1 4.34Å; L828-I869 HydrophobicContact CB-CG2 4.26Å; L828-I869 HydrophobicContact CD1-CG2 4.11Å; A829-I869 HydrophobicContact CB-CD1 4.07Å; I865-I869 HydrophobicContact CG2-CD1 3.77Å; I865-I869 HydrophobicContact CG2-CG1 4.32Å; I865-I869 WeakPolarHBondContact O-CB 3.46Å; I865-I869 VanDerWaalsContact O-CG1 3.27Å; I865-I869 WeakPolarHBondContact O-CG1 3.42Å; I865-I869 PolarHBondContact O-N 3Å; K867-I869 VanDerWaalsContact C-N 3.32Å; K867-I869 PolarHBondContact O-N 3.32Å; I869-D871 PolarHBondContact O-N 3.11Å; I869-T872 WeakPolarHBondContact O-CB 3.32Å; I869-T872 PolarHBondContact O-N 3.19Å; I869-T872 VanDerWaalsContact O-N 3.15Å; I869-V873 WeakPolarHBondContact O-CG2 3.48Å; I869-V873 PolarHBondContact O-N 3.18Å
870	R	68.9	Low	61.4	Low	75 Å²	75	69.4 Å²	69.4	28%	0.283	33%	0.33	S	S	.	.	H	α-helix	trans	-58.6	-46.5	177.2	-81.1	-178.3	-107.5	-107.9	9.8	113	V200 N826 L828 N866 K867 T872 V873 N874	V200-R870 HydrophobicContact CG1-CG 3.81Å; V200-R870 HydrophobicContact CG2-CG 4.11Å; N826-R870 PolarHBondContact OD1-NH2 3.35Å; L828-R870 HydrophobicContact CD1-CG 3.64Å; N866-R870 PolarHBondContact O-N 2.97Å; K867-R870 PolarHBondContact O-N 3.46Å; R870-T872 PolarHBondContact O-N 3.23Å; R870-V873 PolarHBondContact O-N 2.84Å; R870-N874 WeakPolarHBondContact O-CB 3.47Å; R870-N874 VanDerWaalsContact O-CG 3.28Å; R870-N874 PolarHBondContact O-N 2.92Å; R870-N874 PolarHBondContact O-ND2 3.01Å
871	D	64.1	Low	62.4	Low	73 Å²	73	66.1 Å²	66.1	39%	0.39	31%	0.309	S	S	.	.	H	α-helix	trans	-60.6	-38.1	177.9	-68.6	-17.7	0	0	0	110.7	K867 Q868 I869 W875	K867-D871 WeakPolarHBondContact O-CB 3.43Å; K867-D871 VanDerWaalsContact O-CG 3.26Å; K867-D871 PolarHBondContact O-N 3.03Å; Q868-D871 PolarHBondContact O-N 2.6Å; I869-D871 PolarHBondContact O-N 3.11Å; D871-W875 WeakPolarHBondContact O-CB 3.43Å; D871-W875 PolarHBondContact O-N 3.47Å
872	T	59.2	Low	62.9	Low	34 Å²	34	63 Å²	63	21%	0.209	30%	0.297	C	S	.	.	H	α-helix	trans	-67.4	-43.8	176.2	-59.4	0	0	0	0	111.9	Q868 I869 R870 W875 I876	Q868-T872 VanDerWaalsContact O-CB 3.28Å; Q868-T872 WeakPolarHBondContact O-CB 3.21Å; Q868-T872 PolarHBondContact O-N 2.71Å; Q868-T872 PolarHBondContact O-OG1 3.38Å; I869-T872 WeakPolarHBondContact O-CB 3.32Å; I869-T872 PolarHBondContact O-N 3.19Å; I869-T872 VanDerWaalsContact O-N 3.15Å; R870-T872 PolarHBondContact O-N 3.23Å; T872-W875 PolarHBondContact O-N 3.42Å; T872-I876 HydrophobicContact CG2-CD1 4.08Å; T872-I876 WeakPolarHBondContact O-CD1 3.11Å; T872-I876 VanDerWaalsContact O-CG1 3.26Å; T872-I876 WeakPolarHBondContact O-CG1 3.34Å; T872-I876 PolarHBondContact O-N 3.03Å
873	V	60.7	Low	63.2	Low	1 Å²	1	64.6 Å²	64.6	1%	0.006	31%	0.306	C	S	.	.	H	α-helix	trans	-61.8	-51.6	174.7	178.4	0	0	0	0	110.2	L73 V199 V200 V203 I869 R870 W875 I876 F877	L73-V873 HydrophobicContact CD2-CG2 4.41Å; V199-V873 HydrophobicContact CB-CG1 4.39Å; V199-V873 HydrophobicContact CG1-CG1 3.81Å; V200-V873 HydrophobicContact CG2-CB 4.16Å; V200-V873 HydrophobicContact CG2-CG1 3.95Å; V203-V873 HydrophobicContact CB-CG2 4.32Å; V203-V873 HydrophobicContact CG1-CG1 4.35Å; V203-V873 HydrophobicContact CG1-CG2 3.41Å; V203-V873 VanDerWaalsContact CG1-CG2 3.41Å; V203-V873 HydrophobicContact CG2-CG1 4.46Å; I869-V873 WeakPolarHBondContact O-CG2 3.48Å; I869-V873 PolarHBondContact O-N 3.18Å; R870-V873 PolarHBondContact O-N 2.84Å; V873-W875 PolarHBondContact O-N 3.19Å; V873-I876 WeakPolarHBondContact O-CB 3.39Å; V873-I876 PolarHBondContact O-N 3.01Å; V873-F877 HydrophobicContact CG1-CD2 4Å; V873-F877 HydrophobicContact CG1-CE2 4.12Å; V873-F877 VanDerWaalsContact O-CD2 3.29Å; V873-F877 WeakPolarHBondContact O-CD2 3.45Å; V873-F877 PolarHBondContact O-N 3.4Å
874	N	67.4	Low	63.3	Low	97 Å²	97	54.2 Å²	54.2	52%	0.519	27%	0.269	S	S	.	.	H	α-helix	trans	-58.8	-37.6	179.4	-70.8	-25	0	0	0	112.1	R870 C878	R870-N874 WeakPolarHBondContact O-CB 3.47Å; R870-N874 VanDerWaalsContact O-CG 3.28Å; R870-N874 PolarHBondContact O-N 2.92Å; R870-N874 PolarHBondContact O-ND2 3.01Å; N874-C878 PolarHBondContact O-N 3.33Å; N874-C878 VanDerWaalsContact O-N 3.1Å
875	W	67.6	Low	63.5	Low	46 Å²	46	51 Å²	51	17%	0.174	25%	0.248	C	C	.	.	H	α-helix	trans	-65.6	-42.6	174.4	174.6	84.4	0	0	0	112.2	A56 F59 Q60 D871 T872 V873 F877 C878 M881	A56-W875 WeakPolarHBondContact O-CH2 3.44Å; A56-W875 WeakPolarHBondContact O-CZ2 3.45Å; F59-W875 HydrophobicContact CB-CZ2 3.97Å; F59-W875 AromaticContact CD1-CD1 3.66Å; F59-W875 HydrophobicContact CD1-CD2 4.17Å; F59-W875 AromaticContact CD1-CE2 3.62Å; F59-W875 HydrophobicContact CD1-CG 4.19Å; F59-W875 HydrophobicContact CD1-CZ2 4.2Å; F59-W875 AromaticContact CD1-NE1 3.23Å; F59-W875 AromaticContact CE1-CD1 3.71Å; F59-W875 HydrophobicContact CE1-CG 4.32Å; F59-W875 AromaticContact CE1-NE1 3.76Å; F59-W875 AromaticContact CG-NE1 3.93Å; Q60-W875 HydrophobicContact CB-CE3 4.43Å; Q60-W875 HydrophobicContact CB-CH2 3.62Å; Q60-W875 HydrophobicContact CB-CZ2 4.35Å; Q60-W875 HydrophobicContact CB-CZ3 3.72Å; Q60-W875 HydrophobicContact CG-CE3 3.71Å; Q60-W875 HydrophobicContact CG-CH2 3.76Å; Q60-W875 HydrophobicContact CG-CZ3 3.27Å; Q60-W875 VanDerWaalsContact NE2-CZ3 3.26Å; D871-W875 WeakPolarHBondContact O-CB 3.43Å; D871-W875 PolarHBondContact O-N 3.47Å; T872-W875 PolarHBondContact O-N 3.42Å; V873-W875 PolarHBondContact O-N 3.19Å; W875-F877 VanDerWaalsContact C-N 3.26Å; W875-F877 PolarHBondContact O-N 2.98Å; W875-C878 WeakPolarHBondContact O-CB 3.46Å; W875-C878 PolarHBondContact O-N 3.25Å; W875-C878 PolarHBondContact O-SG 3.44Å; W875-M881 HydrophobicContact CD2-CG 4.45Å; W875-M881 HydrophobicContact CH2-CE 3.55Å; W875-M881 HydrophobicContact CH2-CG 4.26Å; W875-M881 HydrophobicContact CH2-SD 3.48Å; W875-M881 WeakPolarHBondContact CH2-SD 3.44Å; W875-M881 HydrophobicContact CZ2-CE 4.14Å; W875-M881 HydrophobicContact CZ2-CG 4.18Å; W875-M881 HydrophobicContact CZ2-SD 3.42Å; W875-M881 WeakPolarHBondContact CZ2-SD 3.39Å; W875-M881 HydrophobicContact CZ3-CE 3.98Å; W875-M881 HydrophobicContact CZ3-CG 4.42Å; W875-M881 HydrophobicContact CZ3-SD 4.16Å; W875-M881 WeakPolarHBondContact O-CG 3.34Å
876	I	51.4	Low	63.7	Low	1 Å²	1	49.6 Å²	49.6	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-57.6	-41.1	177.6	-75.3	156.2	0	0	0	111.6	L73 I77 T872 V873 C878 M881 Y885	L73-I876 HydrophobicContact CD2-CD1 4.11Å; L73-I876 HydrophobicContact CG-CD1 4.38Å; I77-I876 HydrophobicContact CB-CG2 4.43Å; I77-I876 HydrophobicContact CD1-CB 4.15Å; I77-I876 HydrophobicContact CD1-CD1 3.19Å; I77-I876 HydrophobicContact CD1-CG1 3.85Å; I77-I876 HydrophobicContact CD1-CG2 3.38Å; I77-I876 HydrophobicContact CG1-CG2 3.87Å; I77-I876 HydrophobicContact CG2-CG2 3.75Å; T872-I876 HydrophobicContact CG2-CD1 4.08Å; T872-I876 WeakPolarHBondContact O-CD1 3.11Å; T872-I876 VanDerWaalsContact O-CG1 3.26Å; T872-I876 WeakPolarHBondContact O-CG1 3.34Å; T872-I876 PolarHBondContact O-N 3.03Å; V873-I876 WeakPolarHBondContact O-CB 3.39Å; V873-I876 PolarHBondContact O-N 3.01Å; I876-C878 VanDerWaalsContact C-N 3.35Å; I876-M881 WeakPolarHBondContact O-CB 3.36Å; I876-Y885 WeakPolarHBondContact O-CE2 3.39Å; I876-Y885 PolarHBondContact O-OH 3.4Å
877	F	64.3	Low	63.7	Low	81 Å²	81	49.6 Å²	49.6	36%	0.355	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	10.8	-176.2	-65.1	-85.6	0	0	0	112.7	I77 V199 V203 V873 W875	I77-F877 HydrophobicContact CG1-CE2 4.36Å; I77-F877 HydrophobicContact CG1-CZ 4.13Å; V199-F877 HydrophobicContact CG1-CD1 4.2Å; V199-F877 HydrophobicContact CG1-CD2 3.32Å; V199-F877 HydrophobicContact CG1-CE1 4.09Å; V199-F877 HydrophobicContact CG1-CE2 3.2Å; V199-F877 HydrophobicContact CG1-CG 3.85Å; V199-F877 HydrophobicContact CG1-CZ 3.61Å; V203-F877 HydrophobicContact CG2-CE2 3.95Å; V203-F877 HydrophobicContact CG2-CZ 4.23Å; V873-F877 HydrophobicContact CG1-CD2 4Å; V873-F877 HydrophobicContact CG1-CE2 4.12Å; V873-F877 VanDerWaalsContact O-CD2 3.29Å; V873-F877 WeakPolarHBondContact O-CD2 3.45Å; V873-F877 PolarHBondContact O-N 3.4Å; W875-F877 VanDerWaalsContact C-N 3.26Å; W875-F877 PolarHBondContact O-N 2.98Å
878	C	67.3	Low	63.2	Low	29 Å²	29	46.1 Å²	46.1	20%	0.196	23%	0.231	C	C	.	.	S	Bend	trans	-70.8	160.2	177.3	80.5	0	0	0	0	112	N874 W875 I876 Q880 M881 L882	N874-C878 PolarHBondContact O-N 3.33Å; N874-C878 VanDerWaalsContact O-N 3.1Å; W875-C878 WeakPolarHBondContact O-CB 3.46Å; W875-C878 PolarHBondContact O-N 3.25Å; W875-C878 PolarHBondContact O-SG 3.44Å; I876-C878 VanDerWaalsContact C-N 3.35Å; C878-Q880 VanDerWaalsContact C-N 3.28Å; C878-Q880 PolarHBondContact O-N 2.97Å; C878-Q880 PolarHBondContact SG-OE1 3.18Å; C878-M881 WeakPolarHBondContact O-CB 3.24Å; C878-M881 PolarHBondContact O-N 2.94Å; C878-L882 WeakPolarHBondContact O-CG 3.41Å; C878-L882 PolarHBondContact O-N 3.3Å
879	E	72.1	Confident	63.2	Low	68 Å²	68	42.8 Å²	42.8	32%	0.318	22%	0.216	S	C	.	.	H	α-helix	trans	-52.9	-43.1	-177.5	-170.6	-173	160	0	0	113.1	S142 N144 V145 M881 L882 V883	S142-E879 VanDerWaalsContact CB-CD 3.5Å; S142-E879 VanDerWaalsContact CB-OE1 3.25Å; S142-E879 WeakPolarHBondContact CB-OE1 3.3Å; S142-E879 WeakPolarHBondContact OG-CG 3.31Å; S142-E879 PolarHBondContact OG-OE1 2.94Å; N144-E879 WeakPolarHBondContact CB-OE1 3.24Å; N144-E879 PolarHBondContact ND2-OE1 3.35Å; V145-E879 HydrophobicContact CG2-CG 3.66Å; E879-M881 VanDerWaalsContact C-N 3.3Å; E879-M881 PolarHBondContact O-N 3.37Å; E879-L882 PolarHBondContact O-N 3.45Å; E879-V883 WeakPolarHBondContact O-CG2 3.44Å; E879-V883 PolarHBondContact O-N 3.32Å
880	Q	60.8	Low	63.7	Low	127 Å²	127	43.4 Å²	43.4	59%	0.593	22%	0.216	S	C	*	.	H	α-helix	trans	-64.2	-39.1	-178.6	-61.6	80.5	15	0	0	111.4	C878 V883 C884	C878-Q880 VanDerWaalsContact C-N 3.28Å; C878-Q880 PolarHBondContact O-N 2.97Å; C878-Q880 PolarHBondContact SG-OE1 3.18Å; Q880-V883 PolarHBondContact O-N 3.08Å; Q880-C884 WeakPolarHBondContact O-CB 3.47Å; Q880-C884 PolarHBondContact O-N 3.37Å
881	M	65.9	Low	63.5	Low	9 Å²	9	42.4 Å²	42.4	4%	0.044	22%	0.216	C	C	.	.	H	α-helix	trans	-67.9	-44.6	176.9	-68.6	-53.3	-63.1	0	0	110.7	A56 W875 I876 C878 E879 V883 C884 Y885	A56-M881 HydrophobicContact CB-CE 3.77Å; A56-M881 HydrophobicContact CB-SD 3.3Å; A56-M881 WeakPolarHBondContact CB-SD 3.45Å; W875-M881 HydrophobicContact CD2-CG 4.45Å; W875-M881 HydrophobicContact CH2-CE 3.55Å; W875-M881 HydrophobicContact CH2-CG 4.26Å; W875-M881 HydrophobicContact CH2-SD 3.48Å; W875-M881 WeakPolarHBondContact CH2-SD 3.44Å; W875-M881 HydrophobicContact CZ2-CE 4.14Å; W875-M881 HydrophobicContact CZ2-CG 4.18Å; W875-M881 HydrophobicContact CZ2-SD 3.42Å; W875-M881 WeakPolarHBondContact CZ2-SD 3.39Å; W875-M881 HydrophobicContact CZ3-CE 3.98Å; W875-M881 HydrophobicContact CZ3-CG 4.42Å; W875-M881 HydrophobicContact CZ3-SD 4.16Å; W875-M881 WeakPolarHBondContact O-CG 3.34Å; I876-M881 WeakPolarHBondContact O-CB 3.36Å; C878-M881 WeakPolarHBondContact O-CB 3.24Å; C878-M881 PolarHBondContact O-N 2.94Å; E879-M881 VanDerWaalsContact C-N 3.3Å; E879-M881 PolarHBondContact O-N 3.37Å; M881-V883 VanDerWaalsContact C-N 3.3Å; M881-V883 PolarHBondContact O-N 3.39Å; M881-C884 WeakPolarHBondContact O-CB 3.19Å; M881-C884 PolarHBondContact O-N 2.85Å; M881-C884 VanDerWaalsContact O-N 3.14Å; M881-Y885 HydrophobicContact CB-CE2 4Å; M881-Y885 HydrophobicContact CE-CE1 3.65Å; M881-Y885 WeakPolarHBondContact CE-OH 3.5Å; M881-Y885 WeakPolarHBondContact O-CB 3.47Å; M881-Y885 WeakPolarHBondContact O-CD1 3.35Å; M881-Y885 VanDerWaalsContact O-CD2 3.28Å; M881-Y885 WeakPolarHBondContact O-CD2 3.32Å; M881-Y885 PolarHBondContact O-N 3.48Å
882	L	62.4	Low	63.5	Low	57 Å²	57	43.1 Å²	43.1	30%	0.298	22%	0.223	S	C	.	.	H	α-helix	trans	-57.6	-39.6	174.6	-64.2	178.1	0	0	0	112.6	V145 C878 E879 Y885 I886	V145-L882 HydrophobicContact CG2-CB 4.23Å; C878-L882 WeakPolarHBondContact O-CG 3.41Å; C878-L882 PolarHBondContact O-N 3.3Å; E879-L882 PolarHBondContact O-N 3.45Å; L882-Y885 HydrophobicContact CD2-CD2 4.26Å; L882-Y885 VanDerWaalsContact O-CB 3.26Å; L882-Y885 WeakPolarHBondContact O-CB 3.5Å; L882-I886 VanDerWaalsContact O-CD1 3.3Å; L882-I886 WeakPolarHBondContact O-CD1 3.18Å; L882-I886 WeakPolarHBondContact O-CG1 3.39Å; L882-I886 PolarHBondContact O-N 2.98Å
883	V	62.8	Low	63.5	Low	37 Å²	37	43 Å²	43	22%	0.224	22%	0.22	C	C	.	.	H	α-helix	trans	-67.1	-46.3	174.5	173.6	0	0	0	0	111.3	N144 V145 A148 E879 Q880 M881 Y885 I886 S887	N144-V883 HydrophobicContact CB-CG2 3.91Å; V145-V883 HydrophobicContact CG2-CG2 3.75Å; A148-V883 HydrophobicContact CB-CG1 4.46Å; E879-V883 WeakPolarHBondContact O-CG2 3.44Å; E879-V883 PolarHBondContact O-N 3.32Å; Q880-V883 PolarHBondContact O-N 3.08Å; M881-V883 VanDerWaalsContact C-N 3.3Å; M881-V883 PolarHBondContact O-N 3.39Å; V883-Y885 PolarHBondContact O-N 3.38Å; V883-I886 PolarHBondContact O-N 2.64Å; V883-S887 WeakPolarHBondContact O-CB 3.2Å; V883-S887 PolarHBondContact O-N 2.78Å; V883-S887 PolarHBondContact O-OG 3.31Å
884	C	58	Low	64.3	Low	13 Å²	13	43 Å²	43	9%	0.088	22%	0.22	C	C	.	.	H	α-helix	trans	-56.5	-43.2	176.5	169.9	0	0	0	0	111.4	A56 Q880 M881 S887 V888	A56-C884 HydrophobicContact CB-CB 4.49Å; Q880-C884 WeakPolarHBondContact O-CB 3.47Å; Q880-C884 PolarHBondContact O-N 3.37Å; M881-C884 WeakPolarHBondContact O-CB 3.19Å; M881-C884 PolarHBondContact O-N 2.85Å; M881-C884 VanDerWaalsContact O-N 3.14Å; C884-S887 VanDerWaalsContact O-CB 3.26Å; C884-S887 WeakPolarHBondContact O-CB 3.28Å; C884-S887 PolarHBondContact O-N 2.83Å; C884-V888 VanDerWaalsContact O-CG2 3.29Å; C884-V888 WeakPolarHBondContact O-CG2 3.32Å; C884-V888 PolarHBondContact O-N 2.82Å
885	Y	61.2	Low	64.7	Low	16 Å²	16	40.8 Å²	40.8	6%	0.063	21%	0.211	C	C	.	.	H	α-helix	trans	-58.1	-58.9	174.5	-84.6	2.1	0	0	0	113	F81 I876 M881 L882 V883 S887 V888 F889	F81-Y885 AromaticContact CD1-CD1 3.95Å; F81-Y885 HydrophobicContact CD1-CD1 3.95Å; F81-Y885 HydrophobicContact CD1-CD2 4.34Å; F81-Y885 HydrophobicContact CD1-CE1 4.46Å; F81-Y885 AromaticContact CD1-CG 3.9Å; F81-Y885 HydrophobicContact CD1-CG 3.9Å; F81-Y885 AromaticContact CD2-CD2 3.55Å; F81-Y885 HydrophobicContact CD2-CD2 3.55Å; F81-Y885 HydrophobicContact CD2-CE2 4.29Å; F81-Y885 AromaticContact CD2-CG 3.74Å; F81-Y885 HydrophobicContact CD2-CG 3.74Å; F81-Y885 AromaticContact CE1-CD1 3.66Å; F81-Y885 HydrophobicContact CE1-CD1 3.66Å; F81-Y885 HydrophobicContact CE1-CD2 4.33Å; F81-Y885 AromaticContact CE1-CG 3.53Å; F81-Y885 HydrophobicContact CE1-CG 3.53Å; F81-Y885 HydrophobicContact CE2-CD1 4.36Å; F81-Y885 AromaticContact CE2-CD2 3.58Å; F81-Y885 HydrophobicContact CE2-CD2 3.58Å; F81-Y885 AromaticContact CE2-CG 3.4Å; F81-Y885 HydrophobicContact CE2-CG 3.4Å; F81-Y885 HydrophobicContact CG-CD1 4.41Å; F81-Y885 AromaticContact CG-CD2 4Å; F81-Y885 HydrophobicContact CG-CD2 4Å; F81-Y885 HydrophobicContact CG-CE2 4.43Å; F81-Y885 HydrophobicContact CG-CG 4.01Å; F81-Y885 AromaticContact CZ-CD1 3.93Å; F81-Y885 HydrophobicContact CZ-CD1 3.93Å; F81-Y885 AromaticContact CZ-CD2 4Å; F81-Y885 HydrophobicContact CZ-CD2 4Å; F81-Y885 AromaticContact CZ-CG 3.3Å; F81-Y885 HydrophobicContact CZ-CG 3.3Å; F81-Y885 WeakPolarHBondContact CZ-O 3.47Å; I876-Y885 WeakPolarHBondContact O-CE2 3.39Å; I876-Y885 PolarHBondContact O-OH 3.4Å; M881-Y885 HydrophobicContact CB-CE2 4Å; M881-Y885 HydrophobicContact CE-CE1 3.65Å; M881-Y885 WeakPolarHBondContact CE-OH 3.5Å; M881-Y885 WeakPolarHBondContact O-CB 3.47Å; M881-Y885 WeakPolarHBondContact O-CD1 3.35Å; M881-Y885 VanDerWaalsContact O-CD2 3.28Å; M881-Y885 WeakPolarHBondContact O-CD2 3.32Å; M881-Y885 PolarHBondContact O-N 3.48Å; L882-Y885 HydrophobicContact CD2-CD2 4.26Å; L882-Y885 VanDerWaalsContact O-CB 3.26Å; L882-Y885 WeakPolarHBondContact O-CB 3.5Å; V883-Y885 PolarHBondContact O-N 3.38Å; Y885-S887 PolarHBondContact O-N 3.42Å; Y885-V888 PolarHBondContact O-N 3.43Å; Y885-F889 WeakPolarHBondContact O-CB 3.47Å; Y885-F889 PolarHBondContact O-N 3.33Å
886	I	63.6	Low	65.2	Low	19 Å²	19	46.4 Å²	46.4	10%	0.097	25%	0.245	C	C	.	.	H	α-helix	trans	-59.6	-34.9	177.3	-65.4	158.6	0	0	0	110.7	V145 A148 L149 V152 L882 V883 F889 R890	V145-I886 HydrophobicContact CG1-CD1 3.98Å; A148-I886 HydrophobicContact CB-CB 4.17Å; A148-I886 HydrophobicContact CB-CD1 4.39Å; A148-I886 HydrophobicContact CB-CG2 3.75Å; L149-I886 HydrophobicContact CD2-CD1 3.64Å; L149-I886 HydrophobicContact CD2-CG1 4.1Å; L149-I886 HydrophobicContact CD2-CG2 4.46Å; L149-I886 HydrophobicContact CG-CD1 3.8Å; V152-I886 HydrophobicContact CG2-CG2 3.75Å; L882-I886 VanDerWaalsContact O-CD1 3.3Å; L882-I886 WeakPolarHBondContact O-CD1 3.18Å; L882-I886 WeakPolarHBondContact O-CG1 3.39Å; L882-I886 PolarHBondContact O-N 2.98Å; V883-I886 PolarHBondContact O-N 2.64Å; I886-F889 WeakPolarHBondContact O-CB 3.28Å; I886-F889 PolarHBondContact O-N 3.18Å; I886-R890 VanDerWaalsContact O-CB 3.32Å; I886-R890 WeakPolarHBondContact O-CB 3.44Å; I886-R890 PolarHBondContact O-N 3.37Å
887	S	66.2	Low	66.5	Low	12 Å²	12	47.9 Å²	47.9	8%	0.084	26%	0.259	C	S	.	.	H	α-helix	trans	-64.2	-49.8	176.6	-78.2	0	0	0	0	113.3	F49 V883 C884 Y885 F889 R890 D891	F49-S887 WeakPolarHBondContact CE2-OG 3.24Å; F49-S887 WeakPolarHBondContact CZ-OG 3.49Å; V883-S887 WeakPolarHBondContact O-CB 3.2Å; V883-S887 PolarHBondContact O-N 2.78Å; V883-S887 PolarHBondContact O-OG 3.31Å; C884-S887 VanDerWaalsContact O-CB 3.26Å; C884-S887 WeakPolarHBondContact O-CB 3.28Å; C884-S887 PolarHBondContact O-N 2.83Å; Y885-S887 PolarHBondContact O-N 3.42Å; S887-F889 VanDerWaalsContact C-N 3.28Å; S887-F889 PolarHBondContact O-N 3.47Å; S887-R890 PolarHBondContact O-N 3.46Å; S887-D891 WeakPolarHBondContact O-CB 3.48Å; S887-D891 PolarHBondContact O-N 3.08Å
888	V	59.6	Low	67.4	Low	61 Å²	61	51.7 Å²	51.7	37%	0.37	28%	0.276	S	S	.	.	H	α-helix	trans	-60.4	-43.1	174.8	167.3	0	0	0	0	110.2	V53 C884 Y885 D891 T892	V53-V888 HydrophobicContact CG1-CG2 3.91Å; V53-V888 HydrophobicContact CG2-CG2 4.14Å; C884-V888 VanDerWaalsContact O-CG2 3.29Å; C884-V888 WeakPolarHBondContact O-CG2 3.32Å; C884-V888 PolarHBondContact O-N 2.82Å; Y885-V888 PolarHBondContact O-N 3.43Å; V888-D891 PolarHBondContact O-N 3.19Å; V888-T892 WeakPolarHBondContact O-CB 3.09Å; V888-T892 PolarHBondContact O-N 2.68Å; V888-T892 PolarHBondContact O-OG1 3.48Å
889	F	61.6	Low	67.8	Low	12 Å²	12	51.2 Å²	51.2	5%	0.053	27%	0.272	C	S	.	.	H	α-helix	trans	-57.8	-53.7	174.3	167.7	-98.3	0	0	0	111.6	C85 V152 Y885 I886 S887 D891 T892 F893 W894	C85-F889 HydrophobicContact CB-CB 3.99Å; C85-F889 HydrophobicContact CB-CD2 3.78Å; C85-F889 HydrophobicContact CB-CG 4Å; C85-F889 WeakPolarHBondContact O-CD2 3.32Å; C85-F889 WeakPolarHBondContact O-CE2 3.48Å; V152-F889 HydrophobicContact CG1-CD1 4.32Å; V152-F889 HydrophobicContact CG1-CE1 3.64Å; V152-F889 HydrophobicContact CG2-CD1 3.95Å; V152-F889 HydrophobicContact CG2-CE1 4.03Å; Y885-F889 WeakPolarHBondContact O-CB 3.47Å; Y885-F889 PolarHBondContact O-N 3.33Å; I886-F889 WeakPolarHBondContact O-CB 3.28Å; I886-F889 PolarHBondContact O-N 3.18Å; S887-F889 VanDerWaalsContact C-N 3.28Å; S887-F889 PolarHBondContact O-N 3.47Å; F889-D891 VanDerWaalsContact C-N 3.29Å; F889-D891 PolarHBondContact O-N 3.03Å; F889-T892 WeakPolarHBondContact O-CB 3.47Å; F889-T892 PolarHBondContact O-N 3.38Å; F889-F893 AromaticContact CD2-CD2 3.67Å; F889-F893 HydrophobicContact CD2-CD2 3.67Å; F889-F893 AromaticContact CD2-CE2 3.74Å; F889-F893 HydrophobicContact CD2-CE2 3.74Å; F889-F893 AromaticContact CE2-CD2 3.19Å; F889-F893 HydrophobicContact CE2-CD2 3.19Å; F889-F893 AromaticContact CE2-CE2 3.22Å; F889-F893 HydrophobicContact CE2-CE2 3.22Å; F889-F893 HydrophobicContact CE2-CG 4.01Å; F889-F893 HydrophobicContact CE2-CZ 4.02Å; F889-F893 AromaticContact CZ-CD2 3.8Å; F889-F893 HydrophobicContact CZ-CD2 3.8Å; F889-F893 HydrophobicContact CZ-CE2 4.15Å; F889-F893 HydrophobicContact CZ-CG 4.19Å; F889-F893 WeakPolarHBondContact O-CD2 3.37Å; F889-F893 PolarHBondContact O-N 3.27Å; F889-F893 VanDerWaalsContact O-N 3.14Å; F889-W894 HydrophobicContact CE1-CZ3 4.29Å; F889-W894 HydrophobicContact CZ-CZ3 4.4Å
890	R	72.6	Confident	67.7	Low	44 Å²	44	49.3 Å²	49.3	17%	0.166	27%	0.267	C	S	.	.	H	α-helix	trans	-54.2	-46.4	178.3	-174.7	-161.3	70.3	-168.6	3.9	111.3	F49 E151 V152 L155 I886 S887 F893 W894	F49-R890 VanDerWaalsContact CZ-CZ 3.48Å; E151-R890 IonicContact OE2-CZ 3.95Å; E151-R890 IonicContact OE2-NH1 2.71Å; E151-R890 PolarHBondContact OE2-NH1 2.9Å; V152-R890 HydrophobicContact CG2-CB 4.01Å; V152-R890 HydrophobicContact CG2-CG 4.3Å; L155-R890 HydrophobicContact CD1-CG 3.71Å; I886-R890 VanDerWaalsContact O-CB 3.32Å; I886-R890 WeakPolarHBondContact O-CB 3.44Å; I886-R890 PolarHBondContact O-N 3.37Å; S887-R890 PolarHBondContact O-N 3.46Å; R890-F893 PolarHBondContact O-N 2.86Å; R890-W894 CarbonylContact O-C 3.55Å; R890-W894 WeakPolarHBondContact O-CA 3.38Å; R890-W894 WeakPolarHBondContact O-CB 3.47Å; R890-W894 PolarHBondContact O-N 3.07Å
891	D	64.7	Low	68.3	Low	53 Å²	53	48.7 Å²	48.7	28%	0.283	27%	0.274	S	S	.	.	H	α-helix	trans	-76.1	-24.3	-175.9	-79.5	22.3	0	0	0	113.6	F49 S887 V888 F889 P895	F49-D891 WeakPolarHBondContact CD1-OD2 3.49Å; F49-D891 HydrophobicContact CE1-CB 4.27Å; F49-D891 WeakPolarHBondContact CE1-OD2 3.38Å; S887-D891 WeakPolarHBondContact O-CB 3.48Å; S887-D891 PolarHBondContact O-N 3.08Å; V888-D891 PolarHBondContact O-N 3.19Å; F889-D891 VanDerWaalsContact C-N 3.29Å; F889-D891 PolarHBondContact O-N 3.03Å; D891-P895 VanDerWaalsContact O-CA 3.29Å; D891-P895 WeakPolarHBondContact O-CA 3.26Å; D891-P895 WeakPolarHBondContact O-CD 3.27Å; D891-P895 VanDerWaalsContact O-N 3.14Å
892	T	63.6	Low	68	Low	89 Å²	89	53.2 Å²	53.2	55%	0.546	30%	0.295	S	S	.	.	H	α-helix	trans	-68.3	-42	171.8	-58.6	0	0	0	0	110.7	V888 F889	V888-T892 WeakPolarHBondContact O-CB 3.09Å; V888-T892 PolarHBondContact O-N 2.68Å; V888-T892 PolarHBondContact O-OG1 3.48Å; F889-T892 WeakPolarHBondContact O-CB 3.47Å; F889-T892 PolarHBondContact O-N 3.38Å
893	F	59.4	Low	68	Low	31 Å²	31	54.6 Å²	54.6	14%	0.136	32%	0.315	C	S	.	.	H	α-helix	trans	-87.5	-33.8	-177.6	-80.7	-90.8	0	0	0	113.2	G89 V92 L93 F889 R890 P895 L899 A900	G89-F893 WeakPolarHBondContact O-CE1 3.12Å; G89-F893 VanDerWaalsContact O-CZ 3.25Å; G89-F893 WeakPolarHBondContact O-CZ 3.48Å; V92-F893 HydrophobicContact CB-CD1 4.45Å; V92-F893 HydrophobicContact CG1-CB 4.24Å; V92-F893 HydrophobicContact CG1-CD1 3.12Å; V92-F893 HydrophobicContact CG1-CE1 3.48Å; V92-F893 VanDerWaalsContact CG1-CE1 3.48Å; V92-F893 HydrophobicContact CG1-CG 3.78Å; V92-F893 HydrophobicContact CG1-CZ 4.41Å; L93-F893 HydrophobicContact CD1-CE1 4.47Å; L93-F893 HydrophobicContact CD1-CZ 4.46Å; L93-F893 HydrophobicContact CD2-CE1 3.78Å; L93-F893 HydrophobicContact CG-CE1 3.74Å; L93-F893 HydrophobicContact CG-CZ 4.17Å; F889-F893 AromaticContact CD2-CD2 3.67Å; F889-F893 HydrophobicContact CD2-CD2 3.67Å; F889-F893 AromaticContact CD2-CE2 3.74Å; F889-F893 HydrophobicContact CD2-CE2 3.74Å; F889-F893 AromaticContact CE2-CD2 3.19Å; F889-F893 HydrophobicContact CE2-CD2 3.19Å; F889-F893 AromaticContact CE2-CE2 3.22Å; F889-F893 HydrophobicContact CE2-CE2 3.22Å; F889-F893 HydrophobicContact CE2-CG 4.01Å; F889-F893 HydrophobicContact CE2-CZ 4.02Å; F889-F893 AromaticContact CZ-CD2 3.8Å; F889-F893 HydrophobicContact CZ-CD2 3.8Å; F889-F893 HydrophobicContact CZ-CE2 4.15Å; F889-F893 HydrophobicContact CZ-CG 4.19Å; F889-F893 WeakPolarHBondContact O-CD2 3.37Å; F889-F893 PolarHBondContact O-N 3.27Å; F889-F893 VanDerWaalsContact O-N 3.14Å; R890-F893 PolarHBondContact O-N 2.86Å; F893-P895 VanDerWaalsContact C-CD 3.47Å; F893-L899 CarbonylContact O-C 3.6Å; F893-L899 WeakPolarHBondContact O-CA 3.33Å; F893-L899 WeakPolarHBondContact O-CD1 3.46Å; F893-A900 WeakPolarHBondContact O-CB 3.44Å; F893-A900 PolarHBondContact O-N 3.23Å
894	W	78.4	Confident	68.5	Low	0 Å²	0	62 Å²	62	0%	0	34%	0.344	C	S	.	.	S	Bend	trans	-128	65.9	178.7	-66.9	-90.8	0	0	0	111.8	V92 L155 A156 D159 Y160 F889 R890 N896 G897 K898 L899	V92-W894 HydrophobicContact CB-CH2 4.21Å; V92-W894 HydrophobicContact CG1-CH2 3.65Å; V92-W894 HydrophobicContact CG1-CZ2 4.31Å; V92-W894 HydrophobicContact CG1-CZ3 4.05Å; V92-W894 HydrophobicContact CG2-CH2 3.53Å; V92-W894 HydrophobicContact CG2-CZ2 4.47Å; V92-W894 HydrophobicContact CG2-CZ3 4.24Å; L155-W894 HydrophobicContact CB-CD2 3.8Å; L155-W894 HydrophobicContact CB-CE3 4.23Å; L155-W894 HydrophobicContact CB-CG 4.15Å; L155-W894 HydrophobicContact CB-CH2 4.26Å; L155-W894 HydrophobicContact CB-CZ2 3.87Å; L155-W894 HydrophobicContact CB-CZ3 4.45Å; L155-W894 HydrophobicContact CD1-CB 3.95Å; L155-W894 HydrophobicContact CD1-CD2 4.02Å; L155-W894 HydrophobicContact CD1-CE3 4.21Å; L155-W894 HydrophobicContact CD1-CG 3.91Å; L155-W894 HydrophobicContact CD2-CG 4.26Å; L155-W894 HydrophobicContact CG-CD2 4.41Å; L155-W894 HydrophobicContact CG-CG 4.35Å; A156-W894 HydrophobicContact CB-CH2 4.08Å; A156-W894 HydrophobicContact CB-CZ2 4.37Å; D159-W894 VanDerWaalsContact OD2-CD1 3.26Å; D159-W894 PolarHBondContact OD2-NE1 3.29Å; Y160-W894 HydrophobicContact CD2-CZ2 4.08Å; Y160-W894 AromaticContact CE2-CH2 3.92Å; Y160-W894 HydrophobicContact CE2-CH2 3.92Å; Y160-W894 AromaticContact CE2-CZ2 3.47Å; Y160-W894 HydrophobicContact CE2-CZ2 3.47Å; Y160-W894 VanDerWaalsContact CE2-CZ2 3.47Å; F889-W894 HydrophobicContact CE1-CZ3 4.29Å; F889-W894 HydrophobicContact CZ-CZ3 4.4Å; R890-W894 CarbonylContact O-C 3.55Å; R890-W894 WeakPolarHBondContact O-CA 3.38Å; R890-W894 WeakPolarHBondContact O-CB 3.47Å; R890-W894 PolarHBondContact O-N 3.07Å; W894-N896 PolarHBondContact O-N 2.92Å; W894-N896 VanDerWaalsContact O-N 3.13Å; W894-G897 WeakPolarHBondContact O-CA 3.32Å; W894-G897 PolarHBondContact O-N 3.4Å; W894-K898 CarbonylContact C-O 3.51Å; W894-K898 WeakPolarHBondContact CA-O 3.15Å; W894-L899 HydrophobicContact CD2-CD1 4.37Å; W894-L899 HydrophobicContact CZ2-CD1 4.33Å
895	P	74.5	Confident	69.2	Low	52 Å²	52	67.9 Å²	67.9	34%	0.338	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-55.8	123.6	174.2	23.4	-34.1	0	0	0	109.8	D891 F893 G897 K898 A900	D891-P895 VanDerWaalsContact O-CA 3.29Å; D891-P895 WeakPolarHBondContact O-CA 3.26Å; D891-P895 WeakPolarHBondContact O-CD 3.27Å; D891-P895 VanDerWaalsContact O-N 3.14Å; F893-P895 VanDerWaalsContact C-CD 3.47Å; P895-G897 PolarHBondContact O-N 2.84Å; P895-K898 WeakPolarHBondContact CD-O 3.36Å; P895-K898 PolarHBondContact O-N 3.05Å; P895-A900 HydrophobicContact CG-CB 4.29Å
896	N	78.1	Confident	70.3	Confident	164 Å²	164	70 Å²	70	88%	0.877	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	55.6	33.1	-174	-52.2	-55.5	0	0	0	113.8	W894 K898	W894-N896 PolarHBondContact O-N 2.92Å; W894-N896 VanDerWaalsContact O-N 3.13Å; N896-K898 PolarHBondContact O-N 3.4Å
897	G	79.9	Confident	71.5	Confident	31 Å²	31	72.6 Å²	72.6	32%	0.32	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	74.9	5.8	179.6	0	0	0	0	0	115	R158 W894 P895	R158-G897 PolarHBondContact NH1-O 3.19Å; R158-G897 PolarHBondContact NH2-O 3.45Å; W894-G897 WeakPolarHBondContact O-CA 3.32Å; W894-G897 PolarHBondContact O-N 3.4Å; P895-G897 PolarHBondContact O-N 2.84Å
898	K	83.1	Confident	72.5	Confident	161 Å²	161	78.2 Å²	78.2	70%	0.7	43%	0.433	S	S	*	.	S	Bend	trans	-111.8	133.9	179	-67.1	-177.6	-178	178	0	110.7	W894 P895 N896 A900	W894-K898 CarbonylContact C-O 3.51Å; W894-K898 WeakPolarHBondContact CA-O 3.15Å; P895-K898 WeakPolarHBondContact CD-O 3.36Å; P895-K898 PolarHBondContact O-N 3.05Å; N896-K898 PolarHBondContact O-N 3.4Å; K898-A900 PolarHBondContact O-N 3.06Å
899	L	74.7	Confident	74	Confident	20 Å²	20	79.7 Å²	79.7	11%	0.105	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-66.1	126.2	-174.1	-174.9	46	0	0	0	112.7	R96 D159 Y160 F893 W894	R96-L899 VanDerWaalsContact CD-CG 3.41Å; R96-L899 HydrophobicContact CG-CD2 4.12Å; D159-L899 HydrophobicContact CB-CD2 3.42Å; D159-L899 VanDerWaalsContact CB-CD2 3.42Å; D159-L899 WeakPolarHBondContact OD2-CB 3.27Å; Y160-L899 HydrophobicContact CD1-CD2 4.31Å; Y160-L899 HydrophobicContact CE1-CD2 3.69Å; Y160-L899 HydrophobicContact CE2-CD1 4.48Å; Y160-L899 HydrophobicContact CE2-CD2 4.09Å; Y160-L899 WeakPolarHBondContact OH-CD1 3.35Å; F893-L899 CarbonylContact O-C 3.6Å; F893-L899 WeakPolarHBondContact O-CA 3.33Å; F893-L899 WeakPolarHBondContact O-CD1 3.46Å; W894-L899 HydrophobicContact CD2-CD1 4.37Å; W894-L899 HydrophobicContact CZ2-CD1 4.33Å
900	A	71.3	Confident	75.3	Confident	27 Å²	27	82.8 Å²	82.8	22%	0.223	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-52.3	140.3	-170.2	0	0	0	0	0	112.7	F893 P895 K898	F893-A900 WeakPolarHBondContact O-CB 3.44Å; F893-A900 PolarHBondContact O-N 3.23Å; P895-A900 HydrophobicContact CG-CB 4.29Å; K898-A900 PolarHBondContact O-N 3.06Å
901	P	73.1	Confident	76.2	Confident	114 Å²	114	85 Å²	85	74%	0.74	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-67	161	174.8	29	-33.5	0	0	0	110.8	A903	P901-A903 PolarHBondContact O-N 3.4Å
902	H	59.5	Low	77.5	Confident	104 Å²	104	85.2 Å²	85.2	48%	0.481	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-67.3	128.1	174.1	-92.8	-25	0	0	0	111.1	K97 K904	K97-H902 WeakPolarHBondContact CB-NE2 3.28Å; K97-H902 VanDerWaalsContact CD-CD2 3.49Å; K97-H902 WeakPolarHBondContact CD-CD2 3.4Å; K97-H902 WeakPolarHBondContact CD-NE2 3.16Å; K97-H902 WeakPolarHBondContact CG-CE1 3.05Å; K97-H902 WeakPolarHBondContact CG-NE2 3.22Å; K97-H902 PolarHBondContact NZ-CD2 3.34Å; K97-H902 PolarHBondContact NZ-NE2 3.28Å; H902-K904 PolarHBondContact O-N 2.93Å
903	A	63.1	Low	78.9	Confident	87 Å²	87	86.1 Å²	86.1	72%	0.719	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-59.5	129.4	168.3	0	0	0	0	0	109.4	P901	P901-A903 PolarHBondContact O-N 3.4Å
904	K	71.4	Confident	80.5	Confident	191 Å²	191	85 Å²	85	83%	0.83	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-67.8	145.4	171.9	-68.5	-179.1	179.7	179	0	109.1	H902 R906	H902-K904 PolarHBondContact O-N 2.93Å; K904-R906 PolarHBondContact O-N 2.94Å
905	V	74	Confident	81.2	Confident	137 Å²	137	89 Å²	89	83%	0.83	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-65.1	122.7	172.9	-178.8	0	0	0	0	108.3
906	R	83.3	Confident	82.2	Confident	60 Å²	60	92.5 Å²	92.5	23%	0.226	50%	0.498	C	S	.	.	P	Polyproline II helix	trans	-84.1	143.7	-176.8	-61	-165.5	74.8	-169.1	8	112.1	D294 K904 E910 R911 T914	D294-R906 IonicContact OD1-NH1 3.42Å; D294-R906 PolarHBondContact OD1-NH1 2.92Å; D294-R906 IonicContact OD2-NH1 3.69Å; K904-R906 PolarHBondContact O-N 2.94Å; R906-E910 WeakPolarHBondContact CB-OE2 3.43Å; R906-E910 IonicContact CZ-OE2 3.23Å; R906-E910 IonicContact NE-OE2 2.75Å; R906-E910 PolarHBondContact NE-OE2 2.82Å; R906-E910 IonicContact NH2-OE2 3.34Å; R906-R911 HydrophobicContact CB-CG 4.43Å; R906-R911 PolarHBondContact O-NE 2.92Å; R906-R911 PolarHBondContact O-NH2 3.41Å; R906-T914 PolarHBondContact NH1-OG1 3.23Å; R906-T914 PolarHBondContact NH2-OG1 3.37Å
907	T	89.1	Confident	83	Confident	75 Å²	75	90.2 Å²	90.2	46%	0.46	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-74.5	157.4	177.3	63.8	0	0	0	0	111.8	S909 E910 R911	T907-S909 VanDerWaalsContact C-N 3.26Å; T907-S909 PolarHBondContact O-N 3.23Å; T907-E910 WeakPolarHBondContact O-CB 3.01Å; T907-E910 PolarHBondContact O-N 3.04Å; T907-E910 WeakPolarHBondContact OG1-CG 2.94Å; T907-E910 PolarHBondContact OG1-N 2.99Å; T907-R911 WeakPolarHBondContact O-CG 3.06Å; T907-R911 PolarHBondContact O-N 2.89Å; T907-R911 VanDerWaalsContact O-N 3.13Å
908	D	88.1	Confident	83.5	Confident	130 Å²	130	88.8 Å²	88.8	70%	0.695	46%	0.462	S	S	*	.	H	α-helix	trans	-63.8	-32.6	179.6	-64	-33.2	0	0	0	112.6	R911 S912	D908-R911 PolarHBondContact O-N 3.27Å; D908-S912 PolarHBondContact O-N 3.02Å
909	S	89.9	Confident	84	Confident	91 Å²	91	83.8 Å²	83.8	64%	0.636	44%	0.441	S	S	*	.	H	α-helix	trans	-60.3	-49.4	173.8	-172.9	0	0	0	0	111.6	T907 R911 S912 E913	T907-S909 VanDerWaalsContact C-N 3.26Å; T907-S909 PolarHBondContact O-N 3.23Å; S909-R911 VanDerWaalsContact C-N 3.28Å; S909-R911 PolarHBondContact O-N 2.56Å; S909-S912 PolarHBondContact O-N 3.2Å; S909-E913 PolarHBondContact O-N 3.32Å
910	E	90.1	Very high	84.9	Confident	77 Å²	77	87.4 Å²	87.4	36%	0.36	46%	0.457	S	S	.	.	H	α-helix	trans	-60.4	-37.4	176.8	-79.7	175.1	-152.2	0	0	112.7	R906 T907 T914	R906-E910 WeakPolarHBondContact CB-OE2 3.43Å; R906-E910 IonicContact CZ-OE2 3.23Å; R906-E910 IonicContact NE-OE2 2.75Å; R906-E910 PolarHBondContact NE-OE2 2.82Å; R906-E910 IonicContact NH2-OE2 3.34Å; T907-E910 WeakPolarHBondContact O-CB 3.01Å; T907-E910 PolarHBondContact O-N 3.04Å; T907-E910 WeakPolarHBondContact OG1-CG 2.94Å; T907-E910 PolarHBondContact OG1-N 2.99Å; E910-T914 WeakPolarHBondContact O-CB 3.32Å; E910-T914 PolarHBondContact O-N 3.31Å; E910-T914 PolarHBondContact O-OG1 3.35Å
911	R	91.3	Very high	85.7	Confident	90 Å²	90	88.2 Å²	88.2	34%	0.34	46%	0.456	S	S	.	.	H	α-helix	trans	-67.9	-42.2	177.2	-64.7	176.8	-170.2	-148	4.1	111.2	D294 R906 T907 D908 S909 T914 K915	D294-R911 HydrophobicContact CB-CB 4.41Å; D294-R911 HydrophobicContact CB-CG 4Å; R906-R911 HydrophobicContact CB-CG 4.43Å; R906-R911 PolarHBondContact O-NE 2.92Å; R906-R911 PolarHBondContact O-NH2 3.41Å; T907-R911 WeakPolarHBondContact O-CG 3.06Å; T907-R911 PolarHBondContact O-N 2.89Å; T907-R911 VanDerWaalsContact O-N 3.13Å; D908-R911 PolarHBondContact O-N 3.27Å; S909-R911 VanDerWaalsContact C-N 3.28Å; S909-R911 PolarHBondContact O-N 2.56Å; R911-T914 PolarHBondContact O-N 3.08Å; R911-K915 WeakPolarHBondContact O-CB 2.77Å; R911-K915 PolarHBondContact O-N 2.68Å
912	S	91.8	Very high	86.4	Confident	58 Å²	58	84.4 Å²	84.4	41%	0.406	43%	0.429	S	S	.	.	H	α-helix	trans	-63.7	-45.6	177	-162.7	0	0	0	0	111.5	D908 S909 T914 K915 E916	D908-S912 PolarHBondContact O-N 3.02Å; S909-S912 PolarHBondContact O-N 3.2Å; S912-T914 VanDerWaalsContact C-N 3.34Å; S912-T914 PolarHBondContact O-N 3.01Å; S912-K915 WeakPolarHBondContact O-CB 2.86Å; S912-K915 PolarHBondContact O-N 3.06Å; S912-E916 PolarHBondContact O-N 2.85Å
913	E	93.6	Very high	87.7	Confident	109 Å²	109	80.4 Å²	80.4	51%	0.509	41%	0.411	S	S	.	.	H	α-helix	trans	-59.7	-45.6	175.5	-171.9	-167.2	158.3	0	0	111.1	S909 K915 E916 R917	S909-E913 PolarHBondContact O-N 3.32Å; E913-K915 VanDerWaalsContact C-N 3.29Å; E913-K915 PolarHBondContact O-N 2.87Å; E913-E916 PolarHBondContact O-N 3.42Å; E913-R917 WeakPolarHBondContact O-CB 3.41Å; E913-R917 PolarHBondContact O-N 3.07Å
914	T	91.9	Very high	88.8	Confident	7 Å²	7	81.3 Å²	81.3	4%	0.043	40%	0.404	C	S	.	.	H	α-helix	trans	-61	-40.3	177.7	-55.5	0	0	0	0	111.1	N297 R298 L301 R906 E910 R911 S912 A918	N297-T914 HydrophobicContact CB-CG2 4.09Å; R298-T914 HydrophobicContact CG-CG2 3.7Å; L301-T914 HydrophobicContact CD1-CG2 3.77Å; R906-T914 PolarHBondContact NH1-OG1 3.23Å; R906-T914 PolarHBondContact NH2-OG1 3.37Å; E910-T914 WeakPolarHBondContact O-CB 3.32Å; E910-T914 PolarHBondContact O-N 3.31Å; E910-T914 PolarHBondContact O-OG1 3.35Å; R911-T914 PolarHBondContact O-N 3.08Å; S912-T914 VanDerWaalsContact C-N 3.34Å; S912-T914 PolarHBondContact O-N 3.01Å; T914-A918 VanDerWaalsContact O-CB 3.22Å; T914-A918 WeakPolarHBondContact O-CB 3.47Å; T914-A918 PolarHBondContact O-N 3.44Å
915	K	94.3	Very high	89.3	Confident	84 Å²	84	75.7 Å²	75.7	37%	0.365	38%	0.383	S	S	.	.	H	α-helix	trans	-63.1	-50.8	176.9	177.7	-177.8	175.6	179.5	0	112.1	R911 S912 E913 R917 A918 Q919 F947	R911-K915 WeakPolarHBondContact O-CB 2.77Å; R911-K915 PolarHBondContact O-N 2.68Å; S912-K915 WeakPolarHBondContact O-CB 2.86Å; S912-K915 PolarHBondContact O-N 3.06Å; E913-K915 VanDerWaalsContact C-N 3.29Å; E913-K915 PolarHBondContact O-N 2.87Å; K915-R917 VanDerWaalsContact C-N 3.33Å; K915-R917 PolarHBondContact O-N 3.4Å; K915-A918 PolarHBondContact O-N 3.11Å; K915-Q919 WeakPolarHBondContact O-CB 3.42Å; K915-Q919 PolarHBondContact O-N 2.97Å; K915-F947 HydrophobicContact CG-CE1 4.08Å; K915-F947 HydrophobicContact CG-CZ 4.01Å; K915-F947 WeakPolarHBondContact O-CZ 3.42Å
916	E	94.3	Very high	89.4	Confident	126 Å²	126	70.4 Å²	70.4	59%	0.589	35%	0.35	S	S	*	.	H	α-helix	trans	-61.2	-44.5	179.8	-73.1	176.2	-167.1	0	0	111.4	S912 E913 A918 Q919 Q920	S912-E916 PolarHBondContact O-N 2.85Å; E913-E916 PolarHBondContact O-N 3.42Å; E916-A918 PolarHBondContact O-N 3.47Å; E916-Q919 PolarHBondContact O-N 3.38Å; E916-Q920 WeakPolarHBondContact O-CB 3.23Å; E916-Q920 PolarHBondContact O-N 3.14Å
917	R	94.3	Very high	88.8	Confident	116 Å²	116	69 Å²	69	44%	0.438	35%	0.349	S	S	.	.	H	α-helix	trans	-64.1	-42.4	178.6	-146.6	176.7	82.4	-162.8	10.2	111.6	L301 E305 E913 K915 Q920 K921	L301-R917 HydrophobicContact CD1-CB 4.26Å; L301-R917 HydrophobicContact CD2-CB 4.34Å; L301-R917 HydrophobicContact CD2-CG 4.39Å; E305-R917 IonicContact OE1-CZ 3.38Å; E305-R917 IonicContact OE1-NE 3.1Å; E305-R917 IonicContact OE1-NH2 3.51Å; E305-R917 PolarHBondContact OE1-NH2 3.11Å; E305-R917 IonicContact OE2-NH2 3.69Å; E913-R917 WeakPolarHBondContact O-CB 3.41Å; E913-R917 PolarHBondContact O-N 3.07Å; K915-R917 VanDerWaalsContact C-N 3.33Å; K915-R917 PolarHBondContact O-N 3.4Å; R917-Q920 PolarHBondContact O-N 3.28Å; R917-K921 VanDerWaalsContact O-CB 3.27Å; R917-K921 WeakPolarHBondContact O-CB 3.42Å; R917-K921 PolarHBondContact O-N 3.1Å
918	A	91.5	Very high	87.5	Confident	0 Å²	0	71 Å²	71	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-62.8	-44.2	176.6	0	0	0	0	0	111.7	N297 L301 T914 K915 E916 L922 F947	N297-A918 HydrophobicContact CB-CB 3.83Å; L301-A918 HydrophobicContact CD1-CB 4.07Å; L301-A918 HydrophobicContact CD2-CB 4.28Å; L301-A918 HydrophobicContact CG-CB 3.79Å; T914-A918 VanDerWaalsContact O-CB 3.22Å; T914-A918 WeakPolarHBondContact O-CB 3.47Å; T914-A918 PolarHBondContact O-N 3.44Å; K915-A918 PolarHBondContact O-N 3.11Å; E916-A918 PolarHBondContact O-N 3.47Å; A918-L922 VanDerWaalsContact O-CB 3.3Å; A918-L922 WeakPolarHBondContact O-CB 3.44Å; A918-L922 PolarHBondContact O-N 2.65Å; A918-F947 HydrophobicContact CB-CE2 4.01Å; A918-F947 HydrophobicContact CB-CZ 4.31Å
919	Q	93.6	Very high	85.8	Confident	56 Å²	56	67.7 Å²	67.7	26%	0.262	35%	0.347	S	S	.	.	H	α-helix	trans	-61.6	-49.4	178	-168.6	176.1	28.8	0	0	111.3	K915 E916 L922 L923 F947	K915-Q919 WeakPolarHBondContact O-CB 3.42Å; K915-Q919 PolarHBondContact O-N 2.97Å; E916-Q919 PolarHBondContact O-N 3.38Å; Q919-L922 PolarHBondContact O-N 3.29Å; Q919-L923 HydrophobicContact CG-CD1 4.37Å; Q919-L923 WeakPolarHBondContact O-CG 3.29Å; Q919-L923 PolarHBondContact O-N 3.19Å; Q919-F947 HydrophobicContact CB-CD1 4.01Å; Q919-F947 HydrophobicContact CB-CE1 3.57Å; Q919-F947 HydrophobicContact CB-CE2 4.17Å; Q919-F947 HydrophobicContact CB-CG 4.48Å; Q919-F947 HydrophobicContact CB-CZ 3.65Å; Q919-F947 HydrophobicContact CG-CD1 3.75Å; Q919-F947 HydrophobicContact CG-CE1 3.79Å; Q919-F947 HydrophobicContact CG-CG 4.23Å; Q919-F947 HydrophobicContact CG-CZ 4.33Å
920	Q	93.1	Very high	84.3	Confident	97 Å²	97	63.6 Å²	63.6	45%	0.453	32%	0.318	S	S	.	.	H	α-helix	trans	-62	-48.7	-179.3	-174.6	57.4	39.4	0	0	111	E916 R917 L922 L923 D924	E916-Q920 WeakPolarHBondContact O-CB 3.23Å; E916-Q920 PolarHBondContact O-N 3.14Å; R917-Q920 PolarHBondContact O-N 3.28Å; Q920-L922 VanDerWaalsContact C-N 3.26Å; Q920-L922 PolarHBondContact O-N 3.35Å; Q920-L923 PolarHBondContact O-N 2.91Å; Q920-D924 PolarHBondContact NE2-OD1 3Å; Q920-D924 PolarHBondContact NE2-OD2 3.02Å; Q920-D924 VanDerWaalsContact O-CG 3.28Å; Q920-D924 PolarHBondContact O-N 3.37Å
921	K	89	Confident	83.1	Confident	43 Å²	43	60.1 Å²	60.1	19%	0.187	30%	0.302	C	S	.	.	H	α-helix	trans	-58.3	-38.5	178.1	-158.2	94	179.5	-175.2	0	111.9	L301 L304 E308 R917 D924 N925	L301-K921 HydrophobicContact CD2-CB 4.05Å; L301-K921 HydrophobicContact CD2-CG 4.36Å; L304-K921 HydrophobicContact CB-CG 3.83Å; L304-K921 HydrophobicContact CD1-CB 4.01Å; L304-K921 HydrophobicContact CD1-CG 3.85Å; L304-K921 HydrophobicContact CG-CG 4.48Å; E308-K921 VanDerWaalsContact OE2-CE 3.22Å; E308-K921 WeakPolarHBondContact OE2-CE 3.47Å; E308-K921 IonicContact OE2-NZ 3.76Å; E308-K921 PolarHBondContact OE2-NZ 3.33Å; R917-K921 VanDerWaalsContact O-CB 3.27Å; R917-K921 WeakPolarHBondContact O-CB 3.42Å; R917-K921 PolarHBondContact O-N 3.1Å; K921-D924 PolarHBondContact O-N 2.95Å; K921-N925 WeakPolarHBondContact O-CB 3.3Å; K921-N925 PolarHBondContact O-N 2.98Å; K921-N925 PolarHBondContact O-ND2 2.83Å
922	L	86.7	Confident	81.5	Confident	34 Å²	34	62.2 Å²	62.2	18%	0.178	32%	0.32	C	S	.	.	H	α-helix	trans	-67.4	-37.2	177.5	-172.2	67.9	0	0	0	112.1	L304 A918 Q919 Q920 N925 I943 F947	L304-L922 HydrophobicContact CD1-CB 4.33Å; L304-L922 HydrophobicContact CD1-CD1 4.31Å; A918-L922 VanDerWaalsContact O-CB 3.3Å; A918-L922 WeakPolarHBondContact O-CB 3.44Å; A918-L922 PolarHBondContact O-N 2.65Å; Q919-L922 PolarHBondContact O-N 3.29Å; Q920-L922 VanDerWaalsContact C-N 3.26Å; Q920-L922 PolarHBondContact O-N 3.35Å; L922-N925 PolarHBondContact O-N 3.38Å; L922-I943 HydrophobicContact CD2-CG2 3.7Å; L922-I943 HydrophobicContact CG-CG2 3.66Å; L922-F947 HydrophobicContact CD2-CB 4.1Å; L922-F947 HydrophobicContact CD2-CD2 3.9Å; L922-F947 HydrophobicContact CD2-CG 4.42Å
923	L	87.6	Confident	79.9	Confident	20 Å²	20	64.8 Å²	64.8	11%	0.105	33%	0.329	C	S	.	.	H	α-helix	trans	-73.1	-31.9	176.5	-65.6	173.8	0	0	0	113.1	Q919 Q920 N925 I926 R940 I943 I944	Q919-L923 HydrophobicContact CG-CD1 4.37Å; Q919-L923 WeakPolarHBondContact O-CG 3.29Å; Q919-L923 PolarHBondContact O-N 3.19Å; Q920-L923 PolarHBondContact O-N 2.91Å; L923-N925 PolarHBondContact O-N 3.44Å; L923-I926 HydrophobicContact CD2-CD1 4.25Å; L923-I926 WeakPolarHBondContact O-CD1 3.35Å; L923-I926 VanDerWaalsContact O-CG1 3.27Å; L923-I926 WeakPolarHBondContact O-CG1 3.32Å; L923-R940 HydrophobicContact CD2-CG 3.96Å; L923-I943 HydrophobicContact CD2-CB 4.44Å; L923-I943 HydrophobicContact CD2-CG2 3.94Å; L923-I944 HydrophobicContact CD1-CD1 4.47Å; L923-I944 HydrophobicContact CD1-CG1 4.31Å; L923-I944 HydrophobicContact CD2-CD1 4.24Å; L923-I944 HydrophobicContact CD2-CG1 3.67Å
924	D	86	Confident	78.3	Confident	107 Å²	107	60.3 Å²	60.3	57%	0.572	31%	0.309	S	S	*	.	H	α-helix	trans	-73.3	-17.1	176.1	-63.2	-26.2	0	0	0	112.2	Q920 K921	Q920-D924 PolarHBondContact NE2-OD1 3Å; Q920-D924 PolarHBondContact NE2-OD2 3.02Å; Q920-D924 VanDerWaalsContact O-CG 3.28Å; Q920-D924 PolarHBondContact O-N 3.37Å; K921-D924 PolarHBondContact O-N 2.95Å
925	N	82.8	Confident	76.8	Confident	73 Å²	73	61.5 Å²	61.5	39%	0.39	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	29.9	-177.6	-73.2	-91.6	0	0	0	112.9	L304 K921 L922 L923 P927	L304-N925 HydrophobicContact CD2-CB 4.16Å; K921-N925 WeakPolarHBondContact O-CB 3.3Å; K921-N925 PolarHBondContact O-N 2.98Å; K921-N925 PolarHBondContact O-ND2 2.83Å; L922-N925 PolarHBondContact O-N 3.38Å; L923-N925 PolarHBondContact O-N 3.44Å; N925-P927 WeakPolarHBondContact O-CD 3.33Å
926	I	74.6	Confident	75.9	Confident	26 Å²	26	62.8 Å²	62.8	13%	0.133	33%	0.33	C	S	.	.			trans	-65.8	126	173.8	-63.4	169.4	0	0	0	109	L923 D928 A931 A939 R940 I943	L923-I926 HydrophobicContact CD2-CD1 4.25Å; L923-I926 WeakPolarHBondContact O-CD1 3.35Å; L923-I926 VanDerWaalsContact O-CG1 3.27Å; L923-I926 WeakPolarHBondContact O-CG1 3.32Å; I926-D928 PolarHBondContact O-N 2.83Å; I926-A931 HydrophobicContact CG2-CB 4.47Å; I926-A939 HydrophobicContact CG2-CB 4.02Å; I926-R940 HydrophobicContact CD1-CB 4.03Å; I926-R940 HydrophobicContact CD1-CG 4.15Å; I926-I943 HydrophobicContact CG1-CG1 4.25Å
927	P	71.7	Confident	75	Confident	31 Å²	31	65 Å²	65	20%	0.201	34%	0.34	C	S	.	.			trans	-66.3	132.8	179.9	-15.6	25.9	0	0	0	112.4	L66 N925 A929 L930 A931	L66-P927 HydrophobicContact CB-CB 4.17Å; L66-P927 HydrophobicContact CB-CG 3.7Å; L66-P927 HydrophobicContact CD1-CB 4.38Å; L66-P927 HydrophobicContact CD1-CG 3.79Å; L66-P927 HydrophobicContact CD2-CG 3.52Å; L66-P927 HydrophobicContact CG-CG 3.85Å; N925-P927 WeakPolarHBondContact O-CD 3.33Å; P927-A929 PolarHBondContact O-N 3.48Å; P927-L930 HydrophobicContact CB-CB 4.17Å; P927-L930 HydrophobicContact CG-CB 4.34Å; P927-L930 WeakPolarHBondContact O-CB 3.47Å; P927-L930 PolarHBondContact O-N 3.43Å; P927-A931 PolarHBondContact O-N 2.72Å
928	D	61.1	Low	73.9	Confident	115 Å²	115	62.5 Å²	62.5	62%	0.615	34%	0.336	S	S	*	.	H	α-helix	trans	-57.2	-37.6	176.3	-68.4	-34.2	0	0	0	112.3	I926 L930 A931 N932	I926-D928 PolarHBondContact O-N 2.83Å; D928-L930 VanDerWaalsContact C-N 3.29Å; D928-L930 PolarHBondContact O-N 3.22Å; D928-A931 PolarHBondContact O-N 3.37Å; D928-N932 VanDerWaalsContact O-CB 3.23Å; D928-N932 WeakPolarHBondContact O-CB 3.28Å; D928-N932 PolarHBondContact O-N 3.27Å; D928-N932 PolarHBondContact O-ND2 2.84Å; D928-N932 VanDerWaalsContact O-ND2 3.12Å
929	A	52.8	Low	73.2	Confident	61 Å²	61	62.5 Å²	62.5	50%	0.504	34%	0.336	S	S	.	.	H	α-helix	trans	-60.1	-40.1	176.1	0	0	0	0	0	112.2	P927 L933	P927-A929 PolarHBondContact O-N 3.48Å; A929-L933 VanDerWaalsContact O-CB 3.27Å; A929-L933 WeakPolarHBondContact O-CB 3.48Å; A929-L933 PolarHBondContact O-N 2.87Å
930	L	58.8	Low	72.7	Confident	6 Å²	6	66.2 Å²	66.2	3%	0.031	35%	0.347	C	S	.	.	H	α-helix	trans	-69.5	-47.3	176.5	178.5	65.2	0	0	0	110.1	F840 P927 D928 N932 L933 V934 A939 I943	F840-L930 HydrophobicContact CE1-CD1 4.13Å; F840-L930 HydrophobicContact CE1-CD2 3.95Å; F840-L930 HydrophobicContact CE1-CG 4.3Å; F840-L930 HydrophobicContact CE2-CD1 3.89Å; F840-L930 HydrophobicContact CZ-CD1 3.62Å; F840-L930 HydrophobicContact CZ-CD2 3.65Å; F840-L930 HydrophobicContact CZ-CG 4.1Å; P927-L930 HydrophobicContact CB-CB 4.17Å; P927-L930 HydrophobicContact CG-CB 4.34Å; P927-L930 WeakPolarHBondContact O-CB 3.47Å; P927-L930 PolarHBondContact O-N 3.43Å; D928-L930 VanDerWaalsContact C-N 3.29Å; D928-L930 PolarHBondContact O-N 3.22Å; L930-N932 VanDerWaalsContact C-N 3.29Å; L930-N932 PolarHBondContact O-N 2.89Å; L930-L933 PolarHBondContact O-N 3.33Å; L930-L933 VanDerWaalsContact O-N 3.12Å; L930-V934 HydrophobicContact CD1-CG2 4.15Å; L930-V934 HydrophobicContact CG-CG2 4.33Å; L930-V934 VanDerWaalsContact O-CG2 3.24Å; L930-V934 WeakPolarHBondContact O-CG2 3.15Å; L930-V934 PolarHBondContact O-N 3.38Å; L930-A939 HydrophobicContact CG-CB 4.25Å; L930-I943 HydrophobicContact CD2-CD1 4.22Å; L930-I943 HydrophobicContact CD2-CG1 4.42Å
931	A	65.1	Low	72.2	Confident	3 Å²	3	65.2 Å²	65.2	3%	0.025	34%	0.341	C	S	.	.	H	α-helix	trans	-61.5	-35.4	177.9	0	0	0	0	0	113.4	I926 P927 D928 G935 Q936 A939	I926-A931 HydrophobicContact CG2-CB 4.47Å; P927-A931 PolarHBondContact O-N 2.72Å; D928-A931 PolarHBondContact O-N 3.37Å; A931-G935 CarbonylContact O-C 3.51Å; A931-G935 WeakPolarHBondContact O-CA 3.27Å; A931-G935 PolarHBondContact O-N 2.93Å; A931-Q936 VanDerWaalsContact CB-CD 3.43Å; A931-Q936 HydrophobicContact CB-CG 4.08Å; A931-Q936 VanDerWaalsContact CB-NE2 3.32Å; A931-Q936 PolarHBondContact O-N 3.34Å; A931-A939 HydrophobicContact CB-CB 4.24Å
932	N	57.8	Low	71.8	Confident	134 Å²	134	63.1 Å²	63.1	72%	0.717	33%	0.332	S	S	*	.	H	α-helix	trans	-73.6	-30.9	175.3	-69.4	-25.2	0	0	0	112.3	D928 L930	D928-N932 VanDerWaalsContact O-CB 3.23Å; D928-N932 WeakPolarHBondContact O-CB 3.28Å; D928-N932 PolarHBondContact O-N 3.27Å; D928-N932 PolarHBondContact O-ND2 2.84Å; D928-N932 VanDerWaalsContact O-ND2 3.12Å; L930-N932 VanDerWaalsContact C-N 3.29Å; L930-N932 PolarHBondContact O-N 2.89Å
933	L	58.4	Low	71.7	Confident	113 Å²	113	62.4 Å²	62.4	59%	0.592	33%	0.328	S	S	*	.	H	α-helix	trans	-76.5	-45.5	179.8	-178.3	65.5	0	0	0	112.6	A929 L930	A929-L933 VanDerWaalsContact O-CB 3.27Å; A929-L933 WeakPolarHBondContact O-CB 3.48Å; A929-L933 PolarHBondContact O-N 2.87Å; L930-L933 PolarHBondContact O-N 3.33Å; L930-L933 VanDerWaalsContact O-N 3.12Å
934	V	59.1	Low	71.7	Confident	15 Å²	15	63.8 Å²	63.8	9%	0.091	34%	0.335	C	S	.	.	H	α-helix	trans	-107.4	-9.4	-174.3	-61.2	0	0	0	0	114.1	I836 F840 L842 L930 N938 A939	I836-V934 HydrophobicContact CG2-CG1 4.47Å; F840-V934 HydrophobicContact CB-CG1 4.45Å; F840-V934 HydrophobicContact CD1-CG2 3.96Å; F840-V934 HydrophobicContact CE1-CG2 4.39Å; F840-V934 HydrophobicContact CG-CG1 4.33Å; F840-V934 HydrophobicContact CG-CG2 4.3Å; L842-V934 HydrophobicContact CD1-CG1 4.18Å; L842-V934 HydrophobicContact CD2-CB 4.12Å; L842-V934 HydrophobicContact CD2-CG1 4.44Å; L930-V934 HydrophobicContact CD1-CG2 4.15Å; L930-V934 HydrophobicContact CG-CG2 4.33Å; L930-V934 VanDerWaalsContact O-CG2 3.24Å; L930-V934 WeakPolarHBondContact O-CG2 3.15Å; L930-V934 PolarHBondContact O-N 3.38Å; V934-N938 HydrophobicContact CB-CB 4.35Å; V934-N938 HydrophobicContact CG2-CB 4.32Å; V934-N938 VanDerWaalsContact O-CB 3.3Å; V934-N938 WeakPolarHBondContact O-CB 3.34Å; V934-N938 PolarHBondContact O-ND2 3.13Å; V934-A939 HydrophobicContact CG2-CB 3.74Å
935	G	61.3	Low	71.6	Confident	31 Å²	31	60.2 Å²	60.2	32%	0.32	32%	0.315	S	S	.	.			trans	91.1	141	-171.2	0	0	0	0	0	112	A931 Q937 N938 A939	A931-G935 CarbonylContact O-C 3.51Å; A931-G935 WeakPolarHBondContact O-CA 3.27Å; A931-G935 PolarHBondContact O-N 2.93Å; G935-Q937 VanDerWaalsContact C-N 3.32Å; G935-Q937 PolarHBondContact O-N 3.5Å; G935-N938 PolarHBondContact O-N 3.21Å; G935-A939 WeakPolarHBondContact O-CB 3.35Å; G935-A939 PolarHBondContact O-N 3.18Å
936	Q	74.8	Confident	71.8	Confident	112 Å²	112	57.4 Å²	57.4	52%	0.523	30%	0.299	S	S	.	.	H	α-helix	trans	-52.1	-44.6	-176.7	-82.8	-71	-3.1	0	0	113.7	A931 R940	A931-Q936 VanDerWaalsContact CB-CD 3.43Å; A931-Q936 HydrophobicContact CB-CG 4.08Å; A931-Q936 VanDerWaalsContact CB-NE2 3.32Å; A931-Q936 PolarHBondContact O-N 3.34Å; Q936-R940 WeakPolarHBondContact O-CB 3.47Å; Q936-R940 PolarHBondContact O-N 3.42Å
937	Q	74.9	Confident	72.6	Confident	171 Å²	171	56.2 Å²	56.2	80%	0.799	29%	0.293	S	S	*	.	H	α-helix	trans	-67	-44.9	179.9	-71.3	178.5	-13.9	0	0	112.4	G935 R940 F941	G935-Q937 VanDerWaalsContact C-N 3.32Å; G935-Q937 PolarHBondContact O-N 3.5Å; Q937-R940 PolarHBondContact O-N 3.2Å; Q937-F941 WeakPolarHBondContact O-CB 3Å; Q937-F941 PolarHBondContact O-N 3.06Å
938	N	71.4	Confident	73.4	Confident	65 Å²	65	58.2 Å²	58.2	35%	0.348	30%	0.302	S	S	.	.	H	α-helix	trans	-67.4	-40.4	178.4	-65.1	-25.3	0	0	0	111	F840 L842 V934 G935 R940 F941 G942	F840-N938 WeakPolarHBondContact CD1-O 3.32Å; L842-N938 HydrophobicContact CD2-CB 4.1Å; V934-N938 HydrophobicContact CB-CB 4.35Å; V934-N938 HydrophobicContact CG2-CB 4.32Å; V934-N938 VanDerWaalsContact O-CB 3.3Å; V934-N938 WeakPolarHBondContact O-CB 3.34Å; V934-N938 PolarHBondContact O-ND2 3.13Å; G935-N938 PolarHBondContact O-N 3.21Å; N938-R940 PolarHBondContact O-N 3.05Å; N938-F941 PolarHBondContact O-N 2.94Å; N938-G942 PolarHBondContact O-N 3.01Å
939	A	76.2	Confident	74.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-58.2	-48.6	175.3	0	0	0	0	0	111.1	I926 L930 A931 V934 G935 F941 G942 I943	I926-A939 HydrophobicContact CG2-CB 4.02Å; L930-A939 HydrophobicContact CG-CB 4.25Å; A931-A939 HydrophobicContact CB-CB 4.24Å; V934-A939 HydrophobicContact CG2-CB 3.74Å; G935-A939 WeakPolarHBondContact O-CB 3.35Å; G935-A939 PolarHBondContact O-N 3.18Å; A939-F941 PolarHBondContact O-N 3.29Å; A939-G942 PolarHBondContact O-N 2.76Å; A939-I943 WeakPolarHBondContact O-CB 3.38Å; A939-I943 VanDerWaalsContact O-CG1 3.22Å; A939-I943 WeakPolarHBondContact O-CG1 2.99Å; A939-I943 PolarHBondContact O-N 2.98Å
940	R	83.8	Confident	76.4	Confident	134 Å²	134	51.4 Å²	51.4	51%	0.506	26%	0.259	S	S	.	.	H	α-helix	trans	-59.6	-46.7	176	-167.5	-179	176.1	125.4	-0.9	111.7	L923 I926 Q936 Q937 N938 I943 I944	L923-R940 HydrophobicContact CD2-CG 3.96Å; I926-R940 HydrophobicContact CD1-CB 4.03Å; I926-R940 HydrophobicContact CD1-CG 4.15Å; Q936-R940 WeakPolarHBondContact O-CB 3.47Å; Q936-R940 PolarHBondContact O-N 3.42Å; Q937-R940 PolarHBondContact O-N 3.2Å; N938-R940 PolarHBondContact O-N 3.05Å; R940-I943 PolarHBondContact O-N 3.26Å; R940-I944 HydrophobicContact CG-CD1 4.32Å; R940-I944 VanDerWaalsContact O-CG1 3.31Å; R940-I944 WeakPolarHBondContact O-CG1 3.35Å; R940-I944 PolarHBondContact O-N 3.02Å
941	F	81.6	Confident	78.1	Confident	75 Å²	75	52.4 Å²	52.4	33%	0.329	26%	0.263	S	S	.	.	H	α-helix	trans	-62.8	-45.1	178.6	-179.2	-95.1	0	0	0	112.6	R224 E841 Q937 N938 A939 I943 I944 K945	R224-F941 VanDerWaalsContact NH1-CZ 3.29Å; E841-F941 HydrophobicContact CB-CE1 4.22Å; E841-F941 HydrophobicContact CG-CE1 4.25Å; Q937-F941 WeakPolarHBondContact O-CB 3Å; Q937-F941 PolarHBondContact O-N 3.06Å; N938-F941 PolarHBondContact O-N 2.94Å; A939-F941 PolarHBondContact O-N 3.29Å; F941-I943 PolarHBondContact O-N 3.49Å; F941-I944 PolarHBondContact O-N 3.02Å; F941-K945 WeakPolarHBondContact O-CB 3.32Å; F941-K945 PolarHBondContact O-N 3.44Å
942	G	80.8	Confident	79.3	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-63.8	-39.2	178.2	0	0	0	0	0	112.5	N938 A939 K945 I946	N938-G942 PolarHBondContact O-N 3.01Å; A939-G942 PolarHBondContact O-N 2.76Å; G942-K945 WeakPolarHBondContact O-CB 3.38Å; G942-K945 PolarHBondContact O-N 3.01Å; G942-I946 VanDerWaalsContact O-CG1 3.29Å; G942-I946 WeakPolarHBondContact O-CG1 3.21Å; G942-I946 PolarHBondContact O-N 3.35Å
943	I	85.1	Confident	80.9	Confident	19 Å²	19	52.9 Å²	52.9	10%	0.097	27%	0.267	C	S	.	.	H	α-helix	trans	-64.6	-42.6	174.7	-67.8	-71.3	0	0	0	111.5	L922 L923 I926 L930 A939 R940 F941 K945 I946 F947	L922-I943 HydrophobicContact CD2-CG2 3.7Å; L922-I943 HydrophobicContact CG-CG2 3.66Å; L923-I943 HydrophobicContact CD2-CB 4.44Å; L923-I943 HydrophobicContact CD2-CG2 3.94Å; I926-I943 HydrophobicContact CG1-CG1 4.25Å; L930-I943 HydrophobicContact CD2-CD1 4.22Å; L930-I943 HydrophobicContact CD2-CG1 4.42Å; A939-I943 WeakPolarHBondContact O-CB 3.38Å; A939-I943 VanDerWaalsContact O-CG1 3.22Å; A939-I943 WeakPolarHBondContact O-CG1 2.99Å; A939-I943 PolarHBondContact O-N 2.98Å; R940-I943 PolarHBondContact O-N 3.26Å; F941-I943 PolarHBondContact O-N 3.49Å; I943-K945 VanDerWaalsContact C-N 3.28Å; I943-K945 PolarHBondContact O-N 3.45Å; I943-I946 HydrophobicContact CD1-CD1 4.16Å; I943-I946 PolarHBondContact O-N 2.96Å; I943-F947 WeakPolarHBondContact O-CB 3.49Å; I943-F947 PolarHBondContact O-N 3.47Å
944	I	87.3	Confident	82.5	Confident	49 Å²	49	52.3 Å²	52.3	25%	0.251	26%	0.264	S	S	.	.	H	α-helix	trans	-60.4	-41.2	173.3	-67.7	170.5	0	0	0	110.6	L923 R940 F941 F947 N948	L923-I944 HydrophobicContact CD1-CD1 4.47Å; L923-I944 HydrophobicContact CD1-CG1 4.31Å; L923-I944 HydrophobicContact CD2-CD1 4.24Å; L923-I944 HydrophobicContact CD2-CG1 3.67Å; R940-I944 HydrophobicContact CG-CD1 4.32Å; R940-I944 VanDerWaalsContact O-CG1 3.31Å; R940-I944 WeakPolarHBondContact O-CG1 3.35Å; R940-I944 PolarHBondContact O-N 3.02Å; F941-I944 PolarHBondContact O-N 3.02Å; I944-F947 PolarHBondContact O-N 3.04Å; I944-N948 WeakPolarHBondContact O-CB 3.44Å; I944-N948 PolarHBondContact O-N 3.43Å; I944-N948 PolarHBondContact O-ND2 3.24Å
945	K	85	Confident	84	Confident	31 Å²	31	51.9 Å²	51.9	14%	0.135	26%	0.262	C	S	.	.	H	α-helix	trans	-63.6	-44.7	178.7	-173.8	-179.5	173.2	-179.8	0	112.1	E838 I839 E841 F941 G942 I943 F947 N948 A949	E838-K945 PolarHBondContact O-NZ 3.11Å; I839-K945 WeakPolarHBondContact O-CD 2.95Å; E841-K945 WeakPolarHBondContact OE1-CE 3.04Å; E841-K945 IonicContact OE1-NZ 3.14Å; E841-K945 PolarHBondContact OE1-NZ 3.35Å; F941-K945 WeakPolarHBondContact O-CB 3.32Å; F941-K945 PolarHBondContact O-N 3.44Å; G942-K945 WeakPolarHBondContact O-CB 3.38Å; G942-K945 PolarHBondContact O-N 3.01Å; I943-K945 VanDerWaalsContact C-N 3.28Å; I943-K945 PolarHBondContact O-N 3.45Å; K945-F947 VanDerWaalsContact C-N 3.33Å; K945-N948 PolarHBondContact O-N 3.32Å; K945-A949 WeakPolarHBondContact O-CB 3.38Å; K945-A949 PolarHBondContact O-N 2.99Å
946	I	86.8	Confident	85.5	Confident	14 Å²	14	50.8 Å²	50.8	7%	0.072	25%	0.249	C	C	.	.	H	α-helix	trans	-59.4	-48	173.4	-62.1	159.1	0	0	0	109.8	L68 F215 I839 G942 I943 N948 A949 L950	L68-I946 HydrophobicContact CD1-CD1 3.23Å; L68-I946 HydrophobicContact CD1-CG1 4.1Å; F215-I946 HydrophobicContact CE1-CG1 4.48Å; F215-I946 HydrophobicContact CZ-CG1 4.4Å; I839-I946 HydrophobicContact CD1-CG1 4.01Å; I839-I946 HydrophobicContact CG2-CD1 3.81Å; I839-I946 HydrophobicContact CG2-CG1 3.51Å; G942-I946 VanDerWaalsContact O-CG1 3.29Å; G942-I946 WeakPolarHBondContact O-CG1 3.21Å; G942-I946 PolarHBondContact O-N 3.35Å; I943-I946 HydrophobicContact CD1-CD1 4.16Å; I943-I946 PolarHBondContact O-N 2.96Å; I946-N948 VanDerWaalsContact C-N 3.32Å; I946-N948 PolarHBondContact O-N 3Å; I946-A949 WeakPolarHBondContact O-CB 3.08Å; I946-A949 PolarHBondContact O-N 3.44Å; I946-L950 HydrophobicContact CG2-CD1 4.19Å; I946-L950 WeakPolarHBondContact O-CG 3.42Å; I946-L950 PolarHBondContact O-N 3.21Å
947	F	90.4	Very high	86.3	Confident	1 Å²	1	47.2 Å²	47.2	0%	0.004	23%	0.232	C	C	.	.	H	α-helix	trans	-59.6	-44.8	-179	-174.6	-96.4	0	0	0	111.5	N297 L300 K915 A918 Q919 L922 I943 I944 K945 L950 Q951	N297-F947 VanDerWaalsContact OD1-CE2 3.29Å; N297-F947 WeakPolarHBondContact OD1-CE2 3.42Å; N297-F947 WeakPolarHBondContact OD1-CZ 3.49Å; L300-F947 HydrophobicContact CD1-CD2 4.37Å; L300-F947 HydrophobicContact CD1-CE2 4.31Å; K915-F947 HydrophobicContact CG-CE1 4.08Å; K915-F947 HydrophobicContact CG-CZ 4.01Å; K915-F947 WeakPolarHBondContact O-CZ 3.42Å; A918-F947 HydrophobicContact CB-CE2 4.01Å; A918-F947 HydrophobicContact CB-CZ 4.31Å; Q919-F947 HydrophobicContact CB-CD1 4.01Å; Q919-F947 HydrophobicContact CB-CE1 3.57Å; Q919-F947 HydrophobicContact CB-CE2 4.17Å; Q919-F947 HydrophobicContact CB-CG 4.48Å; Q919-F947 HydrophobicContact CB-CZ 3.65Å; Q919-F947 HydrophobicContact CG-CD1 3.75Å; Q919-F947 HydrophobicContact CG-CE1 3.79Å; Q919-F947 HydrophobicContact CG-CG 4.23Å; Q919-F947 HydrophobicContact CG-CZ 4.33Å; L922-F947 HydrophobicContact CD2-CB 4.1Å; L922-F947 HydrophobicContact CD2-CD2 3.9Å; L922-F947 HydrophobicContact CD2-CG 4.42Å; I943-F947 WeakPolarHBondContact O-CB 3.49Å; I943-F947 PolarHBondContact O-N 3.47Å; I944-F947 PolarHBondContact O-N 3.04Å; K945-F947 VanDerWaalsContact C-N 3.33Å; F947-L950 WeakPolarHBondContact O-CB 3.49Å; F947-L950 PolarHBondContact O-N 3.26Å; F947-Q951 HydrophobicContact CD1-CG 4.36Å; F947-Q951 HydrophobicContact CE1-CG 4.17Å; F947-Q951 VanDerWaalsContact O-CG 3.3Å; F947-Q951 WeakPolarHBondContact O-CG 3.46Å; F947-Q951 PolarHBondContact O-N 2.76Å; F947-Q951 PolarHBondContact O-NE2 2.83Å
948	N	89.9	Confident	87.2	Confident	73 Å²	73	40.3 Å²	40.3	39%	0.39	20%	0.2	S	C	.	.	H	α-helix	trans	-64.1	-41.5	177	-71.1	-14	0	0	0	112.2	I944 K945 I946 L950 Q951	I944-N948 WeakPolarHBondContact O-CB 3.44Å; I944-N948 PolarHBondContact O-N 3.43Å; I944-N948 PolarHBondContact O-ND2 3.24Å; K945-N948 PolarHBondContact O-N 3.32Å; I946-N948 VanDerWaalsContact C-N 3.32Å; I946-N948 PolarHBondContact O-N 3Å; N948-L950 VanDerWaalsContact C-N 3.27Å; N948-L950 PolarHBondContact O-N 3.42Å; N948-Q951 WeakPolarHBondContact O-CB 3.23Å; N948-Q951 PolarHBondContact O-N 3.46Å
949	A	87.9	Confident	88.1	Confident	11 Å²	11	38.1 Å²	38.1	9%	0.091	19%	0.188	C	C	.	.	H	α-helix	trans	-57.5	-42.3	174.2	0	0	0	0	0	111.5	F215 L218 K945 I946 Q951 E952 N956	F215-A949 HydrophobicContact CD1-CB 4.47Å; F215-A949 HydrophobicContact CE1-CB 3.64Å; F215-A949 HydrophobicContact CZ-CB 4.12Å; L218-A949 HydrophobicContact CD1-CB 3.57Å; K945-A949 WeakPolarHBondContact O-CB 3.38Å; K945-A949 PolarHBondContact O-N 2.99Å; I946-A949 WeakPolarHBondContact O-CB 3.08Å; I946-A949 PolarHBondContact O-N 3.44Å; A949-Q951 PolarHBondContact O-N 3.07Å; A949-E952 WeakPolarHBondContact O-CB 3.47Å; A949-E952 PolarHBondContact O-N 3.4Å; A949-E952 VanDerWaalsContact O-N 3.08Å; A949-N956 PolarHBondContact O-OD1 3.36Å
950	L	88.3	Confident	88.5	Confident	22 Å²	22	38.4 Å²	38.4	12%	0.115	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-15.4	176.2	-66	172	0	0	0	113.7	L75 I296 L300 I946 F947 N948 E952 N956	L75-L950 HydrophobicContact CD1-CD2 4.35Å; I296-L950 HydrophobicContact CD1-CD2 4.47Å; I296-L950 HydrophobicContact CG2-CB 4.27Å; I296-L950 HydrophobicContact CG2-CD1 4.14Å; L300-L950 HydrophobicContact CD1-CD1 4.43Å; I946-L950 HydrophobicContact CG2-CD1 4.19Å; I946-L950 WeakPolarHBondContact O-CG 3.42Å; I946-L950 PolarHBondContact O-N 3.21Å; F947-L950 WeakPolarHBondContact O-CB 3.49Å; F947-L950 PolarHBondContact O-N 3.26Å; N948-L950 VanDerWaalsContact C-N 3.27Å; N948-L950 PolarHBondContact O-N 3.42Å; L950-E952 VanDerWaalsContact C-N 3.3Å; L950-N956 PolarHBondContact O-ND2 3.43Å
951	Q	93.4	Very high	88.6	Confident	27 Å²	27	32 Å²	32	13%	0.126	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-10.8	174.5	-50.5	-48.8	-72.1	0	0	112.8	P293 N297 F947 N948 A949 A953	P293-Q951 VanDerWaalsContact CG-O 3.25Å; P293-Q951 WeakPolarHBondContact CG-O 3.31Å; N297-Q951 PolarHBondContact ND2-OE1 2.94Å; N297-Q951 VanDerWaalsContact ND2-OE1 3.08Å; N297-Q951 PolarHBondContact OD1-NE2 2.62Å; F947-Q951 HydrophobicContact CD1-CG 4.36Å; F947-Q951 HydrophobicContact CE1-CG 4.17Å; F947-Q951 VanDerWaalsContact O-CG 3.3Å; F947-Q951 WeakPolarHBondContact O-CG 3.46Å; F947-Q951 PolarHBondContact O-N 2.76Å; F947-Q951 PolarHBondContact O-NE2 2.83Å; N948-Q951 WeakPolarHBondContact O-CB 3.23Å; N948-Q951 PolarHBondContact O-N 3.46Å; A949-Q951 PolarHBondContact O-N 3.07Å; Q951-A953 PolarHBondContact O-N 3.41Å
952	E	92.1	Very high	88.8	Confident	113 Å²	113	30.1 Å²	30.1	53%	0.528	16%	0.16	S	C	.	.			trans	-89.3	88.9	-179.2	-66.3	-58.6	146.9	0	0	111.5	A949 L950 N954 A955 N956	A949-E952 WeakPolarHBondContact O-CB 3.47Å; A949-E952 PolarHBondContact O-N 3.4Å; A949-E952 VanDerWaalsContact O-N 3.08Å; L950-E952 VanDerWaalsContact C-N 3.3Å; E952-N954 VanDerWaalsContact C-N 3.33Å; E952-N954 PolarHBondContact O-N 2.91Å; E952-A955 HydrophobicContact CB-CB 3.77Å; E952-A955 WeakPolarHBondContact O-CB 3.33Å; E952-A955 PolarHBondContact O-N 3.31Å; E952-A955 VanDerWaalsContact O-N 3.07Å; E952-N956 VanDerWaalsContact O-CG 3.29Å; E952-N956 PolarHBondContact O-N 2.66Å; E952-N956 PolarHBondContact O-ND2 3.29Å
953	A	91.5	Very high	88.8	Confident	35 Å²	35	30.4 Å²	30.4	29%	0.289	16%	0.161	S	C	.	.	H	α-helix	trans	-54.9	-41.5	-173.2	0	0	0	0	0	114.2	S291 P293 Q951 N956 K957	S291-A953 WeakPolarHBondContact O-CA 3.04Å; P293-A953 HydrophobicContact CG-CB 4.31Å; Q951-A953 PolarHBondContact O-N 3.41Å; A953-N956 PolarHBondContact O-N 2.86Å; A953-K957 WeakPolarHBondContact O-CG 3.47Å; A953-K957 PolarHBondContact O-N 3.13Å
954	N	91.3	Very high	88.6	Confident	100 Å²	100	29.8 Å²	29.8	54%	0.535	16%	0.158	S	C	.	.	H	α-helix	trans	-70.6	-35.4	179.8	-69.9	-30.5	0	0	0	112.4	L234 E952 K957 H958	L234-N954 HydrophobicContact CD2-CB 4.06Å; E952-N954 VanDerWaalsContact C-N 3.33Å; E952-N954 PolarHBondContact O-N 2.91Å; N954-K957 PolarHBondContact O-N 3.21Å; N954-H958 PolarHBondContact O-N 3.31Å
955	A	91.4	Very high	88.4	Confident	6 Å²	6	30.7 Å²	30.7	5%	0.05	16%	0.161	C	C	.	.	H	α-helix	trans	-67.5	-42.1	174.2	0	0	0	0	0	110.5	H214 L218 F232 E952 K957 H958 L959	H214-A955 PolarHBondContact CE1-O 2.64Å; L218-A955 HydrophobicContact CD2-CB 3.83Å; F232-A955 HydrophobicContact CE1-CB 4.22Å; F232-A955 HydrophobicContact CZ-CB 4.22Å; E952-A955 HydrophobicContact CB-CB 3.77Å; E952-A955 WeakPolarHBondContact O-CB 3.33Å; E952-A955 PolarHBondContact O-N 3.31Å; E952-A955 VanDerWaalsContact O-N 3.07Å; A955-K957 VanDerWaalsContact C-N 3.35Å; A955-K957 PolarHBondContact O-N 2.98Å; A955-H958 WeakPolarHBondContact O-CB 3.39Å; A955-H958 PolarHBondContact O-N 3.34Å; A955-L959 PolarHBondContact O-N 2.95Å
956	N	91.3	Very high	88.3	Confident	9 Å²	9	30.1 Å²	30.1	5%	0.048	16%	0.159	C	C	.	.	H	α-helix	trans	-59	-44.4	173	-63.3	-25.1	0	0	0	111.6	S291 I296 A949 L950 E952 A953 L959 I960	S291-N956 PolarHBondContact O-ND2 3.18Å; I296-N956 WeakPolarHBondContact CD1-ND2 3.19Å; A949-N956 PolarHBondContact O-OD1 3.36Å; L950-N956 PolarHBondContact O-ND2 3.43Å; E952-N956 VanDerWaalsContact O-CG 3.29Å; E952-N956 PolarHBondContact O-N 2.66Å; E952-N956 PolarHBondContact O-ND2 3.29Å; A953-N956 PolarHBondContact O-N 2.86Å; N956-L959 PolarHBondContact O-N 2.94Å; N956-I960 WeakPolarHBondContact O-CD1 3.2Å; N956-I960 VanDerWaalsContact O-CG1 3.28Å; N956-I960 WeakPolarHBondContact O-CG1 3.3Å; N956-I960 PolarHBondContact O-N 3.37Å
957	K	92.4	Very high	87.9	Confident	36 Å²	36	31.3 Å²	31.3	16%	0.157	17%	0.165	C	C	.	.	H	α-helix	trans	-59.6	-47.1	175.1	-74.4	-170.1	178.4	179.1	0	111.9	L238 V287 S291 A953 N954 A955 L959 I960 Y961	L238-K957 HydrophobicContact CD1-CB 3.96Å; L238-K957 HydrophobicContact CD2-CB 4.2Å; L238-K957 HydrophobicContact CD2-CD 4.18Å; V287-K957 HydrophobicContact CG1-CB 4.29Å; V287-K957 HydrophobicContact CG1-CD 4.25Å; V287-K957 HydrophobicContact CG1-CG 3.82Å; S291-K957 WeakPolarHBondContact OG-CE 3.12Å; S291-K957 WeakPolarHBondContact OG-CG 3.41Å; A953-K957 WeakPolarHBondContact O-CG 3.47Å; A953-K957 PolarHBondContact O-N 3.13Å; N954-K957 PolarHBondContact O-N 3.21Å; A955-K957 VanDerWaalsContact C-N 3.35Å; A955-K957 PolarHBondContact O-N 2.98Å; K957-L959 VanDerWaalsContact C-N 3.31Å; K957-L959 PolarHBondContact O-N 3.2Å; K957-I960 PolarHBondContact O-N 2.87Å; K957-Y961 HydrophobicContact CB-CD2 4.42Å; K957-Y961 HydrophobicContact CB-CE2 4.32Å; K957-Y961 WeakPolarHBondContact O-CD2 3.31Å; K957-Y961 PolarHBondContact O-N 3.31Å
958	H	93.1	Very high	87.3	Confident	26 Å²	26	32.1 Å²	32.1	12%	0.12	17%	0.17	C	C	.	.	H	α-helix	trans	-56	-48.6	176.6	163.7	90.1	0	0	0	110.8	H214 F232 P233 L234 H235 L238 N954 A955 I960 Y961 V962	H214-H958 AromaticContact ND1-CD2 3.85Å; F232-H958 HydrophobicContact CE1-CB 4Å; F232-H958 AromaticContact CE1-CD2 3.71Å; F232-H958 AromaticContact CE1-CG 3.77Å; F232-H958 AromaticContact CZ-CD2 3.67Å; P233-H958 PolarHBondContact O-CE1 3.24Å; P233-H958 PolarHBondContact O-ND1 3.34Å; L234-H958 HydrophobicContact CD2-CB 4.12Å; H235-H958 HydrophobicContact CB-CB 4.48Å; H235-H958 PolarHBondContact N-ND1 3.17Å; L238-H958 HydrophobicContact CD1-CB 4.03Å; N954-H958 PolarHBondContact O-N 3.31Å; A955-H958 WeakPolarHBondContact O-CB 3.39Å; A955-H958 PolarHBondContact O-N 3.34Å; H958-I960 VanDerWaalsContact C-N 3.34Å; H958-I960 PolarHBondContact O-N 3.42Å; H958-Y961 PolarHBondContact O-N 3.39Å; H958-V962 WeakPolarHBondContact O-CG2 3.32Å; H958-V962 PolarHBondContact O-N 3.38Å
959	L	89.8	Confident	86.7	Confident	19 Å²	19	32.5 Å²	32.5	10%	0.099	17%	0.168	C	C	.	.	H	α-helix	trans	-58.2	-45.8	178.2	178.8	61	0	0	0	111.6	I210 L211 H214 A955 N956 K957 Y961 V962 L963	I210-L959 HydrophobicContact CG2-CD1 3.66Å; L211-L959 HydrophobicContact CD2-CD1 4.14Å; L211-L959 HydrophobicContact CD2-CD2 3.9Å; H214-L959 HydrophobicContact CB-CD1 4.17Å; A955-L959 PolarHBondContact O-N 2.95Å; N956-L959 PolarHBondContact O-N 2.94Å; K957-L959 VanDerWaalsContact C-N 3.31Å; K957-L959 PolarHBondContact O-N 3.2Å; L959-Y961 VanDerWaalsContact C-N 3.33Å; L959-Y961 PolarHBondContact O-N 2.88Å; L959-V962 PolarHBondContact O-N 3.23Å; L959-L963 HydrophobicContact CD1-CD1 3.98Å; L959-L963 HydrophobicContact CD1-CG 4.07Å; L959-L963 HydrophobicContact CG-CD1 3.9Å; L959-L963 HydrophobicContact CG-CG 4.4Å; L959-L963 WeakPolarHBondContact O-CB 3.14Å; L959-L963 WeakPolarHBondContact O-CG 3.16Å; L959-L963 PolarHBondContact O-N 3.34Å
960	I	85.1	Confident	86.2	Confident	6 Å²	6	33.4 Å²	33.4	3%	0.031	17%	0.17	C	C	.	.	H	α-helix	trans	-60.6	-42.9	178.2	-66.8	160.2	0	0	0	111.2	V79 L83 V287 L290 N956 K957 H958 L963 M964	V79-I960 HydrophobicContact CG1-CG1 4.47Å; L83-I960 HydrophobicContact CD1-CG2 4.31Å; V287-I960 HydrophobicContact CG2-CG2 3.96Å; L290-I960 HydrophobicContact CB-CD1 3.58Å; L290-I960 HydrophobicContact CB-CG1 4.5Å; N956-I960 WeakPolarHBondContact O-CD1 3.2Å; N956-I960 VanDerWaalsContact O-CG1 3.28Å; N956-I960 WeakPolarHBondContact O-CG1 3.3Å; N956-I960 PolarHBondContact O-N 3.37Å; K957-I960 PolarHBondContact O-N 2.87Å; H958-I960 VanDerWaalsContact C-N 3.34Å; H958-I960 PolarHBondContact O-N 3.42Å; I960-L963 PolarHBondContact O-N 2.92Å; I960-M964 VanDerWaalsContact O-CB 3.28Å; I960-M964 WeakPolarHBondContact O-CB 3.38Å; I960-M964 PolarHBondContact O-N 3.02Å
961	Y	87.3	Confident	85.4	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-66.1	-42.3	179.6	-75.4	-55.4	0	0	0	112.7	C237 L238 E244 F247 L248 V287 K957 H958 L959 M964 E965	C237-Y961 VanDerWaalsContact SG-CD2 3.59Å; L238-Y961 HydrophobicContact CD1-CD2 4.18Å; L238-Y961 HydrophobicContact CD2-CD2 3.98Å; L238-Y961 HydrophobicContact CD2-CE2 3.57Å; L238-Y961 HydrophobicContact CG-CD2 4.02Å; L238-Y961 HydrophobicContact CG-CE2 4.13Å; E244-Y961 VanDerWaalsContact CD-OH 3.23Å; E244-Y961 HydrophobicContact CG-CE2 4.05Å; E244-Y961 WeakPolarHBondContact CG-OH 3.22Å; E244-Y961 PolarHBondContact OE1-OH 2.91Å; F247-Y961 AromaticContact CD1-CD1 3.76Å; F247-Y961 HydrophobicContact CD1-CD1 3.76Å; F247-Y961 AromaticContact CD1-CE1 3.97Å; F247-Y961 HydrophobicContact CD1-CE1 3.97Å; F247-Y961 AromaticContact CE1-CD1 3.59Å; F247-Y961 HydrophobicContact CE1-CD1 3.59Å; F247-Y961 HydrophobicContact CE1-CE1 4.21Å; F247-Y961 HydrophobicContact CE1-CG 4.45Å; L248-Y961 HydrophobicContact CD2-CE1 3.66Å; L248-Y961 HydrophobicContact CG-CE1 4.23Å; V287-Y961 HydrophobicContact CG1-CE1 4.45Å; V287-Y961 HydrophobicContact CG1-CE2 3.76Å; V287-Y961 HydrophobicContact CG2-CE1 3.88Å; K957-Y961 HydrophobicContact CB-CD2 4.42Å; K957-Y961 HydrophobicContact CB-CE2 4.32Å; K957-Y961 WeakPolarHBondContact O-CD2 3.31Å; K957-Y961 PolarHBondContact O-N 3.31Å; H958-Y961 PolarHBondContact O-N 3.39Å; L959-Y961 VanDerWaalsContact C-N 3.33Å; L959-Y961 PolarHBondContact O-N 2.88Å; Y961-M964 HydrophobicContact CD1-CE 3.64Å; Y961-M964 HydrophobicContact CE1-CE 3.89Å; Y961-M964 PolarHBondContact O-N 3.41Å; Y961-E965 PolarHBondContact O-N 3.26Å
962	V	84.9	Confident	84.5	Confident	36 Å²	36	32.1 Å²	32.1	22%	0.218	17%	0.165	C	C	.	.	H	α-helix	trans	-63.8	-43.6	175.7	175.9	0	0	0	0	111.3	I210 H958 L959 E965 M966	I210-V962 HydrophobicContact CD1-CG1 4.08Å; I210-V962 HydrophobicContact CG1-CG1 4.05Å; I210-V962 HydrophobicContact CG2-CB 4.37Å; I210-V962 HydrophobicContact CG2-CG1 3.7Å; H958-V962 WeakPolarHBondContact O-CG2 3.32Å; H958-V962 PolarHBondContact O-N 3.38Å; L959-V962 PolarHBondContact O-N 3.23Å; V962-E965 PolarHBondContact O-N 2.83Å; V962-M966 PolarHBondContact O-N 3.07Å; V962-M966 VanDerWaalsContact O-N 3.1Å
963	L	80.6	Confident	83.5	Confident	6 Å²	6	30.1 Å²	30.1	3%	0.031	16%	0.161	C	C	.	.	H	α-helix	trans	-65	-39.2	176.4	-67.3	172.3	0	0	0	111.9	F76 V79 I210 L959 I960 M966 L967	F76-L963 HydrophobicContact CD2-CD1 3.86Å; F76-L963 HydrophobicContact CD2-CD2 3.63Å; F76-L963 HydrophobicContact CD2-CG 4.21Å; F76-L963 HydrophobicContact CE2-CB 4.23Å; F76-L963 HydrophobicContact CE2-CD1 4.32Å; F76-L963 HydrophobicContact CE2-CD2 3.62Å; F76-L963 HydrophobicContact CE2-CG 4.25Å; V79-L963 HydrophobicContact CG1-CD1 4.24Å; I210-L963 HydrophobicContact CB-CD2 4.05Å; I210-L963 HydrophobicContact CD1-CD2 3.84Å; I210-L963 HydrophobicContact CG2-CD2 3.66Å; I210-L963 HydrophobicContact CG2-CG 4.2Å; L959-L963 HydrophobicContact CD1-CD1 3.98Å; L959-L963 HydrophobicContact CD1-CG 4.07Å; L959-L963 HydrophobicContact CG-CD1 3.9Å; L959-L963 HydrophobicContact CG-CG 4.4Å; L959-L963 WeakPolarHBondContact O-CB 3.14Å; L959-L963 WeakPolarHBondContact O-CG 3.16Å; L959-L963 PolarHBondContact O-N 3.34Å; I960-L963 PolarHBondContact O-N 2.92Å; L963-M966 PolarHBondContact O-N 3.36Å; L963-L967 WeakPolarHBondContact O-CB 3.41Å; L963-L967 VanDerWaalsContact O-CG 3.3Å; L963-L967 WeakPolarHBondContact O-CG 3.4Å; L963-L967 PolarHBondContact O-N 3.4Å
964	M	81.6	Confident	82.7	Confident	6 Å²	6	33.1 Å²	33.1	3%	0.03	17%	0.169	C	C	.	.	H	α-helix	trans	-66.4	-38.7	177.9	-175	168.1	62	0	0	112	L83 F247 L248 V251 L283 I960 Y961 L967 L968	L83-M964 HydrophobicContact CD2-CB 4.36Å; L83-M964 HydrophobicContact CD2-CG 3.95Å; L83-M964 HydrophobicContact CD2-SD 4.2Å; F247-M964 HydrophobicContact CD1-CE 4.13Å; F247-M964 HydrophobicContact CE1-CE 3.48Å; F247-M964 VanDerWaalsContact CE1-CE 3.48Å; F247-M964 HydrophobicContact CZ-CE 4.46Å; L248-M964 HydrophobicContact CD2-CE 3.73Å; V251-M964 HydrophobicContact CG1-CG 4.43Å; V251-M964 HydrophobicContact CG1-SD 4.05Å; V251-M964 HydrophobicContact CG2-CE 4.01Å; V251-M964 HydrophobicContact CG2-SD 4.47Å; L283-M964 HydrophobicContact CD2-SD 4.15Å; I960-M964 VanDerWaalsContact O-CB 3.28Å; I960-M964 WeakPolarHBondContact O-CB 3.38Å; I960-M964 PolarHBondContact O-N 3.02Å; Y961-M964 HydrophobicContact CD1-CE 3.64Å; Y961-M964 HydrophobicContact CE1-CE 3.89Å; Y961-M964 PolarHBondContact O-N 3.41Å; M964-L967 PolarHBondContact O-N 2.85Å; M964-L968 VanDerWaalsContact O-CB 3.28Å; M964-L968 WeakPolarHBondContact O-CB 3.37Å; M964-L968 PolarHBondContact O-N 3.42Å
965	E	83.1	Confident	81.6	Confident	67 Å²	67	31 Å²	31	31%	0.313	16%	0.158	S	C	.	.	H	α-helix	trans	-63.5	-44.2	174.1	-169.5	-172.8	160.3	0	0	111.5	H235 Y961 V962 L968 K969	H235-E965 IonicContact NE2-OE2 2.93Å; Y961-E965 PolarHBondContact O-N 3.26Å; V962-E965 PolarHBondContact O-N 2.83Å; E965-L968 PolarHBondContact O-N 3.1Å; E965-K969 WeakPolarHBondContact O-CG 3.47Å; E965-K969 PolarHBondContact O-N 3.39Å; E965-K969 WeakPolarHBondContact OE1-CE 3.14Å; E965-K969 IonicContact OE1-NZ 2.75Å; E965-K969 PolarHBondContact OE1-NZ 3.1Å
966	M	83.1	Confident	80.2	Confident	19 Å²	19	35.1 Å²	35.1	9%	0.094	17%	0.172	C	C	.	.	H	α-helix	trans	-59.7	-49.7	176.1	180	-81.6	-71.9	0	0	111.4	F76 V202 D206 S207 I210 V962 L963 L968 K969 E970	F76-M966 HydrophobicContact CE2-CE 3.74Å; F76-M966 HydrophobicContact CZ-CE 3.54Å; V202-M966 HydrophobicContact CG1-CE 3.9Å; V202-M966 HydrophobicContact CG1-SD 3.91Å; D206-M966 HydrophobicContact CB-CE 4.3Å; D206-M966 HydrophobicContact CB-CG 4.16Å; D206-M966 HydrophobicContact CB-SD 4.15Å; S207-M966 WeakPolarHBondContact OG-CE 3.25Å; I210-M966 HydrophobicContact CD1-CB 3.89Å; I210-M966 HydrophobicContact CD1-CE 4.32Å; I210-M966 HydrophobicContact CD1-CG 4.02Å; V962-M966 PolarHBondContact O-N 3.07Å; V962-M966 VanDerWaalsContact O-N 3.1Å; L963-M966 PolarHBondContact O-N 3.36Å; M966-L968 VanDerWaalsContact C-N 3.3Å; M966-L968 PolarHBondContact O-N 3.25Å; M966-K969 PolarHBondContact O-N 3.41Å; M966-E970 PolarHBondContact O-N 2.95Å; M966-E970 VanDerWaalsContact O-N 3.11Å; M966-E970 HydrophobicContact SD-CG 4.13Å
967	L	78.3	Confident	78.6	Confident	39 Å²	39	36.9 Å²	36.9	20%	0.204	19%	0.188	C	C	.	.	H	α-helix	trans	-61.4	-38	178.1	-73.8	171.5	0	0	0	112.4	F76 L83 V202 L963 M964 E970 L971	F76-L967 HydrophobicContact CE2-CD1 4.45Å; F76-L967 HydrophobicContact CZ-CD1 4.43Å; F76-L967 HydrophobicContact CZ-CD2 3.86Å; F76-L967 HydrophobicContact CZ-CG 4.25Å; L83-L967 HydrophobicContact CD2-CD1 4.34Å; V202-L967 HydrophobicContact CG1-CD2 4.26Å; L963-L967 WeakPolarHBondContact O-CB 3.41Å; L963-L967 VanDerWaalsContact O-CG 3.3Å; L963-L967 WeakPolarHBondContact O-CG 3.4Å; L963-L967 PolarHBondContact O-N 3.4Å; M964-L967 PolarHBondContact O-N 2.85Å; L967-E970 PolarHBondContact O-N 3.38Å; L967-L971 VanDerWaalsContact O-CB 3.3Å; L967-L971 WeakPolarHBondContact O-CB 3.47Å; L967-L971 PolarHBondContact O-N 3.49Å
968	L	76.3	Confident	76.8	Confident	18 Å²	18	38 Å²	38	9%	0.094	20%	0.204	C	C	.	.	H	α-helix	trans	-67	-38.1	178.7	-167.3	66.3	0	0	0	111.7	V251 I254 L255 M964 E965 M966 E970 L971 C972 L975	V251-L968 HydrophobicContact CB-CD2 4.47Å; V251-L968 HydrophobicContact CG1-CD1 4.48Å; V251-L968 HydrophobicContact CG1-CD2 4.31Å; V251-L968 HydrophobicContact CG2-CD2 4.14Å; I254-L968 HydrophobicContact CB-CD1 4.38Å; I254-L968 HydrophobicContact CB-CD2 4.37Å; I254-L968 HydrophobicContact CD1-CD2 3.74Å; I254-L968 HydrophobicContact CG2-CD1 3.72Å; I254-L968 HydrophobicContact CG2-CD2 4.16Å; I254-L968 HydrophobicContact CG2-CG 4.06Å; L255-L968 HydrophobicContact CD2-CD1 3.89Å; L255-L968 HydrophobicContact CG-CD1 4.22Å; M964-L968 VanDerWaalsContact O-CB 3.28Å; M964-L968 WeakPolarHBondContact O-CB 3.37Å; M964-L968 PolarHBondContact O-N 3.42Å; E965-L968 PolarHBondContact O-N 3.1Å; M966-L968 VanDerWaalsContact C-N 3.3Å; M966-L968 PolarHBondContact O-N 3.25Å; L968-E970 VanDerWaalsContact C-N 3.33Å; L968-L971 PolarHBondContact O-N 3.1Å; L968-C972 PolarHBondContact O-N 3.19Å; L968-L975 HydrophobicContact CD2-CD1 4.27Å; L968-L975 HydrophobicContact CG-CD1 3.92Å
969	K	77.5	Confident	74.9	Confident	82 Å²	82	39.6 Å²	39.6	36%	0.357	22%	0.222	S	C	.	.	H	α-helix	trans	-66.3	-33.3	174.9	-72.9	173.9	-177.2	171	0	112.6	E965 M966 R976	E965-K969 WeakPolarHBondContact O-CG 3.47Å; E965-K969 PolarHBondContact O-N 3.39Å; E965-K969 WeakPolarHBondContact OE1-CE 3.14Å; E965-K969 IonicContact OE1-NZ 2.75Å; E965-K969 PolarHBondContact OE1-NZ 3.1Å; M966-K969 PolarHBondContact O-N 3.41Å; K969-R976 HydrophobicContact CB-CG 4.37Å; K969-R976 PolarHBondContact O-NE 3.5Å
970	E	78.6	Confident	72.9	Confident	30 Å²	30	46.4 Å²	46.4	14%	0.14	25%	0.253	C	S	.	.	H	α-helix	trans	-75.2	-39.6	174.1	-68.2	-66.6	169	0	0	112.1	I197 V202 M966 L967 L968 R976	I197-E970 HydrophobicContact CD1-CB 4.26Å; I197-E970 HydrophobicContact CG1-CB 4.47Å; I197-E970 HydrophobicContact CG2-CB 4.43Å; V202-E970 HydrophobicContact CG2-CB 4.49Å; V202-E970 HydrophobicContact CG2-CG 3.72Å; M966-E970 PolarHBondContact O-N 2.95Å; M966-E970 VanDerWaalsContact O-N 3.11Å; M966-E970 HydrophobicContact SD-CG 4.13Å; L967-E970 PolarHBondContact O-N 3.38Å; L968-E970 VanDerWaalsContact C-N 3.33Å; E970-R976 IonicContact OE1-CZ 2.63Å; E970-R976 VanDerWaalsContact OE1-CZ 3.31Å; E970-R976 IonicContact OE1-NH1 3.81Å; E970-R976 PolarHBondContact OE1-NH1 3.04Å; E970-R976 VanDerWaalsContact OE1-NH1 3.15Å; E970-R976 IonicContact OE1-NH2 3.91Å; E970-R976 PolarHBondContact OE1-NH2 3.37Å; E970-R976 IonicContact OE2-CZ 3.05Å; E970-R976 IonicContact OE2-NH1 3.04Å; E970-R976 PolarHBondContact OE2-NH1 2.67Å; E970-R976 VanDerWaalsContact OE2-NH1 3.09Å; E970-R976 IonicContact OE2-NH2 2.66Å; E970-R976 PolarHBondContact OE2-NH2 2.99Å
971	L	70.2	Confident	70.7	Confident	21 Å²	21	53.2 Å²	53.2	11%	0.11	29%	0.289	C	S	.	.	H	α-helix	trans	-72.8	-35.8	-178.4	-174.2	68	0	0	0	113.3	L190 R193 L194 I197 L255 L967 L968	L190-L971 HydrophobicContact CD1-CD1 3.98Å; R193-L971 HydrophobicContact CB-CD1 3.95Å; R193-L971 PolarHBondContact NH1-O 2.99Å; L194-L971 HydrophobicContact CD2-CD1 3.93Å; L194-L971 HydrophobicContact CG-CD1 4.36Å; I197-L971 HydrophobicContact CD1-CD1 4.4Å; L255-L971 HydrophobicContact CD2-CD2 3.69Å; L967-L971 VanDerWaalsContact O-CB 3.3Å; L967-L971 WeakPolarHBondContact O-CB 3.47Å; L967-L971 PolarHBondContact O-N 3.49Å; L968-L971 PolarHBondContact O-N 3.1Å
972	C	74.9	Confident	68.2	Low	1 Å²	1	60.1 Å²	60.1	1%	0.007	34%	0.337	C	S	.	.			trans	-121.5	81	177.6	-55.5	0	0	0	0	108.9	I254 C258 L968 E974 L975	I254-C972 HydrophobicContact CG2-CB 4.36Å; C258-C972 WeakPolarHBondContact CB-SG 3.49Å; C258-C972 WeakPolarHBondContact SG-CB 3.11Å; C258-C972 CovalentContact SG-SG 2.09Å; C258-C972 PolarHBondContact SG-SG 2.86Å; L968-C972 PolarHBondContact O-N 3.19Å; C972-E974 WeakPolarHBondContact CA-OE2 3.2Å; C972-E974 WeakPolarHBondContact CB-OE2 3.34Å; C972-E974 PolarHBondContact O-N 2.93Å; C972-E974 VanDerWaalsContact O-N 3.08Å; C972-L975 HydrophobicContact CB-CD1 4Å; C972-L975 HydrophobicContact CB-CG 4.16Å; C972-L975 WeakPolarHBondContact O-CB 3.46Å; C972-L975 WeakPolarHBondContact O-CG 3.34Å; C972-L975 PolarHBondContact O-N 3.44Å
973	P	71.9	Confident	67.4	Low	70 Å²	70	61.3 Å²	61.3	46%	0.455	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.6	-178.7	25	-35	0	0	0	113.2	L975 R976 A977	P973-L975 PolarHBondContact O-N 3.01Å; P973-L975 VanDerWaalsContact O-N 3.17Å; P973-R976 WeakPolarHBondContact O-CB 3.17Å; P973-R976 PolarHBondContact O-N 2.66Å; P973-A977 PolarHBondContact O-N 3.27Å
974	E	74.9	Confident	66.7	Low	98 Å²	98	64.2 Å²	64.2	46%	0.458	36%	0.36	S	S	.	.	H	α-helix	trans	-57.8	-27.2	172.9	-52.7	90.9	156.3	0	0	112.3	R193 C972 A978	R193-E974 IonicContact CZ-OE1 2.6Å; R193-E974 IonicContact NH1-OE1 3.51Å; R193-E974 PolarHBondContact NH1-OE1 2.98Å; R193-E974 IonicContact NH1-OE2 2.82Å; R193-E974 PolarHBondContact NH1-OE2 3.33Å; R193-E974 VanDerWaalsContact NH1-OE2 3.12Å; R193-E974 IonicContact NH2-OE1 2.71Å; R193-E974 PolarHBondContact NH2-OE1 3.47Å; C972-E974 WeakPolarHBondContact CA-OE2 3.2Å; C972-E974 WeakPolarHBondContact CB-OE2 3.34Å; C972-E974 PolarHBondContact O-N 2.93Å; C972-E974 VanDerWaalsContact O-N 3.08Å; E974-A978 WeakPolarHBondContact O-CB 3.34Å; E974-A978 PolarHBondContact O-N 3.45Å
975	L	67.2	Low	65.9	Low	56 Å²	56	67.4 Å²	67.4	29%	0.293	38%	0.378	S	S	.	.	H	α-helix	trans	-69.6	-32.1	174.7	-63.7	173.3	0	0	0	112.6	I254 L968 C972 P973 A979	I254-L975 HydrophobicContact CD1-CD1 4.19Å; I254-L975 HydrophobicContact CD1-CD2 4.12Å; I254-L975 HydrophobicContact CG2-CD1 3.97Å; L968-L975 HydrophobicContact CD2-CD1 4.27Å; L968-L975 HydrophobicContact CG-CD1 3.92Å; C972-L975 HydrophobicContact CB-CD1 4Å; C972-L975 HydrophobicContact CB-CG 4.16Å; C972-L975 WeakPolarHBondContact O-CB 3.46Å; C972-L975 WeakPolarHBondContact O-CG 3.34Å; C972-L975 PolarHBondContact O-N 3.44Å; P973-L975 PolarHBondContact O-N 3.01Å; P973-L975 VanDerWaalsContact O-N 3.17Å; L975-A979 WeakPolarHBondContact O-CB 3.47Å; L975-A979 PolarHBondContact O-N 2.8Å; L975-A979 VanDerWaalsContact O-N 3.07Å
976	R	62.5	Low	64.9	Low	92 Å²	92	67.5 Å²	67.5	35%	0.347	38%	0.382	S	S	.	.	H	α-helix	trans	-69.1	-48.1	176.3	-64	-179.6	172.8	-177.6	-10.9	110.1	K969 E970 P973 A978 A979 E980	K969-R976 HydrophobicContact CB-CG 4.37Å; K969-R976 PolarHBondContact O-NE 3.5Å; E970-R976 IonicContact OE1-CZ 2.63Å; E970-R976 VanDerWaalsContact OE1-CZ 3.31Å; E970-R976 IonicContact OE1-NH1 3.81Å; E970-R976 PolarHBondContact OE1-NH1 3.04Å; E970-R976 VanDerWaalsContact OE1-NH1 3.15Å; E970-R976 IonicContact OE1-NH2 3.91Å; E970-R976 PolarHBondContact OE1-NH2 3.37Å; E970-R976 IonicContact OE2-CZ 3.05Å; E970-R976 IonicContact OE2-NH1 3.04Å; E970-R976 PolarHBondContact OE2-NH1 2.67Å; E970-R976 VanDerWaalsContact OE2-NH1 3.09Å; E970-R976 IonicContact OE2-NH2 2.66Å; E970-R976 PolarHBondContact OE2-NH2 2.99Å; P973-R976 WeakPolarHBondContact O-CB 3.17Å; P973-R976 PolarHBondContact O-N 2.66Å; R976-A978 VanDerWaalsContact C-N 3.27Å; R976-A978 PolarHBondContact O-N 2.82Å; R976-A979 PolarHBondContact O-N 3.15Å; R976-A979 VanDerWaalsContact O-N 3.12Å; R976-E980 WeakPolarHBondContact O-CG 3.08Å; R976-E980 PolarHBondContact O-N 2.82Å
977	A	58.3	Low	63.7	Low	47 Å²	47	70.5 Å²	70.5	39%	0.388	40%	0.4	S	S	.	.	H	α-helix	trans	-60.8	-35.9	176.3	0	0	0	0	0	112.3	P973 N981	P973-A977 PolarHBondContact O-N 3.27Å; A977-N981 WeakPolarHBondContact O-CB 3.25Å; A977-N981 PolarHBondContact O-N 2.66Å; A977-N981 PolarHBondContact O-ND2 2.76Å
978	A	53.8	Low	62.7	Low	59 Å²	59	72.6 Å²	72.6	49%	0.488	41%	0.413	S	S	.	.	H	α-helix	trans	-70.7	-36.1	175.5	0	0	0	0	0	112.9	E974 R976 S982	E974-A978 WeakPolarHBondContact O-CB 3.34Å; E974-A978 PolarHBondContact O-N 3.45Å; R976-A978 VanDerWaalsContact C-N 3.27Å; R976-A978 PolarHBondContact O-N 2.82Å; A978-S982 WeakPolarHBondContact O-CB 3.34Å; A978-S982 PolarHBondContact O-N 2.86Å; A978-S982 PolarHBondContact O-OG 3.25Å
979	A	52.9	Low	61.8	Low	60 Å²	60	76.5 Å²	76.5	50%	0.496	44%	0.436	S	S	.	.	H	α-helix	trans	-76	-28.1	178.9	0	0	0	0	0	113.6	L975 R976 N981 S982	L975-A979 WeakPolarHBondContact O-CB 3.47Å; L975-A979 PolarHBondContact O-N 2.8Å; L975-A979 VanDerWaalsContact O-N 3.07Å; R976-A979 PolarHBondContact O-N 3.15Å; R976-A979 VanDerWaalsContact O-N 3.12Å; A979-N981 VanDerWaalsContact C-N 3.35Å; A979-S982 WeakPolarHBondContact CA-OG 3.47Å; A979-S982 PolarHBondContact O-OG 3.42Å; A979-S982 VanDerWaalsContact O-OG 3.13Å
980	E	47.5	Very low	60.6	Low	162 Å²	162	76.1 Å²	76.1	76%	0.757	44%	0.442	S	S	*	.	H	α-helix	trans	-77.7	-22	174.5	-72.1	173.3	-178	0	0	112.7	R976	R976-E980 WeakPolarHBondContact O-CG 3.08Å; R976-E980 PolarHBondContact O-N 2.82Å
981	N	38.8	Very low	59.1	Low	149 Å²	149	79.9 Å²	79.9	80%	0.797	47%	0.467	S	S	*	.			trans	-96.7	1.3	178.4	-72.7	-47.1	0	0	0	113.7	A977 A979	A977-N981 WeakPolarHBondContact O-CB 3.25Å; A977-N981 PolarHBondContact O-N 2.66Å; A977-N981 PolarHBondContact O-ND2 2.76Å; A979-N981 VanDerWaalsContact C-N 3.35Å
982	S	35.8	Very low	58.1	Low	144 Å²	144	85.3 Å²	85.3	100%	1.007	50%	0.499	S	S	*	.			trans	-113.8	0	178	65.7	0	0	0	0	110.7	A978 A979	A978-S982 WeakPolarHBondContact O-CB 3.34Å; A978-S982 PolarHBondContact O-N 2.86Å; A978-S982 PolarHBondContact O-OG 3.25Å; A979-S982 WeakPolarHBondContact CA-OG 3.47Å; A979-S982 PolarHBondContact O-OG 3.42Å; A979-S982 VanDerWaalsContact O-OG 3.13Å

Retrieved 982 of 982 residues in 367.8 ms (Link to these results)

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