A0A087Y165_POEFO Loading...

RNA uridylyltransferase

AlphaFold DB , UniProt , Accession A0A087Y165, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,073 aa.

						>A0A087Y165_POEFO|A0A087Y165
MREDTDDVAHKPGRRQRNRNKKKPLAEECKGLEMEEARVPVQDLQTTRQVEKRLRRDEIYPLRKNCHGNPGALYTCALCDIPLESISHAFKHVRDKRHKKRAREKQEQLMLAEIMPPGPEHISAVTAALNAVVHEHGMNDQDVLKRESLVSVMQDVLLSVLPEIRLRLYGSSCTKFGFKDSDVNIDIQYPPHMHQPDVLLVVKEALSESPYFCNVEADFHARVPVVICKERKSSGLICKVSAGNENAFQTTSYLSALANMERLLLPLVLGLRHWAQICEIDRPEEGGLPPYVFALMVIFYLQKRKEPLLPTYLNQGIKVFSLSRLSAFNLTHTDEGYIHWIYNVPSSKESTQPAERSTMKGKVPLMFQSSHLPVEVGLLWIEMLRFYSLEFIMADNVISVRTNAVLSREMKDWPKKRIAVEDPFAVKRNVARTVNSQQMFDYILHCLKTTYKYFALPLNTSAANHRDEAKQGLNEGASSLSDFSQLSLQSPSQTRGADDGPDDSDCIIEEEEEVEECSDSDEEQEKEKTDMGKSSFSEDEEDEEEQDEDLDVDSQPHDREHLDSLTTEDEDIFPVDEISGEELLSDEEPPDLDTPGSLDEEEEEELAHVRLSPSMSKTKNESTKSQYQQQSQYAYEFTKQAFTKGKSHMVVCSLCKRDGHLKKDCPEDFKKVELDPLPPLTPDFLSVLNRVCEQCYYLFQAPDDLENGVRELILQDLESFVRRQFAGARLQLFGSSKNGFGFRQSDLDICMVLEGKETMDDVDCINIIKGLARQLKKHPGLRNILPITTAKVPIVKFYHLRTGLEGDISLYNTLALHNTRLLASYAAIDRRVKILCYIMKVFAKMCDIGDASRGSLSSYAYTLMVLFFLQQRNPPVIPVLQEIYGGETKPEVLVDGWNVYFFDDLKTLPCHWPLYGQNTESVGELWLGLLRFYTEDFDFREHVVCIRQHTRLTTFNKQWTSKYIVIEDPFDLNHNLGAGLSRRMTNFIMKAFINGRRVFGTPMKGLPPEYPSEMEYFFDPEVLTEGEVAPNDRCCRVCGKIGHFLKDCPMRNKPKHRRESENRPEHFHDSTEE
					

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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	32	Very low	29.9	Very low	237 Å²	237	157.7 Å²	157.7	100%	1.167	81%	0.807	S	S	*	*				0	152.6	0	-72.6	174.4	167.2	0	0	107.3
2	R	27.2	Very low	30.3	Very low	194 Å²	194	155.8 Å²	155.8	73%	0.732	81%	0.813	S	S	*	*			trans	16.9	148.9	134.6	-65.7	174.7	159.7	-121.4	0.4	119.1
3	E	29.3	Very low	30.2	Very low	129 Å²	129	150.2 Å²	150.2	60%	0.603	82%	0.816	S	S	*	*			cis	-164	141.4	-3.4	-111.7	149.8	172.9	0	0	106.8
4	D	29.2	Very low	30.2	Very low	132 Å²	132	156.6 Å²	156.6	71%	0.706	82%	0.822	S	S	*	*			cis	-161.9	-176.2	-32.7	-94	-24.7	0	0	0	107.2
5	T	32.1	Very low	30.1	Very low	145 Å²	145	163.4 Å²	163.4	89%	0.89	83%	0.832	S	S	*	*			trans	-156.8	124.8	171.5	-16.5	0	0	0	0	112.7
6	D	29.1	Very low	29.9	Very low	153 Å²	153	163.5 Å²	163.5	82%	0.818	83%	0.829	S	S	*	*			trans	-82.5	138.2	-165.9	-68.6	-56.2	0	0	0	116.4
7	D	27.3	Very low	29.9	Very low	144 Å²	144	168.1 Å²	168.1	77%	0.77	83%	0.834	S	S	*	*				52.7	144.1	114.3	-131.8	17.2	0	0	0	119.6
8	V	29.1	Very low	29.6	Very low	130 Å²	130	165.8 Å²	165.8	79%	0.788	83%	0.825	S	S	*	*			cis	-141	163.1	27.6	-179.9	0	0	0	0	112.1
9	A	31.1	Very low	29.6	Very low	78 Å²	78	168.3 Å²	168.3	65%	0.645	82%	0.824	S	S	*	*			trans	-89.8	155.9	-163.2	0	0	0	0	0	120.3
10	H	32.7	Very low	29.4	Very low	189 Å²	189	166.7 Å²	166.7	88%	0.875	82%	0.819	S	S	*	*			trans	45.5	115	147.9	-71.9	-31.2	0	0	0	123.6
11	K	29.7	Very low	29.3	Very low	204 Å²	204	168.9 Å²	168.9	89%	0.887	82%	0.824	S	S	*	*			trans	-136.7	145.6	136.7	-74.4	-176.8	-179.9	172.5	0	110.2
12	P	35	Very low	29.1	Very low	135 Å²	135	166.8 Å²	166.8	88%	0.877	81%	0.809	S	S	*	*			trans	-92.5	134.7	-179.5	34.2	-32.6	0	0	0	113.2
13	G	28.7	Very low	29	Very low	82 Å²	82	167.2 Å²	167.2	85%	0.845	82%	0.815	S	S	*	*			trans	-133.8	99.6	174.1	0	0	0	0	0	112.5
14	R	30	Very low	29.3	Very low	240 Å²	240	166.3 Å²	166.3	91%	0.906	82%	0.821	S	S	*	*			trans	-96	133.5	170.4	-75.2	-176.5	173.9	-178.8	-1.3	110.4
15	R	29.7	Very low	29.1	Very low	259 Å²	259	168.6 Å²	168.6	98%	0.977	83%	0.832	S	S	*	*			trans	-129.8	129.9	155.6	-79.7	-169.5	171.1	-172.3	-1.9	110.2
16	Q	27	Very low	28.8	Very low	165 Å²	165	165.6 Å²	165.6	77%	0.771	82%	0.822	S	S	*	*			trans	-165.7	131	-173.8	-176.9	-170.8	37.7	0	0	108.2
17	R	28.5	Very low	28.8	Very low	242 Å²	242	167.2 Å²	167.2	91%	0.913	83%	0.825	S	S	*	*			trans	161.6	129	164.6	-94.1	154.3	-172.8	-161.7	1.7	107.2
18	N	26	Very low	28.8	Very low	127 Å²	127	169.8 Å²	169.8	68%	0.679	83%	0.832	S	S	*	*			cis	80.2	102.8	5.6	-148.7	6.3	0	0	0	117.9
19	R	28.8	Very low	28.7	Very low	212 Å²	212	169.2 Å²	169.2	80%	0.8	83%	0.832	S	S	*	*			trans	56.5	136.2	146.2	-84.8	179.7	165.2	175.1	-3.3	123.7
20	N	26.4	Very low	28.5	Very low	137 Å²	137	175.5 Å²	175.5	73%	0.733	85%	0.845	S	S	*	*			trans	63.2	123.6	142.6	-59.2	1.4	0	0	0	120.9
21	K	27.1	Very low	28.3	Very low	212 Å²	212	169.8 Å²	169.8	92%	0.922	84%	0.837	S	S	*	*				-178	168.3	103.7	-102.2	176.2	179.4	179.6	0	114.6
22	K	26.6	Very low	28.2	Very low	194 Å²	194	168.4 Å²	168.4	84%	0.843	84%	0.838	S	S	*	*			trans	-83	154.6	171.2	-69.5	178.2	172	179.3	0	111.7
23	K	26.4	Very low	28	Very low	202 Å²	202	171 Å²	171	88%	0.878	84%	0.839	S	S	*	*			trans	64.2	164.6	162.3	-73.8	-172.1	174.5	-170.8	0	116.4
24	P	34.5	Very low	28.1	Very low	110 Å²	110	175.7 Å²	175.7	71%	0.714	84%	0.841	S	S	*	*			cis	-118.7	173.2	-16.9	38.8	-26.4	0	0	0	112.7
25	L	25.7	Very low	28.2	Very low	181 Å²	181	173.2 Å²	173.2	95%	0.948	84%	0.84	S	S	*	*			trans	-137	116.6	144.1	-85.3	179.9	0	0	0	108.9
26	A	25.7	Very low	28.4	Very low	82 Å²	82	169.4 Å²	169.4	68%	0.678	83%	0.833	S	S	*	*			trans	-125.9	151.2	158.5	0	0	0	0	0	106
27	E	28.7	Very low	28.8	Very low	186 Å²	186	165.5 Å²	165.5	87%	0.869	83%	0.829	S	S	*	*			trans	50.7	98.8	169.1	-59	-175.5	131.7	0	0	117.2
28	E	26.6	Very low	29.6	Very low	199 Å²	199	165.7 Å²	165.7	93%	0.93	83%	0.83	S	S	*	*				-141.3	118.9	121.5	-137.3	170.4	-149.4	0	0	109.7
29	C	28.5	Very low	30.3	Very low	117 Å²	117	163.8 Å²	163.8	79%	0.791	82%	0.823	S	S	*	*			trans	-96.3	120.3	176.6	-72.5	0	0	0	0	109.8
30	K	26.4	Very low	31	Very low	211 Å²	211	157.3 Å²	157.3	92%	0.917	81%	0.808	S	S	*	*			trans	-175.6	141.9	137.6	-105.5	156	-173.5	177.2	0	113.1
31	G	28.9	Very low	32.1	Very low	68 Å²	68	156.3 Å²	156.3	70%	0.701	81%	0.807	S	S	*	*			trans	68.6	92.9	150.6	0	0	0	0	0	116.9
32	L	28.1	Very low	33	Very low	175 Å²	175	154 Å²	154	92%	0.916	80%	0.799	S	S	*	*				-160.5	113.5	111.7	-102.2	166.8	0	0	0	107.9
33	E	30.3	Very low	34.1	Very low	190 Å²	190	148.4 Å²	148.4	89%	0.888	78%	0.779	S	S	*	*			trans	-81	135.1	175.6	-65.2	169.4	140.2	0	0	108.7
34	M	29.9	Very low	35.3	Very low	180 Å²	180	141.8 Å²	141.8	89%	0.887	75%	0.752	S	S	*	*			trans	-130.3	146.3	164.2	-82.6	-174.1	64.5	0	0	108.4	E36	M34-E36 PolarHBondContact O-N 3.45Å
35	E	32.7	Very low	36.3	Very low	189 Å²	189	142.6 Å²	142.6	88%	0.883	75%	0.747	S	S	*	*			trans	-72.4	117.3	-157.8	-59.7	177.7	107.5	0	0	113.6	A37	E35-A37 PolarHBondContact O-N 3.43Å
36	E	33.7	Very low	38	Very low	178 Å²	178	137.2 Å²	137.2	83%	0.832	72%	0.721	S	S	*	*			trans	-70.2	84.3	158.3	-77.1	-166.7	146.4	0	0	109.2	M34 R38	M34-E36 PolarHBondContact O-N 3.45Å; E36-R38 VanDerWaalsContact C-N 3.34Å; E36-R38 PolarHBondContact O-N 3.34Å
37	A	36.4	Very low	39.6	Very low	84 Å²	84	135.7 Å²	135.7	69%	0.694	70%	0.704	S	S	*	*			trans	-69.7	83	-178.1	0	0	0	0	0	112.9	E35	E35-A37 PolarHBondContact O-N 3.43Å
38	R	44.6	Very low	41.4	Very low	245 Å²	245	135.2 Å²	135.2	93%	0.925	69%	0.694	S	S	*	*			trans	48.8	72.3	158.6	-61.7	-177.3	178.6	178.6	0.8	116.5	E36	E36-R38 VanDerWaalsContact C-N 3.34Å; E36-R38 PolarHBondContact O-N 3.34Å
39	V	41	Very low	43.4	Very low	87 Å²	87	131.2 Å²	131.2	53%	0.527	68%	0.675	S	S	.	*			trans	-98.8	137.9	160.4	176.9	0	0	0	0	109.6	D43 L44	V39-D43 HydrophobicContact CG1-CB 3.68Å; V39-L44 HydrophobicContact CG1-CG 4.44Å
40	P	42.2	Very low	45.5	Very low	76 Å²	76	127.2 Å²	127.2	49%	0.494	65%	0.647	S	S	.	*			trans	-59.7	148.4	178.6	-25.2	35.2	0	0	0	113.9	Q42 D43 L44	P40-Q42 PolarHBondContact O-N 3.31Å; P40-Q42 VanDerWaalsContact O-N 3.16Å; P40-D43 WeakPolarHBondContact CD-OD2 3.39Å; P40-D43 WeakPolarHBondContact CG-OD2 3.36Å; P40-D43 PolarHBondContact O-N 3.16Å; P40-L44 PolarHBondContact O-N 2.8Å
41	V	49.1	Very low	47.9	Very low	116 Å²	116	118.9 Å²	118.9	70%	0.703	61%	0.612	S	S	*	*	H	α-helix	trans	-63	-25.4	-175.9	179.9	0	0	0	0	113
42	Q	46.5	Very low	50.1	Low	165 Å²	165	123 Å²	123	77%	0.771	61%	0.61	S	S	*	*	H	α-helix	trans	-71.4	-39.9	172.7	-75.9	173.9	-62.1	0	0	112.3	P40 L44 Q45 T46	P40-Q42 PolarHBondContact O-N 3.31Å; P40-Q42 VanDerWaalsContact O-N 3.16Å; Q42-L44 VanDerWaalsContact C-N 3.33Å; Q42-L44 PolarHBondContact O-N 3.12Å; Q42-Q45 PolarHBondContact O-N 3.41Å; Q42-Q45 VanDerWaalsContact O-N 3.12Å; Q42-T46 PolarHBondContact O-N 3.47Å; Q42-T46 PolarHBondContact O-OG1 3.01Å
43	D	50.9	Low	52.4	Low	76 Å²	76	122.6 Å²	122.6	41%	0.406	60%	0.596	S	S	.	*	H	α-helix	trans	-70.6	-27.5	-178.1	-68.7	-50	0	0	0	113.1	V39 P40 Q45 T46 T47	V39-D43 HydrophobicContact CG1-CB 3.68Å; P40-D43 WeakPolarHBondContact CD-OD2 3.39Å; P40-D43 WeakPolarHBondContact CG-OD2 3.36Å; P40-D43 PolarHBondContact O-N 3.16Å; D43-Q45 VanDerWaalsContact C-N 3.26Å; D43-Q45 PolarHBondContact O-N 3.01Å; D43-T46 WeakPolarHBondContact CA-OG1 3.43Å; D43-T46 PolarHBondContact O-OG1 3.22Å; D43-T46 VanDerWaalsContact O-OG1 3.08Å; D43-T47 WeakPolarHBondContact O-CB 3.39Å; D43-T47 PolarHBondContact O-N 3.33Å; D43-T47 PolarHBondContact O-OG1 2.81Å
44	L	51.8	Low	54.8	Low	62 Å²	62	113.5 Å²	113.5	33%	0.325	55%	0.554	S	S	.	*	H	α-helix	trans	-65.6	-27.6	171.8	-79.3	163	0	0	0	112.8	V39 P40 Q42 R48	V39-L44 HydrophobicContact CG1-CG 4.44Å; P40-L44 PolarHBondContact O-N 2.8Å; Q42-L44 VanDerWaalsContact C-N 3.33Å; Q42-L44 PolarHBondContact O-N 3.12Å; L44-R48 WeakPolarHBondContact O-CB 3.37Å; L44-R48 WeakPolarHBondContact O-CD 3.47Å; L44-R48 VanDerWaalsContact O-CG 3.25Å; L44-R48 WeakPolarHBondContact O-CG 3.42Å; L44-R48 PolarHBondContact O-N 3.07Å
45	Q	54.5	Low	57.2	Low	128 Å²	128	110.4 Å²	110.4	60%	0.598	53%	0.532	S	S	*	.	H	α-helix	trans	-80.5	-46.1	176.7	-64.9	-167.8	2.1	0	0	111.8	Q42 D43 R48 Q49	Q42-Q45 PolarHBondContact O-N 3.41Å; Q42-Q45 VanDerWaalsContact O-N 3.12Å; D43-Q45 VanDerWaalsContact C-N 3.26Å; D43-Q45 PolarHBondContact O-N 3.01Å; Q45-R48 PolarHBondContact O-N 3.39Å; Q45-Q49 WeakPolarHBondContact O-CG 3.19Å; Q45-Q49 PolarHBondContact O-N 3.01Å
46	T	60.8	Low	59.5	Low	68 Å²	68	111.5 Å²	111.5	42%	0.417	53%	0.529	S	S	.	.	H	α-helix	trans	-62.2	-42.2	174.2	45.1	0	0	0	0	111.3	Q42 D43 R48 Q49 V50	Q42-T46 PolarHBondContact O-N 3.47Å; Q42-T46 PolarHBondContact O-OG1 3.01Å; D43-T46 WeakPolarHBondContact CA-OG1 3.43Å; D43-T46 PolarHBondContact O-OG1 3.22Å; D43-T46 VanDerWaalsContact O-OG1 3.08Å; T46-R48 PolarHBondContact O-N 2.95Å; T46-Q49 PolarHBondContact O-N 3.12Å; T46-Q49 VanDerWaalsContact O-N 3.13Å; T46-V50 WeakPolarHBondContact O-CB 3.34Å; T46-V50 WeakPolarHBondContact O-CG2 3.45Å; T46-V50 PolarHBondContact O-N 3.43Å
47	T	60.7	Low	61.8	Low	50 Å²	50	105.4 Å²	105.4	31%	0.307	50%	0.502	S	S	.	.	H	α-helix	trans	-58.9	-45.4	175.2	-58.3	0	0	0	0	111.6	D43 Q49 V50 E51 I86	D43-T47 WeakPolarHBondContact O-CB 3.39Å; D43-T47 PolarHBondContact O-N 3.33Å; D43-T47 PolarHBondContact O-OG1 2.81Å; T47-Q49 VanDerWaalsContact C-N 3.33Å; T47-Q49 PolarHBondContact O-N 3.22Å; T47-V50 PolarHBondContact O-N 2.81Å; T47-E51 PolarHBondContact O-N 3.41Å; T47-I86 HydrophobicContact CG2-CD1 4.43Å
48	R	65.4	Low	64.1	Low	175 Å²	175	103.5 Å²	103.5	66%	0.66	48%	0.478	S	S	*	.	H	α-helix	trans	-67.1	-28.9	175.9	-74	174.9	179.9	-173.3	2.7	113.6	L44 Q45 T46 K52	L44-R48 WeakPolarHBondContact O-CB 3.37Å; L44-R48 WeakPolarHBondContact O-CD 3.47Å; L44-R48 VanDerWaalsContact O-CG 3.25Å; L44-R48 WeakPolarHBondContact O-CG 3.42Å; L44-R48 PolarHBondContact O-N 3.07Å; Q45-R48 PolarHBondContact O-N 3.39Å; T46-R48 PolarHBondContact O-N 2.95Å; R48-K52 WeakPolarHBondContact O-CG 3.48Å; R48-K52 PolarHBondContact O-N 2.69Å
49	Q	69.5	Low	66	Low	116 Å²	116	91.9 Å²	91.9	54%	0.542	44%	0.435	S	S	.	.	H	α-helix	trans	-73.8	-39	171.9	-71.4	176.4	11.7	0	0	111.9	Q45 T46 T47 K52 R53	Q45-Q49 WeakPolarHBondContact O-CG 3.19Å; Q45-Q49 PolarHBondContact O-N 3.01Å; T46-Q49 PolarHBondContact O-N 3.12Å; T46-Q49 VanDerWaalsContact O-N 3.13Å; T47-Q49 VanDerWaalsContact C-N 3.33Å; T47-Q49 PolarHBondContact O-N 3.22Å; Q49-K52 WeakPolarHBondContact O-CB 3.44Å; Q49-K52 PolarHBondContact O-N 3.42Å; Q49-R53 PolarHBondContact O-N 2.87Å
50	V	72.7	Confident	68.1	Low	33 Å²	33	92.1 Å²	92.1	20%	0.2	43%	0.427	C	S	.	.	H	α-helix	trans	-64	-44.9	174.5	163.6	0	0	0	0	110.9	T46 T47 K52 R53 L54 I86 F90	T46-V50 WeakPolarHBondContact O-CB 3.34Å; T46-V50 WeakPolarHBondContact O-CG2 3.45Å; T46-V50 PolarHBondContact O-N 3.43Å; T47-V50 PolarHBondContact O-N 2.81Å; V50-K52 VanDerWaalsContact C-N 3.29Å; V50-K52 PolarHBondContact O-N 3.13Å; V50-R53 WeakPolarHBondContact O-CA 3.48Å; V50-R53 WeakPolarHBondContact O-CB 3.46Å; V50-R53 PolarHBondContact O-N 3.08Å; V50-L54 HydrophobicContact CG1-CD1 4.04Å; V50-L54 HydrophobicContact CG1-CG 4.36Å; V50-L54 WeakPolarHBondContact O-CG 3.35Å; V50-L54 PolarHBondContact O-N 3.25Å; V50-I86 HydrophobicContact CG1-CD1 4.03Å; V50-I86 HydrophobicContact CG1-CG1 4.25Å; V50-I86 HydrophobicContact CG1-CG2 3.58Å; V50-F90 HydrophobicContact CG1-CE2 3.68Å; V50-F90 HydrophobicContact CG1-CZ 3.96Å
51	E	75.4	Confident	69.9	Low	36 Å²	36	90.4 Å²	90.4	17%	0.168	42%	0.416	C	S	.	.	H	α-helix	trans	-60.1	-37.7	171.8	-75.4	-163.6	-179	0	0	112.7	T47 R53 L54 R55 Y74	T47-E51 PolarHBondContact O-N 3.41Å; E51-R53 PolarHBondContact O-N 3.39Å; E51-L54 PolarHBondContact O-N 3.28Å; E51-R55 WeakPolarHBondContact O-CB 3.33Å; E51-R55 WeakPolarHBondContact O-CG 3.25Å; E51-R55 PolarHBondContact O-N 3.1Å; E51-R55 IonicContact OE2-CZ 2.8Å; E51-R55 IonicContact OE2-NE 3.06Å; E51-R55 IonicContact OE2-NH2 3.78Å; E51-R55 PolarHBondContact OE2-NH2 2.97Å; E51-Y74 HydrophobicContact CG-CE1 4.16Å
52	K	75.4	Confident	71.2	Confident	154 Å²	154	87.2 Å²	87.2	67%	0.67	39%	0.394	S	S	*	.	H	α-helix	trans	-64.4	-28.2	173.9	-80.9	-179.5	176.5	-173.1	0	112.8	R48 Q49 V50	R48-K52 WeakPolarHBondContact O-CG 3.48Å; R48-K52 PolarHBondContact O-N 2.69Å; Q49-K52 WeakPolarHBondContact O-CB 3.44Å; Q49-K52 PolarHBondContact O-N 3.42Å; V50-K52 VanDerWaalsContact C-N 3.29Å; V50-K52 PolarHBondContact O-N 3.13Å
53	R	77.2	Confident	71.8	Confident	166 Å²	166	90.9 Å²	90.9	63%	0.626	40%	0.401	S	S	*	.	H	α-helix	trans	-74.3	-55.2	171.2	-69.7	179.6	175.4	-176.6	-2.6	110.5	Q49 V50 E51 R55 R56 F90	Q49-R53 PolarHBondContact O-N 2.87Å; V50-R53 WeakPolarHBondContact O-CA 3.48Å; V50-R53 WeakPolarHBondContact O-CB 3.46Å; V50-R53 PolarHBondContact O-N 3.08Å; E51-R53 PolarHBondContact O-N 3.39Å; R53-R55 PolarHBondContact O-N 3.32Å; R53-R55 VanDerWaalsContact O-N 3.11Å; R53-R56 WeakPolarHBondContact O-CA 3.35Å; R53-R56 VanDerWaalsContact O-CB 3.27Å; R53-R56 WeakPolarHBondContact O-CB 3.42Å; R53-R56 PolarHBondContact O-N 3.14Å; R53-F90 HydrophobicContact CB-CZ 4.49Å
54	L	80.8	Confident	72.2	Confident	0 Å²	0	95.8 Å²	95.8	0%	0	42%	0.419	C	S	.	.	H	α-helix	trans	-55.5	-32.9	179.7	-68.6	178.3	0	0	0	113.5	V50 E51 R56 D57 E58 I59 I86 A89 F90	V50-L54 HydrophobicContact CG1-CD1 4.04Å; V50-L54 HydrophobicContact CG1-CG 4.36Å; V50-L54 WeakPolarHBondContact O-CG 3.35Å; V50-L54 PolarHBondContact O-N 3.25Å; E51-L54 PolarHBondContact O-N 3.28Å; L54-R56 VanDerWaalsContact C-N 3.32Å; L54-R56 PolarHBondContact O-N 3.27Å; L54-D57 CarbonylContact O-C 3.31Å; L54-D57 VanDerWaalsContact O-C 3.31Å; L54-D57 WeakPolarHBondContact O-CA 3.27Å; L54-D57 PolarHBondContact O-N 2.74Å; L54-D57 VanDerWaalsContact O-N 3.13Å; L54-E58 PolarHBondContact O-N 3.32Å; L54-I59 CarbonylContact C-O 3.59Å; L54-I59 HydrophobicContact CB-CB 4.12Å; L54-I59 HydrophobicContact CB-CG2 4.28Å; L54-I59 HydrophobicContact CD2-CD1 4.36Å; L54-I59 WeakPolarHBondContact O-CB 3.32Å; L54-I59 PolarHBondContact O-N 3.11Å; L54-I86 HydrophobicContact CD1-CG1 4.47Å; L54-A89 HydrophobicContact CD1-CB 3.99Å; L54-A89 HydrophobicContact CD2-CB 3.76Å; L54-F90 HydrophobicContact CD2-CD1 3.85Å; L54-F90 HydrophobicContact CD2-CD2 4.43Å; L54-F90 HydrophobicContact CD2-CE1 3.65Å; L54-F90 HydrophobicContact CD2-CE2 4.27Å; L54-F90 HydrophobicContact CD2-CG 4.23Å; L54-F90 HydrophobicContact CD2-CZ 3.87Å; L54-F90 HydrophobicContact CG-CE1 4.3Å; L54-F90 HydrophobicContact CG-CE2 4.5Å; L54-F90 HydrophobicContact CG-CZ 4.09Å
55	R	80.9	Confident	72.2	Confident	115 Å²	115	97.9 Å²	97.9	43%	0.434	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-18.8	174.2	-70.7	172.8	-158.6	-163.7	8.5	114.7	E51 R53 D57 I59 Y60	E51-R55 WeakPolarHBondContact O-CB 3.33Å; E51-R55 WeakPolarHBondContact O-CG 3.25Å; E51-R55 PolarHBondContact O-N 3.1Å; E51-R55 IonicContact OE2-CZ 2.8Å; E51-R55 IonicContact OE2-NE 3.06Å; E51-R55 IonicContact OE2-NH2 3.78Å; E51-R55 PolarHBondContact OE2-NH2 2.97Å; R53-R55 PolarHBondContact O-N 3.32Å; R53-R55 VanDerWaalsContact O-N 3.11Å; R55-D57 VanDerWaalsContact C-N 3.35Å; R55-I59 WeakPolarHBondContact CA-O 3.35Å; R55-I59 WeakPolarHBondContact CG-O 3.31Å; R55-I59 PolarHBondContact N-O 2.75Å; R55-Y60 HydrophobicContact CB-CE1 4.46Å; R55-Y60 HydrophobicContact CG-CD1 4.04Å; R55-Y60 HydrophobicContact CG-CE1 4.19Å
56	R	79.4	Confident	72	Confident	212 Å²	212	95 Å²	95	80%	0.8	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-34.1	167.8	-64.3	177.8	173.8	-170.5	-5.5	110.5	R53 L54 E58	R53-R56 WeakPolarHBondContact O-CA 3.35Å; R53-R56 VanDerWaalsContact O-CB 3.27Å; R53-R56 WeakPolarHBondContact O-CB 3.42Å; R53-R56 PolarHBondContact O-N 3.14Å; L54-R56 VanDerWaalsContact C-N 3.32Å; L54-R56 PolarHBondContact O-N 3.27Å; R56-E58 PolarHBondContact O-N 3.1Å
57	D	82.3	Confident	71.7	Confident	50 Å²	50	101.8 Å²	101.8	27%	0.267	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	20.6	173.9	-45.7	-56.9	0	0	0	112.5	L54 R55 I59 V93 H98	L54-D57 CarbonylContact O-C 3.31Å; L54-D57 VanDerWaalsContact O-C 3.31Å; L54-D57 WeakPolarHBondContact O-CA 3.27Å; L54-D57 PolarHBondContact O-N 2.74Å; L54-D57 VanDerWaalsContact O-N 3.13Å; R55-D57 VanDerWaalsContact C-N 3.35Å; D57-I59 PolarHBondContact O-N 3.33Å; D57-I59 VanDerWaalsContact O-N 3.12Å; D57-V93 HydrophobicContact CB-CB 4.46Å; D57-V93 HydrophobicContact CB-CG1 4Å; D57-V93 HydrophobicContact CB-CG2 3.54Å; D57-H98 PolarHBondContact O-CE1 3.4Å; D57-H98 PolarHBondContact O-NE2 3.06Å
58	E	84.7	Confident	71.4	Confident	44 Å²	44	103 Å²	103	21%	0.206	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	57	27.1	177.5	-60	-84.5	152.5	0	0	114.7	L54 R56 Y60 A77 L78 K105	L54-E58 PolarHBondContact O-N 3.32Å; R56-E58 PolarHBondContact O-N 3.1Å; E58-Y60 HydrophobicContact CB-CE2 4.37Å; E58-Y60 WeakPolarHBondContact O-CD2 3.43Å; E58-Y60 WeakPolarHBondContact O-CE2 3.43Å; E58-A77 PolarHBondContact O-N 3.05Å; E58-L78 HydrophobicContact CB-CB 4.5Å; E58-L78 HydrophobicContact CB-CD1 3.83Å; E58-L78 HydrophobicContact CB-CG 3.7Å; E58-L78 HydrophobicContact CG-CD1 3.88Å; E58-L78 HydrophobicContact CG-CG 3.85Å; E58-K105 IonicContact OE1-NZ 3.66Å; E58-K105 PolarHBondContact OE1-NZ 2.88Å; E58-K105 IonicContact OE2-NZ 3.73Å; E58-K105 PolarHBondContact OE2-NZ 3.03Å
59	I	84.4	Confident	71	Confident	1 Å²	1	98.2 Å²	98.2	1%	0.005	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	125.8	174.3	-64.7	171.1	0	0	0	109.7	L54 R55 D57 Y74 T75 C76 L83 A89 V93	L54-I59 CarbonylContact C-O 3.59Å; L54-I59 HydrophobicContact CB-CB 4.12Å; L54-I59 HydrophobicContact CB-CG2 4.28Å; L54-I59 HydrophobicContact CD2-CD1 4.36Å; L54-I59 WeakPolarHBondContact O-CB 3.32Å; L54-I59 PolarHBondContact O-N 3.11Å; R55-I59 WeakPolarHBondContact CA-O 3.35Å; R55-I59 WeakPolarHBondContact CG-O 3.31Å; R55-I59 PolarHBondContact N-O 2.75Å; D57-I59 PolarHBondContact O-N 3.33Å; D57-I59 VanDerWaalsContact O-N 3.12Å; I59-Y74 HydrophobicContact CG2-CD1 4.28Å; I59-Y74 HydrophobicContact CG2-CG 4.33Å; I59-T75 WeakPolarHBondContact CA-O 3.38Å; I59-C76 HydrophobicContact CD1-CB 4.5Å; I59-C76 HydrophobicContact CG1-CB 3.81Å; I59-L83 HydrophobicContact CD1-CD1 3.92Å; I59-L83 HydrophobicContact CG1-CD1 4.22Å; I59-L83 HydrophobicContact CG2-CD1 4.1Å; I59-A89 HydrophobicContact CD1-CB 4.02Å; I59-A89 HydrophobicContact CG2-CB 4.27Å; I59-V93 HydrophobicContact CD1-CG2 3.5Å; I59-V93 VanDerWaalsContact CD1-CG2 3.5Å
60	Y	84.8	Confident	70.5	Confident	92 Å²	92	97.7 Å²	97.7	36%	0.361	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	141.1	-173.1	-59.3	-82.7	0	0	0	111.3	R55 E58 Y74 T75 A77	R55-Y60 HydrophobicContact CB-CE1 4.46Å; R55-Y60 HydrophobicContact CG-CD1 4.04Å; R55-Y60 HydrophobicContact CG-CE1 4.19Å; E58-Y60 HydrophobicContact CB-CE2 4.37Å; E58-Y60 WeakPolarHBondContact O-CD2 3.43Å; E58-Y60 WeakPolarHBondContact O-CE2 3.43Å; Y60-Y74 CarbonylContact O-C 3.57Å; Y60-Y74 WeakPolarHBondContact O-CA 3.48Å; Y60-T75 PolarHBondContact N-O 3.24Å; Y60-T75 PolarHBondContact O-N 3.38Å; Y60-A77 HydrophobicContact CD2-CB 3.96Å; Y60-A77 HydrophobicContact CE2-CB 3.76Å
61	P	80.1	Confident	70	Confident	40 Å²	40	98 Å²	98	26%	0.26	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	134.3	173.8	26.8	-33.3	0	0	0	111	L73 Y74	P61-L73 WeakPolarHBondContact CA-O 3.43Å; P61-Y74 HydrophobicContact CB-CD1 4Å; P61-Y74 HydrophobicContact CB-CE1 3.83Å
62	L	76.2	Confident	69.8	Low	49 Å²	49	96.6 Å²	96.6	26%	0.257	47%	0.471	S	S	.	.			trans	-72.1	129.6	177.3	-79.2	162.5	0	0	0	110.1	A72 L73 Y74 T75	L62-A72 HydrophobicContact CD1-CB 3.65Å; L62-A72 WeakPolarHBondContact CD1-O 3.45Å; L62-L73 PolarHBondContact N-O 3.34Å; L62-Y74 WeakPolarHBondContact CD1-O 3.42Å; L62-T75 HydrophobicContact CD2-CG2 3.75Å; L62-T75 HydrophobicContact CG-CG2 4.05Å
63	R	60.3	Low	69.8	Low	241 Å²	241	94.2 Å²	94.2	91%	0.909	47%	0.465	S	S	*	.	S	Bend	trans	-92	-6.9	-175.6	-69.2	-171.2	176.5	-164.9	-0.9	115
64	K	58.3	Low	70	Confident	179 Å²	179	87.2 Å²	87.2	78%	0.778	44%	0.439	S	S	*	.	S	Bend	trans	-155.4	149	170.8	-73.5	-164.1	173.7	-170.8	0	108.2	C66	K64-C66 PolarHBondContact O-N 3.2Å
65	N	53.3	Low	70.2	Confident	107 Å²	107	88.9 Å²	88.9	57%	0.572	45%	0.449	S	S	*	.			trans	-59.3	133.6	170.7	-76.4	22.3	0	0	0	110.4	P70	N65-P70 PolarHBondContact ND2-O 3.12Å
66	C	49.8	Very low	70.5	Confident	68 Å²	68	83.4 Å²	83.4	46%	0.459	43%	0.428	S	S	.	.	B	Isolated β-bridge	trans	-79.4	132.9	170	-61.1	0	0	0	0	108.9	K64 G68 N69	K64-C66 PolarHBondContact O-N 3.2Å; C66-G68 PolarHBondContact O-N 2.88Å; C66-N69 PolarHBondContact O-N 3.47Å
67	H	53.1	Low	70.7	Confident	209 Å²	209	76.1 Å²	76.1	97%	0.968	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-9.1	-173.5	-70.1	-77.5	0	0	0	115.6
68	G	55.2	Low	70.6	Confident	75 Å²	75	74.8 Å²	74.8	77%	0.773	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-1	176.1	0	0	0	0	0	115.8	C66	C66-G68 PolarHBondContact O-N 2.88Å
69	N	57.8	Low	70.5	Confident	76 Å²	76	73 Å²	73	41%	0.406	40%	0.398	S	S	.	.	B	Isolated β-bridge	trans	-159.5	101.9	176.2	-143.5	-27.2	0	0	0	112.8	C66 G71	C66-N69 PolarHBondContact O-N 3.47Å; N69-G71 PolarHBondContact O-N 2.98Å
70	P	57.8	Low	70.3	Confident	105 Å²	105	79.5 Å²	79.5	68%	0.682	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-12.4	-168.8	30.7	-35.5	0	0	0	115.4	N65	N65-P70 PolarHBondContact ND2-O 3.12Å
71	G	62.6	Low	70.2	Confident	39 Å²	39	77.3 Å²	77.3	40%	0.402	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-1	-178.6	0	0	0	0	0	115.9	N69 L73 E84	N69-G71 PolarHBondContact O-N 2.98Å; G71-L73 PolarHBondContact O-N 2.98Å; G71-E84 WeakPolarHBondContact O-CA 3.45Å
72	A	71.8	Confident	70.4	Confident	6 Å²	6	78.3 Å²	78.3	5%	0.05	43%	0.434	C	S	.	.			trans	-83.1	115.3	-171.8	0	0	0	0	0	112.9	L62 P82	L62-A72 HydrophobicContact CD1-CB 3.65Å; L62-A72 WeakPolarHBondContact CD1-O 3.45Å; A72-P82 HydrophobicContact CB-CB 3.63Å
73	L	74.9	Confident	70.8	Confident	105 Å²	105	76 Å²	76	55%	0.55	42%	0.422	S	S	.	.			trans	-96	-28.4	178.6	-62.9	-177.5	0	0	0	113.2	P61 L62 G71 L83 E84	P61-L73 WeakPolarHBondContact CA-O 3.43Å; L62-L73 PolarHBondContact N-O 3.34Å; G71-L73 PolarHBondContact O-N 2.98Å; L73-L83 PolarHBondContact N-O 3.31Å; L73-E84 WeakPolarHBondContact CD1-O 3.45Å
74	Y	81.9	Confident	71.8	Confident	18 Å²	18	69.5 Å²	69.5	7%	0.071	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	160.4	-179.7	-62.4	-85.7	0	0	0	110.7	E51 I59 Y60 P61 L62 L83 I86	E51-Y74 HydrophobicContact CG-CE1 4.16Å; I59-Y74 HydrophobicContact CG2-CD1 4.28Å; I59-Y74 HydrophobicContact CG2-CG 4.33Å; Y60-Y74 CarbonylContact O-C 3.57Å; Y60-Y74 WeakPolarHBondContact O-CA 3.48Å; P61-Y74 HydrophobicContact CB-CD1 4Å; P61-Y74 HydrophobicContact CB-CE1 3.83Å; L62-Y74 WeakPolarHBondContact CD1-O 3.42Å; Y74-L83 PolarHBondContact N-O 3.11Å; Y74-L83 PolarHBondContact O-N 2.89Å; Y74-I86 HydrophobicContact CE2-CG1 3.74Å
75	T	85.8	Confident	72.8	Confident	35 Å²	35	63.3 Å²	63.3	22%	0.215	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	140.8	167.4	-179.1	0	0	0	0	110.3	I59 Y60 L62 I81	I59-T75 WeakPolarHBondContact CA-O 3.38Å; Y60-T75 PolarHBondContact N-O 3.24Å; Y60-T75 PolarHBondContact O-N 3.38Å; L62-T75 HydrophobicContact CD2-CG2 3.75Å; L62-T75 HydrophobicContact CG-CG2 4.05Å; T75-I81 WeakPolarHBondContact CA-O 3.48Å
76	C	86.6	Confident	74	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	111.6	173.6	-176.9	0	0	0	0	110.4	I59 L78 C79 D80 I81 L83 H98	I59-C76 HydrophobicContact CD1-CB 4.5Å; I59-C76 HydrophobicContact CG1-CB 3.81Å; C76-L78 VanDerWaalsContact C-N 3.25Å; C76-L78 PolarHBondContact O-N 3.15Å; C76-C79 HydrophobicContact CB-CB 4.22Å; C76-C79 PolarHBondContact O-N 2.96Å; C76-C79 PolarHBondContact SG-N 3.1Å; C76-D80 WeakPolarHBondContact O-CA 3.46Å; C76-D80 PolarHBondContact O-N 2.83Å; C76-I81 PolarHBondContact N-O 3.01Å; C76-L83 HydrophobicContact CB-CD1 4.1Å; C76-H98 PolarHBondContact SG-CE1 2.82Å; C76-H98 PolarHBondContact SG-ND1 3.5Å
77	A	82.3	Confident	75.3	Confident	59 Å²	59	61.8 Å²	61.8	49%	0.488	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-23.2	179.7	0	0	0	0	0	113.4	E58 Y60	E58-A77 PolarHBondContact O-N 3.05Å; Y60-A77 HydrophobicContact CD2-CB 3.96Å; Y60-A77 HydrophobicContact CE2-CB 3.76Å
78	L	81.7	Confident	76.7	Confident	23 Å²	23	55.2 Å²	55.2	12%	0.12	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-44.2	170.9	-78	169.2	0	0	0	112.1	E58 C76 R101 A102 K105	E58-L78 HydrophobicContact CB-CB 4.5Å; E58-L78 HydrophobicContact CB-CD1 3.83Å; E58-L78 HydrophobicContact CB-CG 3.7Å; E58-L78 HydrophobicContact CG-CD1 3.88Å; E58-L78 HydrophobicContact CG-CG 3.85Å; C76-L78 VanDerWaalsContact C-N 3.25Å; C76-L78 PolarHBondContact O-N 3.15Å; L78-R101 HydrophobicContact CB-CB 4.35Å; L78-R101 HydrophobicContact CD2-CB 4.31Å; L78-R101 WeakPolarHBondContact O-CD 3.44Å; L78-R101 PolarHBondContact O-NH1 3.35Å; L78-A102 HydrophobicContact CD1-CB 3.87Å; L78-K105 HydrophobicContact CD2-CB 3.89Å; L78-K105 HydrophobicContact CD2-CD 3.76Å; L78-K105 HydrophobicContact CD2-CG 4.4Å
79	C	82.1	Confident	77.9	Confident	6 Å²	6	51.6 Å²	51.6	4%	0.041	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-19.2	-172	-73.1	0	0	0	0	114.6	C76 I81 H92 R101	C76-C79 HydrophobicContact CB-CB 4.22Å; C76-C79 PolarHBondContact O-N 2.96Å; C76-C79 PolarHBondContact SG-N 3.1Å; C79-I81 HydrophobicContact CB-CB 4.27Å; C79-I81 HydrophobicContact CB-CD1 3.82Å; C79-I81 HydrophobicContact CB-CG1 3.93Å; C79-H92 WeakPolarHBondContact CB-NE2 3.27Å; C79-H92 PolarHBondContact SG-CE1 3.13Å; C79-H92 PolarHBondContact SG-NE2 3.44Å; C79-H92 VanDerWaalsContact SG-NE2 3.38Å; C79-R101 VanDerWaalsContact CA-NH1 3.34Å; C79-R101 PolarHBondContact O-NH1 2.84Å; C79-R101 VanDerWaalsContact O-NH1 3.12Å
80	D	81	Confident	79.1	Confident	138 Å²	138	51.2 Å²	51.2	74%	0.738	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	51.4	-167.5	-155.3	25.2	0	0	0	111.9	C76	C76-D80 WeakPolarHBondContact O-CA 3.46Å; C76-D80 PolarHBondContact O-N 2.83Å
81	I	82.3	Confident	80.4	Confident	46 Å²	46	52.9 Å²	52.9	24%	0.236	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	126.5	-176	-67.9	178.2	0	0	0	109.7	T75 C76 C79 L83	T75-I81 WeakPolarHBondContact CA-O 3.48Å; C76-I81 PolarHBondContact N-O 3.01Å; C79-I81 HydrophobicContact CB-CB 4.27Å; C79-I81 HydrophobicContact CB-CD1 3.82Å; C79-I81 HydrophobicContact CB-CG1 3.93Å; I81-L83 HydrophobicContact CG2-CD2 4.29Å
82	P	83.7	Confident	81.5	Confident	61 Å²	61	51.3 Å²	51.3	40%	0.396	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	143.5	169.1	29.9	-32.9	0	0	0	110.9	A72	A72-P82 HydrophobicContact CB-CB 3.63Å
83	L	83.6	Confident	82.1	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	124	-172.9	-67.4	165.1	0	0	0	109.8	I59 L73 Y74 C76 I81 A89 H92	I59-L83 HydrophobicContact CD1-CD1 3.92Å; I59-L83 HydrophobicContact CG1-CD1 4.22Å; I59-L83 HydrophobicContact CG2-CD1 4.1Å; L73-L83 PolarHBondContact N-O 3.31Å; Y74-L83 PolarHBondContact N-O 3.11Å; Y74-L83 PolarHBondContact O-N 2.89Å; C76-L83 HydrophobicContact CB-CD1 4.1Å; I81-L83 HydrophobicContact CG2-CD2 4.29Å; L83-A89 HydrophobicContact CD1-CB 4.14Å; L83-H92 HydrophobicContact CD2-CB 3.89Å
84	E	81.8	Confident	82.6	Confident	105 Å²	105	55 Å²	55	49%	0.491	29%	0.289	S	S	.	.	S	Bend	trans	-81.5	-19.9	-170.3	-57.1	137.7	152.1	0	0	113.7	G71 L73 H88	G71-E84 WeakPolarHBondContact O-CA 3.45Å; L73-E84 WeakPolarHBondContact CD1-O 3.45Å; E84-H88 IonicContact OE2-CE1 2.68Å; E84-H88 PolarHBondContact OE2-CE1 2.89Å; E84-H88 IonicContact OE2-ND1 2.69Å; E84-H88 PolarHBondContact OE2-ND1 3.28Å
85	S	79.8	Confident	82.8	Confident	48 Å²	48	57.2 Å²	57.2	34%	0.336	30%	0.302	S	S	.	.	S	Bend	trans	-153	162.1	-177.8	68.7	0	0	0	0	113.6	S87 H88 A89	S85-S87 PolarHBondContact O-N 3.08Å; S85-H88 WeakPolarHBondContact O-CB 3.37Å; S85-H88 PolarHBondContact O-N 2.95Å; S85-H88 VanDerWaalsContact O-N 3.16Å; S85-H88 WeakPolarHBondContact OG-CB 3.48Å; S85-H88 PolarHBondContact OG-N 3.49Å; S85-H88 VanDerWaalsContact OG-N 3.08Å; S85-A89 PolarHBondContact O-N 3.36Å
86	I	78.5	Confident	82.7	Confident	49 Å²	49	64.9 Å²	64.9	25%	0.251	33%	0.332	S	S	.	.	H	α-helix	trans	-55.5	-40.5	171.4	-71.2	172.8	0	0	0	111.4	T47 V50 L54 Y74 A89 F90	T47-I86 HydrophobicContact CG2-CD1 4.43Å; V50-I86 HydrophobicContact CG1-CD1 4.03Å; V50-I86 HydrophobicContact CG1-CG1 4.25Å; V50-I86 HydrophobicContact CG1-CG2 3.58Å; L54-I86 HydrophobicContact CD1-CG1 4.47Å; Y74-I86 HydrophobicContact CE2-CG1 3.74Å; I86-A89 WeakPolarHBondContact O-CB 3.5Å; I86-A89 PolarHBondContact O-N 3.16Å; I86-F90 HydrophobicContact CG2-CD2 3.79Å; I86-F90 HydrophobicContact CG2-CE2 3.69Å; I86-F90 WeakPolarHBondContact O-CD2 3.44Å; I86-F90 PolarHBondContact O-N 2.93Å
87	S	78.2	Confident	82.3	Confident	94 Å²	94	72.1 Å²	72.1	66%	0.657	36%	0.36	S	S	*	.	H	α-helix	trans	-68.1	-38.1	177.8	-57	0	0	0	0	112.2	S85 K91	S85-S87 PolarHBondContact O-N 3.08Å; S87-K91 PolarHBondContact O-N 3.44Å
88	H	81.7	Confident	82.5	Confident	71 Å²	71	69.5 Å²	69.5	33%	0.329	34%	0.337	S	S	.	.	H	α-helix	trans	-62.9	-44.7	171.5	-163.8	162.9	0	0	0	109.7	E84 S85 F90 K91 H92	E84-H88 IonicContact OE2-CE1 2.68Å; E84-H88 PolarHBondContact OE2-CE1 2.89Å; E84-H88 IonicContact OE2-ND1 2.69Å; E84-H88 PolarHBondContact OE2-ND1 3.28Å; S85-H88 WeakPolarHBondContact O-CB 3.37Å; S85-H88 PolarHBondContact O-N 2.95Å; S85-H88 VanDerWaalsContact O-N 3.16Å; S85-H88 WeakPolarHBondContact OG-CB 3.48Å; S85-H88 PolarHBondContact OG-N 3.49Å; S85-H88 VanDerWaalsContact OG-N 3.08Å; H88-F90 PolarHBondContact O-N 3.44Å; H88-K91 WeakPolarHBondContact O-CB 3.43Å; H88-K91 PolarHBondContact O-N 3.2Å; H88-K91 VanDerWaalsContact O-N 3.15Å; H88-H92 WeakPolarHBondContact O-CB 3.39Å; H88-H92 PolarHBondContact O-N 2.84Å
89	A	81.2	Confident	82.6	Confident	0 Å²	0	73 Å²	73	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-59.1	-48.7	176.4	0	0	0	0	0	113.1	L54 I59 L83 S85 I86 K91 H92 V93	L54-A89 HydrophobicContact CD1-CB 3.99Å; L54-A89 HydrophobicContact CD2-CB 3.76Å; I59-A89 HydrophobicContact CD1-CB 4.02Å; I59-A89 HydrophobicContact CG2-CB 4.27Å; L83-A89 HydrophobicContact CD1-CB 4.14Å; S85-A89 PolarHBondContact O-N 3.36Å; I86-A89 WeakPolarHBondContact O-CB 3.5Å; I86-A89 PolarHBondContact O-N 3.16Å; A89-K91 VanDerWaalsContact C-N 3.28Å; A89-K91 PolarHBondContact O-N 2.68Å; A89-H92 WeakPolarHBondContact O-CB 3.17Å; A89-H92 PolarHBondContact O-N 2.71Å; A89-H92 VanDerWaalsContact O-N 3.1Å; A89-V93 WeakPolarHBondContact O-CG2 3.31Å; A89-V93 PolarHBondContact O-N 2.87Å
90	F	82.9	Confident	82.6	Confident	68 Å²	68	77.3 Å²	77.3	30%	0.298	37%	0.37	S	S	.	.	H	α-helix	trans	-70.3	-18.8	175.9	-74.9	-58.1	0	0	0	114.4	V50 R53 L54 I86 H88 R94	V50-F90 HydrophobicContact CG1-CE2 3.68Å; V50-F90 HydrophobicContact CG1-CZ 3.96Å; R53-F90 HydrophobicContact CB-CZ 4.49Å; L54-F90 HydrophobicContact CD2-CD1 3.85Å; L54-F90 HydrophobicContact CD2-CD2 4.43Å; L54-F90 HydrophobicContact CD2-CE1 3.65Å; L54-F90 HydrophobicContact CD2-CE2 4.27Å; L54-F90 HydrophobicContact CD2-CG 4.23Å; L54-F90 HydrophobicContact CD2-CZ 3.87Å; L54-F90 HydrophobicContact CG-CE1 4.3Å; L54-F90 HydrophobicContact CG-CE2 4.5Å; L54-F90 HydrophobicContact CG-CZ 4.09Å; I86-F90 HydrophobicContact CG2-CD2 3.79Å; I86-F90 HydrophobicContact CG2-CE2 3.69Å; I86-F90 WeakPolarHBondContact O-CD2 3.44Å; I86-F90 PolarHBondContact O-N 2.93Å; H88-F90 PolarHBondContact O-N 3.44Å; F90-R94 PolarHBondContact O-NE 3.14Å; F90-R94 PolarHBondContact O-NH2 3.24Å
91	K	83.7	Confident	82.7	Confident	139 Å²	139	75 Å²	75	60%	0.604	35%	0.351	S	S	*	.	H	α-helix	trans	-71.2	-50.2	164.5	-169.4	179.6	178.5	-174.7	0	109.4	S87 H88 A89 V93 R94 D95	S87-K91 PolarHBondContact O-N 3.44Å; H88-K91 WeakPolarHBondContact O-CB 3.43Å; H88-K91 PolarHBondContact O-N 3.2Å; H88-K91 VanDerWaalsContact O-N 3.15Å; A89-K91 VanDerWaalsContact C-N 3.28Å; A89-K91 PolarHBondContact O-N 2.68Å; K91-V93 PolarHBondContact O-N 2.86Å; K91-R94 WeakPolarHBondContact O-CB 3.48Å; K91-R94 PolarHBondContact O-N 3.44Å; K91-D95 PolarHBondContact O-N 3.23Å
92	H	85.4	Confident	82.8	Confident	7 Å²	7	74.5 Å²	74.5	3%	0.032	35%	0.353	C	S	.	.	H	α-helix	trans	-58.1	-44.1	-177.1	-179.7	51.2	0	0	0	114.2	C79 L83 H88 A89 R94 D95 H98	C79-H92 WeakPolarHBondContact CB-NE2 3.27Å; C79-H92 PolarHBondContact SG-CE1 3.13Å; C79-H92 PolarHBondContact SG-NE2 3.44Å; C79-H92 VanDerWaalsContact SG-NE2 3.38Å; L83-H92 HydrophobicContact CD2-CB 3.89Å; H88-H92 WeakPolarHBondContact O-CB 3.39Å; H88-H92 PolarHBondContact O-N 2.84Å; A89-H92 WeakPolarHBondContact O-CB 3.17Å; A89-H92 PolarHBondContact O-N 2.71Å; A89-H92 VanDerWaalsContact O-N 3.1Å; H92-R94 PolarHBondContact O-N 3.39Å; H92-R94 VanDerWaalsContact O-N 3.12Å; H92-D95 WeakPolarHBondContact CA-OD2 3.43Å; H92-D95 IonicContact CG-OD2 3.64Å; H92-D95 IonicContact ND1-OD2 2.73Å; H92-D95 PolarHBondContact ND1-OD2 2.9Å; H92-D95 VanDerWaalsContact O-CB 3.24Å; H92-D95 WeakPolarHBondContact O-CB 3.43Å; H92-D95 PolarHBondContact O-N 3.47Å; H92-H98 AromaticContact CD2-ND1 3.46Å; H92-H98 PolarHBondContact CD2-ND1 3.09Å; H92-H98 AromaticContact CE1-ND1 3.95Å; H92-H98 AromaticContact NE2-CG 3.98Å; H92-H98 AromaticContact NE2-ND1 3.17Å; H92-H98 PolarHBondContact NE2-ND1 3.24Å; H92-H98 VanDerWaalsContact NE2-ND1 3.17Å; H92-H98 WeakPolarHBondContact O-CB 3.27Å
93	V	85.4	Confident	82.7	Confident	24 Å²	24	79.8 Å²	79.8	15%	0.145	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-29	175.8	175.1	0	0	0	0	112.3	D57 I59 A89 K91	D57-V93 HydrophobicContact CB-CB 4.46Å; D57-V93 HydrophobicContact CB-CG1 4Å; D57-V93 HydrophobicContact CB-CG2 3.54Å; I59-V93 HydrophobicContact CD1-CG2 3.5Å; I59-V93 VanDerWaalsContact CD1-CG2 3.5Å; A89-V93 WeakPolarHBondContact O-CG2 3.31Å; A89-V93 PolarHBondContact O-N 2.87Å; K91-V93 PolarHBondContact O-N 2.86Å
94	R	84.1	Confident	82.6	Confident	163 Å²	163	83.1 Å²	83.1	62%	0.615	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-14	179	-69.6	179.3	-72.8	166.1	-0.5	113.6	F90 K91 H92 K99	F90-R94 PolarHBondContact O-NE 3.14Å; F90-R94 PolarHBondContact O-NH2 3.24Å; K91-R94 WeakPolarHBondContact O-CB 3.48Å; K91-R94 PolarHBondContact O-N 3.44Å; H92-R94 PolarHBondContact O-N 3.39Å; H92-R94 VanDerWaalsContact O-N 3.12Å; R94-K99 VanDerWaalsContact O-CE 3.31Å; R94-K99 WeakPolarHBondContact O-CE 3.22Å; R94-K99 PolarHBondContact O-NZ 3.46Å
95	D	86.9	Confident	82.7	Confident	65 Å²	65	81.3 Å²	81.3	35%	0.348	37%	0.371	S	S	.	.	S	Bend	trans	-62	146	-179.6	-65.6	-24.3	0	0	0	112.3	K91 H92 R97 H98 K99	K91-D95 PolarHBondContact O-N 3.23Å; H92-D95 WeakPolarHBondContact CA-OD2 3.43Å; H92-D95 IonicContact CG-OD2 3.64Å; H92-D95 IonicContact ND1-OD2 2.73Å; H92-D95 PolarHBondContact ND1-OD2 2.9Å; H92-D95 VanDerWaalsContact O-CB 3.24Å; H92-D95 WeakPolarHBondContact O-CB 3.43Å; H92-D95 PolarHBondContact O-N 3.47Å; D95-R97 PolarHBondContact O-N 3.08Å; D95-H98 HydrophobicContact CB-CB 4.48Å; D95-H98 PolarHBondContact O-N 3.48Å; D95-K99 PolarHBondContact O-N 3.24Å; D95-K99 VanDerWaalsContact O-N 3.07Å
96	K	82.9	Confident	82.8	Confident	197 Å²	197	84 Å²	84	86%	0.857	38%	0.379	S	S	*	.	H	α-helix	trans	-54.8	-36.2	174.2	-66.3	-173.1	177.7	-175.3	0	112.2	K100	K96-K100 PolarHBondContact O-N 3.01Å
97	R	78.9	Confident	83	Confident	152 Å²	152	84.9 Å²	84.9	57%	0.574	38%	0.382	S	S	*	.	H	α-helix	trans	-68.3	-44.9	-178.8	-160.8	-176.4	-153.4	-166.7	7.9	112.7	D95 K100 R101	D95-R97 PolarHBondContact O-N 3.08Å; R97-K100 PolarHBondContact O-N 3.5Å; R97-R101 PolarHBondContact O-N 3.04Å
98	H	85.8	Confident	83.2	Confident	4 Å²	4	85 Å²	85	2%	0.019	37%	0.372	C	S	.	.	H	α-helix	trans	-65.3	-47.5	177.1	-172.3	104.2	0	0	0	110.5	D57 C76 H92 D95 K100 R101 A102	D57-H98 PolarHBondContact O-CE1 3.4Å; D57-H98 PolarHBondContact O-NE2 3.06Å; C76-H98 PolarHBondContact SG-CE1 2.82Å; C76-H98 PolarHBondContact SG-ND1 3.5Å; H92-H98 AromaticContact CD2-ND1 3.46Å; H92-H98 PolarHBondContact CD2-ND1 3.09Å; H92-H98 AromaticContact CE1-ND1 3.95Å; H92-H98 AromaticContact NE2-CG 3.98Å; H92-H98 AromaticContact NE2-ND1 3.17Å; H92-H98 PolarHBondContact NE2-ND1 3.24Å; H92-H98 VanDerWaalsContact NE2-ND1 3.17Å; H92-H98 WeakPolarHBondContact O-CB 3.27Å; D95-H98 HydrophobicContact CB-CB 4.48Å; D95-H98 PolarHBondContact O-N 3.48Å; H98-K100 VanDerWaalsContact C-N 3.35Å; H98-K100 PolarHBondContact O-N 3.39Å; H98-R101 PolarHBondContact O-N 3.29Å; H98-A102 WeakPolarHBondContact O-CB 3.42Å; H98-A102 PolarHBondContact O-N 3.36Å
99	K	85.3	Confident	83.4	Confident	96 Å²	96	85.1 Å²	85.1	42%	0.417	38%	0.375	S	S	.	.	H	α-helix	trans	-60	-35.8	176.5	-72.8	171	172.3	161.8	0	114	R94 D95 R103	R94-K99 VanDerWaalsContact O-CE 3.31Å; R94-K99 WeakPolarHBondContact O-CE 3.22Å; R94-K99 PolarHBondContact O-NZ 3.46Å; D95-K99 PolarHBondContact O-N 3.24Å; D95-K99 VanDerWaalsContact O-N 3.07Å; K99-R103 WeakPolarHBondContact O-CG 3.47Å; K99-R103 PolarHBondContact O-N 3.3Å; K99-R103 PolarHBondContact O-NE 2.78Å
100	K	81.1	Confident	83.6	Confident	96 Å²	96	90 Å²	90	42%	0.417	40%	0.399	S	S	.	.	H	α-helix	trans	-61.2	-56.1	171.3	179.1	167.1	172.5	174.2	0	110	K96 R97 H98 A102 R103 E104 D441	K96-K100 PolarHBondContact O-N 3.01Å; R97-K100 PolarHBondContact O-N 3.5Å; H98-K100 VanDerWaalsContact C-N 3.35Å; H98-K100 PolarHBondContact O-N 3.39Å; K100-A102 PolarHBondContact O-N 3.08Å; K100-R103 PolarHBondContact O-N 3.21Å; K100-E104 WeakPolarHBondContact CE-OE1 3.45Å; K100-E104 HydrophobicContact CG-CG 4.38Å; K100-E104 WeakPolarHBondContact CG-OE1 3.41Å; K100-E104 IonicContact NZ-OE1 3.46Å; K100-E104 WeakPolarHBondContact O-CG 3.35Å; K100-E104 PolarHBondContact O-N 2.87Å; K100-D441 IonicContact NZ-OD2 2.69Å; K100-D441 PolarHBondContact NZ-OD2 3.05Å
101	R	82.8	Confident	83.7	Confident	90 Å²	90	87 Å²	87	34%	0.34	39%	0.386	S	S	.	.	H	α-helix	trans	-63.9	-36.1	-177.9	-68.4	-165.1	179.5	179.6	3.1	114.4	L78 C79 R97 H98 E104 K105	L78-R101 HydrophobicContact CB-CB 4.35Å; L78-R101 HydrophobicContact CD2-CB 4.31Å; L78-R101 WeakPolarHBondContact O-CD 3.44Å; L78-R101 PolarHBondContact O-NH1 3.35Å; C79-R101 VanDerWaalsContact CA-NH1 3.34Å; C79-R101 PolarHBondContact O-NH1 2.84Å; C79-R101 VanDerWaalsContact O-NH1 3.12Å; R97-R101 PolarHBondContact O-N 3.04Å; H98-R101 PolarHBondContact O-N 3.29Å; R101-E104 WeakPolarHBondContact CA-OE2 3.46Å; R101-E104 PolarHBondContact O-N 3.35Å; R101-K105 PolarHBondContact O-N 3.02Å
102	A	84.1	Confident	83.8	Confident	36 Å²	36	82.4 Å²	82.4	30%	0.298	37%	0.374	S	S	.	.	H	α-helix	trans	-62.4	-45.6	175.6	0	0	0	0	0	111.7	L78 H98 K100 K105 Q106	L78-A102 HydrophobicContact CD1-CB 3.87Å; H98-A102 WeakPolarHBondContact O-CB 3.42Å; H98-A102 PolarHBondContact O-N 3.36Å; K100-A102 PolarHBondContact O-N 3.08Å; A102-K105 PolarHBondContact O-N 2.91Å; A102-Q106 WeakPolarHBondContact O-CB 3.48Å; A102-Q106 PolarHBondContact O-N 2.69Å
103	R	82.8	Confident	83.9	Confident	171 Å²	171	89.1 Å²	89.1	65%	0.645	41%	0.405	S	S	*	.	H	α-helix	trans	-65.9	-39.9	175.1	-72.1	-177.9	-64.6	-145.3	6.7	112.4	K99 K100 K105 Q106 E107	K99-R103 WeakPolarHBondContact O-CG 3.47Å; K99-R103 PolarHBondContact O-N 3.3Å; K99-R103 PolarHBondContact O-NE 2.78Å; K100-R103 PolarHBondContact O-N 3.21Å; R103-K105 PolarHBondContact O-N 3.01Å; R103-Q106 PolarHBondContact O-N 3.01Å; R103-E107 WeakPolarHBondContact O-CB 3.5Å; R103-E107 PolarHBondContact O-N 3.49Å
104	E	81	Confident	83.9	Confident	70 Å²	70	89.3 Å²	89.3	33%	0.327	41%	0.405	S	S	.	.	H	α-helix	trans	-61.5	-41.8	175.5	-71.2	166.9	154.8	0	0	112.1	K100 R101 Q108	K100-E104 WeakPolarHBondContact CE-OE1 3.45Å; K100-E104 HydrophobicContact CG-CG 4.38Å; K100-E104 WeakPolarHBondContact CG-OE1 3.41Å; K100-E104 IonicContact NZ-OE1 3.46Å; K100-E104 WeakPolarHBondContact O-CG 3.35Å; K100-E104 PolarHBondContact O-N 2.87Å; R101-E104 WeakPolarHBondContact CA-OE2 3.46Å; R101-E104 PolarHBondContact O-N 3.35Å; E104-Q108 WeakPolarHBondContact O-CB 3.46Å; E104-Q108 PolarHBondContact O-N 3.14Å
105	K	83.1	Confident	83.7	Confident	67 Å²	67	89 Å²	89	29%	0.291	41%	0.412	S	S	.	.	H	α-helix	trans	-66	-43.7	174.2	-170.7	-178.5	-177.9	-171.5	0	111.5	E58 L78 R101 A102 R103 Q108 L109	E58-K105 IonicContact OE1-NZ 3.66Å; E58-K105 PolarHBondContact OE1-NZ 2.88Å; E58-K105 IonicContact OE2-NZ 3.73Å; E58-K105 PolarHBondContact OE2-NZ 3.03Å; L78-K105 HydrophobicContact CD2-CB 3.89Å; L78-K105 HydrophobicContact CD2-CD 3.76Å; L78-K105 HydrophobicContact CD2-CG 4.4Å; R101-K105 PolarHBondContact O-N 3.02Å; A102-K105 PolarHBondContact O-N 2.91Å; R103-K105 PolarHBondContact O-N 3.01Å; K105-Q108 PolarHBondContact O-N 3.39Å; K105-L109 HydrophobicContact CG-CD1 4.43Å; K105-L109 WeakPolarHBondContact O-CG 3.38Å; K105-L109 PolarHBondContact O-N 2.98Å
106	Q	83.9	Confident	83.4	Confident	104 Å²	104	91.2 Å²	91.2	49%	0.486	43%	0.43	S	S	.	.	H	α-helix	trans	-63.9	-41.7	178.9	-171.5	61.8	25.1	0	0	112	A102 R103 L109 M110	A102-Q106 WeakPolarHBondContact O-CB 3.48Å; A102-Q106 PolarHBondContact O-N 2.69Å; R103-Q106 PolarHBondContact O-N 3.01Å; Q106-L109 PolarHBondContact O-N 2.86Å; Q106-M110 HydrophobicContact CG-CE 4.22Å; Q106-M110 WeakPolarHBondContact O-CG 3.28Å; Q106-M110 PolarHBondContact O-N 3.29Å
107	E	82.3	Confident	83.6	Confident	69 Å²	69	83.1 Å²	83.1	32%	0.322	40%	0.398	S	S	.	.	H	α-helix	trans	-61.3	-46.1	172.1	-178	-172.3	-126.1	0	0	111.1	R103 L109 M110 L111 K448	R103-E107 WeakPolarHBondContact O-CB 3.5Å; R103-E107 PolarHBondContact O-N 3.49Å; E107-L109 VanDerWaalsContact C-N 3.29Å; E107-L109 PolarHBondContact O-N 2.97Å; E107-M110 PolarHBondContact O-N 3.49Å; E107-L111 HydrophobicContact CG-CD1 3.98Å; E107-L111 HydrophobicContact CG-CG 4.32Å; E107-L111 WeakPolarHBondContact O-CB 3.47Å; E107-L111 VanDerWaalsContact O-CG 3.28Å; E107-L111 WeakPolarHBondContact O-CG 3.47Å; E107-L111 PolarHBondContact O-N 2.9Å; E107-K448 WeakPolarHBondContact OE2-CD 3.06Å; E107-K448 WeakPolarHBondContact OE2-CE 3.47Å; E107-K448 IonicContact OE2-NZ 2.83Å; E107-K448 PolarHBondContact OE2-NZ 3.26Å
108	Q	82.8	Confident	83.9	Confident	97 Å²	97	77.7 Å²	77.7	45%	0.453	39%	0.389	S	S	.	.	H	α-helix	trans	-60.6	-37.7	178.6	-167.2	-179.6	11.3	0	0	112.3	E104 K105 A112 L389	E104-Q108 WeakPolarHBondContact O-CB 3.46Å; E104-Q108 PolarHBondContact O-N 3.14Å; K105-Q108 PolarHBondContact O-N 3.39Å; Q108-A112 VanDerWaalsContact O-CB 3.27Å; Q108-A112 WeakPolarHBondContact O-CB 3.46Å; Q108-A112 PolarHBondContact O-N 3Å; Q108-L389 HydrophobicContact CG-CD2 3.85Å
109	L	84.9	Confident	83.9	Confident	73 Å²	73	82.4 Å²	82.4	38%	0.382	42%	0.42	S	S	.	.	H	α-helix	trans	-64.8	-51.9	173.1	-70.4	169.9	0	0	0	111.3	K105 Q106 E107 L111 A112 E113	K105-L109 HydrophobicContact CG-CD1 4.43Å; K105-L109 WeakPolarHBondContact O-CG 3.38Å; K105-L109 PolarHBondContact O-N 2.98Å; Q106-L109 PolarHBondContact O-N 2.86Å; E107-L109 VanDerWaalsContact C-N 3.29Å; E107-L109 PolarHBondContact O-N 2.97Å; L109-L111 VanDerWaalsContact C-N 3.26Å; L109-L111 PolarHBondContact O-N 3.24Å; L109-A112 PolarHBondContact O-N 3.35Å; L109-E113 WeakPolarHBondContact O-CG 3.39Å; L109-E113 PolarHBondContact O-N 3.39Å
110	M	85.1	Confident	83.8	Confident	102 Å²	102	82.4 Å²	82.4	50%	0.502	42%	0.422	S	S	.	.	H	α-helix	trans	-56.1	-38	177.2	-72.6	179.8	173.7	0	0	112.9	Q106 E107 I114	Q106-M110 HydrophobicContact CG-CE 4.22Å; Q106-M110 WeakPolarHBondContact O-CG 3.28Å; Q106-M110 PolarHBondContact O-N 3.29Å; E107-M110 PolarHBondContact O-N 3.49Å; M110-I114 WeakPolarHBondContact O-CG1 3.38Å
111	L	86.1	Confident	84.1	Confident	4 Å²	4	78.1 Å²	78.1	2%	0.021	40%	0.403	C	S	.	.	H	α-helix	trans	-74.3	-33.7	176.6	-67	177.5	0	0	0	112.6	E107 L109 I114 L389 K448 Y451 K452	E107-L111 HydrophobicContact CG-CD1 3.98Å; E107-L111 HydrophobicContact CG-CG 4.32Å; E107-L111 WeakPolarHBondContact O-CB 3.47Å; E107-L111 VanDerWaalsContact O-CG 3.28Å; E107-L111 WeakPolarHBondContact O-CG 3.47Å; E107-L111 PolarHBondContact O-N 2.9Å; L109-L111 VanDerWaalsContact C-N 3.26Å; L109-L111 PolarHBondContact O-N 3.24Å; L111-I114 HydrophobicContact CD2-CD1 4.07Å; L111-L389 HydrophobicContact CB-CD1 4.03Å; L111-L389 HydrophobicContact CB-CD2 3.83Å; L111-L389 HydrophobicContact CB-CG 4.46Å; L111-L389 HydrophobicContact CD1-CD2 4.24Å; L111-K448 HydrophobicContact CD1-CB 3.99Å; L111-K448 HydrophobicContact CD1-CD 4.4Å; L111-K448 HydrophobicContact CD1-CG 3.92Å; L111-Y451 HydrophobicContact CB-CD1 4.37Å; L111-Y451 HydrophobicContact CB-CE1 4.15Å; L111-Y451 HydrophobicContact CD2-CD1 4.13Å; L111-Y451 HydrophobicContact CD2-CE1 4.44Å; L111-Y451 WeakPolarHBondContact O-CE1 3.39Å; L111-Y451 PolarHBondContact O-OH 3.24Å; L111-K452 HydrophobicContact CD2-CB 3.81Å; L111-K452 HydrophobicContact CD2-CD 4.24Å; L111-K452 HydrophobicContact CD2-CG 4.18Å
112	A	85.4	Confident	84.4	Confident	43 Å²	43	74.8 Å²	74.8	36%	0.355	39%	0.392	S	S	.	.	H	α-helix	trans	-69.4	-34.8	177.3	0	0	0	0	0	112.5	Q108 L109 R385 L389	Q108-A112 VanDerWaalsContact O-CB 3.27Å; Q108-A112 WeakPolarHBondContact O-CB 3.46Å; Q108-A112 PolarHBondContact O-N 3Å; L109-A112 PolarHBondContact O-N 3.35Å; A112-R385 PolarHBondContact O-NH1 2.92Å; A112-R385 PolarHBondContact O-NH2 2.85Å; A112-L389 HydrophobicContact CB-CD1 4.36Å
113	E	87.2	Confident	84.7	Confident	148 Å²	148	76.3 Å²	76.3	69%	0.692	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-10.2	-178.5	-72.6	174.7	176.6	0	0	114.7	L109 M115	L109-E113 WeakPolarHBondContact O-CG 3.39Å; L109-E113 PolarHBondContact O-N 3.39Å; E113-M115 PolarHBondContact O-N 2.94Å
114	I	85.3	Confident	84.9	Confident	28 Å²	28	68.9 Å²	68.9	14%	0.144	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-59.3	126.8	177.1	-53.6	178.2	0	0	0	110.1	M110 L111 Y451 A455 L456	M110-I114 WeakPolarHBondContact O-CG1 3.38Å; L111-I114 HydrophobicContact CD2-CD1 4.07Å; I114-Y451 HydrophobicContact CD1-CE1 4.12Å; I114-A455 HydrophobicContact CD1-CB 4.08Å; I114-A455 HydrophobicContact CG2-CB 3.89Å; I114-A455 WeakPolarHBondContact CG2-O 3.48Å; I114-L456 HydrophobicContact CG2-CD2 4.17Å
115	M	80.8	Confident	85.4	Confident	156 Å²	156	65.6 Å²	65.6	77%	0.768	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-66.8	150.7	179.6	-63.7	-152.1	78.5	0	0	112.1	E113	E113-M115 PolarHBondContact O-N 2.94Å
116	P	80	Confident	85.8	Confident	112 Å²	112	63.3 Å²	63.3	73%	0.727	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-61.2	142.8	177.3	25.9	-35	0	0	0	111.6
117	P	86.4	Confident	86.1	Confident	27 Å²	27	61.2 Å²	61.2	18%	0.175	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-69	143.6	-175.4	29.9	-37	0	0	0	112.1	H121 I122 L378 I381	P117-H121 HydrophobicContact CB-CB 4.48Å; P117-H121 WeakPolarHBondContact CB-ND1 3.39Å; P117-I122 HydrophobicContact CB-CG1 3.97Å; P117-I122 HydrophobicContact CG-CD1 4.18Å; P117-I122 HydrophobicContact CG-CG1 3.85Å; P117-L378 HydrophobicContact CG-CD1 4.14Å; P117-I381 HydrophobicContact CB-CD1 4.03Å; P117-I381 HydrophobicContact CG-CD1 3.83Å; P117-I381 HydrophobicContact CG-CG2 4.46Å
118	G	85	Confident	86.5	Confident	38 Å²	38	58.4 Å²	58.4	39%	0.392	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-79	163.8	173.8	0	0	0	0	0	113.1	E120 H121 I122	G118-E120 PolarHBondContact O-N 3.24Å; G118-H121 WeakPolarHBondContact O-CB 3.39Å; G118-H121 PolarHBondContact O-N 2.99Å; G118-H121 VanDerWaalsContact O-N 3.08Å; G118-I122 WeakPolarHBondContact O-CG1 3.37Å; G118-I122 PolarHBondContact O-N 2.97Å
119	P	85.8	Confident	86.9	Confident	103 Å²	103	53.8 Å²	53.8	67%	0.669	32%	0.32	S	S	*	.	H	α-helix	trans	-57	-41.9	-174.5	-27.3	35.9	0	0	0	114.9	H121 I122 S123	P119-H121 VanDerWaalsContact C-N 3.28Å; P119-H121 PolarHBondContact O-N 3.03Å; P119-I122 PolarHBondContact O-N 3.47Å; P119-S123 WeakPolarHBondContact O-CB 3.37Å; P119-S123 PolarHBondContact O-N 2.99Å
120	E	84.4	Confident	87.2	Confident	97 Å²	97	54 Å²	54	45%	0.453	32%	0.321	S	S	.	.	H	α-helix	trans	-62.7	-35.7	178.4	-62.1	-176.9	148.3	0	0	112.2	G118 A124 Q630 Y633	G118-E120 PolarHBondContact O-N 3.24Å; E120-A124 PolarHBondContact O-N 3.07Å; E120-A124 VanDerWaalsContact O-N 3.09Å; E120-Q630 PolarHBondContact OE1-NE2 2.89Å; E120-Y633 HydrophobicContact CB-CD2 4.26Å; E120-Y633 HydrophobicContact CB-CE2 4.06Å
121	H	87.6	Confident	87.4	Confident	6 Å²	6	51 Å²	51	3%	0.028	31%	0.312	C	S	.	.	H	α-helix	trans	-71.4	-44.4	176.2	178.4	-162.5	0	0	0	111.1	P117 G118 P119 S123 A124 V125 F454 Y635	P117-H121 HydrophobicContact CB-CB 4.48Å; P117-H121 WeakPolarHBondContact CB-ND1 3.39Å; G118-H121 WeakPolarHBondContact O-CB 3.39Å; G118-H121 PolarHBondContact O-N 2.99Å; G118-H121 VanDerWaalsContact O-N 3.08Å; P119-H121 VanDerWaalsContact C-N 3.28Å; P119-H121 PolarHBondContact O-N 3.03Å; H121-S123 VanDerWaalsContact C-N 3.28Å; H121-S123 PolarHBondContact O-N 3.36Å; H121-A124 PolarHBondContact O-N 3.23Å; H121-V125 WeakPolarHBondContact O-CG2 3.24Å; H121-V125 PolarHBondContact O-N 3.24Å; H121-F454 PolarHBondContact CE1-O 2.79Å; H121-F454 VanDerWaalsContact CE1-O 3.24Å; H121-F454 PolarHBondContact NE2-O 3.45Å; H121-Y635 AromaticContact CD2-CE2 3.63Å; H121-Y635 AromaticContact CD2-CZ 3.58Å; H121-Y635 PolarHBondContact CD2-OH 3.21Å; H121-Y635 VanDerWaalsContact CD2-OH 3.24Å; H121-Y635 AromaticContact NE2-CE2 3.94Å; H121-Y635 AromaticContact NE2-CZ 3.41Å; H121-Y635 PolarHBondContact NE2-OH 2.93Å
122	I	88.5	Confident	87.6	Confident	20 Å²	20	51 Å²	51	10%	0.103	31%	0.313	C	S	.	.	H	α-helix	trans	-59	-41.1	175	-64.4	166.3	0	0	0	111	P117 G118 P119 V125 T126 E375 L378	P117-I122 HydrophobicContact CB-CG1 3.97Å; P117-I122 HydrophobicContact CG-CD1 4.18Å; P117-I122 HydrophobicContact CG-CG1 3.85Å; G118-I122 WeakPolarHBondContact O-CG1 3.37Å; G118-I122 PolarHBondContact O-N 2.97Å; P119-I122 PolarHBondContact O-N 3.47Å; I122-V125 PolarHBondContact O-N 3.27Å; I122-T126 WeakPolarHBondContact O-CB 3.21Å; I122-T126 PolarHBondContact O-N 3.38Å; I122-T126 PolarHBondContact O-OG1 2.96Å; I122-E375 HydrophobicContact CG2-CB 3.64Å; I122-E375 HydrophobicContact CG2-CG 4.47Å; I122-L378 HydrophobicContact CD1-CB 4.28Å; I122-L378 HydrophobicContact CD1-CD1 4.19Å; I122-L378 HydrophobicContact CG1-CB 4.41Å; I122-L378 HydrophobicContact CG2-CB 3.95Å
123	S	89.3	Confident	87.8	Confident	68 Å²	68	50.6 Å²	50.6	48%	0.476	31%	0.306	S	S	.	.	H	α-helix	trans	-65.8	-42.2	178.1	-162.2	0	0	0	0	112	P119 H121 T126 A127	P119-S123 WeakPolarHBondContact O-CB 3.37Å; P119-S123 PolarHBondContact O-N 2.99Å; H121-S123 VanDerWaalsContact C-N 3.28Å; H121-S123 PolarHBondContact O-N 3.36Å; S123-T126 WeakPolarHBondContact O-CB 3.42Å; S123-T126 PolarHBondContact O-N 2.84Å; S123-A127 PolarHBondContact O-N 3.06Å
124	A	88.7	Confident	87.9	Confident	15 Å²	15	50.9 Å²	50.9	12%	0.124	31%	0.307	C	S	.	.	H	α-helix	trans	-62.8	-43	175.7	0	0	0	0	0	113.1	E120 H121 T126 A127 A128 Y633 Y635	E120-A124 PolarHBondContact O-N 3.07Å; E120-A124 VanDerWaalsContact O-N 3.09Å; H121-A124 PolarHBondContact O-N 3.23Å; A124-T126 VanDerWaalsContact C-N 3.33Å; A124-T126 PolarHBondContact O-N 3.19Å; A124-A127 WeakPolarHBondContact O-CB 3.37Å; A124-A127 PolarHBondContact O-N 3.27Å; A124-A128 PolarHBondContact O-N 3.44Å; A124-Y633 WeakPolarHBondContact CB-O 3.34Å; A124-Y635 HydrophobicContact CB-CD2 4.1Å; A124-Y635 HydrophobicContact CB-CE2 4.19Å
125	V	90.2	Very high	88.1	Confident	0 Å²	0	55 Å²	55	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-66.8	-36.2	175.5	177	0	0	0	0	111.1	H121 I122 A127 A128 L129 W380 I381 F454 Y635	H121-V125 WeakPolarHBondContact O-CG2 3.24Å; H121-V125 PolarHBondContact O-N 3.24Å; I122-V125 PolarHBondContact O-N 3.27Å; V125-A127 VanDerWaalsContact C-N 3.34Å; V125-A128 PolarHBondContact O-N 3.21Å; V125-L129 HydrophobicContact CG1-CD1 4.28Å; V125-L129 WeakPolarHBondContact O-CG 3.38Å; V125-L129 PolarHBondContact O-N 3.17Å; V125-L129 VanDerWaalsContact O-N 3.1Å; V125-W380 HydrophobicContact CG1-CG 4.32Å; V125-I381 HydrophobicContact CG2-CD1 4.31Å; V125-F454 HydrophobicContact CG1-CD1 4.04Å; V125-F454 HydrophobicContact CG1-CE1 4.48Å; V125-F454 HydrophobicContact CG2-CD1 4.03Å; V125-Y635 HydrophobicContact CG2-CD2 3.97Å; V125-Y635 HydrophobicContact CG2-CE2 4.08Å; V125-Y635 HydrophobicContact CG2-CG 4.28Å
126	T	91.9	Very high	88.5	Confident	20 Å²	20	50.8 Å²	50.8	12%	0.123	30%	0.304	C	S	.	.	H	α-helix	trans	-63.1	-39.4	172.3	-58.7	0	0	0	0	111.8	I122 S123 A124 N130 V376 G377	I122-T126 WeakPolarHBondContact O-CB 3.21Å; I122-T126 PolarHBondContact O-N 3.38Å; I122-T126 PolarHBondContact O-OG1 2.96Å; S123-T126 WeakPolarHBondContact O-CB 3.42Å; S123-T126 PolarHBondContact O-N 2.84Å; A124-T126 VanDerWaalsContact C-N 3.33Å; A124-T126 PolarHBondContact O-N 3.19Å; T126-N130 VanDerWaalsContact O-CG 3.28Å; T126-N130 PolarHBondContact O-N 2.94Å; T126-N130 VanDerWaalsContact O-N 3.09Å; T126-N130 PolarHBondContact O-ND2 3.19Å; T126-N130 VanDerWaalsContact O-ND2 3.12Å; T126-V376 HydrophobicContact CG2-CB 4.26Å; T126-G377 WeakPolarHBondContact OG1-CA 3.35Å; T126-G377 PolarHBondContact OG1-N 3.4Å
127	A	90.4	Very high	88.9	Confident	59 Å²	59	45.7 Å²	45.7	49%	0.488	27%	0.271	S	S	.	.	H	α-helix	trans	-64.6	-44.6	175.7	0	0	0	0	0	112.2	S123 A124 V125 L129 N130 A131	S123-A127 PolarHBondContact O-N 3.06Å; A124-A127 WeakPolarHBondContact O-CB 3.37Å; A124-A127 PolarHBondContact O-N 3.27Å; V125-A127 VanDerWaalsContact C-N 3.34Å; A127-L129 PolarHBondContact O-N 3.46Å; A127-N130 PolarHBondContact O-N 3.48Å; A127-A131 PolarHBondContact O-N 2.71Å
128	A	89.9	Confident	89	Confident	11 Å²	11	45 Å²	45	9%	0.091	27%	0.266	C	S	.	.	H	α-helix	trans	-60.4	-43.3	176.9	0	0	0	0	0	112.6	A124 V125 N130 A131 V132 Y635 F637	A124-A128 PolarHBondContact O-N 3.44Å; V125-A128 PolarHBondContact O-N 3.21Å; A128-N130 PolarHBondContact O-N 3.45Å; A128-A131 WeakPolarHBondContact O-CB 3.42Å; A128-A131 PolarHBondContact O-N 2.67Å; A128-V132 PolarHBondContact O-N 2.95Å; A128-Y635 VanDerWaalsContact CB-O 3.31Å; A128-Y635 WeakPolarHBondContact CB-O 3.25Å; A128-F637 HydrophobicContact CB-CE2 4.47Å
129	L	91.4	Very high	89.2	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.2	-39.2	175.8	-70.8	165.7	0	0	0	112.3	V125 A127 A131 V132 V133 V376 W380 F637	V125-L129 HydrophobicContact CG1-CD1 4.28Å; V125-L129 WeakPolarHBondContact O-CG 3.38Å; V125-L129 PolarHBondContact O-N 3.17Å; V125-L129 VanDerWaalsContact O-N 3.1Å; A127-L129 PolarHBondContact O-N 3.46Å; L129-A131 VanDerWaalsContact C-N 3.34Å; L129-V132 PolarHBondContact O-N 2.89Å; L129-V133 WeakPolarHBondContact O-CG2 3.42Å; L129-V133 PolarHBondContact O-N 2.9Å; L129-V133 VanDerWaalsContact O-N 3.17Å; L129-V376 HydrophobicContact CD1-CG1 3.78Å; L129-W380 HydrophobicContact CD1-CB 3.71Å; L129-W380 HydrophobicContact CD1-CD2 4.08Å; L129-W380 HydrophobicContact CD1-CE3 4.45Å; L129-W380 HydrophobicContact CD1-CG 3.77Å; L129-W380 HydrophobicContact CD2-CD2 3.92Å; L129-W380 HydrophobicContact CD2-CE3 3.96Å; L129-W380 HydrophobicContact CD2-CG 4.42Å; L129-W380 HydrophobicContact CD2-CH2 4.43Å; L129-W380 HydrophobicContact CD2-CZ2 4.38Å; L129-W380 HydrophobicContact CD2-CZ3 4.22Å; L129-F637 HydrophobicContact CD2-CE2 4.42Å; L129-F637 HydrophobicContact CD2-CZ 3.85Å
130	N	91.6	Very high	89.3	Confident	77 Å²	77	46.5 Å²	46.5	41%	0.412	26%	0.259	S	S	.	.	H	α-helix	trans	-68.3	-31.3	176.3	-71.6	-31.9	0	0	0	112.8	T126 A127 A128 V133 H134	T126-N130 VanDerWaalsContact O-CG 3.28Å; T126-N130 PolarHBondContact O-N 2.94Å; T126-N130 VanDerWaalsContact O-N 3.09Å; T126-N130 PolarHBondContact O-ND2 3.19Å; T126-N130 VanDerWaalsContact O-ND2 3.12Å; A127-N130 PolarHBondContact O-N 3.48Å; A128-N130 PolarHBondContact O-N 3.45Å; N130-V133 PolarHBondContact O-N 2.92Å; N130-H134 WeakPolarHBondContact O-CB 3.5Å; N130-H134 PolarHBondContact O-N 3.34Å
131	A	90	Very high	89.6	Confident	38 Å²	38	48.2 Å²	48.2	31%	0.314	27%	0.267	S	S	.	.	H	α-helix	trans	-62.9	-49	172.6	0	0	0	0	0	111.2	A127 A128 L129 V133 H134 E135	A127-A131 PolarHBondContact O-N 2.71Å; A128-A131 WeakPolarHBondContact O-CB 3.42Å; A128-A131 PolarHBondContact O-N 2.67Å; L129-A131 VanDerWaalsContact C-N 3.34Å; A131-V133 VanDerWaalsContact C-N 3.3Å; A131-V133 PolarHBondContact O-N 3.12Å; A131-H134 PolarHBondContact O-N 2.86Å; A131-E135 WeakPolarHBondContact O-CB 3.41Å; A131-E135 WeakPolarHBondContact O-CG 3.5Å; A131-E135 PolarHBondContact O-N 3.46Å
132	V	89.4	Confident	89.6	Confident	6 Å²	6	48.8 Å²	48.8	4%	0.036	27%	0.27	C	S	.	.	H	α-helix	trans	-55.1	-43.9	175.3	174.1	0	0	0	0	111.7	A128 L129 H134 H136 G137 H273 F637	A128-V132 PolarHBondContact O-N 2.95Å; L129-V132 PolarHBondContact O-N 2.89Å; V132-H134 PolarHBondContact O-N 3.36Å; V132-H136 WeakPolarHBondContact O-CB 3.42Å; V132-H136 PolarHBondContact O-N 3.39Å; V132-G137 PolarHBondContact O-N 2.87Å; V132-H273 HydrophobicContact CG1-CB 3.7Å; V132-F637 HydrophobicContact CG2-CD1 4.31Å; V132-F637 HydrophobicContact CG2-CD2 3.8Å; V132-F637 HydrophobicContact CG2-CE1 4.45Å; V132-F637 HydrophobicContact CG2-CE2 3.94Å; V132-F637 HydrophobicContact CG2-CG 4.01Å; V132-F637 HydrophobicContact CG2-CZ 4.29Å
133	V	90.4	Very high	89.7	Confident	34 Å²	34	48.6 Å²	48.6	21%	0.206	27%	0.27	C	S	.	.	H	α-helix	trans	-62.7	-40	176.8	175	0	0	0	0	112.2	L129 N130 A131 G137 P266 L269	L129-V133 WeakPolarHBondContact O-CG2 3.42Å; L129-V133 PolarHBondContact O-N 2.9Å; L129-V133 VanDerWaalsContact O-N 3.17Å; N130-V133 PolarHBondContact O-N 2.92Å; A131-V133 VanDerWaalsContact C-N 3.3Å; A131-V133 PolarHBondContact O-N 3.12Å; V133-G137 WeakPolarHBondContact O-CA 3.44Å; V133-G137 PolarHBondContact O-N 3.04Å; V133-G137 VanDerWaalsContact O-N 3.1Å; V133-P266 HydrophobicContact CG2-CB 3.93Å; V133-P266 HydrophobicContact CG2-CG 4.35Å; V133-L269 HydrophobicContact CB-CD1 4.43Å; V133-L269 HydrophobicContact CG1-CD1 4.18Å; V133-L269 HydrophobicContact CG2-CB 4.22Å; V133-L269 HydrophobicContact CG2-CD1 4.03Å
134	H	89.3	Confident	89.7	Confident	154 Å²	154	50.5 Å²	50.5	71%	0.713	28%	0.275	S	S	*	.	H	α-helix	trans	-73.2	-43.8	-179.5	179.4	-94.5	0	0	0	112.6	N130 A131 V132 K179	N130-H134 WeakPolarHBondContact O-CB 3.5Å; N130-H134 PolarHBondContact O-N 3.34Å; A131-H134 PolarHBondContact O-N 2.86Å; V132-H134 PolarHBondContact O-N 3.36Å; H134-K179 PolarHBondContact O-NZ 2.97Å
135	E	89.3	Confident	89.7	Confident	114 Å²	114	54.4 Å²	54.4	53%	0.533	29%	0.289	S	S	.	.	H	α-helix	trans	-74.6	-47.8	-175.9	-71.2	166.9	-174.8	0	0	112.2	A131 K179	A131-E135 WeakPolarHBondContact O-CB 3.41Å; A131-E135 WeakPolarHBondContact O-CG 3.5Å; A131-E135 PolarHBondContact O-N 3.46Å; E135-K179 WeakPolarHBondContact O-CE 3.44Å; E135-K179 PolarHBondContact O-NZ 3.48Å
136	H	88.4	Confident	89.8	Confident	68 Å²	68	54.5 Å²	54.5	32%	0.315	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-30.9	-171.6	-57.9	85.1	0	0	0	113.1	V132 F178 K179 H273	V132-H136 WeakPolarHBondContact O-CB 3.42Å; V132-H136 PolarHBondContact O-N 3.39Å; H136-F178 HydrophobicContact CB-CD1 3.68Å; H136-F178 HydrophobicContact CB-CE1 4.09Å; H136-F178 HydrophobicContact CB-CG 4.45Å; H136-F178 VanDerWaalsContact O-CA 3.23Å; H136-F178 WeakPolarHBondContact O-CA 3.46Å; H136-F178 WeakPolarHBondContact O-CB 3.38Å; H136-K179 PolarHBondContact O-N 3.49Å; H136-K179 VanDerWaalsContact O-N 3.14Å; H136-H273 AromaticContact CD2-CE1 3.7Å; H136-H273 AromaticContact CE1-CE1 3.54Å; H136-H273 AromaticContact CE1-NE2 3.68Å; H136-H273 AromaticContact CG-CE1 3.94Å; H136-H273 AromaticContact ND1-CE1 3.84Å; H136-H273 AromaticContact ND1-NE2 3.96Å; H136-H273 AromaticContact NE2-CE1 3.44Å; H136-H273 PolarHBondContact NE2-CE1 3.44Å
137	G	88.4	Confident	89.8	Confident	5 Å²	5	58 Å²	58	5%	0.052	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-68.7	145.8	-172.8	0	0	0	0	0	115.1	V132 V133 K179	V132-G137 PolarHBondContact O-N 2.87Å; V133-G137 WeakPolarHBondContact O-CA 3.44Å; V133-G137 PolarHBondContact O-N 3.04Å; V133-G137 VanDerWaalsContact O-N 3.1Å; G137-K179 WeakPolarHBondContact O-CE 3.36Å
138	M	89.7	Confident	89.8	Confident	12 Å²	12	58.6 Å²	58.6	6%	0.059	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-72.5	131.2	178.3	-167.9	-175.6	-54.7	0	0	111.9	D142 V143 G177 F178	M138-D142 HydrophobicContact CG-CB 3.68Å; M138-V143 HydrophobicContact CG-CG2 4.21Å; M138-V143 HydrophobicContact SD-CG2 3.74Å; M138-G177 PolarHBondContact N-O 2.88Å; M138-F178 WeakPolarHBondContact CE-O 3.35Å
139	N	88.3	Confident	89.8	Confident	70 Å²	70	58.7 Å²	58.7	37%	0.374	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-100.8	173.4	175.8	66.2	64.1	0	0	0	112.5	Q141 D142 V143	N139-Q141 VanDerWaalsContact C-N 3.28Å; N139-Q141 PolarHBondContact O-N 3.47Å; N139-Q141 WeakPolarHBondContact OD1-CA 3.42Å; N139-Q141 VanDerWaalsContact OD1-CB 3.27Å; N139-Q141 WeakPolarHBondContact OD1-CB 3.47Å; N139-Q141 PolarHBondContact OD1-N 3.29Å; N139-D142 VanDerWaalsContact CG-OD2 3.26Å; N139-D142 PolarHBondContact ND2-OD2 3.22Å; N139-D142 PolarHBondContact O-N 3.04Å; N139-D142 VanDerWaalsContact O-N 3.07Å; N139-D142 PolarHBondContact OD1-N 3.28Å; N139-D142 VanDerWaalsContact OD1-N 3.07Å; N139-D142 PolarHBondContact OD1-OD2 2.98Å; N139-V143 PolarHBondContact O-N 2.89Å; N139-V143 VanDerWaalsContact O-N 3.13Å
140	D	88.6	Confident	89.8	Confident	102 Å²	102	59.3 Å²	59.3	55%	0.545	31%	0.308	S	S	.	.	H	α-helix	trans	-60.8	-32.4	-177.5	-62.8	-14.5	0	0	0	113.6	V143 L144 K175	D140-V143 PolarHBondContact O-N 3.22Å; D140-L144 WeakPolarHBondContact O-CG 3.38Å; D140-L144 PolarHBondContact O-N 3.41Å; D140-K175 WeakPolarHBondContact OD1-CE 3.47Å; D140-K175 IonicContact OD1-NZ 2.88Å; D140-K175 PolarHBondContact OD1-NZ 3.1Å
141	Q	89.2	Confident	89.8	Confident	133 Å²	133	58.9 Å²	58.9	62%	0.621	31%	0.31	S	S	*	.	H	α-helix	trans	-71.1	-33.3	176.4	-167.7	-177.1	1.9	0	0	111.5	N139 L144 K145	N139-Q141 VanDerWaalsContact C-N 3.28Å; N139-Q141 PolarHBondContact O-N 3.47Å; N139-Q141 WeakPolarHBondContact OD1-CA 3.42Å; N139-Q141 VanDerWaalsContact OD1-CB 3.27Å; N139-Q141 WeakPolarHBondContact OD1-CB 3.47Å; N139-Q141 PolarHBondContact OD1-N 3.29Å; Q141-L144 PolarHBondContact O-N 3.48Å; Q141-K145 WeakPolarHBondContact O-CG 3.41Å; Q141-K145 PolarHBondContact O-N 3.41Å; Q141-K145 VanDerWaalsContact O-N 3.09Å
142	D	89	Confident	89.9	Confident	18 Å²	18	59.4 Å²	59.4	10%	0.096	31%	0.31	C	S	.	.	H	α-helix	trans	-72.5	-32.7	175.8	-62.8	-37.8	0	0	0	112.2	M138 N139 K145 R146	M138-D142 HydrophobicContact CG-CB 3.68Å; N139-D142 VanDerWaalsContact CG-OD2 3.26Å; N139-D142 PolarHBondContact ND2-OD2 3.22Å; N139-D142 PolarHBondContact O-N 3.04Å; N139-D142 VanDerWaalsContact O-N 3.07Å; N139-D142 PolarHBondContact OD1-N 3.28Å; N139-D142 VanDerWaalsContact OD1-N 3.07Å; N139-D142 PolarHBondContact OD1-OD2 2.98Å; D142-K145 IonicContact OD1-NZ 2.65Å; D142-K145 PolarHBondContact OD1-NZ 2.65Å; D142-R146 WeakPolarHBondContact O-CD 3.41Å; D142-R146 VanDerWaalsContact O-CG 3.31Å; D142-R146 WeakPolarHBondContact O-CG 3.42Å; D142-R146 PolarHBondContact O-N 3.23Å
143	V	89.4	Confident	90	Very high	16 Å²	16	59.1 Å²	59.1	10%	0.097	31%	0.308	C	S	.	.	H	α-helix	trans	-64.1	-46.8	168.9	179	0	0	0	0	110.7	M138 N139 D140 K145 R146 E147 K175	M138-V143 HydrophobicContact CG-CG2 4.21Å; M138-V143 HydrophobicContact SD-CG2 3.74Å; N139-V143 PolarHBondContact O-N 2.89Å; N139-V143 VanDerWaalsContact O-N 3.13Å; D140-V143 PolarHBondContact O-N 3.22Å; V143-K145 VanDerWaalsContact C-N 3.3Å; V143-K145 PolarHBondContact O-N 3.09Å; V143-R146 WeakPolarHBondContact O-CA 3.33Å; V143-R146 WeakPolarHBondContact O-CB 3.42Å; V143-R146 PolarHBondContact O-N 3.23Å; V143-E147 HydrophobicContact CG1-CG 4.43Å; V143-E147 PolarHBondContact O-N 3.06Å; V143-K175 HydrophobicContact CG2-CG 4.12Å
144	L	90.3	Very high	90.2	Very high	108 Å²	108	59.2 Å²	59.2	57%	0.565	31%	0.306	S	S	*	.	H	α-helix	trans	-60.3	-34.9	178	-73.3	166.7	0	0	0	113.2	D140 Q141 S148	D140-L144 WeakPolarHBondContact O-CG 3.38Å; D140-L144 PolarHBondContact O-N 3.41Å; Q141-L144 PolarHBondContact O-N 3.48Å; L144-S148 WeakPolarHBondContact O-CB 3.47Å; L144-S148 PolarHBondContact O-N 3.12Å
145	K	89.2	Confident	90.3	Very high	98 Å²	98	57.4 Å²	57.4	43%	0.426	30%	0.302	S	S	.	.	H	α-helix	trans	-60.9	-44.7	171.4	-69.1	168.5	-163.4	165.8	0	111.4	Q141 D142 V143 S148 L149	Q141-K145 WeakPolarHBondContact O-CG 3.41Å; Q141-K145 PolarHBondContact O-N 3.41Å; Q141-K145 VanDerWaalsContact O-N 3.09Å; D142-K145 IonicContact OD1-NZ 2.65Å; D142-K145 PolarHBondContact OD1-NZ 2.65Å; V143-K145 VanDerWaalsContact C-N 3.3Å; V143-K145 PolarHBondContact O-N 3.09Å; K145-S148 PolarHBondContact O-N 2.7Å; K145-L149 WeakPolarHBondContact O-CB 3.37Å; K145-L149 PolarHBondContact O-N 2.96Å
146	R	91.6	Very high	90.3	Very high	1 Å²	1	53.1 Å²	53.1	0%	0.004	28%	0.283	C	S	.	.	H	α-helix	trans	-67.8	-38.8	-179	-66.2	162.7	177.4	-103.1	-7	111.6	D142 V143 L149 V150 L168 S172 K179 S181 D182 V183 L236	D142-R146 WeakPolarHBondContact O-CD 3.41Å; D142-R146 VanDerWaalsContact O-CG 3.31Å; D142-R146 WeakPolarHBondContact O-CG 3.42Å; D142-R146 PolarHBondContact O-N 3.23Å; V143-R146 WeakPolarHBondContact O-CA 3.33Å; V143-R146 WeakPolarHBondContact O-CB 3.42Å; V143-R146 PolarHBondContact O-N 3.23Å; R146-L149 PolarHBondContact O-N 2.8Å; R146-V150 WeakPolarHBondContact O-CG2 3.36Å; R146-V150 PolarHBondContact O-N 3.29Å; R146-V150 VanDerWaalsContact O-N 3.08Å; R146-L168 HydrophobicContact CB-CD1 4.39Å; R146-S172 PolarHBondContact NH1-OG 3.08Å; R146-K179 PolarHBondContact NH2-O 3.1Å; R146-S181 PolarHBondContact NH1-O 3.17Å; R146-S181 PolarHBondContact NH2-O 2.74Å; R146-D182 PolarHBondContact NH1-O 3.37Å; R146-V183 HydrophobicContact CB-CG1 4.34Å; R146-V183 HydrophobicContact CG-CG1 4.5Å; R146-V183 HydrophobicContact CG-CG2 4Å; R146-L236 HydrophobicContact CG-CD1 4.11Å
147	E	91.3	Very high	90.5	Very high	94 Å²	94	50 Å²	50	44%	0.439	27%	0.269	S	S	.	.	H	α-helix	trans	-63.4	-43.9	171.8	-70.5	177.9	166.6	0	0	112.1	V143 L149 V150 S151 L168	V143-E147 HydrophobicContact CG1-CG 4.43Å; V143-E147 PolarHBondContact O-N 3.06Å; E147-L149 VanDerWaalsContact C-N 3.34Å; E147-L149 PolarHBondContact O-N 2.89Å; E147-V150 PolarHBondContact O-N 2.93Å; E147-S151 PolarHBondContact O-N 3.36Å; E147-S151 PolarHBondContact O-OG 2.82Å; E147-L168 HydrophobicContact CB-CD1 4.46Å; E147-L168 HydrophobicContact CG-CD1 3.72Å
148	S	90.3	Very high	90.7	Very high	72 Å²	72	53 Å²	53	50%	0.503	28%	0.283	S	S	.	.	H	α-helix	trans	-62.9	-38.2	174.8	-169.8	0	0	0	0	112.7	L144 K145 S151 V152	L144-S148 WeakPolarHBondContact O-CB 3.47Å; L144-S148 PolarHBondContact O-N 3.12Å; K145-S148 PolarHBondContact O-N 2.7Å; S148-S151 WeakPolarHBondContact O-CB 3.14Å; S148-S151 PolarHBondContact O-N 3.26Å; S148-V152 PolarHBondContact O-N 2.64Å; S148-V152 VanDerWaalsContact O-N 3.09Å
149	L	90.1	Very high	90.6	Very high	13 Å²	13	57.1 Å²	57.1	7%	0.068	31%	0.313	C	S	.	.	H	α-helix	trans	-63.8	-43.2	176	178	150.8	0	0	0	111.7	K145 R146 E147 S151 V152 M153 V183 I185 E230 C238	K145-L149 WeakPolarHBondContact O-CB 3.37Å; K145-L149 PolarHBondContact O-N 2.96Å; R146-L149 PolarHBondContact O-N 2.8Å; E147-L149 VanDerWaalsContact C-N 3.34Å; E147-L149 PolarHBondContact O-N 2.89Å; L149-S151 VanDerWaalsContact C-N 3.27Å; L149-S151 PolarHBondContact O-N 3.38Å; L149-V152 PolarHBondContact O-N 3.34Å; L149-M153 PolarHBondContact O-N 3.18Å; L149-V183 HydrophobicContact CD2-CG1 4.42Å; L149-I185 HydrophobicContact CD2-CD1 4.2Å; L149-E230 HydrophobicContact CD1-CB 3.78Å; L149-E230 HydrophobicContact CD1-CG 3.68Å; L149-C238 VanDerWaalsContact CD2-SG 3.57Å
150	V	92.2	Very high	90.6	Very high	13 Å²	13	57.4 Å²	57.4	8%	0.079	32%	0.318	C	S	.	.	H	α-helix	trans	-68.4	-28.8	176.7	173.3	0	0	0	0	111.8	R146 E147 M153 Q154 L166 L168 V183 I185	R146-V150 WeakPolarHBondContact O-CG2 3.36Å; R146-V150 PolarHBondContact O-N 3.29Å; R146-V150 VanDerWaalsContact O-N 3.08Å; E147-V150 PolarHBondContact O-N 2.93Å; V150-M153 PolarHBondContact O-N 3.08Å; V150-Q154 WeakPolarHBondContact O-CB 3.31Å; V150-Q154 PolarHBondContact O-N 2.96Å; V150-L166 HydrophobicContact CG1-CB 3.64Å; V150-L166 HydrophobicContact CG1-CD1 3.99Å; V150-L166 HydrophobicContact CG1-CG 4.49Å; V150-L168 HydrophobicContact CB-CG 4.42Å; V150-L168 HydrophobicContact CG2-CD1 4.45Å; V150-L168 HydrophobicContact CG2-CD2 3.51Å; V150-L168 HydrophobicContact CG2-CG 3.78Å; V150-V183 HydrophobicContact CG2-CG1 4.49Å; V150-I185 HydrophobicContact CG1-CG2 4.47Å; V150-I185 HydrophobicContact CG2-CD1 3.69Å; V150-I185 HydrophobicContact CG2-CG1 3.71Å; V150-I185 HydrophobicContact CG2-CG2 4.41Å
151	S	91.9	Very high	90.5	Very high	67 Å²	67	53.5 Å²	53.5	47%	0.469	30%	0.296	S	S	.	.	H	α-helix	trans	-66.2	-45	172.2	-54.9	0	0	0	0	111.2	E147 S148 L149 M153 Q154 D155	E147-S151 PolarHBondContact O-N 3.36Å; E147-S151 PolarHBondContact O-OG 2.82Å; S148-S151 WeakPolarHBondContact O-CB 3.14Å; S148-S151 PolarHBondContact O-N 3.26Å; L149-S151 VanDerWaalsContact C-N 3.27Å; L149-S151 PolarHBondContact O-N 3.38Å; S151-M153 VanDerWaalsContact C-N 3.32Å; S151-M153 PolarHBondContact O-N 2.72Å; S151-Q154 WeakPolarHBondContact O-CB 3.49Å; S151-Q154 PolarHBondContact O-N 2.79Å; S151-D155 PolarHBondContact O-N 2.87Å
152	V	91.1	Very high	90.4	Very high	50 Å²	50	51.9 Å²	51.9	30%	0.303	30%	0.298	S	S	.	.	H	α-helix	trans	-62.3	-38.2	173.3	173.6	0	0	0	0	111.8	S148 L149 D155 V156 Y211	S148-V152 PolarHBondContact O-N 2.64Å; S148-V152 VanDerWaalsContact O-N 3.09Å; L149-V152 PolarHBondContact O-N 3.34Å; V152-D155 PolarHBondContact O-N 2.97Å; V152-V156 WeakPolarHBondContact O-CG2 3.35Å; V152-V156 PolarHBondContact O-N 3.3Å; V152-V156 VanDerWaalsContact O-N 3.15Å; V152-Y211 HydrophobicContact CG1-CD1 4.01Å; V152-Y211 HydrophobicContact CG1-CD2 4.39Å; V152-Y211 HydrophobicContact CG1-CE1 4.41Å; V152-Y211 HydrophobicContact CG1-CG 4.01Å
153	M	92.6	Very high	90.4	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-67.8	-37.5	175.5	-167.4	179.1	-78.1	0	0	112.3	L149 V150 S151 V156 L157 L166 I185 L206 F212 C238 V240	L149-M153 PolarHBondContact O-N 3.18Å; V150-M153 PolarHBondContact O-N 3.08Å; S151-M153 VanDerWaalsContact C-N 3.32Å; S151-M153 PolarHBondContact O-N 2.72Å; M153-V156 PolarHBondContact O-N 3.08Å; M153-L157 HydrophobicContact CG-CD1 3.97Å; M153-L157 HydrophobicContact CG-CG 4.44Å; M153-L157 WeakPolarHBondContact O-CG 3.31Å; M153-L157 PolarHBondContact O-N 2.84Å; M153-L166 HydrophobicContact CB-CD1 3.73Å; M153-L166 HydrophobicContact CG-CD1 3.74Å; M153-L166 HydrophobicContact SD-CD1 4.11Å; M153-I185 HydrophobicContact CE-CD1 3.79Å; M153-I185 HydrophobicContact SD-CD1 3.66Å; M153-L206 HydrophobicContact CE-CD1 4.42Å; M153-L206 HydrophobicContact CE-CD2 4.24Å; M153-L206 HydrophobicContact CG-CD2 4.05Å; M153-L206 HydrophobicContact SD-CD2 4.49Å; M153-F212 HydrophobicContact CB-CZ 4.06Å; M153-F212 HydrophobicContact CE-CD1 4.41Å; M153-F212 HydrophobicContact CE-CE1 3.65Å; M153-F212 HydrophobicContact CE-CE2 4.29Å; M153-F212 HydrophobicContact CE-CZ 3.58Å; M153-F212 HydrophobicContact CG-CE2 4.46Å; M153-F212 HydrophobicContact CG-CZ 4.23Å; M153-C238 HydrophobicContact CE-CB 4.15Å; M153-V240 HydrophobicContact CE-CG2 3.94Å; M153-V240 HydrophobicContact SD-CG2 3.68Å
154	Q	93.8	Very high	90.5	Very high	35 Å²	35	56.4 Å²	56.4	16%	0.164	32%	0.317	C	S	.	.	H	α-helix	trans	-62.7	-45.4	174.7	178.4	78.8	55.5	0	0	110.6	V150 S151 V156 L157 L158 I164 L166	V150-Q154 WeakPolarHBondContact O-CB 3.31Å; V150-Q154 PolarHBondContact O-N 2.96Å; S151-Q154 WeakPolarHBondContact O-CB 3.49Å; S151-Q154 PolarHBondContact O-N 2.79Å; Q154-V156 VanDerWaalsContact C-N 3.33Å; Q154-V156 PolarHBondContact O-N 3.45Å; Q154-L157 PolarHBondContact O-N 3.47Å; Q154-L158 HydrophobicContact CG-CD1 3.84Å; Q154-L158 HydrophobicContact CG-CG 4.22Å; Q154-L158 VanDerWaalsContact NE2-CG 3.29Å; Q154-L158 WeakPolarHBondContact O-CB 3.38Å; Q154-L158 VanDerWaalsContact O-CG 3.26Å; Q154-L158 WeakPolarHBondContact O-CG 3.42Å; Q154-L158 PolarHBondContact O-N 3.28Å; Q154-I164 PolarHBondContact NE2-O 2.95Å; Q154-L166 HydrophobicContact CB-CD1 4.02Å; Q154-L166 HydrophobicContact CB-CG 4.34Å
155	D	91.4	Very high	90.5	Very high	117 Å²	117	59.2 Å²	59.2	63%	0.626	32%	0.321	S	S	*	.	H	α-helix	trans	-62.5	-37.8	178.7	-71	-22.2	0	0	0	112.4	S151 V152	S151-D155 PolarHBondContact O-N 2.87Å; V152-D155 PolarHBondContact O-N 2.97Å
156	V	90.3	Very high	90.7	Very high	24 Å²	24	55.1 Å²	55.1	15%	0.145	30%	0.303	C	S	.	.	H	α-helix	trans	-64.1	-54.1	173	170	0	0	0	0	110.6	V152 M153 Q154 L158 S159 Y211	V152-V156 WeakPolarHBondContact O-CG2 3.35Å; V152-V156 PolarHBondContact O-N 3.3Å; V152-V156 VanDerWaalsContact O-N 3.15Å; M153-V156 PolarHBondContact O-N 3.08Å; Q154-V156 VanDerWaalsContact C-N 3.33Å; Q154-V156 PolarHBondContact O-N 3.45Å; V156-L158 PolarHBondContact O-N 3.02Å; V156-S159 WeakPolarHBondContact O-CB 3.42Å; V156-S159 PolarHBondContact O-N 3.04Å; V156-S159 PolarHBondContact O-OG 3.43Å; V156-Y211 HydrophobicContact CG2-CD2 4.16Å
157	L	91.8	Very high	90.7	Very high	1 Å²	1	56.2 Å²	56.2	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-72.8	-28.2	-171.8	-64.8	174	0	0	0	113.5	M153 Q154 S159 V160 L161 I164 L166 V202 A205 L206	M153-L157 HydrophobicContact CG-CD1 3.97Å; M153-L157 HydrophobicContact CG-CG 4.44Å; M153-L157 WeakPolarHBondContact O-CG 3.31Å; M153-L157 PolarHBondContact O-N 2.84Å; Q154-L157 PolarHBondContact O-N 3.47Å; L157-S159 PolarHBondContact O-N 3.3Å; L157-V160 PolarHBondContact O-N 2.83Å; L157-V160 VanDerWaalsContact O-N 3.07Å; L157-L161 PolarHBondContact O-N 3.27Å; L157-I164 HydrophobicContact CB-CD1 3.91Å; L157-I164 HydrophobicContact CD1-CD1 4.22Å; L157-L166 HydrophobicContact CD1-CD1 4.34Å; L157-L166 HydrophobicContact CD1-CD2 4.12Å; L157-V202 HydrophobicContact CD1-CG1 4.32Å; L157-V202 HydrophobicContact CD1-CG2 4.18Å; L157-V202 HydrophobicContact CD2-CB 4.28Å; L157-V202 HydrophobicContact CD2-CG1 4.24Å; L157-V202 HydrophobicContact CD2-CG2 3.98Å; L157-A205 HydrophobicContact CD2-CB 3.92Å; L157-L206 HydrophobicContact CD2-CD2 4.43Å; L157-L206 HydrophobicContact CD2-CG 4.34Å
158	L	92.1	Very high	90.7	Very high	68 Å²	68	52.7 Å²	52.7	36%	0.356	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-21.4	174.3	-80.9	173.9	0	0	0	113.7	Q154 V156 V160	Q154-L158 HydrophobicContact CG-CD1 3.84Å; Q154-L158 HydrophobicContact CG-CG 4.22Å; Q154-L158 VanDerWaalsContact NE2-CG 3.29Å; Q154-L158 WeakPolarHBondContact O-CB 3.38Å; Q154-L158 VanDerWaalsContact O-CG 3.26Å; Q154-L158 WeakPolarHBondContact O-CG 3.42Å; Q154-L158 PolarHBondContact O-N 3.28Å; V156-L158 PolarHBondContact O-N 3.02Å; L158-V160 PolarHBondContact O-N 2.89Å
159	S	87.2	Confident	90.8	Very high	99 Å²	99	50 Å²	50	69%	0.692	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-21.4	175.7	71.1	0	0	0	0	113.4	V156 L157	V156-S159 WeakPolarHBondContact O-CB 3.42Å; V156-S159 PolarHBondContact O-N 3.04Å; V156-S159 PolarHBondContact O-OG 3.43Å; L157-S159 PolarHBondContact O-N 3.3Å
160	V	88.5	Confident	90.7	Very high	77 Å²	77	49.6 Å²	49.6	47%	0.467	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.9	-34.8	-178.4	-162.4	0	0	0	0	111.9	L157 L158 V201 A205	L157-V160 PolarHBondContact O-N 2.83Å; L157-V160 VanDerWaalsContact O-N 3.07Å; L158-V160 PolarHBondContact O-N 2.89Å; V160-V201 HydrophobicContact CB-CG1 4.18Å; V160-V201 HydrophobicContact CG1-CG1 3.47Å; V160-V201 VanDerWaalsContact CG1-CG1 3.47Å; V160-A205 HydrophobicContact CG2-CB 4.01Å
161	L	88.3	Confident	90.5	Very high	19 Å²	19	49.6 Å²	49.6	10%	0.099	27%	0.27	C	S	.	.			trans	-124.5	86.6	-178.4	-65.5	177.1	0	0	0	110.2	L157 E163 I164 V198 V201 V202	L157-L161 PolarHBondContact O-N 3.27Å; L161-E163 VanDerWaalsContact C-N 3.29Å; L161-E163 PolarHBondContact O-N 3.44Å; L161-I164 HydrophobicContact CB-CD1 4.21Å; L161-I164 HydrophobicContact CB-CG1 3.86Å; L161-I164 HydrophobicContact CB-CG2 3.95Å; L161-I164 HydrophobicContact CD1-CD1 4.3Å; L161-I164 HydrophobicContact CD1-CG2 4.26Å; L161-I164 WeakPolarHBondContact O-CG1 3.48Å; L161-V198 HydrophobicContact CD1-CG1 4.24Å; L161-V201 HydrophobicContact CD1-CB 4.37Å; L161-V201 HydrophobicContact CD1-CG1 3.98Å; L161-V201 HydrophobicContact CD2-CG1 4.02Å; L161-V201 HydrophobicContact CG-CG1 3.84Å; L161-V202 HydrophobicContact CD1-CG2 4.15Å
162	P	86	Confident	90.4	Very high	100 Å²	100	46.5 Å²	46.5	65%	0.649	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-14.4	-170.7	28.7	-36.3	0	0	0	115
163	E	88.6	Confident	90.3	Very high	122 Å²	122	46 Å²	46	57%	0.57	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.2	-1.4	-177.8	-71	-172	-130.1	0	0	114.4	L161 P190 H192 M193	L161-E163 VanDerWaalsContact C-N 3.29Å; L161-E163 PolarHBondContact O-N 3.44Å; E163-P190 HydrophobicContact CB-CG 4.03Å; E163-H192 IonicContact OE1-CE1 3.19Å; E163-H192 IonicContact OE2-CE1 2.69Å; E163-M193 HydrophobicContact CB-CE 4.45Å
164	I	91.3	Very high	90.1	Very high	7 Å²	7	46.4 Å²	46.4	4%	0.036	25%	0.249	C	C	.	.			trans	-88.1	155.7	-176.3	68.6	152.1	0	0	0	114	Q154 L157 L161 L166 I187 Q188	Q154-I164 PolarHBondContact NE2-O 2.95Å; L157-I164 HydrophobicContact CB-CD1 3.91Å; L157-I164 HydrophobicContact CD1-CD1 4.22Å; L161-I164 HydrophobicContact CB-CD1 4.21Å; L161-I164 HydrophobicContact CB-CG1 3.86Å; L161-I164 HydrophobicContact CB-CG2 3.95Å; L161-I164 HydrophobicContact CD1-CD1 4.3Å; L161-I164 HydrophobicContact CD1-CG2 4.26Å; L161-I164 WeakPolarHBondContact O-CG1 3.48Å; I164-L166 HydrophobicContact CD1-CD2 4.4Å; I164-I187 HydrophobicContact CB-CG2 3.83Å; I164-I187 HydrophobicContact CD1-CG2 3.78Å; I164-I187 HydrophobicContact CG1-CG2 4.43Å; I164-I187 HydrophobicContact CG2-CG2 3.93Å; I164-Q188 VanDerWaalsContact CA-O 3.32Å; I164-Q188 WeakPolarHBondContact CA-O 3.3Å; I164-Q188 WeakPolarHBondContact CB-O 3.38Å
165	R	91.5	Very high	89.9	Confident	167 Å²	167	47.1 Å²	47.1	63%	0.63	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.7	123.6	172.8	-176.9	-179	-178	-174.1	2.1	111.5	Q188	R165-Q188 HydrophobicContact CB-CB 4.36Å; R165-Q188 PolarHBondContact N-O 2.97Å; R165-Q188 WeakPolarHBondContact O-CB 2.76Å; R165-Q188 PolarHBondContact O-N 3.38Å
166	L	93.2	Very high	89.8	Confident	12 Å²	12	42.2 Å²	42.2	6%	0.063	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	145.3	170.6	-57	-174.1	0	0	0	111.1	V150 M153 Q154 L157 I164 I185 D186 I187	V150-L166 HydrophobicContact CG1-CB 3.64Å; V150-L166 HydrophobicContact CG1-CD1 3.99Å; V150-L166 HydrophobicContact CG1-CG 4.49Å; M153-L166 HydrophobicContact CB-CD1 3.73Å; M153-L166 HydrophobicContact CG-CD1 3.74Å; M153-L166 HydrophobicContact SD-CD1 4.11Å; Q154-L166 HydrophobicContact CB-CD1 4.02Å; Q154-L166 HydrophobicContact CB-CG 4.34Å; L157-L166 HydrophobicContact CD1-CD1 4.34Å; L157-L166 HydrophobicContact CD1-CD2 4.12Å; I164-L166 HydrophobicContact CD1-CD2 4.4Å; L166-I185 HydrophobicContact CB-CG2 4.16Å; L166-I185 HydrophobicContact CD1-CG2 4.28Å; L166-I185 HydrophobicContact CD2-CG2 4.09Å; L166-I185 HydrophobicContact CG-CG2 4.41Å; L166-D186 CarbonylContact C-O 3.58Å; L166-D186 WeakPolarHBondContact CA-O 3.34Å; L166-I187 HydrophobicContact CD2-CB 4.36Å; L166-I187 HydrophobicContact CD2-CG1 3.53Å
167	R	91.6	Very high	89.6	Confident	23 Å²	23	41 Å²	41	9%	0.087	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	136.1	167.8	60.2	-171	175.7	176.3	-10.6	110	D186 E245 F248	R167-D186 HydrophobicContact CG-CB 3.93Å; R167-D186 WeakPolarHBondContact CG-O 3.48Å; R167-D186 IonicContact CZ-OD2 3.88Å; R167-D186 PolarHBondContact N-O 3.45Å; R167-D186 IonicContact NE-OD2 3.28Å; R167-D186 PolarHBondContact NE-OD2 3.16Å; R167-D186 IonicContact NH2-OD2 3.36Å; R167-D186 PolarHBondContact NH2-OD2 3.02Å; R167-D186 PolarHBondContact O-N 3.38Å; R167-E245 IonicContact CZ-OE2 2.67Å; R167-E245 IonicContact NH1-OE1 3.55Å; R167-E245 PolarHBondContact NH1-OE1 3.24Å; R167-E245 IonicContact NH1-OE2 3.21Å; R167-E245 PolarHBondContact NH1-OE2 3.24Å; R167-E245 IonicContact NH2-OE2 3.98Å; R167-E245 PolarHBondContact NH2-OE2 3.23Å; R167-F248 HydrophobicContact CB-CE2 4.37Å; R167-F248 HydrophobicContact CG-CD2 4.11Å; R167-F248 HydrophobicContact CG-CE2 4.39Å; R167-F248 VanDerWaalsContact NH1-CG 3.29Å
168	L	91.7	Very high	89.5	Confident	20 Å²	20	41.2 Å²	41.2	11%	0.105	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	147.7	168.1	-79.4	169.1	0	0	0	110.3	R146 E147 V150 C173 V183 I185	R146-L168 HydrophobicContact CB-CD1 4.39Å; E147-L168 HydrophobicContact CB-CD1 4.46Å; E147-L168 HydrophobicContact CG-CD1 3.72Å; V150-L168 HydrophobicContact CB-CG 4.42Å; V150-L168 HydrophobicContact CG2-CD1 4.45Å; V150-L168 HydrophobicContact CG2-CD2 3.51Å; V150-L168 HydrophobicContact CG2-CG 3.78Å; L168-C173 WeakPolarHBondContact CB-SG 3.32Å; L168-C173 PolarHBondContact O-SG 3.21Å; L168-V183 HydrophobicContact CD2-CG1 3.51Å; L168-I185 HydrophobicContact CD2-CG1 4.32Å
169	Y	91.3	Very high	89.3	Confident	15 Å²	15	42 Å²	42	6%	0.059	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	-177.3	167.1	74.9	-88.5	0	0	0	113.2	N184 D186 S241 N244 A247	Y169-N184 HydrophobicContact CD1-CB 4.05Å; Y169-N184 HydrophobicContact CD2-CB 3.96Å; Y169-N184 HydrophobicContact CE1-CB 3.91Å; Y169-N184 HydrophobicContact CE2-CB 3.81Å; Y169-N184 HydrophobicContact CG-CB 4.08Å; Y169-N184 PolarHBondContact N-O 3.2Å; Y169-D186 HydrophobicContact CD1-CB 3.77Å; Y169-D186 HydrophobicContact CE1-CB 3.83Å; Y169-S241 PolarHBondContact OH-OG 2.78Å; Y169-N244 PolarHBondContact OH-ND2 3.46Å; Y169-A247 HydrophobicContact CD2-CB 3.88Å; Y169-A247 HydrophobicContact CE2-CB 3.79Å
170	G	88.5	Confident	89.3	Confident	5 Å²	5	42.6 Å²	42.6	5%	0.052	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	67	-137.5	174.4	0	0	0	0	0	114.9	S172 C173 T174 T251	G170-S172 VanDerWaalsContact C-N 3.27Å; G170-S172 PolarHBondContact O-N 3.32Å; G170-C173 PolarHBondContact O-N 2.8Å; G170-T174 WeakPolarHBondContact O-CG2 3.44Å; G170-T174 PolarHBondContact O-N 2.86Å; G170-T174 PolarHBondContact O-OG1 2.91Å; G170-T251 VanDerWaalsContact N-CG2 3.25Å; G170-T251 PolarHBondContact N-OG1 3.48Å
171	S	88.4	Confident	89.3	Confident	14 Å²	14	39.5 Å²	39.5	10%	0.098	20%	0.196	C	C	.	.	H	α-helix	trans	-48.7	-42.6	-178.7	62.7	0	0	0	0	113.9	C173 T174 K175 D182	S171-C173 PolarHBondContact O-N 3.03Å; S171-T174 WeakPolarHBondContact CA-OG1 3.27Å; S171-T174 PolarHBondContact O-N 3.04Å; S171-T174 PolarHBondContact O-OG1 2.78Å; S171-K175 PolarHBondContact O-N 3.48Å; S171-D182 PolarHBondContact OG-O 2.83Å
172	S	89.4	Confident	89.4	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.007	20%	0.196	C	C	.	.	H	α-helix	trans	-66	-33.2	-173.6	-57.3	0	0	0	0	113.4	R146 G170	R146-S172 PolarHBondContact NH1-OG 3.08Å; G170-S172 VanDerWaalsContact C-N 3.27Å; G170-S172 PolarHBondContact O-N 3.32Å
173	C	88	Confident	89.7	Confident	41 Å²	41	34.6 Å²	34.6	28%	0.277	17%	0.165	S	C	.	.	H	α-helix	trans	-93.2	-21	179.1	-60.3	0	0	0	0	113.1	L168 G170 S171 T251 S255	L168-C173 WeakPolarHBondContact CB-SG 3.32Å; L168-C173 PolarHBondContact O-SG 3.21Å; G170-C173 PolarHBondContact O-N 2.8Å; S171-C173 PolarHBondContact O-N 3.03Å; C173-T251 HydrophobicContact CB-CG2 3.54Å; C173-S255 VanDerWaalsContact O-CB 3.29Å; C173-S255 WeakPolarHBondContact O-CB 2.96Å; C173-S255 PolarHBondContact O-OG 2.79Å
174	T	88.8	Confident	89.8	Confident	7 Å²	7	29.3 Å²	29.3	4%	0.043	14%	0.141	C	C	.	.	H	α-helix	trans	-95.5	-19.8	-176.4	52.8	0	0	0	0	113.5	G170 S171 F176 T251 L254	G170-T174 WeakPolarHBondContact O-CG2 3.44Å; G170-T174 PolarHBondContact O-N 2.86Å; G170-T174 PolarHBondContact O-OG1 2.91Å; S171-T174 WeakPolarHBondContact CA-OG1 3.27Å; S171-T174 PolarHBondContact O-N 3.04Å; S171-T174 PolarHBondContact O-OG1 2.78Å; T174-F176 HydrophobicContact CG2-CD2 4.35Å; T174-F176 PolarHBondContact O-N 2.9Å; T174-F176 VanDerWaalsContact O-N 3.16Å; T174-T251 HydrophobicContact CG2-CG2 4.09Å; T174-L254 HydrophobicContact CG2-CB 3.57Å
175	K	89.4	Confident	90	Very high	50 Å²	50	29 Å²	29	22%	0.217	14%	0.139	C	C	.	.	S	Bend	trans	60.3	11.1	-170.2	-53.2	178.2	-170.7	173.1	0	114.2	D140 V143 S171 G177 L265	D140-K175 WeakPolarHBondContact OD1-CE 3.47Å; D140-K175 IonicContact OD1-NZ 2.88Å; D140-K175 PolarHBondContact OD1-NZ 3.1Å; V143-K175 HydrophobicContact CG2-CG 4.12Å; S171-K175 PolarHBondContact O-N 3.48Å; K175-G177 PolarHBondContact O-N 2.71Å; K175-L265 HydrophobicContact CB-CD1 4.14Å; K175-L265 VanDerWaalsContact O-CD1 3.29Å; K175-L265 WeakPolarHBondContact O-CD1 3.37Å
176	F	89.4	Confident	90.1	Very high	14 Å²	14	21 Å²	21	6%	0.061	11%	0.109	C	C	.	.			trans	-77.4	0.6	165.7	-54.1	-27.3	0	0	0	112.1	T174 L254 A258 L264 L265 V268 R272 A294	T174-F176 HydrophobicContact CG2-CD2 4.35Å; T174-F176 PolarHBondContact O-N 2.9Å; T174-F176 VanDerWaalsContact O-N 3.16Å; F176-L254 HydrophobicContact CE2-CB 4.09Å; F176-L254 HydrophobicContact CE2-CD2 4.38Å; F176-A258 HydrophobicContact CE1-CB 3.91Å; F176-A258 HydrophobicContact CZ-CB 3.79Å; F176-L264 HydrophobicContact CE1-CG 4.26Å; F176-L264 HydrophobicContact CZ-CD2 3.8Å; F176-L264 HydrophobicContact CZ-CG 3.87Å; F176-L265 HydrophobicContact CD1-CD1 3.91Å; F176-L265 HydrophobicContact CE1-CD1 4.21Å; F176-V268 HydrophobicContact CB-CG1 3.84Å; F176-V268 HydrophobicContact CD1-CB 3.89Å; F176-V268 HydrophobicContact CD1-CG1 3.73Å; F176-V268 HydrophobicContact CD1-CG2 4.42Å; F176-V268 HydrophobicContact CD2-CG1 3.9Å; F176-V268 HydrophobicContact CE1-CB 4.06Å; F176-V268 HydrophobicContact CE1-CG1 4.25Å; F176-V268 HydrophobicContact CE1-CG2 4.14Å; F176-V268 HydrophobicContact CE2-CG1 4.39Å; F176-V268 HydrophobicContact CE2-CG2 4.49Å; F176-V268 HydrophobicContact CG-CB 4.24Å; F176-V268 HydrophobicContact CG-CG1 3.55Å; F176-V268 HydrophobicContact CZ-CG2 4.18Å; F176-R272 PolarHBondContact O-NH1 3.4Å; F176-R272 VanDerWaalsContact O-NH1 3.1Å; F176-A294 HydrophobicContact CD2-CB 3.91Å; F176-A294 HydrophobicContact CE2-CB 3.96Å
177	G	87.2	Confident	90.1	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.106	C	C	.	.	S	Bend	trans	-72.5	155.2	166.5	0	0	0	0	0	113.5	M138 K175	M138-G177 PolarHBondContact N-O 2.88Å; K175-G177 PolarHBondContact O-N 2.71Å
178	F	89.8	Confident	90.1	Very high	4 Å²	4	22.7 Å²	22.7	2%	0.018	12%	0.117	C	C	.	.	B	Isolated β-bridge	trans	-93	169.9	160.7	-56.4	-58.7	0	0	0	108.3	H136 M138 D180 S181 L269 R272 H273 Q276	H136-F178 HydrophobicContact CB-CD1 3.68Å; H136-F178 HydrophobicContact CB-CE1 4.09Å; H136-F178 HydrophobicContact CB-CG 4.45Å; H136-F178 VanDerWaalsContact O-CA 3.23Å; H136-F178 WeakPolarHBondContact O-CA 3.46Å; H136-F178 WeakPolarHBondContact O-CB 3.38Å; M138-F178 WeakPolarHBondContact CE-O 3.35Å; F178-D180 VanDerWaalsContact C-N 3.25Å; F178-D180 WeakPolarHBondContact CB-OD1 2.97Å; F178-D180 PolarHBondContact O-N 3.06Å; F178-S181 PolarHBondContact N-OG 3.4Å; F178-S181 VanDerWaalsContact N-OG 3.12Å; F178-S181 PolarHBondContact O-N 3.45Å; F178-L269 HydrophobicContact CD1-CD2 4.01Å; F178-L269 HydrophobicContact CE1-CD2 3.72Å; F178-L269 HydrophobicContact CZ-CD2 4.45Å; F178-R272 VanDerWaalsContact CD2-CZ 3.42Å; F178-R272 HydrophobicContact CE2-CB 4.3Å; F178-R272 HydrophobicContact CE2-CG 3.73Å; F178-R272 VanDerWaalsContact CE2-CZ 3.45Å; F178-R272 HydrophobicContact CZ-CB 3.9Å; F178-R272 HydrophobicContact CZ-CG 3.87Å; F178-H273 HydrophobicContact CE1-CB 4.23Å; F178-H273 HydrophobicContact CZ-CB 3.89Å; F178-Q276 HydrophobicContact CE2-CG 4.27Å
179	K	87.6	Confident	90	Very high	84 Å²	84	25 Å²	25	37%	0.365	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-36.3	-172.5	-66.2	165.4	-171.1	171.2	0	113	H134 E135 H136 G137 R146	H134-K179 PolarHBondContact O-NZ 2.97Å; E135-K179 WeakPolarHBondContact O-CE 3.44Å; E135-K179 PolarHBondContact O-NZ 3.48Å; H136-K179 PolarHBondContact O-N 3.49Å; H136-K179 VanDerWaalsContact O-N 3.14Å; G137-K179 WeakPolarHBondContact O-CE 3.36Å; R146-K179 PolarHBondContact NH2-O 3.1Å
180	D	86	Confident	89.9	Confident	112 Å²	112	25.2 Å²	25.2	60%	0.599	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-27.2	178.3	54.2	10	0	0	0	115.3	F178 L236	F178-D180 VanDerWaalsContact C-N 3.25Å; F178-D180 WeakPolarHBondContact CB-OD1 2.97Å; F178-D180 PolarHBondContact O-N 3.06Å; D180-L236 WeakPolarHBondContact O-CD2 3.44Å
181	S	88.9	Confident	89.7	Confident	13 Å²	13	31.7 Å²	31.7	9%	0.091	17%	0.169	C	C	.	.	S	Bend	trans	-63.3	145.8	-162.1	-61.5	0	0	0	0	112.3	R146 F178 R272	R146-S181 PolarHBondContact NH1-O 3.17Å; R146-S181 PolarHBondContact NH2-O 2.74Å; F178-S181 PolarHBondContact N-OG 3.4Å; F178-S181 VanDerWaalsContact N-OG 3.12Å; F178-S181 PolarHBondContact O-N 3.45Å; S181-R272 PolarHBondContact OG-NH1 2.9Å; S181-R272 PolarHBondContact OG-NH2 2.74Å
182	D	90.4	Very high	89.6	Confident	16 Å²	16	36.7 Å²	36.7	9%	0.086	19%	0.191	C	C	.	.			trans	-43.9	148.3	-174.6	-61.1	-48.6	0	0	0	115.7	R146 S171 K239	R146-D182 PolarHBondContact NH1-O 3.37Å; S171-D182 PolarHBondContact OG-O 2.83Å; D182-K239 HydrophobicContact CB-CD 4.14Å; D182-K239 IonicContact OD1-NZ 3.74Å; D182-K239 WeakPolarHBondContact OD2-CE 3.47Å; D182-K239 IonicContact OD2-NZ 2.74Å; D182-K239 PolarHBondContact OD2-NZ 3.2Å
183	V	91.8	Very high	89.4	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	96.6	170.7	-168.6	0	0	0	0	109.2	R146 L149 V150 L168 I185 L236 I237 C238 K239	R146-V183 HydrophobicContact CB-CG1 4.34Å; R146-V183 HydrophobicContact CG-CG1 4.5Å; R146-V183 HydrophobicContact CG-CG2 4Å; L149-V183 HydrophobicContact CD2-CG1 4.42Å; V150-V183 HydrophobicContact CG2-CG1 4.49Å; L168-V183 HydrophobicContact CD2-CG1 3.51Å; V183-I185 HydrophobicContact CG1-CD1 4.23Å; V183-I185 HydrophobicContact CG1-CG1 4.05Å; V183-L236 HydrophobicContact CG2-CB 3.95Å; V183-L236 HydrophobicContact CG2-CD1 3.82Å; V183-L236 HydrophobicContact CG2-CG 4.4Å; V183-I237 PolarHBondContact N-O 2.92Å; V183-C238 WeakPolarHBondContact O-CA 3.34Å; V183-K239 PolarHBondContact O-N 2.72Å
184	N	92.6	Very high	89.2	Confident	11 Å²	11	42.6 Å²	42.6	6%	0.059	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	121	177.9	-69.5	-18.9	0	0	0	110.8	Y169 E582	Y169-N184 HydrophobicContact CD1-CB 4.05Å; Y169-N184 HydrophobicContact CD2-CB 3.96Å; Y169-N184 HydrophobicContact CE1-CB 3.91Å; Y169-N184 HydrophobicContact CE2-CB 3.81Å; Y169-N184 HydrophobicContact CG-CB 4.08Å; Y169-N184 PolarHBondContact N-O 3.2Å; N184-E582 PolarHBondContact ND2-OE1 2.91Å; N184-E582 VanDerWaalsContact ND2-OE1 3.13Å
185	I	93.6	Very high	89.1	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	133.8	-173.6	-53.8	168	0	0	0	108.3	L149 V150 M153 L166 L168 V183 C238 K239 V240 S241	L149-I185 HydrophobicContact CD2-CD1 4.2Å; V150-I185 HydrophobicContact CG1-CG2 4.47Å; V150-I185 HydrophobicContact CG2-CD1 3.69Å; V150-I185 HydrophobicContact CG2-CG1 3.71Å; V150-I185 HydrophobicContact CG2-CG2 4.41Å; M153-I185 HydrophobicContact CE-CD1 3.79Å; M153-I185 HydrophobicContact SD-CD1 3.66Å; L166-I185 HydrophobicContact CB-CG2 4.16Å; L166-I185 HydrophobicContact CD1-CG2 4.28Å; L166-I185 HydrophobicContact CD2-CG2 4.09Å; L166-I185 HydrophobicContact CG-CG2 4.41Å; L168-I185 HydrophobicContact CD2-CG1 4.32Å; V183-I185 HydrophobicContact CG1-CD1 4.23Å; V183-I185 HydrophobicContact CG1-CG1 4.05Å; I185-C238 HydrophobicContact CD1-CB 4.19Å; I185-K239 PolarHBondContact N-O 3.12Å; I185-V240 HydrophobicContact CB-CG2 4.43Å; I185-V240 HydrophobicContact CD1-CG2 4.3Å; I185-V240 CarbonylContact O-C 3.02Å; I185-V240 WeakPolarHBondContact O-CA 3.38Å; I185-S241 PolarHBondContact O-N 3.21Å; I185-S241 PolarHBondContact O-OG 3.03Å
186	D	94.1	Very high	88.9	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	136.5	174.9	-175.5	59.2	0	0	0	111.5	L166 R167 Y169 S241 A242 G243 N244	L166-D186 CarbonylContact C-O 3.58Å; L166-D186 WeakPolarHBondContact CA-O 3.34Å; R167-D186 HydrophobicContact CG-CB 3.93Å; R167-D186 WeakPolarHBondContact CG-O 3.48Å; R167-D186 IonicContact CZ-OD2 3.88Å; R167-D186 PolarHBondContact N-O 3.45Å; R167-D186 IonicContact NE-OD2 3.28Å; R167-D186 PolarHBondContact NE-OD2 3.16Å; R167-D186 IonicContact NH2-OD2 3.36Å; R167-D186 PolarHBondContact NH2-OD2 3.02Å; R167-D186 PolarHBondContact O-N 3.38Å; Y169-D186 HydrophobicContact CD1-CB 3.77Å; Y169-D186 HydrophobicContact CE1-CB 3.83Å; D186-S241 CarbonylContact C-O 3.45Å; D186-S241 WeakPolarHBondContact CA-O 3.25Å; D186-S241 PolarHBondContact OD1-OG 2.9Å; D186-A242 VanDerWaalsContact OD1-C 3.27Å; D186-A242 WeakPolarHBondContact OD1-CA 3.25Å; D186-A242 PolarHBondContact OD1-N 3.1Å; D186-G243 PolarHBondContact OD1-N 2.96Å; D186-G243 VanDerWaalsContact OD1-N 3.13Å; D186-N244 VanDerWaalsContact OD1-CB 3.22Å; D186-N244 WeakPolarHBondContact OD1-CB 3.22Å; D186-N244 PolarHBondContact OD1-N 3.45Å; D186-N244 PolarHBondContact OD2-N 3.18Å
187	I	93.3	Very high	88.7	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	117.1	175.1	-57.2	159.4	0	0	0	109.3	I164 L166 V198 L199 V202 V240 S241 A242 G243	I164-I187 HydrophobicContact CB-CG2 3.83Å; I164-I187 HydrophobicContact CD1-CG2 3.78Å; I164-I187 HydrophobicContact CG1-CG2 4.43Å; I164-I187 HydrophobicContact CG2-CG2 3.93Å; L166-I187 HydrophobicContact CD2-CB 4.36Å; L166-I187 HydrophobicContact CD2-CG1 3.53Å; I187-V198 HydrophobicContact CD1-CG1 4.04Å; I187-V198 HydrophobicContact CG2-CG1 3.97Å; I187-L199 HydrophobicContact CD1-CD2 4.11Å; I187-V202 HydrophobicContact CD1-CB 4.39Å; I187-V202 HydrophobicContact CD1-CG1 4.26Å; I187-V202 HydrophobicContact CD1-CG2 3.54Å; I187-V240 HydrophobicContact CD1-CG1 3.62Å; I187-V240 HydrophobicContact CG1-CG1 3.86Å; I187-S241 WeakPolarHBondContact CG1-O 3.16Å; I187-S241 PolarHBondContact N-O 3.3Å; I187-A242 HydrophobicContact CB-CB 3.96Å; I187-A242 HydrophobicContact CD1-CB 4.28Å; I187-A242 WeakPolarHBondContact O-CA 3.28Å; I187-G243 PolarHBondContact O-N 3.5Å
188	Q	91.9	Very high	88.8	Confident	69 Å²	69	43.5 Å²	43.5	32%	0.322	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	127.8	160	-59	-173.5	-45.4	0	0	109	I164 R165	I164-Q188 VanDerWaalsContact CA-O 3.32Å; I164-Q188 WeakPolarHBondContact CA-O 3.3Å; I164-Q188 WeakPolarHBondContact CB-O 3.38Å; R165-Q188 HydrophobicContact CB-CB 4.36Å; R165-Q188 PolarHBondContact N-O 2.97Å; R165-Q188 WeakPolarHBondContact O-CB 2.76Å; R165-Q188 PolarHBondContact O-N 3.38Å
189	Y	90.6	Very high	88.8	Confident	68 Å²	68	43.3 Å²	43.3	27%	0.267	22%	0.221	S	C	.	.			trans	-131	154	178.6	58.4	-94.7	0	0	0	110.4	M193 V198 A242	Y189-M193 HydrophobicContact CD2-CB 4.01Å; Y189-M193 VanDerWaalsContact CE2-O 3.27Å; Y189-M193 WeakPolarHBondContact CE2-O 3.48Å; Y189-V198 HydrophobicContact CD1-CG1 4.47Å; Y189-V198 HydrophobicContact CD1-CG2 4.39Å; Y189-V198 HydrophobicContact CD2-CG2 4.48Å; Y189-V198 HydrophobicContact CG-CG2 4.08Å; Y189-A242 HydrophobicContact CD1-CB 3.99Å; Y189-A242 HydrophobicContact CE1-CB 3.75Å
190	P	88.6	Confident	88.8	Confident	21 Å²	21	41.8 Å²	41.8	14%	0.136	22%	0.217	C	C	.	.			trans	-71.2	154.6	-178.1	29.2	-36.8	0	0	0	112.5	E163 H192 M193	E163-P190 HydrophobicContact CB-CG 4.03Å; P190-H192 WeakPolarHBondContact CG-CE1 3Å; P190-H192 PolarHBondContact O-N 3.34Å; P190-M193 HydrophobicContact CG-CE 3.97Å; P190-M193 HydrophobicContact CG-CG 4.05Å; P190-M193 HydrophobicContact CG-SD 3.92Å; P190-M193 PolarHBondContact O-N 3.01Å
191	P	84.8	Confident	89	Confident	140 Å²	140	38.5 Å²	38.5	91%	0.909	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-3.5	-173.8	-23.9	34.7	0	0	0	116.9
192	H	84.8	Confident	89.1	Confident	120 Å²	120	37.9 Å²	37.9	56%	0.556	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-8.4	175.9	71.6	-109.9	0	0	0	113.2	E163 P190	E163-H192 IonicContact OE1-CE1 3.19Å; E163-H192 IonicContact OE2-CE1 2.69Å; P190-H192 WeakPolarHBondContact CG-CE1 3Å; P190-H192 PolarHBondContact O-N 3.34Å
193	M	85.6	Confident	89.1	Confident	41 Å²	41	40.3 Å²	40.3	20%	0.202	21%	0.206	C	C	.	.	S	Bend	trans	-100.2	147.2	174.1	-62.7	-179.2	-177.4	0	0	110.2	E163 Y189 P190 V198	E163-M193 HydrophobicContact CB-CE 4.45Å; Y189-M193 HydrophobicContact CD2-CB 4.01Å; Y189-M193 VanDerWaalsContact CE2-O 3.27Å; Y189-M193 WeakPolarHBondContact CE2-O 3.48Å; P190-M193 HydrophobicContact CG-CE 3.97Å; P190-M193 HydrophobicContact CG-CG 4.05Å; P190-M193 HydrophobicContact CG-SD 3.92Å; P190-M193 PolarHBondContact O-N 3.01Å; M193-V198 HydrophobicContact CB-CG2 3.95Å; M193-V198 HydrophobicContact SD-CG2 4.17Å
194	H	83.8	Confident	88.9	Confident	124 Å²	124	46.4 Å²	46.4	57%	0.574	24%	0.235	S	C	*	.			trans	-100.2	149.7	172.9	-58	-70.4	0	0	0	111.6	P196 D197 V198	H194-P196 VanDerWaalsContact C-CD 3.44Å; H194-D197 IonicContact CD2-OD2 3.5Å; H194-D197 PolarHBondContact O-N 2.93Å; H194-V198 WeakPolarHBondContact O-CG2 3.38Å; H194-V198 PolarHBondContact O-N 3.33Å
195	Q	87.5	Confident	88.8	Confident	10 Å²	10	46.5 Å²	46.5	5%	0.047	24%	0.237	C	C	.	.	H	α-helix	trans	-53.6	-41.4	-178.1	-162.8	-166.8	41.1	0	0	114.1	L199 A242	Q195-L199 HydrophobicContact CG-CD1 4.08Å; Q195-L199 PolarHBondContact O-N 3.08Å; Q195-L199 VanDerWaalsContact O-N 3.15Å; Q195-A242 HydrophobicContact CG-CB 4.03Å; Q195-A242 PolarHBondContact NE2-O 3.02Å
196	P	85.6	Confident	88.7	Confident	3 Å²	3	46.5 Å²	46.5	2%	0.019	24%	0.237	C	C	.	.	H	α-helix	trans	-68.2	-43.4	-178.1	-20.9	35.1	0	0	0	113.3	H194 V198 L199 L200 F955 Q958	H194-P196 VanDerWaalsContact C-CD 3.44Å; P196-V198 VanDerWaalsContact C-N 3.33Å; P196-V198 PolarHBondContact O-N 2.79Å; P196-L199 PolarHBondContact O-N 3.32Å; P196-L200 PolarHBondContact O-N 3.29Å; P196-F955 HydrophobicContact CB-CD1 3.93Å; P196-F955 HydrophobicContact CB-CD2 4.26Å; P196-F955 HydrophobicContact CB-CE1 3.79Å; P196-F955 HydrophobicContact CB-CE2 4.1Å; P196-F955 HydrophobicContact CB-CG 4.18Å; P196-F955 HydrophobicContact CB-CZ 3.9Å; P196-F955 HydrophobicContact CG-CE2 4.33Å; P196-F955 HydrophobicContact CG-CZ 4.49Å; P196-F955 WeakPolarHBondContact CG-O 3.26Å; P196-F955 WeakPolarHBondContact O-CE1 3.37Å; P196-Q958 HydrophobicContact CG-CG 3.92Å
197	D	85	Confident	88.5	Confident	74 Å²	74	49.7 Å²	49.7	40%	0.396	26%	0.259	S	S	.	.	H	α-helix	trans	-61.5	-44.2	-179.6	-52	-45.2	0	0	0	110.7	H194 L199 L200 V201	H194-D197 IonicContact CD2-OD2 3.5Å; H194-D197 PolarHBondContact O-N 2.93Å; D197-L199 PolarHBondContact O-N 2.97Å; D197-L200 PolarHBondContact O-N 2.89Å; D197-V201 VanDerWaalsContact O-CG2 3.31Å; D197-V201 WeakPolarHBondContact O-CG2 3.3Å; D197-V201 PolarHBondContact O-N 3.38Å; D197-V201 VanDerWaalsContact O-N 3.07Å
198	V	88.8	Confident	88.3	Confident	3 Å²	3	57.5 Å²	57.5	2%	0.018	30%	0.296	C	S	.	.	H	α-helix	trans	-58.7	-47.7	175.2	172.4	0	0	0	0	111	L161 I187 Y189 M193 H194 P196 V201 V202 A242	L161-V198 HydrophobicContact CD1-CG1 4.24Å; I187-V198 HydrophobicContact CD1-CG1 4.04Å; I187-V198 HydrophobicContact CG2-CG1 3.97Å; Y189-V198 HydrophobicContact CD1-CG1 4.47Å; Y189-V198 HydrophobicContact CD1-CG2 4.39Å; Y189-V198 HydrophobicContact CD2-CG2 4.48Å; Y189-V198 HydrophobicContact CG-CG2 4.08Å; M193-V198 HydrophobicContact CB-CG2 3.95Å; M193-V198 HydrophobicContact SD-CG2 4.17Å; H194-V198 WeakPolarHBondContact O-CG2 3.38Å; H194-V198 PolarHBondContact O-N 3.33Å; P196-V198 VanDerWaalsContact C-N 3.33Å; P196-V198 PolarHBondContact O-N 2.79Å; V198-V201 PolarHBondContact O-N 2.87Å; V198-V202 HydrophobicContact CG1-CG2 4.39Å; V198-V202 WeakPolarHBondContact O-CB 3.48Å; V198-V202 WeakPolarHBondContact O-CG2 3.37Å; V198-V202 PolarHBondContact O-N 3.13Å; V198-A242 HydrophobicContact CG1-CB 4.27Å
199	L	90.1	Very high	88.1	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-75	-28.2	-176.2	-73.5	172.2	0	0	0	113.8	I187 Q195 P196 D197 K203 F219 P224 V226 A242 F955	I187-L199 HydrophobicContact CD1-CD2 4.11Å; Q195-L199 HydrophobicContact CG-CD1 4.08Å; Q195-L199 PolarHBondContact O-N 3.08Å; Q195-L199 VanDerWaalsContact O-N 3.15Å; P196-L199 PolarHBondContact O-N 3.32Å; D197-L199 PolarHBondContact O-N 2.97Å; L199-K203 WeakPolarHBondContact O-CB 3.48Å; L199-K203 PolarHBondContact O-N 3.27Å; L199-F219 HydrophobicContact CB-CE1 4.03Å; L199-P224 HydrophobicContact CD1-CB 3.87Å; L199-P224 WeakPolarHBondContact CD1-O 3.45Å; L199-V226 HydrophobicContact CD2-CG2 4.29Å; L199-V226 WeakPolarHBondContact O-CG2 3.33Å; L199-A242 HydrophobicContact CD1-CB 4.11Å; L199-A242 HydrophobicContact CD2-CB 3.98Å; L199-A242 HydrophobicContact CG-CB 3.88Å; L199-F955 HydrophobicContact CB-CE1 4.02Å; L199-F955 HydrophobicContact CB-CZ 3.91Å; L199-F955 HydrophobicContact CD1-CZ 4.02Å
200	L	87.8	Confident	88	Confident	53 Å²	53	55.1 Å²	55.1	28%	0.277	30%	0.295	S	S	.	.	H	α-helix	trans	-65.3	-50.6	168.5	-79.3	-173.4	0	0	0	111.7	P196 D197 V202 K203 E204 F219 F955 N956	P196-L200 PolarHBondContact O-N 3.29Å; D197-L200 PolarHBondContact O-N 2.89Å; L200-V202 PolarHBondContact O-N 3.36Å; L200-K203 WeakPolarHBondContact O-CB 3.15Å; L200-K203 PolarHBondContact O-N 3.12Å; L200-K203 VanDerWaalsContact O-N 3.07Å; L200-E204 PolarHBondContact O-N 2.75Å; L200-F219 HydrophobicContact CD2-CE2 3.59Å; L200-F219 HydrophobicContact CD2-CZ 3.89Å; L200-F955 HydrophobicContact CD2-CD1 4.28Å; L200-F955 HydrophobicContact CG-CD1 4.21Å; L200-F955 HydrophobicContact CG-CE1 4.36Å; L200-N956 WeakPolarHBondContact CD1-ND2 3.44Å; L200-N956 WeakPolarHBondContact CD1-OD1 3.5Å
201	V	88.9	Confident	87.8	Confident	42 Å²	42	59 Å²	59	26%	0.255	31%	0.307	S	S	.	.	H	α-helix	trans	-61	-36.2	179.1	171.9	0	0	0	0	111	V160 L161 D197 V198 E204 A205	V160-V201 HydrophobicContact CB-CG1 4.18Å; V160-V201 HydrophobicContact CG1-CG1 3.47Å; V160-V201 VanDerWaalsContact CG1-CG1 3.47Å; L161-V201 HydrophobicContact CD1-CB 4.37Å; L161-V201 HydrophobicContact CD1-CG1 3.98Å; L161-V201 HydrophobicContact CD2-CG1 4.02Å; L161-V201 HydrophobicContact CG-CG1 3.84Å; D197-V201 VanDerWaalsContact O-CG2 3.31Å; D197-V201 WeakPolarHBondContact O-CG2 3.3Å; D197-V201 PolarHBondContact O-N 3.38Å; D197-V201 VanDerWaalsContact O-N 3.07Å; V198-V201 PolarHBondContact O-N 2.87Å; V201-E204 PolarHBondContact O-N 3.16Å; V201-A205 VanDerWaalsContact O-CB 3.27Å; V201-A205 WeakPolarHBondContact O-CB 3.38Å; V201-A205 PolarHBondContact O-N 3.35Å
202	V	91	Very high	88.1	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-66.3	-42.3	173.4	168.2	0	0	0	0	112	L157 L161 I187 V198 L200 E204 L206 V226 V240	L157-V202 HydrophobicContact CD1-CG1 4.32Å; L157-V202 HydrophobicContact CD1-CG2 4.18Å; L157-V202 HydrophobicContact CD2-CB 4.28Å; L157-V202 HydrophobicContact CD2-CG1 4.24Å; L157-V202 HydrophobicContact CD2-CG2 3.98Å; L161-V202 HydrophobicContact CD1-CG2 4.15Å; I187-V202 HydrophobicContact CD1-CB 4.39Å; I187-V202 HydrophobicContact CD1-CG1 4.26Å; I187-V202 HydrophobicContact CD1-CG2 3.54Å; V198-V202 HydrophobicContact CG1-CG2 4.39Å; V198-V202 WeakPolarHBondContact O-CB 3.48Å; V198-V202 WeakPolarHBondContact O-CG2 3.37Å; V198-V202 PolarHBondContact O-N 3.13Å; L200-V202 PolarHBondContact O-N 3.36Å; V202-E204 VanDerWaalsContact C-N 3.34Å; V202-E204 PolarHBondContact O-N 3.33Å; V202-L206 HydrophobicContact CG1-CD1 3.66Å; V202-L206 HydrophobicContact CG1-CG 4.24Å; V202-L206 VanDerWaalsContact O-CB 3.28Å; V202-L206 WeakPolarHBondContact O-CB 3.16Å; V202-L206 WeakPolarHBondContact O-CG 3.43Å; V202-L206 PolarHBondContact O-N 2.96Å; V202-V226 HydrophobicContact CG1-CB 4.41Å; V202-V226 HydrophobicContact CG1-CG2 4.28Å; V202-V240 HydrophobicContact CG1-CG1 4.19Å
203	K	90.4	Very high	88.3	Confident	68 Å²	68	48.3 Å²	48.3	30%	0.296	25%	0.249	S	C	.	.	H	α-helix	trans	-58.9	-46.5	175.3	-173.4	-172.3	-177.3	176.1	0	111	L199 L200 S207 V215 A217 F219 V226	L199-K203 WeakPolarHBondContact O-CB 3.48Å; L199-K203 PolarHBondContact O-N 3.27Å; L200-K203 WeakPolarHBondContact O-CB 3.15Å; L200-K203 PolarHBondContact O-N 3.12Å; L200-K203 VanDerWaalsContact O-N 3.07Å; K203-S207 WeakPolarHBondContact O-CB 3.39Å; K203-S207 PolarHBondContact O-N 3.4Å; K203-S207 PolarHBondContact O-OG 3.32Å; K203-V215 HydrophobicContact CG-CG1 4.43Å; K203-A217 HydrophobicContact CD-CB 3.74Å; K203-A217 HydrophobicContact CG-CB 4.32Å; K203-F219 HydrophobicContact CD-CE2 4.26Å; K203-F219 HydrophobicContact CD-CZ 4.14Å; K203-V226 HydrophobicContact CB-CG1 4.36Å; K203-V226 HydrophobicContact CB-CG2 3.99Å
204	E	89.4	Confident	88.3	Confident	128 Å²	128	51.2 Å²	51.2	60%	0.598	27%	0.265	S	S	*	.	H	α-helix	trans	-63.5	-54.8	179.1	-169.3	165.8	-143.4	0	0	111.2	L200 V201 V202 L206 S207 E208	L200-E204 PolarHBondContact O-N 2.75Å; V201-E204 PolarHBondContact O-N 3.16Å; V202-E204 VanDerWaalsContact C-N 3.34Å; V202-E204 PolarHBondContact O-N 3.33Å; E204-L206 VanDerWaalsContact C-N 3.31Å; E204-L206 PolarHBondContact O-N 3.45Å; E204-S207 WeakPolarHBondContact O-CB 3.25Å; E204-S207 PolarHBondContact O-N 3.34Å; E204-E208 PolarHBondContact O-N 2.89Å; E204-E208 VanDerWaalsContact O-N 3.08Å
205	A	89.9	Confident	88.5	Confident	12 Å²	12	46.7 Å²	46.7	10%	0.099	25%	0.246	C	C	.	.	H	α-helix	trans	-62.7	-31.4	-179.4	0	0	0	0	0	114.2	L157 V160 V201 S209	L157-A205 HydrophobicContact CD2-CB 3.92Å; V160-A205 HydrophobicContact CG2-CB 4.01Å; V201-A205 VanDerWaalsContact O-CB 3.27Å; V201-A205 WeakPolarHBondContact O-CB 3.38Å; V201-A205 PolarHBondContact O-N 3.35Å; A205-S209 WeakPolarHBondContact O-CB 3.09Å
206	L	90.7	Very high	88.5	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-76.1	-31.9	172.7	-68.2	176.5	0	0	0	112.2	M153 L157 V202 E204 S209 F212 V215 V226 V240	M153-L206 HydrophobicContact CE-CD1 4.42Å; M153-L206 HydrophobicContact CE-CD2 4.24Å; M153-L206 HydrophobicContact CG-CD2 4.05Å; M153-L206 HydrophobicContact SD-CD2 4.49Å; L157-L206 HydrophobicContact CD2-CD2 4.43Å; L157-L206 HydrophobicContact CD2-CG 4.34Å; V202-L206 HydrophobicContact CG1-CD1 3.66Å; V202-L206 HydrophobicContact CG1-CG 4.24Å; V202-L206 VanDerWaalsContact O-CB 3.28Å; V202-L206 WeakPolarHBondContact O-CB 3.16Å; V202-L206 WeakPolarHBondContact O-CG 3.43Å; V202-L206 PolarHBondContact O-N 2.96Å; E204-L206 VanDerWaalsContact C-N 3.31Å; E204-L206 PolarHBondContact O-N 3.45Å; L206-S209 WeakPolarHBondContact O-CB 3.32Å; L206-S209 PolarHBondContact O-N 3.17Å; L206-F212 HydrophobicContact CD2-CD2 3.67Å; L206-F212 HydrophobicContact CD2-CE2 3.73Å; L206-F212 HydrophobicContact CD2-CG 4.4Å; L206-V215 HydrophobicContact CB-CG1 4Å; L206-V215 HydrophobicContact CB-CG2 4.38Å; L206-V226 HydrophobicContact CD1-CG1 4.04Å; L206-V240 HydrophobicContact CD1-CG2 4.35Å
207	S	90	Very high	88.4	Confident	67 Å²	67	53.3 Å²	53.3	47%	0.469	28%	0.281	S	S	.	.	H	α-helix	trans	-68.5	-37.1	177.6	-60.7	0	0	0	0	112.5	K203 E204 S209 V215	K203-S207 WeakPolarHBondContact O-CB 3.39Å; K203-S207 PolarHBondContact O-N 3.4Å; K203-S207 PolarHBondContact O-OG 3.32Å; E204-S207 WeakPolarHBondContact O-CB 3.25Å; E204-S207 PolarHBondContact O-N 3.34Å; S207-S209 VanDerWaalsContact C-N 3.26Å; S207-S209 PolarHBondContact O-N 3.46Å; S207-V215 WeakPolarHBondContact OG-CG1 3.37Å
208	E	89.8	Confident	88.2	Confident	164 Å²	164	52 Å²	52	77%	0.766	28%	0.275	S	S	*	.	S	Bend	trans	-76	-12	174.1	-61.9	-164.5	141.3	0	0	113.4	E204	E204-E208 PolarHBondContact O-N 2.89Å; E204-E208 VanDerWaalsContact O-N 3.08Å
209	S	87.4	Confident	87.8	Confident	7 Å²	7	52.1 Å²	52.1	5%	0.049	28%	0.275	C	S	.	.			trans	-79.1	128.5	-169.6	-175.8	0	0	0	0	113.8	A205 L206 S207 Y211 F212	A205-S209 WeakPolarHBondContact O-CB 3.09Å; L206-S209 WeakPolarHBondContact O-CB 3.32Å; L206-S209 PolarHBondContact O-N 3.17Å; S207-S209 VanDerWaalsContact C-N 3.26Å; S207-S209 PolarHBondContact O-N 3.46Å; S209-Y211 PolarHBondContact O-N 3.01Å; S209-F212 PolarHBondContact O-N 2.71Å
210	P	87.5	Confident	86.8	Confident	81 Å²	81	55.6 Å²	55.6	53%	0.526	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	7.3	177.9	33.7	-37.9	0	0	0	113.9	K232	P210-K232 VanDerWaalsContact O-CE 3.23Å; P210-K232 WeakPolarHBondContact O-CE 3.48Å; P210-K232 PolarHBondContact O-NZ 3.41Å
211	Y	86.3	Confident	85.8	Confident	102 Å²	102	53.7 Å²	53.7	40%	0.4	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-21.8	178.2	-63.7	-80.9	0	0	0	113.2	V152 V156 S209 R231 K232	V152-Y211 HydrophobicContact CG1-CD1 4.01Å; V152-Y211 HydrophobicContact CG1-CD2 4.39Å; V152-Y211 HydrophobicContact CG1-CE1 4.41Å; V152-Y211 HydrophobicContact CG1-CG 4.01Å; V156-Y211 HydrophobicContact CG2-CD2 4.16Å; S209-Y211 PolarHBondContact O-N 3.01Å; Y211-R231 VanDerWaalsContact O-CB 3.3Å; Y211-R231 WeakPolarHBondContact O-CB 3.35Å; Y211-R231 PolarHBondContact O-N 3.45Å; Y211-K232 HydrophobicContact CD1-CD 3.95Å; Y211-K232 HydrophobicContact CE1-CD 4.27Å; Y211-K232 VanDerWaalsContact CE1-NZ 3.34Å
212	F	89.2	Confident	84.7	Confident	3 Å²	3	58.8 Å²	58.8	1%	0.013	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	168.8	-176	-58.8	-75.8	0	0	0	111.2	M153 L206 S209 V215 C228 K229 R231	M153-F212 HydrophobicContact CB-CZ 4.06Å; M153-F212 HydrophobicContact CE-CD1 4.41Å; M153-F212 HydrophobicContact CE-CE1 3.65Å; M153-F212 HydrophobicContact CE-CE2 4.29Å; M153-F212 HydrophobicContact CE-CZ 3.58Å; M153-F212 HydrophobicContact CG-CE2 4.46Å; M153-F212 HydrophobicContact CG-CZ 4.23Å; L206-F212 HydrophobicContact CD2-CD2 3.67Å; L206-F212 HydrophobicContact CD2-CE2 3.73Å; L206-F212 HydrophobicContact CD2-CG 4.4Å; S209-F212 PolarHBondContact O-N 2.71Å; F212-V215 HydrophobicContact CB-CG2 4.42Å; F212-C228 HydrophobicContact CB-CB 4.31Å; F212-C228 HydrophobicContact CD1-CB 4.48Å; F212-K229 CarbonylContact C-O 3.15Å; F212-K229 WeakPolarHBondContact CA-O 3.21Å; F212-R231 VanDerWaalsContact O-CZ 3.28Å; F212-R231 PolarHBondContact O-NE 3.48Å; F212-R231 PolarHBondContact O-NH2 3.44Å
213	C	88.8	Confident	83.8	Confident	32 Å²	32	59.3 Å²	59.3	22%	0.216	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	170.7	173.3	51.3	0	0	0	0	109	V215 K229	C213-V215 PolarHBondContact O-N 3.04Å; C213-K229 PolarHBondContact N-O 3.41Å; C213-K229 PolarHBondContact O-N 2.94Å; C213-K229 PolarHBondContact SG-O 3.49Å; C213-K229 VanDerWaalsContact SG-O 3.34Å
214	N	85.9	Confident	83.3	Confident	102 Å²	102	56.8 Å²	56.8	55%	0.545	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	47.5	57.8	-177.5	-59.6	34.9	0	0	0	111	E216	N214-E216 PolarHBondContact O-N 3.24Å
215	V	88.3	Confident	83.3	Confident	29 Å²	29	51.5 Å²	51.5	18%	0.176	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	103.4	-176.4	-175.1	0	0	0	0	109.1	K203 L206 S207 F212 C213 V226 I227 C228	K203-V215 HydrophobicContact CG-CG1 4.43Å; L206-V215 HydrophobicContact CB-CG1 4Å; L206-V215 HydrophobicContact CB-CG2 4.38Å; S207-V215 WeakPolarHBondContact OG-CG1 3.37Å; F212-V215 HydrophobicContact CB-CG2 4.42Å; C213-V215 PolarHBondContact O-N 3.04Å; V215-V226 HydrophobicContact CG1-CG1 4.01Å; V215-I227 CarbonylContact C-O 3.45Å; V215-I227 WeakPolarHBondContact CA-O 3.27Å; V215-C228 HydrophobicContact CB-CB 4.48Å; V215-C228 HydrophobicContact CG2-CB 3.89Å
216	E	87.2	Confident	83.4	Confident	124 Å²	124	51 Å²	51	58%	0.579	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.4	168.4	-177.6	-69.2	178.6	-157.1	0	0	110.3	N214 V226 I227	N214-E216 PolarHBondContact O-N 3.24Å; E216-V226 CarbonylContact O-C 3.51Å; E216-V226 WeakPolarHBondContact O-CA 2.83Å; E216-V226 WeakPolarHBondContact O-CG1 3.47Å; E216-I227 PolarHBondContact N-O 3.29Å; E216-I227 PolarHBondContact O-N 2.89Å
217	A	84.1	Confident	83.4	Confident	28 Å²	28	53 Å²	53	23%	0.231	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	118.6	176.7	0	0	0	0	0	110.9	K203 F219 V225 V226	K203-A217 HydrophobicContact CD-CB 3.74Å; K203-A217 HydrophobicContact CG-CB 4.32Å; A217-F219 HydrophobicContact CB-CD1 4.03Å; A217-F219 HydrophobicContact CB-CD2 4.16Å; A217-F219 HydrophobicContact CB-CE1 3.6Å; A217-F219 HydrophobicContact CB-CE2 3.75Å; A217-F219 HydrophobicContact CB-CG 4.3Å; A217-F219 HydrophobicContact CB-CZ 3.46Å; A217-F219 VanDerWaalsContact CB-CZ 3.46Å; A217-V225 CarbonylContact C-O 3.53Å; A217-V225 WeakPolarHBondContact CA-O 3.23Å; A217-V226 HydrophobicContact CB-CG2 4.36Å
218	D	80.4	Confident	83.5	Confident	48 Å²	48	49.9 Å²	49.9	26%	0.257	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	92.5	165.6	-169.5	-5.6	0	0	0	108.4	H220 A221 P224 V225	D218-H220 VanDerWaalsContact C-N 3.32Å; D218-H220 WeakPolarHBondContact OD1-CA 3.46Å; D218-H220 PolarHBondContact OD1-N 2.93Å; D218-A221 HydrophobicContact CB-CB 4.12Å; D218-A221 PolarHBondContact OD1-N 2.85Å; D218-A221 WeakPolarHBondContact OD2-CB 3.41Å; D218-P224 WeakPolarHBondContact O-CA 3.4Å; D218-V225 HydrophobicContact CB-CG2 4.39Å; D218-V225 PolarHBondContact N-O 2.8Å; D218-V225 PolarHBondContact O-N 2.89Å
219	F	80.3	Confident	83.6	Confident	5 Å²	5	46.4 Å²	46.4	2%	0.022	23%	0.234	C	C	.	.	S	Bend	trans	-85.1	-6.7	173.3	-62.2	-35.9	0	0	0	113	L199 L200 K203 A217 P224 V226 F955	L199-F219 HydrophobicContact CB-CE1 4.03Å; L200-F219 HydrophobicContact CD2-CE2 3.59Å; L200-F219 HydrophobicContact CD2-CZ 3.89Å; K203-F219 HydrophobicContact CD-CE2 4.26Å; K203-F219 HydrophobicContact CD-CZ 4.14Å; A217-F219 HydrophobicContact CB-CD1 4.03Å; A217-F219 HydrophobicContact CB-CD2 4.16Å; A217-F219 HydrophobicContact CB-CE1 3.6Å; A217-F219 HydrophobicContact CB-CE2 3.75Å; A217-F219 HydrophobicContact CB-CG 4.3Å; A217-F219 HydrophobicContact CB-CZ 3.46Å; A217-F219 VanDerWaalsContact CB-CZ 3.46Å; F219-P224 HydrophobicContact CD1-CB 4.26Å; F219-V226 HydrophobicContact CE1-CG2 4.16Å; F219-F955 HydrophobicContact CB-CB 4.08Å; F219-F955 HydrophobicContact CB-CD1 4.08Å; F219-F955 HydrophobicContact CB-CD2 3.67Å; F219-F955 HydrophobicContact CB-CE1 4.41Å; F219-F955 HydrophobicContact CB-CE2 4.07Å; F219-F955 HydrophobicContact CB-CG 3.68Å; F219-F955 HydrophobicContact CB-CZ 4.39Å; F219-F955 AromaticContact CD1-CD1 3.82Å; F219-F955 HydrophobicContact CD1-CD1 3.82Å; F219-F955 HydrophobicContact CD1-CD2 4.31Å; F219-F955 AromaticContact CD1-CE1 3.4Å; F219-F955 HydrophobicContact CD1-CE1 3.4Å; F219-F955 AromaticContact CD1-CE2 3.97Å; F219-F955 HydrophobicContact CD1-CE2 3.97Å; F219-F955 HydrophobicContact CD1-CG 4.25Å; F219-F955 AromaticContact CD1-CZ 3.46Å; F219-F955 HydrophobicContact CD1-CZ 3.46Å; F219-F955 VanDerWaalsContact CD1-CZ 3.46Å; F219-F955 HydrophobicContact CD2-CB 4.25Å; F219-F955 AromaticContact CD2-CD1 3.51Å; F219-F955 HydrophobicContact CD2-CD1 3.51Å; F219-F955 AromaticContact CD2-CE1 3.93Å; F219-F955 HydrophobicContact CD2-CE1 3.93Å; F219-F955 AromaticContact CD2-CG 3.9Å; F219-F955 HydrophobicContact CD2-CG 3.9Å; F219-F955 HydrophobicContact CE1-CD1 4.05Å; F219-F955 AromaticContact CE1-CE1 3.41Å; F219-F955 HydrophobicContact CE1-CE1 3.41Å; F219-F955 VanDerWaalsContact CE1-CE1 3.41Å; F219-F955 AromaticContact CE1-CZ 3.78Å; F219-F955 HydrophobicContact CE1-CZ 3.78Å; F219-F955 AromaticContact CE2-CD1 3.76Å; F219-F955 HydrophobicContact CE2-CD1 3.76Å; F219-F955 AromaticContact CE2-CE1 3.94Å; F219-F955 HydrophobicContact CE2-CE1 3.94Å; F219-F955 HydrophobicContact CG-CB 4.35Å; F219-F955 AromaticContact CG-CD1 3.54Å; F219-F955 HydrophobicContact CG-CD1 3.54Å; F219-F955 AromaticContact CG-CD2 4Å; F219-F955 HydrophobicContact CG-CD2 4Å; F219-F955 AromaticContact CG-CE1 3.66Å; F219-F955 HydrophobicContact CG-CE1 3.66Å; F219-F955 HydrophobicContact CG-CE2 4.13Å; F219-F955 AromaticContact CG-CG 3.7Å; F219-F955 HydrophobicContact CG-CG 3.7Å; F219-F955 AromaticContact CG-CZ 3.94Å; F219-F955 HydrophobicContact CG-CZ 3.94Å; F219-F955 HydrophobicContact CZ-CD1 4.01Å; F219-F955 AromaticContact CZ-CE1 3.68Å; F219-F955 HydrophobicContact CZ-CE1 3.68Å; F219-F955 HydrophobicContact CZ-CZ 4.49Å
220	H	69.3	Low	83.6	Confident	72 Å²	72	47.1 Å²	47.1	33%	0.333	24%	0.237	S	C	.	.	S	Bend	trans	-98.1	-12.8	178.7	-55.7	-65.3	0	0	0	112.3	D218 R940 E941 T960	D218-H220 VanDerWaalsContact C-N 3.32Å; D218-H220 WeakPolarHBondContact OD1-CA 3.46Å; D218-H220 PolarHBondContact OD1-N 2.93Å; H220-R940 PolarHBondContact CE1-O 2.84Å; H220-E941 IonicContact CD2-OE1 2.69Å; H220-E941 IonicContact CE1-OE1 3.75Å; H220-E941 IonicContact NE2-OE1 3.18Å; H220-E941 PolarHBondContact NE2-OE1 3.09Å; H220-T960 WeakPolarHBondContact ND1-CG2 3.19Å
221	A	67	Low	83.3	Confident	13 Å²	13	50.5 Å²	50.5	11%	0.107	24%	0.239	C	C	.	.	S	Bend	trans	-53.5	151.4	164.4	0	0	0	0	0	112.1	D218 V223 L583	D218-A221 HydrophobicContact CB-CB 4.12Å; D218-A221 PolarHBondContact OD1-N 2.85Å; D218-A221 WeakPolarHBondContact OD2-CB 3.41Å; A221-V223 VanDerWaalsContact CB-O 3.23Å; A221-V223 WeakPolarHBondContact CB-O 3.48Å; A221-V223 CarbonylContact O-C 3.55Å; A221-V223 PolarHBondContact O-N 2.74Å; A221-V223 VanDerWaalsContact O-N 3.13Å; A221-L583 HydrophobicContact CB-CD1 3.73Å
222	R	65.8	Low	82.2	Confident	150 Å²	150	51.6 Å²	51.6	57%	0.566	25%	0.246	S	C	*	.	S	Bend	trans	-61.7	-22.3	176.9	-168.8	177.3	-173.7	-136.9	-7.4	113.2	R428 E581	R222-R428 VanDerWaalsContact NH1-NH2 3.16Å; R222-E581 IonicContact NH1-OE2 3.41Å; R222-E581 PolarHBondContact NH1-OE2 2.84Å
223	V	72.1	Confident	81	Confident	10 Å²	10	56.2 Å²	56.2	6%	0.061	28%	0.278	C	S	.	.	S	Bend	trans	-120.7	113.9	161.7	-175.8	0	0	0	0	105.7	A221 V225 G580	A221-V223 VanDerWaalsContact CB-O 3.23Å; A221-V223 WeakPolarHBondContact CB-O 3.48Å; A221-V223 CarbonylContact O-C 3.55Å; A221-V223 PolarHBondContact O-N 2.74Å; A221-V223 VanDerWaalsContact O-N 3.13Å; V223-V225 HydrophobicContact CG1-CG1 4.27Å; V223-V225 PolarHBondContact O-N 3.49Å; V223-G580 VanDerWaalsContact CG2-CA 3.44Å
224	P	80.9	Confident	80	Confident	16 Å²	16	57 Å²	57	10%	0.104	29%	0.285	C	S	.	.			trans	-58.6	128.3	172.9	-26.7	36.4	0	0	0	110.6	L199 D218 F219 F955	L199-P224 HydrophobicContact CD1-CB 3.87Å; L199-P224 WeakPolarHBondContact CD1-O 3.45Å; D218-P224 WeakPolarHBondContact O-CA 3.4Å; F219-P224 HydrophobicContact CD1-CB 4.26Å; P224-F955 HydrophobicContact CB-CE2 3.47Å; P224-F955 VanDerWaalsContact CB-CE2 3.47Å; P224-F955 HydrophobicContact CB-CZ 3.79Å; P224-F955 HydrophobicContact CG-CE2 3.69Å; P224-F955 HydrophobicContact CG-CZ 4.45Å
225	V	88.3	Confident	79.8	Confident	17 Å²	17	53.9 Å²	53.9	10%	0.103	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	143.8	-177.4	-72.9	0	0	0	0	112.4	A217 D218 V223 I227 V240	A217-V225 CarbonylContact C-O 3.53Å; A217-V225 WeakPolarHBondContact CA-O 3.23Å; D218-V225 HydrophobicContact CB-CG2 4.39Å; D218-V225 PolarHBondContact N-O 2.8Å; D218-V225 PolarHBondContact O-N 2.89Å; V223-V225 HydrophobicContact CG1-CG1 4.27Å; V223-V225 PolarHBondContact O-N 3.49Å; V225-I227 HydrophobicContact CG2-CG1 4.26Å; V225-V240 WeakPolarHBondContact CA-O 3.3Å
226	V	91.9	Very high	79.8	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	128.1	162.6	-179.8	0	0	0	0	107.9	L199 V202 K203 L206 V215 E216 A217 F219 V240	L199-V226 HydrophobicContact CD2-CG2 4.29Å; L199-V226 WeakPolarHBondContact O-CG2 3.33Å; V202-V226 HydrophobicContact CG1-CB 4.41Å; V202-V226 HydrophobicContact CG1-CG2 4.28Å; K203-V226 HydrophobicContact CB-CG1 4.36Å; K203-V226 HydrophobicContact CB-CG2 3.99Å; L206-V226 HydrophobicContact CD1-CG1 4.04Å; V215-V226 HydrophobicContact CG1-CG1 4.01Å; E216-V226 CarbonylContact O-C 3.51Å; E216-V226 WeakPolarHBondContact O-CA 2.83Å; E216-V226 WeakPolarHBondContact O-CG1 3.47Å; A217-V226 HydrophobicContact CB-CG2 4.36Å; F219-V226 HydrophobicContact CE1-CG2 4.16Å; V226-V240 HydrophobicContact CB-CB 4.42Å; V226-V240 PolarHBondContact N-O 2.92Å; V226-V240 PolarHBondContact O-N 3.36Å
227	I	91.9	Very high	79.9	Confident	44 Å²	44	49.6 Å²	49.6	23%	0.226	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	134.9	179.5	-52.2	-177.6	0	0	0	107.5	V215 E216 V225 I237 C238 K239	V215-I227 CarbonylContact C-O 3.45Å; V215-I227 WeakPolarHBondContact CA-O 3.27Å; E216-I227 PolarHBondContact N-O 3.29Å; E216-I227 PolarHBondContact O-N 2.89Å; V225-I227 HydrophobicContact CG2-CG1 4.26Å; I227-I237 HydrophobicContact CG2-CG2 3.76Å; I227-C238 WeakPolarHBondContact CA-O 3.07Å; I227-K239 HydrophobicContact CG1-CG 4.38Å; I227-K239 HydrophobicContact CG2-CG 4.47Å
228	C	92.4	Very high	80.3	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.007	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	155.2	173.9	61.2	0	0	0	0	111.9	F212 V215 C238	F212-C228 HydrophobicContact CB-CB 4.31Å; F212-C228 HydrophobicContact CD1-CB 4.48Å; V215-C228 HydrophobicContact CB-CB 4.48Å; V215-C228 HydrophobicContact CG2-CB 3.89Å; C228-C238 PolarHBondContact N-O 3.14Å; C228-C238 WeakPolarHBondContact O-CB 3.31Å; C228-C238 PolarHBondContact O-N 3.49Å
229	K	90.9	Very high	80.7	Confident	91 Å²	91	46.9 Å²	46.9	40%	0.396	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	135.4	179.1	-163.2	167.2	-171.4	165	0	110.8	F212 C213 G235	F212-K229 CarbonylContact C-O 3.15Å; F212-K229 WeakPolarHBondContact CA-O 3.21Å; C213-K229 PolarHBondContact N-O 3.41Å; C213-K229 PolarHBondContact O-N 2.94Å; C213-K229 PolarHBondContact SG-O 3.49Å; C213-K229 VanDerWaalsContact SG-O 3.34Å; K229-G235 WeakPolarHBondContact CE-O 3.21Å; K229-G235 WeakPolarHBondContact CG-O 3.39Å
230	E	87.1	Confident	81.4	Confident	22 Å²	22	46.7 Å²	46.7	10%	0.103	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	127.8	-179.6	-167.7	-121	154.3	0	0	111.9	L149 K232 S233 S234 G235 L236	L149-E230 HydrophobicContact CD1-CB 3.78Å; L149-E230 HydrophobicContact CD1-CG 3.68Å; E230-K232 PolarHBondContact OE1-N 3.35Å; E230-S233 WeakPolarHBondContact OE1-CB 3.33Å; E230-S233 PolarHBondContact OE1-N 3.26Å; E230-S233 PolarHBondContact OE1-OG 2.91Å; E230-S233 PolarHBondContact OE2-N 2.68Å; E230-S233 PolarHBondContact OE2-OG 3.04Å; E230-S234 WeakPolarHBondContact OE2-CA 3.38Å; E230-S234 WeakPolarHBondContact OE2-CB 3.31Å; E230-S234 PolarHBondContact OE2-N 3.07Å; E230-S234 PolarHBondContact OE2-OG 3.12Å; E230-G235 WeakPolarHBondContact O-CA 3.32Å; E230-L236 PolarHBondContact N-O 2.85Å; E230-L236 VanDerWaalsContact N-O 3.09Å
231	R	81.3	Confident	82.5	Confident	152 Å²	152	43.2 Å²	43.2	57%	0.574	22%	0.219	S	C	*	.	S	Bend	trans	-84.7	-18.5	-169.5	-159.8	-171.1	-66.9	-138.8	6.4	114.7	Y211 F212	Y211-R231 VanDerWaalsContact O-CB 3.3Å; Y211-R231 WeakPolarHBondContact O-CB 3.35Å; Y211-R231 PolarHBondContact O-N 3.45Å; F212-R231 VanDerWaalsContact O-CZ 3.28Å; F212-R231 PolarHBondContact O-NE 3.48Å; F212-R231 PolarHBondContact O-NH2 3.44Å
232	K	64.3	Low	83.6	Confident	125 Å²	125	42.6 Å²	42.6	54%	0.543	21%	0.214	S	C	.	.	S	Bend	trans	-119.8	-25	-158.5	-73.4	-177.9	-175.5	163.8	0	118.4	P210 Y211 E230	P210-K232 VanDerWaalsContact O-CE 3.23Å; P210-K232 WeakPolarHBondContact O-CE 3.48Å; P210-K232 PolarHBondContact O-NZ 3.41Å; Y211-K232 HydrophobicContact CD1-CD 3.95Å; Y211-K232 HydrophobicContact CE1-CD 4.27Å; Y211-K232 VanDerWaalsContact CE1-NZ 3.34Å; E230-K232 PolarHBondContact OE1-N 3.35Å
233	S	62.7	Low	84.6	Confident	99 Å²	99	36.9 Å²	36.9	69%	0.692	20%	0.201	S	C	*	.	S	Bend	trans	-137.2	-32.3	-171.4	71.4	0	0	0	0	117.1	E230	E230-S233 WeakPolarHBondContact OE1-CB 3.33Å; E230-S233 PolarHBondContact OE1-N 3.26Å; E230-S233 PolarHBondContact OE1-OG 2.91Å; E230-S233 PolarHBondContact OE2-N 2.68Å; E230-S233 PolarHBondContact OE2-OG 3.04Å
234	S	68.3	Low	85.2	Confident	50 Å²	50	36.5 Å²	36.5	35%	0.35	20%	0.199	S	C	.	.	S	Bend	trans	-132.2	-23.2	-171.7	71.3	0	0	0	0	115	E230 L236	E230-S234 WeakPolarHBondContact OE2-CA 3.38Å; E230-S234 WeakPolarHBondContact OE2-CB 3.31Å; E230-S234 PolarHBondContact OE2-N 3.07Å; E230-S234 PolarHBondContact OE2-OG 3.12Å; S234-L236 PolarHBondContact O-N 3.45Å; S234-L236 WeakPolarHBondContact OG-CB 3.33Å; S234-L236 WeakPolarHBondContact OG-CG 3.41Å; S234-L236 PolarHBondContact OG-N 3.28Å
235	G	81.4	Confident	85.4	Confident	35 Å²	35	39.2 Å²	39.2	36%	0.361	21%	0.211	S	C	.	.			trans	69.6	7.1	-174.8	0	0	0	0	0	114.5	K229 E230	K229-G235 WeakPolarHBondContact CE-O 3.21Å; K229-G235 WeakPolarHBondContact CG-O 3.39Å; E230-G235 WeakPolarHBondContact O-CA 3.32Å
236	L	87.6	Confident	85.2	Confident	20 Å²	20	40 Å²	40	11%	0.105	21%	0.214	C	C	.	.			trans	-63.9	142.5	-177.6	-71.5	171	0	0	0	112.1	R146 D180 V183 E230 S234	R146-L236 HydrophobicContact CG-CD1 4.11Å; D180-L236 WeakPolarHBondContact O-CD2 3.44Å; V183-L236 HydrophobicContact CG2-CB 3.95Å; V183-L236 HydrophobicContact CG2-CD1 3.82Å; V183-L236 HydrophobicContact CG2-CG 4.4Å; E230-L236 PolarHBondContact N-O 2.85Å; E230-L236 VanDerWaalsContact N-O 3.09Å; S234-L236 PolarHBondContact O-N 3.45Å; S234-L236 WeakPolarHBondContact OG-CB 3.33Å; S234-L236 WeakPolarHBondContact OG-CG 3.41Å; S234-L236 PolarHBondContact OG-N 3.28Å
237	I	89.9	Confident	84.8	Confident	43 Å²	43	40.5 Å²	40.5	22%	0.221	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	131.7	170.1	-60.8	169.8	0	0	0	108.4	V183 I227 K239	V183-I237 PolarHBondContact N-O 2.92Å; I227-I237 HydrophobicContact CG2-CG2 3.76Å; I237-K239 HydrophobicContact CG2-CG 4.4Å
238	C	91.5	Very high	84.6	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	125.4	-176.9	-57.7	0	0	0	0	108.6	L149 M153 V183 I185 I227 C228	L149-C238 VanDerWaalsContact CD2-SG 3.57Å; M153-C238 HydrophobicContact CE-CB 4.15Å; V183-C238 WeakPolarHBondContact O-CA 3.34Å; I185-C238 HydrophobicContact CD1-CB 4.19Å; I227-C238 WeakPolarHBondContact CA-O 3.07Å; C228-C238 PolarHBondContact N-O 3.14Å; C228-C238 WeakPolarHBondContact O-CB 3.31Å; C228-C238 PolarHBondContact O-N 3.49Å
239	K	90.9	Very high	84.4	Confident	20 Å²	20	42.3 Å²	42.3	9%	0.087	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	109.2	-177.3	-70.2	178.7	174.3	169.2	0	109.2	D182 V183 I185 I227 I237 L583 S585	D182-K239 HydrophobicContact CB-CD 4.14Å; D182-K239 IonicContact OD1-NZ 3.74Å; D182-K239 WeakPolarHBondContact OD2-CE 3.47Å; D182-K239 IonicContact OD2-NZ 2.74Å; D182-K239 PolarHBondContact OD2-NZ 3.2Å; V183-K239 PolarHBondContact O-N 2.72Å; I185-K239 PolarHBondContact N-O 3.12Å; I227-K239 HydrophobicContact CG1-CG 4.38Å; I227-K239 HydrophobicContact CG2-CG 4.47Å; I237-K239 HydrophobicContact CG2-CG 4.4Å; K239-L583 PolarHBondContact NZ-O 3.23Å; K239-S585 VanDerWaalsContact NZ-N 3.16Å
240	V	93.1	Very high	84.3	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	108.8	-170.9	-168.8	0	0	0	0	109.8	M153 I185 I187 V202 L206 V225 V226	M153-V240 HydrophobicContact CE-CG2 3.94Å; M153-V240 HydrophobicContact SD-CG2 3.68Å; I185-V240 HydrophobicContact CB-CG2 4.43Å; I185-V240 HydrophobicContact CD1-CG2 4.3Å; I185-V240 CarbonylContact O-C 3.02Å; I185-V240 WeakPolarHBondContact O-CA 3.38Å; I187-V240 HydrophobicContact CD1-CG1 3.62Å; I187-V240 HydrophobicContact CG1-CG1 3.86Å; V202-V240 HydrophobicContact CG1-CG1 4.19Å; L206-V240 HydrophobicContact CD1-CG2 4.35Å; V225-V240 WeakPolarHBondContact CA-O 3.3Å; V226-V240 HydrophobicContact CB-CB 4.42Å; V226-V240 PolarHBondContact N-O 2.92Å; V226-V240 PolarHBondContact O-N 3.36Å
241	S	92.6	Very high	84.5	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	172.4	168.8	67.2	0	0	0	0	111.3	Y169 I185 D186 I187 N244	Y169-S241 PolarHBondContact OH-OG 2.78Å; I185-S241 PolarHBondContact O-N 3.21Å; I185-S241 PolarHBondContact O-OG 3.03Å; D186-S241 CarbonylContact C-O 3.45Å; D186-S241 WeakPolarHBondContact CA-O 3.25Å; D186-S241 PolarHBondContact OD1-OG 2.9Å; I187-S241 WeakPolarHBondContact CG1-O 3.16Å; I187-S241 PolarHBondContact N-O 3.3Å; S241-N244 WeakPolarHBondContact OG-CB 3.15Å
242	A	90.3	Very high	84.9	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	136.1	170	0	0	0	0	0	111	D186 I187 Y189 Q195 V198 L199 N244	D186-A242 VanDerWaalsContact OD1-C 3.27Å; D186-A242 WeakPolarHBondContact OD1-CA 3.25Å; D186-A242 PolarHBondContact OD1-N 3.1Å; I187-A242 HydrophobicContact CB-CB 3.96Å; I187-A242 HydrophobicContact CD1-CB 4.28Å; I187-A242 WeakPolarHBondContact O-CA 3.28Å; Y189-A242 HydrophobicContact CD1-CB 3.99Å; Y189-A242 HydrophobicContact CE1-CB 3.75Å; Q195-A242 HydrophobicContact CG-CB 4.03Å; Q195-A242 PolarHBondContact NE2-O 3.02Å; V198-A242 HydrophobicContact CG1-CB 4.27Å; L199-A242 HydrophobicContact CD1-CB 4.11Å; L199-A242 HydrophobicContact CD2-CB 3.98Å; L199-A242 HydrophobicContact CG-CB 3.88Å; A242-N244 VanDerWaalsContact C-N 3.35Å; A242-N244 PolarHBondContact O-N 3.48Å
243	G	87.2	Confident	86.1	Confident	29 Å²	29	26.3 Å²	26.3	30%	0.299	17%	0.165	S	C	.	.	S	Bend	trans	71.7	16.4	175.5	0	0	0	0	0	116.1	D186 I187 E245	D186-G243 PolarHBondContact OD1-N 2.96Å; D186-G243 VanDerWaalsContact OD1-N 3.13Å; I187-G243 PolarHBondContact O-N 3.5Å; G243-E245 VanDerWaalsContact C-N 3.25Å; G243-E245 PolarHBondContact O-N 2.97Å
244	N	85.1	Confident	87.5	Confident	2 Å²	2	21.9 Å²	21.9	1%	0.011	13%	0.134	C	C	.	.			trans	-80.8	60	-171.2	-167.4	4.6	0	0	0	113.4	Y169 D186 S241 A242 N246 A247 F248 G580	Y169-N244 PolarHBondContact OH-ND2 3.46Å; D186-N244 VanDerWaalsContact OD1-CB 3.22Å; D186-N244 WeakPolarHBondContact OD1-CB 3.22Å; D186-N244 PolarHBondContact OD1-N 3.45Å; D186-N244 PolarHBondContact OD2-N 3.18Å; S241-N244 WeakPolarHBondContact OG-CB 3.15Å; A242-N244 VanDerWaalsContact C-N 3.35Å; A242-N244 PolarHBondContact O-N 3.48Å; N244-N246 PolarHBondContact O-N 3.41Å; N244-A247 VanDerWaalsContact CG-CB 3.49Å; N244-A247 WeakPolarHBondContact ND2-CB 3.39Å; N244-A247 PolarHBondContact O-N 3.23Å; N244-A247 VanDerWaalsContact OD1-CB 3.29Å; N244-A247 WeakPolarHBondContact OD1-CB 3.27Å; N244-F248 PolarHBondContact O-N 3.31Å; N244-G580 WeakPolarHBondContact OD1-CA 3.41Å; N244-G580 PolarHBondContact OD1-N 3.1Å
245	E	84.3	Confident	88.5	Confident	74 Å²	74	20.6 Å²	20.6	35%	0.346	12%	0.124	S	C	.	.	H	α-helix	trans	-59.1	-41.9	-172	-168.3	57.9	-142.9	0	0	113.4	R167 G243 A247 F248 Q249	R167-E245 IonicContact CZ-OE2 2.67Å; R167-E245 IonicContact NH1-OE1 3.55Å; R167-E245 PolarHBondContact NH1-OE1 3.24Å; R167-E245 IonicContact NH1-OE2 3.21Å; R167-E245 PolarHBondContact NH1-OE2 3.24Å; R167-E245 IonicContact NH2-OE2 3.98Å; R167-E245 PolarHBondContact NH2-OE2 3.23Å; G243-E245 VanDerWaalsContact C-N 3.25Å; G243-E245 PolarHBondContact O-N 2.97Å; E245-A247 PolarHBondContact O-N 2.86Å; E245-F248 WeakPolarHBondContact O-CB 3.25Å; E245-F248 PolarHBondContact O-N 2.97Å; E245-F248 VanDerWaalsContact O-N 3.15Å; E245-Q249 HydrophobicContact CG-CG 4.32Å; E245-Q249 WeakPolarHBondContact O-CG 3.4Å; E245-Q249 PolarHBondContact O-N 3.32Å; E245-Q249 PolarHBondContact OE1-NE2 3.4Å
246	N	84.4	Confident	88.9	Confident	32 Å²	32	20 Å²	20	17%	0.171	12%	0.116	C	C	.	.	H	α-helix	trans	-65.9	-35	-177.8	-70.4	-77.2	0	0	0	113.1	N244 T250 I578 S579	N244-N246 PolarHBondContact O-N 3.41Å; N246-T250 WeakPolarHBondContact O-CB 3.3Å; N246-T250 PolarHBondContact O-N 3.48Å; N246-T250 PolarHBondContact O-OG1 3.12Å; N246-I578 PolarHBondContact ND2-O 3.21Å; N246-S579 WeakPolarHBondContact CB-OG 3.47Å
247	A	83.8	Confident	89	Confident	12 Å²	12	19 Å²	19	10%	0.099	11%	0.111	C	C	.	.	H	α-helix	trans	-69.9	-37.7	173.7	0	0	0	0	0	111.1	Y169 N244 E245 T250 T251	Y169-A247 HydrophobicContact CD2-CB 3.88Å; Y169-A247 HydrophobicContact CE2-CB 3.79Å; N244-A247 VanDerWaalsContact CG-CB 3.49Å; N244-A247 WeakPolarHBondContact ND2-CB 3.39Å; N244-A247 PolarHBondContact O-N 3.23Å; N244-A247 VanDerWaalsContact OD1-CB 3.29Å; N244-A247 WeakPolarHBondContact OD1-CB 3.27Å; E245-A247 PolarHBondContact O-N 2.86Å; A247-T250 PolarHBondContact O-N 3.2Å; A247-T251 WeakPolarHBondContact O-CB 3.44Å; A247-T251 PolarHBondContact O-N 2.88Å; A247-T251 PolarHBondContact O-OG1 3.27Å
248	F	87.3	Confident	89	Confident	56 Å²	56	17.9 Å²	17.9	25%	0.246	11%	0.108	C	C	.	.	H	α-helix	trans	-64.4	-42.2	173.5	178.6	-101.2	0	0	0	112.8	R167 N244 E245 T251 S252	R167-F248 HydrophobicContact CB-CE2 4.37Å; R167-F248 HydrophobicContact CG-CD2 4.11Å; R167-F248 HydrophobicContact CG-CE2 4.39Å; R167-F248 VanDerWaalsContact NH1-CG 3.29Å; N244-F248 PolarHBondContact O-N 3.31Å; E245-F248 WeakPolarHBondContact O-CB 3.25Å; E245-F248 PolarHBondContact O-N 2.97Å; E245-F248 VanDerWaalsContact O-N 3.15Å; F248-T251 WeakPolarHBondContact O-CB 3.33Å; F248-T251 PolarHBondContact O-N 3.07Å; F248-S252 WeakPolarHBondContact O-CB 3.38Å; F248-S252 PolarHBondContact O-N 2.67Å; F248-S252 PolarHBondContact O-OG 3.19Å
249	Q	88	Confident	88.8	Confident	26 Å²	26	23.2 Å²	23.2	12%	0.121	14%	0.136	C	C	.	.	H	α-helix	trans	-68.2	-39.9	176.7	-65.1	-59.4	-18.4	0	0	112.1	E245 T251 S252 Y253 T331 F424	E245-Q249 HydrophobicContact CG-CG 4.32Å; E245-Q249 WeakPolarHBondContact O-CG 3.4Å; E245-Q249 PolarHBondContact O-N 3.32Å; E245-Q249 PolarHBondContact OE1-NE2 3.4Å; Q249-T251 VanDerWaalsContact C-N 3.31Å; Q249-T251 PolarHBondContact O-N 2.59Å; Q249-S252 PolarHBondContact O-N 3.37Å; Q249-Y253 WeakPolarHBondContact O-CB 3.44Å; Q249-Y253 PolarHBondContact O-N 3.28Å; Q249-T331 VanDerWaalsContact CD-O 3.25Å; Q249-T331 VanDerWaalsContact CG-O 3.32Å; Q249-T331 WeakPolarHBondContact CG-O 3.4Å; Q249-T331 PolarHBondContact OE1-O 3.21Å; Q249-F424 HydrophobicContact CB-CD1 3.95Å; Q249-F424 HydrophobicContact CB-CE1 3.9Å; Q249-F424 HydrophobicContact CB-CE2 4.5Å; Q249-F424 HydrophobicContact CB-CG 4.29Å; Q249-F424 HydrophobicContact CB-CZ 4.19Å
250	T	88.8	Confident	88.5	Confident	14 Å²	14	25.9 Å²	25.9	9%	0.086	15%	0.15	C	C	.	.	H	α-helix	trans	-59.8	-42.6	171.3	-58.1	0	0	0	0	111.4	N246 A247 Y253 L254 F424	N246-T250 WeakPolarHBondContact O-CB 3.3Å; N246-T250 PolarHBondContact O-N 3.48Å; N246-T250 PolarHBondContact O-OG1 3.12Å; A247-T250 PolarHBondContact O-N 3.2Å; T250-Y253 PolarHBondContact O-N 3.41Å; T250-L254 HydrophobicContact CG2-CD1 4.16Å; T250-L254 WeakPolarHBondContact O-CB 3.49Å; T250-L254 VanDerWaalsContact O-CG 3.32Å; T250-L254 WeakPolarHBondContact O-CG 3.37Å; T250-L254 PolarHBondContact O-N 2.92Å; T250-F424 WeakPolarHBondContact OG1-CD2 3.48Å
251	T	90.9	Very high	88.2	Confident	10 Å²	10	26.5 Å²	26.5	6%	0.061	15%	0.153	C	C	.	.	H	α-helix	trans	-64.6	-46.7	176.5	-58	0	0	0	0	111.9	G170 C173 T174 A247 F248 Q249 Y253 L254 S255	G170-T251 VanDerWaalsContact N-CG2 3.25Å; G170-T251 PolarHBondContact N-OG1 3.48Å; C173-T251 HydrophobicContact CB-CG2 3.54Å; T174-T251 HydrophobicContact CG2-CG2 4.09Å; A247-T251 WeakPolarHBondContact O-CB 3.44Å; A247-T251 PolarHBondContact O-N 2.88Å; A247-T251 PolarHBondContact O-OG1 3.27Å; F248-T251 WeakPolarHBondContact O-CB 3.33Å; F248-T251 PolarHBondContact O-N 3.07Å; Q249-T251 VanDerWaalsContact C-N 3.31Å; Q249-T251 PolarHBondContact O-N 2.59Å; T251-Y253 VanDerWaalsContact C-N 3.29Å; T251-Y253 PolarHBondContact O-N 3.39Å; T251-L254 PolarHBondContact O-N 2.83Å; T251-S255 VanDerWaalsContact O-CB 3.25Å; T251-S255 WeakPolarHBondContact O-CB 3.46Å; T251-S255 PolarHBondContact O-N 3.07Å
252	S	90.1	Very high	87.9	Confident	30 Å²	30	37.1 Å²	37.1	21%	0.21	19%	0.193	C	C	.	.	H	α-helix	trans	-59.3	-42.9	179.5	-60.5	0	0	0	0	110.8	F248 Q249 A256	F248-S252 WeakPolarHBondContact O-CB 3.38Å; F248-S252 PolarHBondContact O-N 2.67Å; F248-S252 PolarHBondContact O-OG 3.19Å; Q249-S252 PolarHBondContact O-N 3.37Å; S252-A256 VanDerWaalsContact O-CB 3.23Å; S252-A256 WeakPolarHBondContact O-CB 3.31Å; S252-A256 PolarHBondContact O-N 2.9Å
253	Y	90.6	Very high	87.9	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.4	-51.4	173.6	167.6	-111.6	0	0	0	113.4	Q249 T250 T251 A256 L257 I298 Y312 T333 I338 L365 V400 F424	Q249-Y253 WeakPolarHBondContact O-CB 3.44Å; Q249-Y253 PolarHBondContact O-N 3.28Å; T250-Y253 PolarHBondContact O-N 3.41Å; T251-Y253 VanDerWaalsContact C-N 3.29Å; T251-Y253 PolarHBondContact O-N 3.39Å; Y253-A256 PolarHBondContact O-N 2.89Å; Y253-L257 HydrophobicContact CD2-CD1 4.26Å; Y253-L257 HydrophobicContact CE1-CD1 4.07Å; Y253-L257 HydrophobicContact CE2-CD1 3.57Å; Y253-L257 HydrophobicContact CE2-CG 4.21Å; Y253-L257 VanDerWaalsContact CZ-CD1 3.45Å; Y253-L257 PolarHBondContact O-N 3.24Å; Y253-L257 VanDerWaalsContact O-N 3.1Å; Y253-L257 WeakPolarHBondContact OH-CD1 3.48Å; Y253-I298 HydrophobicContact CE1-CD1 4.43Å; Y253-Y312 AromaticContact CE2-CE2 3.76Å; Y253-Y312 HydrophobicContact CE2-CE2 3.76Å; Y253-Y312 AromaticContact CE2-CZ 3.78Å; Y253-Y312 WeakPolarHBondContact CE2-OH 3.44Å; Y253-Y312 AromaticContact CZ-CE2 3.92Å; Y253-Y312 WeakPolarHBondContact OH-CE2 3.33Å; Y253-Y312 PolarHBondContact OH-OH 3.43Å; Y253-T333 HydrophobicContact CD2-CG2 4.17Å; Y253-I338 HydrophobicContact CD2-CD1 3.76Å; Y253-I338 HydrophobicContact CE2-CD1 4.05Å; Y253-L365 HydrophobicContact CD2-CD2 3.79Å; Y253-L365 HydrophobicContact CE2-CD2 3.71Å; Y253-V400 HydrophobicContact CE1-CG2 4.47Å; Y253-F424 HydrophobicContact CD1-CE2 4.34Å; Y253-F424 HydrophobicContact CG-CE2 4.2Å; Y253-F424 HydrophobicContact CG-CZ 4.39Å
254	L	91.4	Very high	88.1	Confident	7 Å²	7	36.9 Å²	36.9	4%	0.037	19%	0.185	C	C	.	.	H	α-helix	trans	-66	-38.5	-179.9	-70.3	178.6	0	0	0	112.2	T174 F176 T250 T251 L257 A258 A294 I298	T174-L254 HydrophobicContact CG2-CB 3.57Å; F176-L254 HydrophobicContact CE2-CB 4.09Å; F176-L254 HydrophobicContact CE2-CD2 4.38Å; T250-L254 HydrophobicContact CG2-CD1 4.16Å; T250-L254 WeakPolarHBondContact O-CB 3.49Å; T250-L254 VanDerWaalsContact O-CG 3.32Å; T250-L254 WeakPolarHBondContact O-CG 3.37Å; T250-L254 PolarHBondContact O-N 2.92Å; T251-L254 PolarHBondContact O-N 2.83Å; L254-L257 PolarHBondContact O-N 2.79Å; L254-A258 WeakPolarHBondContact O-CB 3.43Å; L254-A258 PolarHBondContact O-N 3.27Å; L254-A294 HydrophobicContact CD1-CB 4.48Å; L254-A294 HydrophobicContact CD2-CB 4.33Å; L254-I298 HydrophobicContact CD2-CD1 3.38Å
255	S	90.2	Very high	88.3	Confident	22 Å²	22	39 Å²	39	15%	0.154	20%	0.196	C	C	.	.	H	α-helix	trans	-69.3	-42	177.7	-175.2	0	0	0	0	111.8	C173 T251 L257 A258 N259	C173-S255 VanDerWaalsContact O-CB 3.29Å; C173-S255 WeakPolarHBondContact O-CB 2.96Å; C173-S255 PolarHBondContact O-OG 2.79Å; T251-S255 VanDerWaalsContact O-CB 3.25Å; T251-S255 WeakPolarHBondContact O-CB 3.46Å; T251-S255 PolarHBondContact O-N 3.07Å; S255-L257 VanDerWaalsContact C-N 3.32Å; S255-L257 PolarHBondContact O-N 2.96Å; S255-A258 PolarHBondContact O-N 3.46Å; S255-N259 WeakPolarHBondContact O-CB 3.38Å; S255-N259 PolarHBondContact O-N 2.82Å; S255-N259 PolarHBondContact O-ND2 3.05Å; S255-N259 PolarHBondContact OG-ND2 2.91Å
256	A	89.7	Confident	88.7	Confident	23 Å²	23	36.1 Å²	36.1	19%	0.19	18%	0.184	C	C	.	.	H	α-helix	trans	-58.7	-44.4	173.6	0	0	0	0	0	111.3	S252 Y253 M260 L365	S252-A256 VanDerWaalsContact O-CB 3.23Å; S252-A256 WeakPolarHBondContact O-CB 3.31Å; S252-A256 PolarHBondContact O-N 2.9Å; Y253-A256 PolarHBondContact O-N 2.89Å; A256-M260 HydrophobicContact CB-CE 4.07Å; A256-M260 WeakPolarHBondContact O-CE 3.34Å; A256-M260 WeakPolarHBondContact O-CG 3.38Å; A256-M260 PolarHBondContact O-N 2.9Å; A256-L365 HydrophobicContact CB-CD1 3.87Å
257	L	89.5	Confident	89.2	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65	-44.9	174.6	-73.2	178.1	0	0	0	112.7	Y253 L254 S255 N259 M260 E261 L264 I298 L309 L365 M366	Y253-L257 HydrophobicContact CD2-CD1 4.26Å; Y253-L257 HydrophobicContact CE1-CD1 4.07Å; Y253-L257 HydrophobicContact CE2-CD1 3.57Å; Y253-L257 HydrophobicContact CE2-CG 4.21Å; Y253-L257 VanDerWaalsContact CZ-CD1 3.45Å; Y253-L257 PolarHBondContact O-N 3.24Å; Y253-L257 VanDerWaalsContact O-N 3.1Å; Y253-L257 WeakPolarHBondContact OH-CD1 3.48Å; L254-L257 PolarHBondContact O-N 2.79Å; S255-L257 VanDerWaalsContact C-N 3.32Å; S255-L257 PolarHBondContact O-N 2.96Å; L257-N259 VanDerWaalsContact C-N 3.29Å; L257-N259 PolarHBondContact O-N 2.89Å; L257-M260 PolarHBondContact O-N 3.34Å; L257-M260 VanDerWaalsContact O-N 3.16Å; L257-E261 PolarHBondContact O-N 2.75Å; L257-L264 HydrophobicContact CB-CD2 3.87Å; L257-I298 HydrophobicContact CD1-CD1 3.8Å; L257-I298 HydrophobicContact CD1-CG1 4.33Å; L257-I298 HydrophobicContact CD1-CG2 4.47Å; L257-L309 HydrophobicContact CD2-CD2 4.33Å; L257-L365 HydrophobicContact CD2-CB 4.19Å; L257-L365 HydrophobicContact CD2-CD2 4.27Å; L257-M366 HydrophobicContact CD2-SD 4.16Å
258	A	89	Confident	89.7	Confident	18 Å²	18	34.1 Å²	34.1	15%	0.149	17%	0.171	C	C	.	.	H	α-helix	trans	-61.2	-35.4	179.1	0	0	0	0	0	113.1	F176 L254 S255	F176-A258 HydrophobicContact CE1-CB 3.91Å; F176-A258 HydrophobicContact CZ-CB 3.79Å; L254-A258 WeakPolarHBondContact O-CB 3.43Å; L254-A258 PolarHBondContact O-N 3.27Å; S255-A258 PolarHBondContact O-N 3.46Å
259	N	86.9	Confident	89.9	Confident	112 Å²	112	31.5 Å²	31.5	60%	0.599	16%	0.16	S	C	*	.	H	α-helix	trans	-76.3	-24.9	177.2	-72.8	-54.7	0	0	0	113.3	S255 L257	S255-N259 WeakPolarHBondContact O-CB 3.38Å; S255-N259 PolarHBondContact O-N 2.82Å; S255-N259 PolarHBondContact O-ND2 3.05Å; S255-N259 PolarHBondContact OG-ND2 2.91Å; L257-N259 VanDerWaalsContact C-N 3.29Å; L257-N259 PolarHBondContact O-N 2.89Å
260	M	85.4	Confident	90.1	Very high	77 Å²	77	30.3 Å²	30.3	38%	0.379	15%	0.154	S	C	.	.	H	α-helix	trans	-93.4	-34.8	178.7	-73.6	-175.1	-78.8	0	0	113.8	A256 L257 L365 M366	A256-M260 HydrophobicContact CB-CE 4.07Å; A256-M260 WeakPolarHBondContact O-CE 3.34Å; A256-M260 WeakPolarHBondContact O-CG 3.38Å; A256-M260 PolarHBondContact O-N 2.9Å; L257-M260 PolarHBondContact O-N 3.34Å; L257-M260 VanDerWaalsContact O-N 3.16Å; M260-L365 HydrophobicContact CE-CB 3.71Å; M260-L365 HydrophobicContact CE-CD1 3.68Å; M260-L365 HydrophobicContact CE-CG 4.34Å; M260-M366 HydrophobicContact CB-CG 3.85Å; M260-M366 HydrophobicContact CB-SD 4.25Å; M260-M366 HydrophobicContact CE-CG 4.36Å; M260-M366 HydrophobicContact CG-CG 4.42Å; M260-M366 HydrophobicContact SD-CG 3.8Å
261	E	87.6	Confident	90.3	Very high	12 Å²	12	29.8 Å²	29.8	6%	0.056	15%	0.151	C	C	.	.			trans	-113.1	100.3	-176.3	-176.6	47.4	-93.4	0	0	111.8	L257 L263 L264 L309 M366 H371	L257-E261 PolarHBondContact O-N 2.75Å; E261-L263 HydrophobicContact CG-CB 4.3Å; E261-L263 PolarHBondContact O-N 3.44Å; E261-L263 WeakPolarHBondContact OE1-CB 3.4Å; E261-L263 WeakPolarHBondContact OE1-CG 3.42Å; E261-L263 PolarHBondContact OE1-N 2.59Å; E261-L264 HydrophobicContact CB-CB 4.32Å; E261-L264 HydrophobicContact CG-CB 4.18Å; E261-L264 WeakPolarHBondContact O-CB 3.42Å; E261-L264 PolarHBondContact O-N 3.01Å; E261-L264 VanDerWaalsContact O-N 3.14Å; E261-L309 HydrophobicContact CB-CD2 4.31Å; E261-L309 HydrophobicContact CG-CD2 4.25Å; E261-M366 HydrophobicContact CB-CE 3.87Å; E261-M366 HydrophobicContact CB-SD 4.34Å; E261-M366 HydrophobicContact CG-CE 4.35Å; E261-M366 WeakPolarHBondContact OE2-CE 3.29Å; E261-H371 IonicContact OE2-CE1 2.66Å; E261-H371 PolarHBondContact OE2-CE1 3.45Å; E261-H371 VanDerWaalsContact OE2-CE1 3.27Å
262	R	86.6	Confident	90.4	Very high	224 Å²	224	30 Å²	30	85%	0.845	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-24.5	-178.5	-66.8	-177.2	176.8	-176.2	-2.5	113.3	L264 P266	R262-L264 PolarHBondContact O-N 2.79Å; R262-P266 WeakPolarHBondContact O-CD 3.45Å
263	L	89.4	Confident	90.5	Very high	23 Å²	23	29.5 Å²	29.5	12%	0.12	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-19.3	177.2	-60.9	169.7	0	0	0	112.4	E261 L267 L308 V376 L379	E261-L263 HydrophobicContact CG-CB 4.3Å; E261-L263 PolarHBondContact O-N 3.44Å; E261-L263 WeakPolarHBondContact OE1-CB 3.4Å; E261-L263 WeakPolarHBondContact OE1-CG 3.42Å; E261-L263 PolarHBondContact OE1-N 2.59Å; L263-L267 WeakPolarHBondContact O-CD1 3.25Å; L263-L267 WeakPolarHBondContact O-CG 3.24Å; L263-L308 HydrophobicContact CD1-CD1 4.24Å; L263-V376 HydrophobicContact CD2-CG2 3.79Å; L263-L379 HydrophobicContact CB-CD1 4.35Å; L263-L379 HydrophobicContact CD1-CD1 4Å; L263-L379 HydrophobicContact CD2-CD1 4.42Å; L263-L379 HydrophobicContact CG-CD1 4.5Å
264	L	90.4	Very high	90.7	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-73.2	-44.3	-174.6	-173.8	59.7	0	0	0	112.4	F176 L257 E261 R262 L267 V268 V297 I298 L301	F176-L264 HydrophobicContact CE1-CG 4.26Å; F176-L264 HydrophobicContact CZ-CD2 3.8Å; F176-L264 HydrophobicContact CZ-CG 3.87Å; L257-L264 HydrophobicContact CB-CD2 3.87Å; E261-L264 HydrophobicContact CB-CB 4.32Å; E261-L264 HydrophobicContact CG-CB 4.18Å; E261-L264 WeakPolarHBondContact O-CB 3.42Å; E261-L264 PolarHBondContact O-N 3.01Å; E261-L264 VanDerWaalsContact O-N 3.14Å; R262-L264 PolarHBondContact O-N 2.79Å; L264-L267 PolarHBondContact O-N 3.32Å; L264-V268 HydrophobicContact CD1-CG2 3.68Å; L264-V268 HydrophobicContact CG-CG2 4.06Å; L264-V268 WeakPolarHBondContact O-CG2 3.09Å; L264-V268 PolarHBondContact O-N 3.3Å; L264-V297 HydrophobicContact CD1-CB 4.27Å; L264-V297 HydrophobicContact CD1-CG1 3.63Å; L264-I298 HydrophobicContact CD1-CG1 3.9Å; L264-I298 HydrophobicContact CD2-CD1 4.48Å; L264-I298 HydrophobicContact CD2-CG1 4.31Å; L264-L301 HydrophobicContact CD1-CD1 4.02Å
265	L	90.9	Very high	90.7	Very high	46 Å²	46	29.3 Å²	29.3	24%	0.241	14%	0.144	C	C	.	.	H	α-helix	trans	-59.3	-48.3	-174	178.5	65.3	0	0	0	113.5	K175 F176 L267 V268 L269	K175-L265 HydrophobicContact CB-CD1 4.14Å; K175-L265 VanDerWaalsContact O-CD1 3.29Å; K175-L265 WeakPolarHBondContact O-CD1 3.37Å; F176-L265 HydrophobicContact CD1-CD1 3.91Å; F176-L265 HydrophobicContact CE1-CD1 4.21Å; L265-L267 PolarHBondContact O-N 2.72Å; L265-V268 PolarHBondContact O-N 3.09Å; L265-L269 HydrophobicContact CD1-CD1 3.6Å; L265-L269 HydrophobicContact CD1-CG 4.01Å; L265-L269 HydrophobicContact CG-CD1 4.06Å; L265-L269 WeakPolarHBondContact O-CB 3.32Å; L265-L269 PolarHBondContact O-N 3.07Å
266	P	92.4	Very high	90.6	Very high	14 Å²	14	31 Å²	31	9%	0.091	15%	0.15	C	C	.	.	H	α-helix	trans	-69.2	-33.6	179.1	-20.3	34.9	0	0	0	113.6	V133 R262 G270 V376	V133-P266 HydrophobicContact CG2-CB 3.93Å; V133-P266 HydrophobicContact CG2-CG 4.35Å; R262-P266 WeakPolarHBondContact O-CD 3.45Å; P266-G270 PolarHBondContact O-N 3.28Å; P266-V376 HydrophobicContact CB-CG1 3.95Å
267	L	93.9	Very high	90.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-68.7	-41	177.1	-68.4	175	0	0	0	111.8	L263 L264 L265 L271 V297 L301 V376 L379 W380	L263-L267 WeakPolarHBondContact O-CD1 3.25Å; L263-L267 WeakPolarHBondContact O-CG 3.24Å; L264-L267 PolarHBondContact O-N 3.32Å; L265-L267 PolarHBondContact O-N 2.72Å; L267-L271 VanDerWaalsContact O-CB 3.31Å; L267-L271 WeakPolarHBondContact O-CB 3.23Å; L267-L271 PolarHBondContact O-N 3.07Å; L267-V297 HydrophobicContact CB-CG1 3.72Å; L267-V297 HydrophobicContact CB-CG2 4.38Å; L267-V297 HydrophobicContact CD1-CG1 4.12Å; L267-L301 HydrophobicContact CD1-CD2 4.3Å; L267-V376 HydrophobicContact CD2-CG1 3.81Å; L267-V376 HydrophobicContact CG-CG1 4.06Å; L267-L379 HydrophobicContact CD1-CB 3.97Å; L267-L379 HydrophobicContact CD1-CD1 4.23Å; L267-L379 HydrophobicContact CD2-CB 4.19Å; L267-W380 HydrophobicContact CD2-CB 4.03Å; L267-W380 HydrophobicContact CD2-CE3 4.17Å
268	V	93.9	Very high	90.6	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.012	15%	0.149	C	C	.	.	H	α-helix	trans	-72	-45	178.8	178.1	0	0	0	0	111.5	F176 L264 L265 L271 R272 A294 V297	F176-V268 HydrophobicContact CB-CG1 3.84Å; F176-V268 HydrophobicContact CD1-CB 3.89Å; F176-V268 HydrophobicContact CD1-CG1 3.73Å; F176-V268 HydrophobicContact CD1-CG2 4.42Å; F176-V268 HydrophobicContact CD2-CG1 3.9Å; F176-V268 HydrophobicContact CE1-CB 4.06Å; F176-V268 HydrophobicContact CE1-CG1 4.25Å; F176-V268 HydrophobicContact CE1-CG2 4.14Å; F176-V268 HydrophobicContact CE2-CG1 4.39Å; F176-V268 HydrophobicContact CE2-CG2 4.49Å; F176-V268 HydrophobicContact CG-CB 4.24Å; F176-V268 HydrophobicContact CG-CG1 3.55Å; F176-V268 HydrophobicContact CZ-CG2 4.18Å; L264-V268 HydrophobicContact CD1-CG2 3.68Å; L264-V268 HydrophobicContact CG-CG2 4.06Å; L264-V268 WeakPolarHBondContact O-CG2 3.09Å; L264-V268 PolarHBondContact O-N 3.3Å; L265-V268 PolarHBondContact O-N 3.09Å; V268-L271 PolarHBondContact O-N 3.46Å; V268-R272 WeakPolarHBondContact O-CB 3.43Å; V268-R272 PolarHBondContact O-N 3.37Å; V268-A294 HydrophobicContact CG1-CB 3.89Å; V268-A294 HydrophobicContact CG2-CB 4.25Å; V268-V297 HydrophobicContact CG2-CB 3.93Å; V268-V297 HydrophobicContact CG2-CG1 4.13Å; V268-V297 HydrophobicContact CG2-CG2 3.89Å
269	L	92.1	Very high	90.5	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.01	15%	0.152	C	C	.	.	H	α-helix	trans	-66.3	-40.2	177.2	-73	176	0	0	0	111.9	V133 F178 L265 R272 H273	V133-L269 HydrophobicContact CB-CD1 4.43Å; V133-L269 HydrophobicContact CG1-CD1 4.18Å; V133-L269 HydrophobicContact CG2-CB 4.22Å; V133-L269 HydrophobicContact CG2-CD1 4.03Å; F178-L269 HydrophobicContact CD1-CD2 4.01Å; F178-L269 HydrophobicContact CE1-CD2 3.72Å; F178-L269 HydrophobicContact CZ-CD2 4.45Å; L265-L269 HydrophobicContact CD1-CD1 3.6Å; L265-L269 HydrophobicContact CD1-CG 4.01Å; L265-L269 HydrophobicContact CG-CD1 4.06Å; L265-L269 WeakPolarHBondContact O-CB 3.32Å; L265-L269 PolarHBondContact O-N 3.07Å; L269-R272 PolarHBondContact O-N 3.09Å; L269-H273 VanDerWaalsContact O-CB 3.3Å; L269-H273 WeakPolarHBondContact O-CB 3.32Å; L269-H273 PolarHBondContact O-N 3.43Å
270	G	92.5	Very high	90.6	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-59.4	-45.1	172.3	0	0	0	0	0	112.5	P266 W274 W380	P266-G270 PolarHBondContact O-N 3.28Å; G270-W274 VanDerWaalsContact O-CB 3.3Å; G270-W274 WeakPolarHBondContact O-CB 3.43Å; G270-W274 PolarHBondContact O-N 2.73Å; G270-W380 VanDerWaalsContact C-CH2 3.43Å; G270-W380 WeakPolarHBondContact O-CH2 3.32Å
271	L	93.8	Very high	90.6	Very high	4 Å²	4	24.4 Å²	24.4	2%	0.021	11%	0.108	C	C	.	.	H	α-helix	trans	-69.8	-36.4	179.3	-168.3	62.4	0	0	0	112.2	L267 V268 W274 A275 F293 V297 W380 M383	L267-L271 VanDerWaalsContact O-CB 3.31Å; L267-L271 WeakPolarHBondContact O-CB 3.23Å; L267-L271 PolarHBondContact O-N 3.07Å; V268-L271 PolarHBondContact O-N 3.46Å; L271-W274 HydrophobicContact CD1-CD2 4.28Å; L271-W274 HydrophobicContact CD1-CE3 3.61Å; L271-W274 HydrophobicContact CD1-CZ3 4.01Å; L271-W274 HydrophobicContact CG-CE3 4.38Å; L271-A275 WeakPolarHBondContact O-CB 3.28Å; L271-A275 PolarHBondContact O-N 3.03Å; L271-F293 HydrophobicContact CD2-CB 3.95Å; L271-F293 HydrophobicContact CD2-CD1 4.25Å; L271-F293 HydrophobicContact CG-CB 4.14Å; L271-F293 HydrophobicContact CG-CD1 4.15Å; L271-F293 HydrophobicContact CG-CG 4.44Å; L271-V297 HydrophobicContact CB-CG2 4.48Å; L271-V297 HydrophobicContact CD2-CG2 3.82Å; L271-W380 HydrophobicContact CB-CH2 4.34Å; L271-W380 HydrophobicContact CB-CZ3 3.98Å; L271-W380 HydrophobicContact CD1-CH2 4.35Å; L271-W380 HydrophobicContact CD1-CZ3 4.41Å; L271-M383 HydrophobicContact CB-CE 4.42Å; L271-M383 HydrophobicContact CD1-CE 4.15Å; L271-M383 HydrophobicContact CD2-CE 4.12Å; L271-M383 HydrophobicContact CD2-SD 4.4Å; L271-M383 HydrophobicContact CG-CE 4.47Å
272	R	92.5	Very high	90.4	Very high	15 Å²	15	29.1 Å²	29.1	6%	0.057	13%	0.125	C	C	.	.	H	α-helix	trans	-69.9	-40.2	176.4	-168.7	-176.4	168.2	-139.2	-10.6	112	F176 F178 S181 V268 L269 A275 Q276	F176-R272 PolarHBondContact O-NH1 3.4Å; F176-R272 VanDerWaalsContact O-NH1 3.1Å; F178-R272 VanDerWaalsContact CD2-CZ 3.42Å; F178-R272 HydrophobicContact CE2-CB 4.3Å; F178-R272 HydrophobicContact CE2-CG 3.73Å; F178-R272 VanDerWaalsContact CE2-CZ 3.45Å; F178-R272 HydrophobicContact CZ-CB 3.9Å; F178-R272 HydrophobicContact CZ-CG 3.87Å; S181-R272 PolarHBondContact OG-NH1 2.9Å; S181-R272 PolarHBondContact OG-NH2 2.74Å; V268-R272 WeakPolarHBondContact O-CB 3.43Å; V268-R272 PolarHBondContact O-N 3.37Å; L269-R272 PolarHBondContact O-N 3.09Å; R272-A275 WeakPolarHBondContact O-CB 3.47Å; R272-A275 PolarHBondContact O-N 3.19Å; R272-A275 VanDerWaalsContact O-N 3.16Å; R272-Q276 PolarHBondContact O-N 2.63Å
273	H	92	Very high	90	Very high	18 Å²	18	19 Å²	19	8%	0.083	9%	0.088	C	C	.	.	H	α-helix	trans	-70.7	-37.4	178.6	-173.5	60.4	0	0	0	111.7	V132 H136 F178 L269 A275 Q276 I277 F637	V132-H273 HydrophobicContact CG1-CB 3.7Å; H136-H273 AromaticContact CD2-CE1 3.7Å; H136-H273 AromaticContact CE1-CE1 3.54Å; H136-H273 AromaticContact CE1-NE2 3.68Å; H136-H273 AromaticContact CG-CE1 3.94Å; H136-H273 AromaticContact ND1-CE1 3.84Å; H136-H273 AromaticContact ND1-NE2 3.96Å; H136-H273 AromaticContact NE2-CE1 3.44Å; H136-H273 PolarHBondContact NE2-CE1 3.44Å; F178-H273 HydrophobicContact CE1-CB 4.23Å; F178-H273 HydrophobicContact CZ-CB 3.89Å; L269-H273 VanDerWaalsContact O-CB 3.3Å; L269-H273 WeakPolarHBondContact O-CB 3.32Å; L269-H273 PolarHBondContact O-N 3.43Å; H273-A275 VanDerWaalsContact C-N 3.31Å; H273-A275 PolarHBondContact O-N 3.13Å; H273-Q276 PolarHBondContact O-N 3.49Å; H273-I277 WeakPolarHBondContact O-CG1 3.32Å; H273-I277 PolarHBondContact O-N 2.9Å; H273-F637 AromaticContact CD2-CD1 3.75Å
274	W	93.8	Very high	89.1	Confident	3 Å²	3	20.7 Å²	20.7	1%	0.011	10%	0.096	C	C	.	.	H	α-helix	trans	-55	-45.7	165.7	166	81.6	0	0	0	112	G270 L271 I277 C278 I280 F293 W380 C446 L447 T450 F637 F642	G270-W274 VanDerWaalsContact O-CB 3.3Å; G270-W274 WeakPolarHBondContact O-CB 3.43Å; G270-W274 PolarHBondContact O-N 2.73Å; L271-W274 HydrophobicContact CD1-CD2 4.28Å; L271-W274 HydrophobicContact CD1-CE3 3.61Å; L271-W274 HydrophobicContact CD1-CZ3 4.01Å; L271-W274 HydrophobicContact CG-CE3 4.38Å; W274-I277 PolarHBondContact O-N 2.81Å; W274-C278 PolarHBondContact O-N 2.79Å; W274-C278 VanDerWaalsContact O-N 3.08Å; W274-C278 PolarHBondContact O-SG 2.78Å; W274-I280 HydrophobicContact CH2-CD1 3.69Å; W274-I280 HydrophobicContact CZ2-CD1 4.03Å; W274-I280 HydrophobicContact CZ3-CD1 4.24Å; W274-F293 HydrophobicContact CZ3-CE1 4.37Å; W274-W380 HydrophobicContact CB-CH2 4.38Å; W274-C446 HydrophobicContact CH2-CB 4.49Å; W274-C446 HydrophobicContact CZ2-CB 3.7Å; W274-L447 HydrophobicContact CH2-CD2 3.63Å; W274-L447 HydrophobicContact CH2-CG 3.75Å; W274-L447 HydrophobicContact CZ2-CD2 3.87Å; W274-L447 HydrophobicContact CZ2-CG 3.95Å; W274-L447 HydrophobicContact CZ3-CD2 4.27Å; W274-T450 PolarHBondContact NE1-OG1 2.93Å; W274-F637 HydrophobicContact CB-CE1 4.27Å; W274-F642 AromaticContact CD1-CD2 3.58Å; W274-F642 AromaticContact CD1-CE2 3.89Å; W274-F642 AromaticContact CD1-CG 3.67Å; W274-F642 HydrophobicContact CG-CD2 4.5Å
275	A	91.5	Very high	88.5	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-65.5	-40	-179.8	0	0	0	0	0	112.4	L271 R272 H273 C278 E279 I280 D281 F293	L271-A275 WeakPolarHBondContact O-CB 3.28Å; L271-A275 PolarHBondContact O-N 3.03Å; R272-A275 WeakPolarHBondContact O-CB 3.47Å; R272-A275 PolarHBondContact O-N 3.19Å; R272-A275 VanDerWaalsContact O-N 3.16Å; H273-A275 VanDerWaalsContact C-N 3.31Å; H273-A275 PolarHBondContact O-N 3.13Å; A275-C278 CarbonylContact O-C 3.47Å; A275-C278 PolarHBondContact O-N 3.3Å; A275-E279 PolarHBondContact O-N 2.85Å; A275-I280 HydrophobicContact CB-CB 4.31Å; A275-I280 PolarHBondContact O-N 3.19Å; A275-D281 HydrophobicContact CB-CB 3.97Å; A275-F293 HydrophobicContact CB-CD1 4.43Å; A275-F293 HydrophobicContact CB-CD2 4.3Å; A275-F293 HydrophobicContact CB-CE1 3.81Å; A275-F293 HydrophobicContact CB-CE2 3.68Å; A275-F293 HydrophobicContact CB-CZ 3.4Å
276	Q	89.5	Confident	87.7	Confident	59 Å²	59	19.7 Å²	19.7	28%	0.276	9%	0.09	S	C	.	.	H	α-helix	trans	-58.5	-49.7	172	-77	-176.7	-43.1	0	0	112.5	F178 R272 H273 C278 E279 D281	F178-Q276 HydrophobicContact CE2-CG 4.27Å; R272-Q276 PolarHBondContact O-N 2.63Å; H273-Q276 PolarHBondContact O-N 3.49Å; Q276-C278 PolarHBondContact O-N 3.29Å; Q276-E279 PolarHBondContact O-N 2.71Å; Q276-D281 WeakPolarHBondContact CA-OD1 3.47Å; Q276-D281 WeakPolarHBondContact CG-OD2 3.34Å
277	I	89.4	Confident	87.3	Confident	33 Å²	33	19 Å²	19	17%	0.169	9%	0.086	C	C	.	.	H	α-helix	trans	-63	-28.1	-179.7	-70.4	167.1	0	0	0	111.8	H273 W274 F637 K639 F642	H273-I277 WeakPolarHBondContact O-CG1 3.32Å; H273-I277 PolarHBondContact O-N 2.9Å; W274-I277 PolarHBondContact O-N 2.81Å; I277-F637 HydrophobicContact CD1-CB 3.76Å; I277-F637 HydrophobicContact CD1-CD1 4.39Å; I277-K639 HydrophobicContact CG2-CB 3.9Å; I277-K639 HydrophobicContact CG2-CG 4.5Å; I277-K639 WeakPolarHBondContact O-CG 3.28Å; I277-F642 HydrophobicContact CB-CD2 4.22Å; I277-F642 HydrophobicContact CB-CE2 4.5Å; I277-F642 HydrophobicContact CD1-CE2 4.17Å; I277-F642 HydrophobicContact CG2-CD2 3.71Å; I277-F642 HydrophobicContact CG2-CE2 4.19Å
278	C	88.7	Confident	87.1	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-0.8	173.8	-58.5	0	0	0	0	113.9	W274 A275 Q276 I280 Y442 F642	W274-C278 PolarHBondContact O-N 2.79Å; W274-C278 VanDerWaalsContact O-N 3.08Å; W274-C278 PolarHBondContact O-SG 2.78Å; A275-C278 CarbonylContact O-C 3.47Å; A275-C278 PolarHBondContact O-N 3.3Å; Q276-C278 PolarHBondContact O-N 3.29Å; C278-I280 HydrophobicContact CB-CB 4.41Å; C278-I280 HydrophobicContact CB-CD1 3.46Å; C278-I280 VanDerWaalsContact CB-CD1 3.46Å; C278-I280 HydrophobicContact CB-CG1 3.65Å; C278-I280 PolarHBondContact O-N 3.36Å; C278-Y442 WeakPolarHBondContact O-CE1 3.43Å; C278-Y442 PolarHBondContact O-OH 3.37Å; C278-F642 VanDerWaalsContact SG-CB 3.52Å
279	E	88	Confident	86.7	Confident	46 Å²	46	19.1 Å²	19.1	22%	0.215	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	22.2	-171.9	-69.8	137.5	-163.9	0	0	114.5	A275 Q276 K639 H648	A275-E279 PolarHBondContact O-N 2.85Å; Q276-E279 PolarHBondContact O-N 2.71Å; E279-K639 IonicContact OE1-NZ 2.71Å; E279-K639 PolarHBondContact OE1-NZ 3.34Å; E279-K639 IonicContact OE2-NZ 3.93Å; E279-K639 PolarHBondContact OE2-NZ 3.26Å; E279-H648 VanDerWaalsContact CB-CE1 3.48Å; E279-H648 WeakPolarHBondContact CB-CE1 3.37Å; E279-H648 IonicContact OE2-CE1 3.74Å
280	I	88.4	Confident	86.4	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-23.5	-178.5	-65.1	169.9	0	0	0	112.1	W274 A275 C278 R282 G287 L288 F293 Y442 I443 C446	W274-I280 HydrophobicContact CH2-CD1 3.69Å; W274-I280 HydrophobicContact CZ2-CD1 4.03Å; W274-I280 HydrophobicContact CZ3-CD1 4.24Å; A275-I280 HydrophobicContact CB-CB 4.31Å; A275-I280 PolarHBondContact O-N 3.19Å; C278-I280 HydrophobicContact CB-CB 4.41Å; C278-I280 HydrophobicContact CB-CD1 3.46Å; C278-I280 VanDerWaalsContact CB-CD1 3.46Å; C278-I280 HydrophobicContact CB-CG1 3.65Å; C278-I280 PolarHBondContact O-N 3.36Å; I280-R282 PolarHBondContact O-N 2.97Å; I280-G287 CarbonylContact O-C 3.55Å; I280-G287 VanDerWaalsContact O-CA 3.25Å; I280-G287 WeakPolarHBondContact O-CA 3.15Å; I280-L288 HydrophobicContact CG2-CD1 4.46Å; I280-L288 PolarHBondContact O-N 3.48Å; I280-F293 HydrophobicContact CG2-CE1 4.35Å; I280-F293 HydrophobicContact CG2-CZ 4.08Å; I280-Y442 HydrophobicContact CD1-CE1 4.23Å; I280-Y442 HydrophobicContact CG1-CD1 4.19Å; I280-Y442 HydrophobicContact CG1-CE1 3.77Å; I280-I443 HydrophobicContact CD1-CG1 4.09Å; I280-I443 HydrophobicContact CG1-CG1 4.12Å; I280-I443 HydrophobicContact CG2-CD1 3.97Å; I280-I443 HydrophobicContact CG2-CG1 3.74Å; I280-C446 HydrophobicContact CD1-CB 3.87Å
281	D	85.6	Confident	86.1	Confident	12 Å²	12	20.8 Å²	20.8	6%	0.064	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	20.3	-176.7	79.2	-36.9	0	0	0	114.7	A275 Q276 P283 L288 F293 L584	A275-D281 HydrophobicContact CB-CB 3.97Å; Q276-D281 WeakPolarHBondContact CA-OD1 3.47Å; Q276-D281 WeakPolarHBondContact CG-OD2 3.34Å; D281-P283 WeakPolarHBondContact O-CD 3.48Å; D281-L288 CarbonylContact C-O 3.49Å; D281-L288 WeakPolarHBondContact CA-O 3.36Å; D281-F293 HydrophobicContact CB-CE2 3.71Å; D281-F293 HydrophobicContact CB-CZ 4.24Å; D281-L584 WeakPolarHBondContact O-CD1 3.4Å
282	R	82.3	Confident	86	Confident	110 Å²	110	20.6 Å²	20.6	42%	0.415	9%	0.094	S	C	.	.			trans	-107.6	92.7	-177.9	-61.2	-174.1	-179.2	-179.3	0.3	113.2	I280 E284 E285 G287	I280-R282 PolarHBondContact O-N 2.97Å; R282-E284 VanDerWaalsContact C-N 3.26Å; R282-E284 PolarHBondContact O-N 2.67Å; R282-E285 HydrophobicContact CB-CB 4.31Å; R282-E285 HydrophobicContact CB-CG 4.32Å; R282-E285 WeakPolarHBondContact CD-OE1 3.27Å; R282-E285 IonicContact CZ-OE1 2.95Å; R282-E285 IonicContact NE-OE1 2.7Å; R282-E285 IonicContact NH1-OE1 3.88Å; R282-E285 PolarHBondContact NH1-OE1 3.03Å; R282-E285 PolarHBondContact O-N 3.23Å; R282-G287 VanDerWaalsContact O-CA 3.31Å; R282-G287 WeakPolarHBondContact O-CA 3.34Å; R282-G287 PolarHBondContact O-N 3.35Å
283	P	78.4	Confident	86	Confident	11 Å²	11	20 Å²	20	7%	0.071	9%	0.092	C	C	.	.	G	3₁₀ helix	trans	-52.4	-36.6	176.3	-31.4	37.3	0	0	0	115.3	D281 E285 G286 P289 T433	D281-P283 WeakPolarHBondContact O-CD 3.48Å; P283-E285 VanDerWaalsContact C-N 3.31Å; P283-E285 PolarHBondContact O-N 3.46Å; P283-G286 PolarHBondContact O-N 3.16Å; P283-P289 HydrophobicContact CG-CB 4.3Å; P283-P289 HydrophobicContact CG-CG 4.07Å; P283-T433 HydrophobicContact CB-CG2 4.14Å
284	E	72.1	Confident	86.1	Confident	59 Å²	59	19.2 Å²	19.2	28%	0.276	9%	0.088	S	C	.	.	G	3₁₀ helix	trans	-64.1	-33.2	-177.8	-63.2	-51.4	131.9	0	0	113.3	R282 G286	R282-E284 VanDerWaalsContact C-N 3.26Å; R282-E284 PolarHBondContact O-N 2.67Å; E284-G286 VanDerWaalsContact C-N 3.31Å
285	E	77.4	Confident	86.1	Confident	25 Å²	25	19.1 Å²	19.1	12%	0.117	9%	0.088	C	C	.	.	G	3₁₀ helix	trans	-86.6	-2.6	176.4	-61.9	-178.4	-149.7	0	0	112.9	R282 P283 H648 V650 V651 L661	R282-E285 HydrophobicContact CB-CB 4.31Å; R282-E285 HydrophobicContact CB-CG 4.32Å; R282-E285 WeakPolarHBondContact CD-OE1 3.27Å; R282-E285 IonicContact CZ-OE1 2.95Å; R282-E285 IonicContact NE-OE1 2.7Å; R282-E285 IonicContact NH1-OE1 3.88Å; R282-E285 PolarHBondContact NH1-OE1 3.03Å; R282-E285 PolarHBondContact O-N 3.23Å; P283-E285 VanDerWaalsContact C-N 3.31Å; P283-E285 PolarHBondContact O-N 3.46Å; E285-H648 IonicContact OE2-CD2 3.27Å; E285-H648 IonicContact OE2-CE1 2.96Å; E285-H648 IonicContact OE2-NE2 3.98Å; E285-H648 PolarHBondContact OE2-NE2 2.97Å; E285-V650 HydrophobicContact CB-CG1 4.34Å; E285-V650 HydrophobicContact CG-CG1 4.25Å; E285-V650 HydrophobicContact CG-CG2 4.46Å; E285-V651 PolarHBondContact O-N 3.22Å; E285-V651 VanDerWaalsContact O-N 3.08Å; E285-L661 HydrophobicContact CG-CD2 3.94Å
286	G	74.6	Confident	86.2	Confident	1 Å²	1	19.4 Å²	19.4	1%	0.01	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.7	7.7	-175.8	0	0	0	0	0	115.2	P283 E284 T433 V434	P283-G286 PolarHBondContact O-N 3.16Å; E284-G286 VanDerWaalsContact C-N 3.31Å; G286-T433 CarbonylContact O-C 3.55Å; G286-V434 VanDerWaalsContact O-CA 3.28Å; G286-V434 WeakPolarHBondContact O-CA 3.3Å; G286-V434 WeakPolarHBondContact O-CG2 3.31Å; G286-V434 PolarHBondContact O-N 2.92Å
287	G	84	Confident	86.4	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.076	C	C	.	.			trans	-73.2	-163.1	177.2	0	0	0	0	0	114.9	I280 R282 T433	I280-G287 CarbonylContact O-C 3.55Å; I280-G287 VanDerWaalsContact O-CA 3.25Å; I280-G287 WeakPolarHBondContact O-CA 3.15Å; R282-G287 VanDerWaalsContact O-CA 3.31Å; R282-G287 WeakPolarHBondContact O-CA 3.34Å; R282-G287 PolarHBondContact O-N 3.35Å; G287-T433 WeakPolarHBondContact O-CB 3.47Å; G287-T433 PolarHBondContact O-OG1 3.06Å
288	L	87.7	Confident	86.6	Confident	1 Å²	1	15 Å²	15	1%	0.005	7%	0.068	C	C	.	.			trans	-106.8	137	-176.9	-70.2	172.2	0	0	0	112.3	I280 D281 V292 F293 I418 A431 V434 I443	I280-L288 HydrophobicContact CG2-CD1 4.46Å; I280-L288 PolarHBondContact O-N 3.48Å; D281-L288 CarbonylContact C-O 3.49Å; D281-L288 WeakPolarHBondContact CA-O 3.36Å; L288-V292 HydrophobicContact CD2-CG1 4.35Å; L288-F293 HydrophobicContact CB-CE1 4.23Å; L288-F293 HydrophobicContact CB-CE2 4.32Å; L288-F293 HydrophobicContact CB-CZ 3.73Å; L288-F293 HydrophobicContact CD1-CE1 3.89Å; L288-F293 HydrophobicContact CD1-CZ 4.22Å; L288-I418 HydrophobicContact CD1-CD1 4.01Å; L288-I418 HydrophobicContact CD2-CD1 4.39Å; L288-A431 HydrophobicContact CD2-CB 3.6Å; L288-V434 HydrophobicContact CD2-CG2 3.51Å; L288-V434 HydrophobicContact CG-CG2 3.78Å; L288-I443 HydrophobicContact CD1-CD1 4.29Å; L288-I443 HydrophobicContact CG-CD1 4.35Å
289	P	85.8	Confident	86.9	Confident	3 Å²	3	15.1 Å²	15.1	2%	0.019	7%	0.068	C	C	.	.			trans	-62.3	145.9	172.9	-21.5	31	0	0	0	113.3	P283 Y291 V292	P283-P289 HydrophobicContact CG-CB 4.3Å; P283-P289 HydrophobicContact CG-CG 4.07Å; P289-Y291 HydrophobicContact CB-CD1 4.12Å; P289-Y291 HydrophobicContact CB-CE1 3.95Å; P289-Y291 PolarHBondContact O-N 3.23Å; P289-V292 HydrophobicContact CB-CG2 4.1Å; P289-V292 HydrophobicContact CG-CG2 4.24Å; P289-V292 VanDerWaalsContact O-CB 3.23Å; P289-V292 WeakPolarHBondContact O-CB 3.16Å; P289-V292 WeakPolarHBondContact O-CG2 3.44Å; P289-V292 PolarHBondContact O-N 2.91Å
290	P	86.4	Confident	87.2	Confident	14 Å²	14	13.2 Å²	13.2	9%	0.091	6%	0.059	C	C	.	.	H	α-helix	trans	-54.1	-43.1	-172.4	-32.1	37.5	0	0	0	116.2	V292 F293 L584	P290-V292 PolarHBondContact O-N 3.2Å; P290-V292 VanDerWaalsContact O-N 3.17Å; P290-F293 VanDerWaalsContact O-CD2 3.32Å; P290-F293 WeakPolarHBondContact O-CD2 3.47Å; P290-F293 PolarHBondContact O-N 2.99Å; P290-F293 VanDerWaalsContact O-N 3.16Å; P290-L584 HydrophobicContact CG-CD1 3.71Å; P290-L584 HydrophobicContact CG-CD2 4.29Å; P290-L584 HydrophobicContact CG-CG 4.33Å
291	Y	87.4	Confident	87.4	Confident	23 Å²	23	13.2 Å²	13.2	9%	0.09	6%	0.059	C	C	.	.	H	α-helix	trans	-66.5	-16	-179.7	77.8	-86.5	0	0	0	113.7	P289 F293 A294 L295 V430 E581	P289-Y291 HydrophobicContact CB-CD1 4.12Å; P289-Y291 HydrophobicContact CB-CE1 3.95Å; P289-Y291 PolarHBondContact O-N 3.23Å; Y291-F293 VanDerWaalsContact C-N 3.29Å; Y291-F293 PolarHBondContact O-N 3.45Å; Y291-A294 WeakPolarHBondContact O-CB 3.31Å; Y291-A294 PolarHBondContact O-N 3.19Å; Y291-L295 HydrophobicContact CD2-CD1 3.9Å; Y291-L295 HydrophobicContact CD2-CG 4.39Å; Y291-L295 HydrophobicContact CE2-CD1 3.97Å; Y291-L295 PolarHBondContact O-N 3.16Å; Y291-V430 HydrophobicContact CE2-CB 4.3Å; Y291-V430 HydrophobicContact CE2-CG1 4.11Å; Y291-V430 HydrophobicContact CE2-CG2 4.35Å; Y291-V430 WeakPolarHBondContact OH-CB 3.21Å; Y291-V430 WeakPolarHBondContact OH-CG1 3.28Å; Y291-E581 HydrophobicContact CE1-CG 4.2Å; Y291-E581 WeakPolarHBondContact OH-CG 3.23Å
292	V	90.9	Very high	87.7	Confident	0 Å²	0	12.9 Å²	12.9	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-64.4	-37.3	174.1	-174.9	0	0	0	0	110.6	L288 P289 P290 A294 L295 M296 V420 V430	L288-V292 HydrophobicContact CD2-CG1 4.35Å; P289-V292 HydrophobicContact CB-CG2 4.1Å; P289-V292 HydrophobicContact CG-CG2 4.24Å; P289-V292 VanDerWaalsContact O-CB 3.23Å; P289-V292 WeakPolarHBondContact O-CB 3.16Å; P289-V292 WeakPolarHBondContact O-CG2 3.44Å; P289-V292 PolarHBondContact O-N 2.91Å; P290-V292 PolarHBondContact O-N 3.2Å; P290-V292 VanDerWaalsContact O-N 3.17Å; V292-A294 VanDerWaalsContact C-N 3.32Å; V292-A294 PolarHBondContact O-N 3.14Å; V292-L295 PolarHBondContact O-N 3.17Å; V292-M296 HydrophobicContact CG1-SD 4.46Å; V292-M296 WeakPolarHBondContact O-CG 3.46Å; V292-M296 PolarHBondContact O-N 2.97Å; V292-V420 HydrophobicContact CG1-CB 4.2Å; V292-V420 HydrophobicContact CG1-CG1 4.26Å; V292-V420 HydrophobicContact CG1-CG2 3.7Å; V292-V430 HydrophobicContact CG1-CG2 4.43Å; V292-V430 HydrophobicContact CG2-CB 4.18Å; V292-V430 HydrophobicContact CG2-CG2 3.64Å
293	F	92.9	Very high	88	Confident	2 Å²	2	9.3 Å²	9.3	1%	0.009	5%	0.045	C	C	.	.	H	α-helix	trans	-63.5	-38.5	174	-55.2	-64.4	0	0	0	111.5	L271 W274 A275 I280 D281 L288 P290 Y291 M296 V297	L271-F293 HydrophobicContact CD2-CB 3.95Å; L271-F293 HydrophobicContact CD2-CD1 4.25Å; L271-F293 HydrophobicContact CG-CB 4.14Å; L271-F293 HydrophobicContact CG-CD1 4.15Å; L271-F293 HydrophobicContact CG-CG 4.44Å; W274-F293 HydrophobicContact CZ3-CE1 4.37Å; A275-F293 HydrophobicContact CB-CD1 4.43Å; A275-F293 HydrophobicContact CB-CD2 4.3Å; A275-F293 HydrophobicContact CB-CE1 3.81Å; A275-F293 HydrophobicContact CB-CE2 3.68Å; A275-F293 HydrophobicContact CB-CZ 3.4Å; I280-F293 HydrophobicContact CG2-CE1 4.35Å; I280-F293 HydrophobicContact CG2-CZ 4.08Å; D281-F293 HydrophobicContact CB-CE2 3.71Å; D281-F293 HydrophobicContact CB-CZ 4.24Å; L288-F293 HydrophobicContact CB-CE1 4.23Å; L288-F293 HydrophobicContact CB-CE2 4.32Å; L288-F293 HydrophobicContact CB-CZ 3.73Å; L288-F293 HydrophobicContact CD1-CE1 3.89Å; L288-F293 HydrophobicContact CD1-CZ 4.22Å; P290-F293 VanDerWaalsContact O-CD2 3.32Å; P290-F293 WeakPolarHBondContact O-CD2 3.47Å; P290-F293 PolarHBondContact O-N 2.99Å; P290-F293 VanDerWaalsContact O-N 3.16Å; Y291-F293 VanDerWaalsContact C-N 3.29Å; Y291-F293 PolarHBondContact O-N 3.45Å; F293-M296 HydrophobicContact CD1-SD 4.47Å; F293-M296 WeakPolarHBondContact O-CB 3.3Å; F293-M296 PolarHBondContact O-N 3.27Å; F293-V297 WeakPolarHBondContact O-CG2 3.49Å; F293-V297 PolarHBondContact O-N 2.6Å
294	A	93.1	Very high	88.5	Confident	1 Å²	1	10.5 Å²	10.5	1%	0.008	5%	0.048	C	C	.	.	H	α-helix	trans	-62.8	-44	173.8	0	0	0	0	0	112.1	F176 L254 V268 Y291 V292 M296 V297 I298	F176-A294 HydrophobicContact CD2-CB 3.91Å; F176-A294 HydrophobicContact CE2-CB 3.96Å; L254-A294 HydrophobicContact CD1-CB 4.48Å; L254-A294 HydrophobicContact CD2-CB 4.33Å; V268-A294 HydrophobicContact CG1-CB 3.89Å; V268-A294 HydrophobicContact CG2-CB 4.25Å; Y291-A294 WeakPolarHBondContact O-CB 3.31Å; Y291-A294 PolarHBondContact O-N 3.19Å; V292-A294 VanDerWaalsContact C-N 3.32Å; V292-A294 PolarHBondContact O-N 3.14Å; A294-M296 VanDerWaalsContact C-N 3.31Å; A294-M296 PolarHBondContact O-N 3.06Å; A294-V297 PolarHBondContact O-N 3.39Å; A294-I298 VanDerWaalsContact O-CG1 3.3Å; A294-I298 WeakPolarHBondContact O-CG1 3.49Å; A294-I298 PolarHBondContact O-N 3.28Å
295	L	93.5	Very high	89	Confident	1 Å²	1	17.2 Å²	17.2	1%	0.005	8%	0.076	C	C	.	.	H	α-helix	trans	-64.2	-34.1	174.2	-66.3	177.4	0	0	0	112.5	Y291 V292 F299 V400 V420 P423 V430	Y291-L295 HydrophobicContact CD2-CD1 3.9Å; Y291-L295 HydrophobicContact CD2-CG 4.39Å; Y291-L295 HydrophobicContact CE2-CD1 3.97Å; Y291-L295 PolarHBondContact O-N 3.16Å; V292-L295 PolarHBondContact O-N 3.17Å; L295-F299 VanDerWaalsContact O-CB 3.27Å; L295-F299 WeakPolarHBondContact O-CB 3.36Å; L295-F299 PolarHBondContact O-N 2.93Å; L295-V400 HydrophobicContact CD2-CG1 4.21Å; L295-V400 HydrophobicContact CD2-CG2 4.16Å; L295-V420 HydrophobicContact CB-CG1 4.2Å; L295-V420 HydrophobicContact CD1-CG1 4.09Å; L295-P423 HydrophobicContact CD2-CG 4.18Å; L295-V430 HydrophobicContact CD1-CG2 4.47Å
296	M	94.2	Very high	89.4	Confident	7 Å²	7	22.6 Å²	22.6	3%	0.034	10%	0.101	C	C	.	.	H	α-helix	trans	-66.2	-43.6	174.2	-73.5	177.6	67.1	0	0	112.3	V292 F293 A294 Y300 Y387 I398	V292-M296 HydrophobicContact CG1-SD 4.46Å; V292-M296 WeakPolarHBondContact O-CG 3.46Å; V292-M296 PolarHBondContact O-N 2.97Å; F293-M296 HydrophobicContact CD1-SD 4.47Å; F293-M296 WeakPolarHBondContact O-CB 3.3Å; F293-M296 PolarHBondContact O-N 3.27Å; A294-M296 VanDerWaalsContact C-N 3.31Å; A294-M296 PolarHBondContact O-N 3.06Å; M296-Y300 WeakPolarHBondContact O-CB 3.35Å; M296-Y300 PolarHBondContact O-N 3.1Å; M296-Y387 WeakPolarHBondContact CA-OH 3.48Å; M296-Y387 HydrophobicContact CB-CE2 4.12Å; M296-Y387 HydrophobicContact CE-CD1 4Å; M296-Y387 HydrophobicContact CE-CD2 4.11Å; M296-Y387 HydrophobicContact CE-CE1 3.95Å; M296-Y387 HydrophobicContact CE-CE2 4.04Å; M296-Y387 HydrophobicContact CE-CG 4.09Å; M296-Y387 PolarHBondContact O-OH 2.95Å; M296-I398 HydrophobicContact CG-CD1 3.89Å
297	V	94.6	Very high	89.8	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-62.6	-48	174.9	178.2	0	0	0	0	110.3	L264 L267 V268 L271 F293 A294 F299 Y300 L301 M383	L264-V297 HydrophobicContact CD1-CB 4.27Å; L264-V297 HydrophobicContact CD1-CG1 3.63Å; L267-V297 HydrophobicContact CB-CG1 3.72Å; L267-V297 HydrophobicContact CB-CG2 4.38Å; L267-V297 HydrophobicContact CD1-CG1 4.12Å; V268-V297 HydrophobicContact CG2-CB 3.93Å; V268-V297 HydrophobicContact CG2-CG1 4.13Å; V268-V297 HydrophobicContact CG2-CG2 3.89Å; L271-V297 HydrophobicContact CB-CG2 4.48Å; L271-V297 HydrophobicContact CD2-CG2 3.82Å; F293-V297 WeakPolarHBondContact O-CG2 3.49Å; F293-V297 PolarHBondContact O-N 2.6Å; A294-V297 PolarHBondContact O-N 3.39Å; V297-F299 PolarHBondContact O-N 3.42Å; V297-Y300 PolarHBondContact O-N 2.8Å; V297-L301 HydrophobicContact CG1-CD1 3.88Å; V297-L301 HydrophobicContact CG1-CG 4.35Å; V297-L301 VanDerWaalsContact O-CG 3.31Å; V297-L301 WeakPolarHBondContact O-CG 3.41Å; V297-L301 PolarHBondContact O-N 3.06Å; V297-M383 HydrophobicContact CB-SD 4.34Å; V297-M383 HydrophobicContact CG1-SD 4.48Å; V297-M383 HydrophobicContact CG2-CE 4.38Å; V297-M383 HydrophobicContact CG2-SD 3.74Å
298	I	93.8	Very high	90	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-60.3	-46	179.1	-68.2	165	0	0	0	111.2	Y253 L254 L257 L264 A294 Y300 L301 Q302 L309 V400	Y253-I298 HydrophobicContact CE1-CD1 4.43Å; L254-I298 HydrophobicContact CD2-CD1 3.38Å; L257-I298 HydrophobicContact CD1-CD1 3.8Å; L257-I298 HydrophobicContact CD1-CG1 4.33Å; L257-I298 HydrophobicContact CD1-CG2 4.47Å; L264-I298 HydrophobicContact CD1-CG1 3.9Å; L264-I298 HydrophobicContact CD2-CD1 4.48Å; L264-I298 HydrophobicContact CD2-CG1 4.31Å; A294-I298 VanDerWaalsContact O-CG1 3.3Å; A294-I298 WeakPolarHBondContact O-CG1 3.49Å; A294-I298 PolarHBondContact O-N 3.28Å; I298-Y300 PolarHBondContact O-N 3.49Å; I298-L301 PolarHBondContact O-N 3.47Å; I298-Q302 WeakPolarHBondContact O-CG 3.36Å; I298-Q302 PolarHBondContact O-N 3Å; I298-L309 HydrophobicContact CB-CD1 4.32Å; I298-L309 HydrophobicContact CG1-CD1 4.2Å; I298-L309 HydrophobicContact CG2-CD1 3.95Å; I298-V400 HydrophobicContact CB-CG1 4.09Å; I298-V400 HydrophobicContact CG2-CB 4.11Å; I298-V400 HydrophobicContact CG2-CG1 3.64Å
299	F	94.2	Very high	90	Very high	1 Å²	1	25.6 Å²	25.6	0%	0.004	12%	0.12	C	C	.	.	H	α-helix	trans	-60.5	-45.6	177.3	179.8	-101.2	0	0	0	111.7	L295 V297 L301 Q302 K303 F386 Y387 F391 I398 S399 V400	L295-F299 VanDerWaalsContact O-CB 3.27Å; L295-F299 WeakPolarHBondContact O-CB 3.36Å; L295-F299 PolarHBondContact O-N 2.93Å; V297-F299 PolarHBondContact O-N 3.42Å; F299-L301 PolarHBondContact O-N 2.87Å; F299-Q302 PolarHBondContact O-N 2.64Å; F299-K303 HydrophobicContact CD1-CG 4.06Å; F299-K303 HydrophobicContact CD2-CG 4.21Å; F299-K303 HydrophobicContact CE1-CG 3.83Å; F299-K303 HydrophobicContact CE2-CD 4.24Å; F299-K303 HydrophobicContact CE2-CG 4Å; F299-K303 HydrophobicContact CG-CG 4.26Å; F299-K303 HydrophobicContact CZ-CD 4.33Å; F299-K303 VanDerWaalsContact CZ-CE 3.48Å; F299-K303 HydrophobicContact CZ-CG 3.82Å; F299-K303 WeakPolarHBondContact O-CB 3.32Å; F299-K303 VanDerWaalsContact O-CG 3.31Å; F299-K303 WeakPolarHBondContact O-CG 3.25Å; F299-K303 PolarHBondContact O-N 3.44Å; F299-F386 HydrophobicContact CD1-CE1 4.15Å; F299-F386 HydrophobicContact CD1-CZ 4.41Å; F299-F386 HydrophobicContact CE1-CE1 4.11Å; F299-F386 HydrophobicContact CE1-CZ 4.04Å; F299-Y387 WeakPolarHBondContact CD1-OH 3.45Å; F299-F391 HydrophobicContact CE1-CD2 4.07Å; F299-F391 HydrophobicContact CE1-CE1 4.39Å; F299-F391 AromaticContact CE1-CE2 3.69Å; F299-F391 HydrophobicContact CE1-CE2 3.69Å; F299-F391 AromaticContact CE1-CZ 3.87Å; F299-F391 HydrophobicContact CE1-CZ 3.87Å; F299-F391 HydrophobicContact CZ-CD2 4.49Å; F299-F391 AromaticContact CZ-CE2 3.76Å; F299-F391 HydrophobicContact CZ-CE2 3.76Å; F299-F391 HydrophobicContact CZ-CZ 4Å; F299-I398 HydrophobicContact CB-CG2 3.61Å; F299-I398 HydrophobicContact CD1-CB 4.44Å; F299-I398 HydrophobicContact CD1-CG1 4.33Å; F299-I398 HydrophobicContact CD1-CG2 3.86Å; F299-I398 HydrophobicContact CD2-CG2 3.95Å; F299-I398 HydrophobicContact CE1-CG1 4.25Å; F299-I398 HydrophobicContact CE1-CG2 4.44Å; F299-I398 HydrophobicContact CG-CB 4.42Å; F299-I398 HydrophobicContact CG-CG2 3.56Å; F299-S399 VanDerWaalsContact CD2-O 3.27Å; F299-S399 WeakPolarHBondContact CD2-O 3.15Å; F299-S399 VanDerWaalsContact CE2-N 3.25Å; F299-S399 WeakPolarHBondContact CE2-O 3.34Å; F299-V400 HydrophobicContact CB-CG1 4.18Å
300	Y	94	Very high	90	Very high	6 Å²	6	26 Å²	26	2%	0.024	12%	0.123	C	C	.	.	H	α-helix	trans	-57.1	-50.5	174.8	159.4	-102.1	0	0	0	111	M296 V297 I298 Q302 K303 R304 E382 M383 F386	M296-Y300 WeakPolarHBondContact O-CB 3.35Å; M296-Y300 PolarHBondContact O-N 3.1Å; V297-Y300 PolarHBondContact O-N 2.8Å; I298-Y300 PolarHBondContact O-N 3.49Å; Y300-Q302 PolarHBondContact O-N 3.1Å; Y300-K303 PolarHBondContact O-N 2.71Å; Y300-R304 HydrophobicContact CD2-CG 4.3Å; Y300-R304 HydrophobicContact CE1-CG 4.17Å; Y300-R304 HydrophobicContact CE2-CG 3.71Å; Y300-R304 WeakPolarHBondContact O-CG 3.44Å; Y300-R304 PolarHBondContact O-N 3Å; Y300-R304 VanDerWaalsContact OH-CD 3.27Å; Y300-R304 WeakPolarHBondContact OH-CD 3.37Å; Y300-R304 PolarHBondContact OH-NE 3Å; Y300-E382 HydrophobicContact CE2-CB 4.25Å; Y300-E382 WeakPolarHBondContact OH-CB 3.41Å; Y300-E382 PolarHBondContact OH-OE2 2.75Å; Y300-M383 HydrophobicContact CD1-CB 3.69Å; Y300-M383 HydrophobicContact CD1-CG 3.81Å; Y300-M383 HydrophobicContact CD1-SD 4.21Å; Y300-M383 HydrophobicContact CD2-CB 4.15Å; Y300-M383 HydrophobicContact CD2-CG 4.34Å; Y300-M383 HydrophobicContact CE1-CB 3.75Å; Y300-M383 HydrophobicContact CE1-CG 4.39Å; Y300-M383 HydrophobicContact CE2-CB 4.19Å; Y300-M383 HydrophobicContact CG-CB 3.92Å; Y300-M383 HydrophobicContact CG-CG 3.8Å; Y300-F386 HydrophobicContact CD2-CB 3.88Å; Y300-F386 AromaticContact CD2-CD1 3.92Å; Y300-F386 HydrophobicContact CD2-CD1 3.92Å; Y300-F386 AromaticContact CD2-CG 3.88Å; Y300-F386 HydrophobicContact CD2-CG 3.88Å; Y300-F386 HydrophobicContact CE2-CB 4.17Å
301	L	92.1	Very high	89.9	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.005	12%	0.122	C	C	.	.	H	α-helix	trans	-60.3	-27.6	178.9	-67.5	171.4	0	0	0	113.7	L264 L267 V297 I298 F299 P307 L308 L309 L379	L264-L301 HydrophobicContact CD1-CD1 4.02Å; L267-L301 HydrophobicContact CD1-CD2 4.3Å; V297-L301 HydrophobicContact CG1-CD1 3.88Å; V297-L301 HydrophobicContact CG1-CG 4.35Å; V297-L301 VanDerWaalsContact O-CG 3.31Å; V297-L301 WeakPolarHBondContact O-CG 3.41Å; V297-L301 PolarHBondContact O-N 3.06Å; I298-L301 PolarHBondContact O-N 3.47Å; F299-L301 PolarHBondContact O-N 2.87Å; L301-P307 WeakPolarHBondContact O-CA 3.23Å; L301-L308 HydrophobicContact CD2-CB 4.4Å; L301-L308 HydrophobicContact CD2-CD1 3.91Å; L301-L308 PolarHBondContact O-N 3.24Å; L301-L309 HydrophobicContact CB-CB 4.47Å; L301-L309 HydrophobicContact CB-CD1 3.98Å; L301-L309 HydrophobicContact CB-CG 4.06Å; L301-L309 HydrophobicContact CD1-CD1 3.94Å; L301-L309 HydrophobicContact CD1-CG 4.41Å; L301-L379 HydrophobicContact CD2-CD1 4.4Å
302	Q	91.6	Very high	89.7	Confident	4 Å²	4	24.8 Å²	24.8	2%	0.019	12%	0.118	C	C	.	.	H	α-helix	trans	-81.4	-27.6	172	-72.5	176.5	-27.5	0	0	114	I298 F299 Y300 L309 P310 T311 V400	I298-Q302 WeakPolarHBondContact O-CG 3.36Å; I298-Q302 PolarHBondContact O-N 3Å; F299-Q302 PolarHBondContact O-N 2.64Å; Y300-Q302 PolarHBondContact O-N 3.1Å; Q302-L309 HydrophobicContact CG-CB 3.82Å; Q302-P310 PolarHBondContact NE2-O 3.03Å; Q302-T311 HydrophobicContact CB-CG2 3.92Å; Q302-T311 HydrophobicContact CG-CG2 4.04Å; Q302-V400 PolarHBondContact NE2-O 3.34Å; Q302-V400 PolarHBondContact OE1-O 2.97Å
303	K	89.8	Confident	89.2	Confident	36 Å²	36	24.8 Å²	24.8	16%	0.157	12%	0.118	C	C	.	.	H	α-helix	trans	-95.3	-7.9	-177.7	-63.7	-46.4	-173.7	-172.2	0	114.6	F299 Y300 F386 T402 N403 A404	F299-K303 HydrophobicContact CD1-CG 4.06Å; F299-K303 HydrophobicContact CD2-CG 4.21Å; F299-K303 HydrophobicContact CE1-CG 3.83Å; F299-K303 HydrophobicContact CE2-CD 4.24Å; F299-K303 HydrophobicContact CE2-CG 4Å; F299-K303 HydrophobicContact CG-CG 4.26Å; F299-K303 HydrophobicContact CZ-CD 4.33Å; F299-K303 VanDerWaalsContact CZ-CE 3.48Å; F299-K303 HydrophobicContact CZ-CG 3.82Å; F299-K303 WeakPolarHBondContact O-CB 3.32Å; F299-K303 VanDerWaalsContact O-CG 3.31Å; F299-K303 WeakPolarHBondContact O-CG 3.25Å; F299-K303 PolarHBondContact O-N 3.44Å; Y300-K303 PolarHBondContact O-N 2.71Å; K303-F386 HydrophobicContact CB-CE2 4.32Å; K303-F386 HydrophobicContact CB-CZ 4.03Å; K303-F386 HydrophobicContact CG-CZ 4.42Å; K303-T402 PolarHBondContact NZ-O 2.99Å; K303-N403 PolarHBondContact NZ-O 3.44Å; K303-A404 PolarHBondContact NZ-O 3.23Å
304	R	88.9	Confident	88.4	Confident	35 Å²	35	27.2 Å²	27.2	13%	0.132	13%	0.131	C	C	.	.	S	Bend	trans	-52.2	148.5	171.8	-69.4	-175.8	81.8	-117.7	9.9	111.2	Y300 E306 E382	Y300-R304 HydrophobicContact CD2-CG 4.3Å; Y300-R304 HydrophobicContact CE1-CG 4.17Å; Y300-R304 HydrophobicContact CE2-CG 3.71Å; Y300-R304 WeakPolarHBondContact O-CG 3.44Å; Y300-R304 PolarHBondContact O-N 3Å; Y300-R304 VanDerWaalsContact OH-CD 3.27Å; Y300-R304 WeakPolarHBondContact OH-CD 3.37Å; Y300-R304 PolarHBondContact OH-NE 3Å; R304-E306 VanDerWaalsContact CB-O 3.25Å; R304-E306 WeakPolarHBondContact CB-O 3.34Å; R304-E306 PolarHBondContact NH1-O 2.95Å; R304-E306 CarbonylContact O-C 3.6Å; R304-E306 PolarHBondContact O-N 2.9Å; R304-E382 IonicContact CZ-OE2 3.93Å; R304-E382 VanDerWaalsContact CZ-OE2 3.27Å; R304-E382 IonicContact NE-OE2 2.75Å; R304-E382 PolarHBondContact NE-OE2 2.74Å; R304-E382 IonicContact NH2-OE1 3.93Å; R304-E382 PolarHBondContact NH2-OE1 3.09Å; R304-E382 IonicContact NH2-OE2 3.11Å; R304-E382 PolarHBondContact NH2-OE2 3.24Å
305	K	82.1	Confident	86.8	Confident	200 Å²	200	35.9 Å²	35.9	87%	0.87	17%	0.171	S	C	*	.	S	Bend	trans	-54.1	-37.4	174.8	-65.4	168.5	-173.3	157.9	0	111.8
306	E	85	Confident	85.2	Confident	138 Å²	138	39.4 Å²	39.4	65%	0.645	21%	0.208	S	C	*	.	S	Bend	trans	-110.5	97.2	165.3	-66.8	179.1	-177.2	0	0	107.1	R304	R304-E306 VanDerWaalsContact CB-O 3.25Å; R304-E306 WeakPolarHBondContact CB-O 3.34Å; R304-E306 PolarHBondContact NH1-O 2.95Å; R304-E306 CarbonylContact O-C 3.6Å; R304-E306 PolarHBondContact O-N 2.9Å
307	P	84.6	Confident	84.1	Confident	57 Å²	57	40.4 Å²	40.4	37%	0.37	21%	0.213	S	C	.	.			trans	-70.8	135.4	-176.3	28.9	-34.6	0	0	0	110.2	L301 F367	L301-P307 WeakPolarHBondContact O-CA 3.23Å; P307-F367 HydrophobicContact CB-CE2 4.24Å; P307-F367 HydrophobicContact CB-CZ 4.22Å; P307-F367 HydrophobicContact CG-CE2 4.3Å; P307-F367 HydrophobicContact CG-CZ 4Å; P307-F367 VanDerWaalsContact O-CE2 3.3Å; P307-F367 WeakPolarHBondContact O-CE2 3.49Å
308	L	86.6	Confident	82.7	Confident	7 Å²	7	50.6 Å²	50.6	4%	0.037	26%	0.257	C	S	.	.	S	Bend	trans	-94	-27.6	177.3	-63.3	177.7	0	0	0	111.6	L263 L301 F367 H371 L379	L263-L308 HydrophobicContact CD1-CD1 4.24Å; L301-L308 HydrophobicContact CD2-CB 4.4Å; L301-L308 HydrophobicContact CD2-CD1 3.91Å; L301-L308 PolarHBondContact O-N 3.24Å; L308-F367 WeakPolarHBondContact O-CD2 3.49Å; L308-H371 HydrophobicContact CD2-CB 3.83Å; L308-L379 HydrophobicContact CD1-CD1 3.91Å; L308-L379 HydrophobicContact CD1-CD2 3.84Å
309	L	87.7	Confident	81.5	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	27%	0.273	C	S	.	.	S	Bend	trans	-113.9	141.6	173.8	-63.3	179.9	0	0	0	111.1	L257 E261 I298 L301 Q302 M366	L257-L309 HydrophobicContact CD2-CD2 4.33Å; E261-L309 HydrophobicContact CB-CD2 4.31Å; E261-L309 HydrophobicContact CG-CD2 4.25Å; I298-L309 HydrophobicContact CB-CD1 4.32Å; I298-L309 HydrophobicContact CG1-CD1 4.2Å; I298-L309 HydrophobicContact CG2-CD1 3.95Å; L301-L309 HydrophobicContact CB-CB 4.47Å; L301-L309 HydrophobicContact CB-CD1 3.98Å; L301-L309 HydrophobicContact CB-CG 4.06Å; L301-L309 HydrophobicContact CD1-CD1 3.94Å; L301-L309 HydrophobicContact CD1-CG 4.41Å; Q302-L309 HydrophobicContact CG-CB 3.82Å; L309-M366 HydrophobicContact CD2-CE 3.85Å; L309-M366 HydrophobicContact CD2-SD 3.49Å; L309-M366 WeakPolarHBondContact CD2-SD 3.34Å
310	P	85.9	Confident	80.6	Confident	12 Å²	12	54.6 Å²	54.6	8%	0.078	28%	0.279	C	S	.	.			trans	-75.5	152.3	173.5	32	-35.4	0	0	0	111.8	Q302 Y312 L365 F367	Q302-P310 PolarHBondContact NE2-O 3.03Å; P310-Y312 HydrophobicContact CG-CE1 4.28Å; P310-Y312 WeakPolarHBondContact O-CE1 3.42Å; P310-L365 WeakPolarHBondContact CD-O 3.49Å; P310-L365 WeakPolarHBondContact CG-O 3.38Å; P310-F367 HydrophobicContact CB-CD1 4.22Å; P310-F367 HydrophobicContact CB-CE1 3.83Å; P310-F367 HydrophobicContact CB-CE2 4.38Å; P310-F367 HydrophobicContact CB-CZ 3.92Å
311	T	84.6	Confident	79.7	Confident	11 Å²	11	56.6 Å²	56.6	7%	0.067	29%	0.294	C	S	.	.			trans	-91.1	150.1	162.1	57.1	0	0	0	0	110	Q302 N314 N403	Q302-T311 HydrophobicContact CB-CG2 3.92Å; Q302-T311 HydrophobicContact CG-CG2 4.04Å; T311-N314 PolarHBondContact O-ND2 3.28Å; T311-N314 PolarHBondContact O-OD1 3.45Å; T311-N314 PolarHBondContact OG1-OD1 3.1Å; T311-N403 HydrophobicContact CG2-CB 4.2Å; T311-N403 WeakPolarHBondContact OG1-CB 3.33Å
312	Y	83.8	Confident	78.8	Confident	1 Å²	1	59.6 Å²	59.6	0%	0.004	31%	0.31	C	S	.	.	S	Bend	trans	-94.4	-41.3	-167.8	-44.1	-59.6	0	0	0	113.7	Y253 P310 L330 I338 V363 L365 R401	Y253-Y312 AromaticContact CE2-CE2 3.76Å; Y253-Y312 HydrophobicContact CE2-CE2 3.76Å; Y253-Y312 AromaticContact CE2-CZ 3.78Å; Y253-Y312 WeakPolarHBondContact CE2-OH 3.44Å; Y253-Y312 AromaticContact CZ-CE2 3.92Å; Y253-Y312 WeakPolarHBondContact OH-CE2 3.33Å; Y253-Y312 PolarHBondContact OH-OH 3.43Å; P310-Y312 HydrophobicContact CG-CE1 4.28Å; P310-Y312 WeakPolarHBondContact O-CE1 3.42Å; Y312-L330 HydrophobicContact CD2-CD1 4.35Å; Y312-I338 HydrophobicContact CD1-CG2 3.55Å; Y312-I338 HydrophobicContact CD2-CG2 4.33Å; Y312-I338 HydrophobicContact CE1-CG2 4.14Å; Y312-I338 HydrophobicContact CG-CG2 3.67Å; Y312-V363 HydrophobicContact CD1-CG1 4.45Å; Y312-L365 HydrophobicContact CE1-CD2 4.04Å; Y312-R401 PolarHBondContact N-O 3.21Å
313	L	81.1	Confident	77.9	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-98.9	96	-177.3	-57.2	-179.4	0	0	0	110.7	I317 F320 L325 F328 W340 R401 T402	L313-I317 HydrophobicContact CD2-CD1 4.08Å; L313-F320 HydrophobicContact CB-CD2 4.21Å; L313-F320 HydrophobicContact CB-CE2 3.69Å; L313-F320 HydrophobicContact CB-CZ 4.18Å; L313-F320 WeakPolarHBondContact O-CZ 3.48Å; L313-L325 HydrophobicContact CB-CD1 4.42Å; L313-L325 HydrophobicContact CD1-CD1 3.77Å; L313-F328 HydrophobicContact CD1-CB 3.72Å; L313-F328 HydrophobicContact CD1-CG 4.37Å; L313-F328 HydrophobicContact CD2-CB 4.39Å; L313-F328 HydrophobicContact CD2-CD1 4.12Å; L313-F328 HydrophobicContact CD2-CG 4.47Å; L313-W340 HydrophobicContact CD2-CB 4.34Å; L313-W340 HydrophobicContact CD2-CG 4.25Å; L313-R401 WeakPolarHBondContact CB-O 3.41Å; L313-R401 HydrophobicContact CD1-CB 4.4Å; L313-R401 PolarHBondContact N-O 3.16Å; L313-T402 WeakPolarHBondContact O-CB 3.34Å; L313-T402 PolarHBondContact O-OG1 3.49Å
314	N	74.9	Confident	77.2	Confident	53 Å²	53	66.7 Å²	66.7	28%	0.283	35%	0.351	S	S	.	.			trans	-125.5	161.7	-168	-57.4	-27.2	0	0	0	112	T311 G316 I317	T311-N314 PolarHBondContact O-ND2 3.28Å; T311-N314 PolarHBondContact O-OD1 3.45Å; T311-N314 PolarHBondContact OG1-OD1 3.1Å; N314-G316 PolarHBondContact O-N 3.09Å; N314-I317 PolarHBondContact O-N 3.3Å
315	Q	60.5	Low	76.7	Confident	182 Å²	182	65.5 Å²	65.5	85%	0.85	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-11.3	175.6	-65.2	179.9	1.4	0	0	114.9	I317	Q315-I317 VanDerWaalsContact C-N 3.27Å; Q315-I317 PolarHBondContact O-N 3.36Å
316	G	58.2	Low	76.3	Confident	75 Å²	75	60.1 Å²	60.1	77%	0.773	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-20	171.4	0	0	0	0	0	114.1	N314 K318	N314-G316 PolarHBondContact O-N 3.09Å; G316-K318 PolarHBondContact O-N 3.35Å
317	I	71.9	Confident	76.1	Confident	28 Å²	28	54.6 Å²	54.6	14%	0.144	31%	0.312	C	S	.	.	S	Bend	trans	-78.5	112.2	172	-61.4	170	0	0	0	107.7	L313 N314 Q315 V319 F320 F328 W340	L313-I317 HydrophobicContact CD2-CD1 4.08Å; N314-I317 PolarHBondContact O-N 3.3Å; Q315-I317 VanDerWaalsContact C-N 3.27Å; Q315-I317 PolarHBondContact O-N 3.36Å; I317-V319 PolarHBondContact O-N 2.85Å; I317-F320 HydrophobicContact CB-CB 3.85Å; I317-F320 HydrophobicContact CG2-CB 4.08Å; I317-F320 WeakPolarHBondContact O-CB 3.45Å; I317-F320 PolarHBondContact O-N 3.28Å; I317-F328 HydrophobicContact CG2-CE1 4.32Å; I317-W340 HydrophobicContact CD1-CZ2 3.98Å; I317-W340 HydrophobicContact CG1-CZ2 4.2Å; I317-W340 HydrophobicContact CG2-CH2 3.85Å; I317-W340 HydrophobicContact CG2-CZ2 3.84Å
318	K	64.4	Low	76	Confident	215 Å²	215	51.9 Å²	51.9	94%	0.935	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-19.6	-172	-66.8	-176.6	180	177.7	0	116.3	G316	G316-K318 PolarHBondContact O-N 3.35Å
319	V	69.4	Low	75.9	Confident	56 Å²	56	54.1 Å²	54.1	34%	0.339	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-7.2	-176.4	-171.9	0	0	0	0	112.2	I317 Y342 M359	I317-V319 PolarHBondContact O-N 2.85Å; V319-Y342 HydrophobicContact CG1-CD1 4.47Å; V319-Y342 HydrophobicContact CG1-CE1 4.42Å; V319-M359 HydrophobicContact CG2-SD 4.14Å
320	F	75.6	Confident	75.8	Confident	28 Å²	28	54.4 Å²	54.4	12%	0.123	31%	0.308	C	S	.	.			trans	-74.7	132.3	-172.4	178.9	-101.2	0	0	0	113	L313 I317 L322 L325 F328	L313-F320 HydrophobicContact CB-CD2 4.21Å; L313-F320 HydrophobicContact CB-CE2 3.69Å; L313-F320 HydrophobicContact CB-CZ 4.18Å; L313-F320 WeakPolarHBondContact O-CZ 3.48Å; I317-F320 HydrophobicContact CB-CB 3.85Å; I317-F320 HydrophobicContact CG2-CB 4.08Å; I317-F320 WeakPolarHBondContact O-CB 3.45Å; I317-F320 PolarHBondContact O-N 3.28Å; F320-L322 HydrophobicContact CE1-CD2 4.19Å; F320-L322 HydrophobicContact CE1-CG 4.46Å; F320-L322 HydrophobicContact CZ-CD2 3.95Å; F320-L325 HydrophobicContact CE2-CD1 3.85Å; F320-L325 HydrophobicContact CZ-CD1 4.23Å; F320-F328 HydrophobicContact CB-CZ 4.15Å; F320-F328 HydrophobicContact CD2-CD2 4.1Å; F320-F328 AromaticContact CD2-CE2 3.78Å; F320-F328 HydrophobicContact CD2-CE2 3.78Å; F320-F328 HydrophobicContact CD2-CZ 4.04Å
321	S	75.1	Confident	75.6	Confident	48 Å²	48	55.7 Å²	55.7	34%	0.336	32%	0.316	S	S	.	.			trans	-140.3	143.6	167.8	177.2	0	0	0	0	108.4	S323 R324 L325	S321-S323 PolarHBondContact O-N 3.21Å; S321-S323 PolarHBondContact OG-N 3.48Å; S321-S323 PolarHBondContact OG-OG 2.7Å; S321-R324 PolarHBondContact O-N 3.47Å; S321-L325 PolarHBondContact O-N 3.27Å
322	L	73.9	Confident	75.6	Confident	64 Å²	64	58.8 Å²	58.8	34%	0.335	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-59.5	-33.1	176	-69.1	168.5	0	0	0	112	F320 R324 L325 A404 M410	F320-L322 HydrophobicContact CE1-CD2 4.19Å; F320-L322 HydrophobicContact CE1-CG 4.46Å; F320-L322 HydrophobicContact CZ-CD2 3.95Å; L322-R324 PolarHBondContact O-N 3.01Å; L322-R324 VanDerWaalsContact O-N 3.13Å; L322-L325 VanDerWaalsContact O-CB 3.29Å; L322-L325 WeakPolarHBondContact O-CB 3.39Å; L322-L325 PolarHBondContact O-N 3.02Å; L322-A404 HydrophobicContact CD1-CB 3.91Å; L322-A404 HydrophobicContact CD2-CB 3.54Å; L322-A404 HydrophobicContact CG-CB 4.4Å; L322-M410 HydrophobicContact CB-CE 4.24Å
323	S	71.9	Confident	75.6	Confident	101 Å²	101	60.1 Å²	60.1	71%	0.706	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-66.8	-7	173.8	58.9	0	0	0	0	114.9	S321	S321-S323 PolarHBondContact O-N 3.21Å; S321-S323 PolarHBondContact OG-N 3.48Å; S321-S323 PolarHBondContact OG-OG 2.7Å
324	R	74.7	Confident	75.7	Confident	88 Å²	88	64 Å²	64	33%	0.332	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-120.5	9.1	179.1	-55.3	173.9	90.8	-168	13.7	112	S321 L322 S326 A327 F328 Y342	S321-R324 PolarHBondContact O-N 3.47Å; L322-R324 PolarHBondContact O-N 3.01Å; L322-R324 VanDerWaalsContact O-N 3.13Å; R324-S326 PolarHBondContact O-N 2.96Å; R324-S326 VanDerWaalsContact O-N 3.15Å; R324-A327 PolarHBondContact O-N 3.19Å; R324-F328 WeakPolarHBondContact O-CD2 3.26Å; R324-Y342 HydrophobicContact CB-CE2 4.43Å; R324-Y342 PolarHBondContact NE-OH 3.21Å; R324-Y342 PolarHBondContact NH2-OH 3.05Å
325	L	78	Confident	75.8	Confident	10 Å²	10	69 Å²	69	5%	0.052	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-60.5	-24.4	-174.8	179.1	63.7	0	0	0	113.4	L313 F320 S321 L322 A327 R401 T402 L406	L313-L325 HydrophobicContact CB-CD1 4.42Å; L313-L325 HydrophobicContact CD1-CD1 3.77Å; F320-L325 HydrophobicContact CE2-CD1 3.85Å; F320-L325 HydrophobicContact CZ-CD1 4.23Å; S321-L325 PolarHBondContact O-N 3.27Å; L322-L325 VanDerWaalsContact O-CB 3.29Å; L322-L325 WeakPolarHBondContact O-CB 3.39Å; L322-L325 PolarHBondContact O-N 3.02Å; L325-A327 VanDerWaalsContact C-N 3.32Å; L325-R401 PolarHBondContact O-NH2 3.34Å; L325-T402 HydrophobicContact CD2-CG2 4Å; L325-L406 HydrophobicContact CD2-CD1 3.76Å; L325-L406 HydrophobicContact CD2-CD2 3.87Å; L325-L406 HydrophobicContact CD2-CG 4.46Å
326	S	75.5	Confident	76.7	Confident	87 Å²	87	61.7 Å²	61.7	61%	0.608	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-73.3	-15.8	174.2	47.9	0	0	0	0	114.7	R324	R324-S326 PolarHBondContact O-N 2.96Å; R324-S326 VanDerWaalsContact O-N 3.15Å
327	A	79	Confident	78	Confident	22 Å²	22	61.8 Å²	61.8	18%	0.182	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-103.9	3.7	179.8	0	0	0	0	0	113.6	R324 L325 Y342 N343	R324-A327 PolarHBondContact O-N 3.19Å; L325-A327 VanDerWaalsContact C-N 3.32Å; A327-Y342 HydrophobicContact CB-CD2 4.38Å; A327-Y342 HydrophobicContact CB-CE2 3.7Å; A327-Y342 VanDerWaalsContact O-CD2 3.28Å; A327-Y342 WeakPolarHBondContact O-CD2 3.37Å; A327-N343 PolarHBondContact O-N 3.48Å
328	F	82.8	Confident	78.7	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	120.4	165.9	-75	-93.5	0	0	0	109.2	L313 I317 F320 R324 W340 I341 Y342 R401	L313-F328 HydrophobicContact CD1-CB 3.72Å; L313-F328 HydrophobicContact CD1-CG 4.37Å; L313-F328 HydrophobicContact CD2-CB 4.39Å; L313-F328 HydrophobicContact CD2-CD1 4.12Å; L313-F328 HydrophobicContact CD2-CG 4.47Å; I317-F328 HydrophobicContact CG2-CE1 4.32Å; F320-F328 HydrophobicContact CB-CZ 4.15Å; F320-F328 HydrophobicContact CD2-CD2 4.1Å; F320-F328 AromaticContact CD2-CE2 3.78Å; F320-F328 HydrophobicContact CD2-CE2 3.78Å; F320-F328 HydrophobicContact CD2-CZ 4.04Å; R324-F328 WeakPolarHBondContact O-CD2 3.26Å; F328-W340 HydrophobicContact CD1-CD2 4.46Å; F328-W340 AromaticContact CD1-CE3 3.83Å; F328-W340 HydrophobicContact CD1-CE3 3.83Å; F328-W340 HydrophobicContact CD1-CZ3 4.13Å; F328-W340 AromaticContact CE1-CE3 3.96Å; F328-W340 HydrophobicContact CE1-CE3 3.96Å; F328-W340 HydrophobicContact CE1-CH2 4.34Å; F328-W340 AromaticContact CE1-CZ3 3.78Å; F328-W340 HydrophobicContact CE1-CZ3 3.78Å; F328-I341 CarbonylContact C-O 3.48Å; F328-I341 WeakPolarHBondContact CA-O 3.39Å; F328-Y342 AromaticContact CD1-CD2 3.78Å; F328-Y342 HydrophobicContact CD1-CD2 3.78Å; F328-Y342 HydrophobicContact CD1-CG 4.23Å; F328-Y342 AromaticContact CD2-CD2 3.42Å; F328-Y342 HydrophobicContact CD2-CD2 3.42Å; F328-Y342 VanDerWaalsContact CD2-CD2 3.42Å; F328-Y342 AromaticContact CD2-CE2 3.79Å; F328-Y342 HydrophobicContact CD2-CE2 3.79Å; F328-Y342 AromaticContact CE1-CD2 3.69Å; F328-Y342 HydrophobicContact CE1-CD2 3.69Å; F328-Y342 AromaticContact CE1-CG 3.92Å; F328-Y342 HydrophobicContact CE1-CG 3.92Å; F328-Y342 AromaticContact CE2-CD2 3.3Å; F328-Y342 HydrophobicContact CE2-CD2 3.3Å; F328-Y342 AromaticContact CE2-CE2 3.55Å; F328-Y342 HydrophobicContact CE2-CE2 3.55Å; F328-Y342 HydrophobicContact CE2-CG 4.22Å; F328-Y342 AromaticContact CG-CD2 3.64Å; F328-Y342 HydrophobicContact CG-CD2 3.64Å; F328-Y342 HydrophobicContact CG-CE2 4.43Å; F328-Y342 AromaticContact CZ-CD2 3.44Å; F328-Y342 HydrophobicContact CZ-CD2 3.44Å; F328-Y342 VanDerWaalsContact CZ-CD2 3.44Å; F328-Y342 HydrophobicContact CZ-CE2 4.03Å; F328-Y342 AromaticContact CZ-CG 3.91Å; F328-Y342 HydrophobicContact CZ-CG 3.91Å; F328-R401 PolarHBondContact O-NH2 2.93Å
329	N	84.1	Confident	79.8	Confident	55 Å²	55	52 Å²	52	29%	0.294	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	140.2	172.4	-67.8	-15.6	0	0	0	110	W340 I341	N329-W340 CarbonylContact O-C 3.59Å; N329-W340 VanDerWaalsContact O-CA 3.23Å; N329-W340 WeakPolarHBondContact O-CA 3.39Å; N329-I341 PolarHBondContact N-O 3.18Å; N329-I341 PolarHBondContact O-N 2.92Å
330	L	85.8	Confident	80.7	Confident	6 Å²	6	50.7 Å²	50.7	3%	0.031	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	147.4	162.6	-57.9	178.2	0	0	0	107.5	Y312 I338 H339 W340 R401 P423 F424	Y312-L330 HydrophobicContact CD2-CD1 4.35Å; L330-I338 HydrophobicContact CB-CD1 4.24Å; L330-I338 HydrophobicContact CD1-CD1 3.77Å; L330-I338 HydrophobicContact CD2-CD1 4.13Å; L330-I338 HydrophobicContact CD2-CG1 4.28Å; L330-I338 HydrophobicContact CG-CD1 4.26Å; L330-H339 WeakPolarHBondContact CA-O 3.33Å; L330-W340 HydrophobicContact CD2-CB 4.2Å; L330-R401 HydrophobicContact CD1-CG 3.94Å; L330-P423 HydrophobicContact CD1-CB 4.1Å; L330-P423 WeakPolarHBondContact CD1-O 3.44Å; L330-F424 HydrophobicContact CB-CD1 3.96Å; L330-F424 HydrophobicContact CB-CE1 3.78Å; L330-F424 HydrophobicContact CB-CZ 4.37Å; L330-F424 WeakPolarHBondContact O-CD1 3.45Å
331	T	83	Confident	81.2	Confident	40 Å²	40	51.1 Å²	51.1	25%	0.245	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	-55.9	-174.6	52.2	0	0	0	0	114.5	Q249 H339 I341	Q249-T331 VanDerWaalsContact CD-O 3.25Å; Q249-T331 VanDerWaalsContact CG-O 3.32Å; Q249-T331 WeakPolarHBondContact CG-O 3.4Å; Q249-T331 PolarHBondContact OE1-O 3.21Å; T331-H339 PolarHBondContact N-O 3.21Å; T331-H339 PolarHBondContact OG1-O 2.98Å; T331-I341 HydrophobicContact CG2-CB 4.32Å; T331-I341 HydrophobicContact CG2-CD1 3.77Å; T331-I341 HydrophobicContact CG2-CG1 3.72Å
332	H	83.5	Confident	81.5	Confident	76 Å²	76	49 Å²	49	35%	0.352	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	165	177	54.9	-104.4	0	0	0	112.2	H339	H332-H339 AromaticContact CD2-CG 3.79Å; H332-H339 AromaticContact CD2-ND1 3.7Å; H332-H339 AromaticContact CE1-ND1 3.91Å; H332-H339 AromaticContact NE2-CE1 3.73Å; H332-H339 AromaticContact NE2-CG 3.55Å; H332-H339 AromaticContact NE2-ND1 3.01Å; H332-H339 PolarHBondContact NE2-ND1 2.69Å; H332-H339 PolarHBondContact O-N 2.95Å
333	T	84.8	Confident	81.7	Confident	29 Å²	29	49.5 Å²	49.5	18%	0.178	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	131.1	171.8	50.3	0	0	0	0	111.2	Y253 Y337 I338 L365	Y253-T333 HydrophobicContact CD2-CG2 4.17Å; T333-Y337 CarbonylContact C-O 3.58Å; T333-Y337 VanDerWaalsContact CA-O 3.25Å; T333-Y337 WeakPolarHBondContact CA-O 3.45Å; T333-I338 HydrophobicContact CG2-CB 4.13Å; T333-I338 HydrophobicContact CG2-CD1 4.18Å; T333-I338 HydrophobicContact CG2-CG1 3.97Å; T333-L365 HydrophobicContact CG2-CD1 3.85Å; T333-L365 HydrophobicContact CG2-CD2 4.29Å
334	D	83	Confident	81.5	Confident	80 Å²	80	47.8 Å²	47.8	43%	0.428	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	137.9	-177.2	-179.2	35.5	0	0	0	110.5	G336 Y337	D334-G336 PolarHBondContact O-N 3.14Å; D334-Y337 PolarHBondContact N-O 3.37Å; D334-Y337 WeakPolarHBondContact O-CA 3.29Å; D334-Y337 WeakPolarHBondContact O-CB 3.43Å; D334-Y337 PolarHBondContact O-N 3.24Å
335	E	76.1	Confident	80.8	Confident	160 Å²	160	47.7 Å²	47.7	75%	0.748	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	43	34	-177.9	-61.1	-169.9	142.1	0	0	116.2	Y337	E335-Y337 HydrophobicContact CB-CD2 4.46Å; E335-Y337 VanDerWaalsContact O-CD2 3.32Å; E335-Y337 WeakPolarHBondContact O-CD2 3.32Å
336	G	80.3	Confident	79.3	Confident	28 Å²	28	52.2 Å²	52.2	29%	0.289	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.2	11.7	-177	0	0	0	0	0	115.1	D334 L365	D334-G336 PolarHBondContact O-N 3.14Å; G336-L365 WeakPolarHBondContact O-CB 3.24Å; G336-L365 PolarHBondContact O-N 2.67Å
337	Y	86.1	Confident	77.6	Confident	76 Å²	76	52.4 Å²	52.4	30%	0.298	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	153.8	171.3	-63.3	-96.6	0	0	0	110.7	T333 D334 E335 K362 V363 P364	T333-Y337 CarbonylContact C-O 3.58Å; T333-Y337 VanDerWaalsContact CA-O 3.25Å; T333-Y337 WeakPolarHBondContact CA-O 3.45Å; D334-Y337 PolarHBondContact N-O 3.37Å; D334-Y337 WeakPolarHBondContact O-CA 3.29Å; D334-Y337 WeakPolarHBondContact O-CB 3.43Å; D334-Y337 PolarHBondContact O-N 3.24Å; E335-Y337 HydrophobicContact CB-CD2 4.46Å; E335-Y337 VanDerWaalsContact O-CD2 3.32Å; E335-Y337 WeakPolarHBondContact O-CD2 3.32Å; Y337-K362 HydrophobicContact CD1-CD 4.04Å; Y337-K362 HydrophobicContact CD1-CG 4.03Å; Y337-K362 HydrophobicContact CD2-CD 4.43Å; Y337-K362 HydrophobicContact CG-CD 3.86Å; Y337-K362 HydrophobicContact CG-CG 4.3Å; Y337-V363 CarbonylContact C-O 3.49Å; Y337-V363 WeakPolarHBondContact CA-O 3.43Å; Y337-P364 HydrophobicContact CD1-CB 4.13Å; Y337-P364 HydrophobicContact CE1-CB 4Å
338	I	86.6	Confident	75.9	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	133.5	165.8	-167	163.6	0	0	0	110.3	Y253 Y312 L330 T333 K362 V363 L365 F424	Y253-I338 HydrophobicContact CD2-CD1 3.76Å; Y253-I338 HydrophobicContact CE2-CD1 4.05Å; Y312-I338 HydrophobicContact CD1-CG2 3.55Å; Y312-I338 HydrophobicContact CD2-CG2 4.33Å; Y312-I338 HydrophobicContact CE1-CG2 4.14Å; Y312-I338 HydrophobicContact CG-CG2 3.67Å; L330-I338 HydrophobicContact CB-CD1 4.24Å; L330-I338 HydrophobicContact CD1-CD1 3.77Å; L330-I338 HydrophobicContact CD2-CD1 4.13Å; L330-I338 HydrophobicContact CD2-CG1 4.28Å; L330-I338 HydrophobicContact CG-CD1 4.26Å; T333-I338 HydrophobicContact CG2-CB 4.13Å; T333-I338 HydrophobicContact CG2-CD1 4.18Å; T333-I338 HydrophobicContact CG2-CG1 3.97Å; I338-K362 WeakPolarHBondContact O-CA 3.47Å; I338-V363 HydrophobicContact CG2-CB 4.38Å; I338-V363 PolarHBondContact N-O 3.08Å; I338-V363 PolarHBondContact O-N 3.47Å; I338-L365 HydrophobicContact CB-CD2 3.85Å; I338-L365 HydrophobicContact CB-CG 4.25Å; I338-L365 HydrophobicContact CD1-CD2 4.44Å; I338-L365 HydrophobicContact CG2-CD2 4.18Å; I338-F424 HydrophobicContact CD1-CZ 4.34Å
339	H	87.7	Confident	73.8	Confident	38 Å²	38	68.9 Å²	68.9	18%	0.176	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	142.6	-177.6	-73	-153.5	0	0	0	110.1	L330 T331 H332 G361 K362	L330-H339 WeakPolarHBondContact CA-O 3.33Å; T331-H339 PolarHBondContact N-O 3.21Å; T331-H339 PolarHBondContact OG1-O 2.98Å; H332-H339 AromaticContact CD2-CG 3.79Å; H332-H339 AromaticContact CD2-ND1 3.7Å; H332-H339 AromaticContact CE1-ND1 3.91Å; H332-H339 AromaticContact NE2-CE1 3.73Å; H332-H339 AromaticContact NE2-CG 3.55Å; H332-H339 AromaticContact NE2-ND1 3.01Å; H332-H339 PolarHBondContact NE2-ND1 2.69Å; H332-H339 PolarHBondContact O-N 2.95Å; H339-G361 WeakPolarHBondContact CA-O 3.46Å; H339-K362 WeakPolarHBondContact CD2-CB 3.42Å; H339-K362 WeakPolarHBondContact NE2-CD 3.4Å
340	W	87.4	Confident	71.4	Confident	29 Å²	29	70.2 Å²	70.2	11%	0.11	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	148.1	177	59.7	-96.8	0	0	0	111.3	L313 I317 F328 N329 L330 K360 G361	L313-W340 HydrophobicContact CD2-CB 4.34Å; L313-W340 HydrophobicContact CD2-CG 4.25Å; I317-W340 HydrophobicContact CD1-CZ2 3.98Å; I317-W340 HydrophobicContact CG1-CZ2 4.2Å; I317-W340 HydrophobicContact CG2-CH2 3.85Å; I317-W340 HydrophobicContact CG2-CZ2 3.84Å; F328-W340 HydrophobicContact CD1-CD2 4.46Å; F328-W340 AromaticContact CD1-CE3 3.83Å; F328-W340 HydrophobicContact CD1-CE3 3.83Å; F328-W340 HydrophobicContact CD1-CZ3 4.13Å; F328-W340 AromaticContact CE1-CE3 3.96Å; F328-W340 HydrophobicContact CE1-CE3 3.96Å; F328-W340 HydrophobicContact CE1-CH2 4.34Å; F328-W340 AromaticContact CE1-CZ3 3.78Å; F328-W340 HydrophobicContact CE1-CZ3 3.78Å; N329-W340 CarbonylContact O-C 3.59Å; N329-W340 VanDerWaalsContact O-CA 3.23Å; N329-W340 WeakPolarHBondContact O-CA 3.39Å; L330-W340 HydrophobicContact CD2-CB 4.2Å; W340-K360 WeakPolarHBondContact O-CA 3.35Å; W340-G361 PolarHBondContact N-O 2.92Å; W340-G361 PolarHBondContact O-N 2.92Å
341	I	86.1	Confident	69.1	Low	37 Å²	37	77.4 Å²	77.4	19%	0.19	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	136.9	172	-58.6	-172.4	0	0	0	108.5	F328 N329 T331 T358 M359 K360	F328-I341 CarbonylContact C-O 3.48Å; F328-I341 WeakPolarHBondContact CA-O 3.39Å; N329-I341 PolarHBondContact N-O 3.18Å; N329-I341 PolarHBondContact O-N 2.92Å; T331-I341 HydrophobicContact CG2-CB 4.32Å; T331-I341 HydrophobicContact CG2-CD1 3.77Å; T331-I341 HydrophobicContact CG2-CG1 3.72Å; I341-T358 HydrophobicContact CG2-CG2 4.33Å; I341-M359 CarbonylContact C-O 3.53Å; I341-M359 WeakPolarHBondContact CA-O 3.48Å; I341-K360 HydrophobicContact CD1-CD 4.17Å; I341-K360 HydrophobicContact CD1-CG 4.39Å; I341-K360 HydrophobicContact CG1-CD 4.32Å; I341-K360 HydrophobicContact CG1-CG 4.07Å
342	Y	82.3	Confident	66.9	Low	3 Å²	3	83.2 Å²	83.2	1%	0.012	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	115.8	170.3	-179.8	-102.4	0	0	0	110	V319 R324 A327 F328 V344 P345 M359	V319-Y342 HydrophobicContact CG1-CD1 4.47Å; V319-Y342 HydrophobicContact CG1-CE1 4.42Å; R324-Y342 HydrophobicContact CB-CE2 4.43Å; R324-Y342 PolarHBondContact NE-OH 3.21Å; R324-Y342 PolarHBondContact NH2-OH 3.05Å; A327-Y342 HydrophobicContact CB-CD2 4.38Å; A327-Y342 HydrophobicContact CB-CE2 3.7Å; A327-Y342 VanDerWaalsContact O-CD2 3.28Å; A327-Y342 WeakPolarHBondContact O-CD2 3.37Å; F328-Y342 AromaticContact CD1-CD2 3.78Å; F328-Y342 HydrophobicContact CD1-CD2 3.78Å; F328-Y342 HydrophobicContact CD1-CG 4.23Å; F328-Y342 AromaticContact CD2-CD2 3.42Å; F328-Y342 HydrophobicContact CD2-CD2 3.42Å; F328-Y342 VanDerWaalsContact CD2-CD2 3.42Å; F328-Y342 AromaticContact CD2-CE2 3.79Å; F328-Y342 HydrophobicContact CD2-CE2 3.79Å; F328-Y342 AromaticContact CE1-CD2 3.69Å; F328-Y342 HydrophobicContact CE1-CD2 3.69Å; F328-Y342 AromaticContact CE1-CG 3.92Å; F328-Y342 HydrophobicContact CE1-CG 3.92Å; F328-Y342 AromaticContact CE2-CD2 3.3Å; F328-Y342 HydrophobicContact CE2-CD2 3.3Å; F328-Y342 AromaticContact CE2-CE2 3.55Å; F328-Y342 HydrophobicContact CE2-CE2 3.55Å; F328-Y342 HydrophobicContact CE2-CG 4.22Å; F328-Y342 AromaticContact CG-CD2 3.64Å; F328-Y342 HydrophobicContact CG-CD2 3.64Å; F328-Y342 HydrophobicContact CG-CE2 4.43Å; F328-Y342 AromaticContact CZ-CD2 3.44Å; F328-Y342 HydrophobicContact CZ-CD2 3.44Å; F328-Y342 VanDerWaalsContact CZ-CD2 3.44Å; F328-Y342 HydrophobicContact CZ-CE2 4.03Å; F328-Y342 AromaticContact CZ-CG 3.91Å; F328-Y342 HydrophobicContact CZ-CG 3.91Å; Y342-V344 HydrophobicContact CD1-CG2 4.01Å; Y342-V344 HydrophobicContact CE1-CB 4.35Å; Y342-V344 HydrophobicContact CE1-CG2 3.84Å; Y342-P345 VanDerWaalsContact OH-CD 3.3Å; Y342-P345 WeakPolarHBondContact OH-CD 3.42Å; Y342-M359 PolarHBondContact N-O 3.38Å; Y342-M359 PolarHBondContact O-N 2.85Å; Y342-M359 VanDerWaalsContact O-N 3.07Å
343	N	76.5	Confident	64.7	Low	74 Å²	74	86 Å²	86	40%	0.396	48%	0.475	S	S	.	.			trans	-87.2	112.1	176.4	-69.8	-14.7	0	0	0	108.7	A327 P345	A327-N343 PolarHBondContact O-N 3.48Å; N343-P345 VanDerWaalsContact O-CD 3.27Å; N343-P345 WeakPolarHBondContact O-CD 3.47Å
344	V	69.5	Low	62.4	Low	66 Å²	66	88.1 Å²	88.1	40%	0.4	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-70.6	119.6	176.6	-176.6	0	0	0	0	109	Y342 S346 S357	Y342-V344 HydrophobicContact CD1-CG2 4.01Å; Y342-V344 HydrophobicContact CE1-CB 4.35Å; Y342-V344 HydrophobicContact CE1-CG2 3.84Å; V344-S346 PolarHBondContact O-N 2.99Å; V344-S357 WeakPolarHBondContact CG2-O 3.38Å
345	P	58.1	Low	60.4	Low	85 Å²	85	93.1 Å²	93.1	55%	0.552	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-65.2	130.1	170.9	-18.2	32	0	0	0	109.4	Y342 N343 S347	Y342-P345 VanDerWaalsContact OH-CD 3.3Å; Y342-P345 WeakPolarHBondContact OH-CD 3.42Å; N343-P345 VanDerWaalsContact O-CD 3.27Å; N343-P345 WeakPolarHBondContact O-CD 3.47Å; P345-S347 PolarHBondContact O-N 2.67Å
346	S	47.1	Very low	59	Low	106 Å²	106	96.4 Å²	96.4	74%	0.741	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-65.3	122.5	175.3	51.1	0	0	0	0	110.6	V344	V344-S346 PolarHBondContact O-N 2.99Å
347	S	40.3	Very low	58	Low	90 Å²	90	99.1 Å²	99.1	63%	0.629	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-57.8	139.7	159	41.2	0	0	0	0	109.4	P345 E349	P345-S347 PolarHBondContact O-N 2.67Å; S347-E349 PolarHBondContact O-N 3.25Å
348	K	43.4	Very low	57.2	Low	190 Å²	190	98.3 Å²	98.3	83%	0.826	54%	0.54	S	S	*	.	S	Bend	trans	-68.7	24.8	-175.9	-76.1	-165.8	166.2	-160.8	0	115
349	E	38.3	Very low	56.8	Low	179 Å²	179	103 Å²	103	84%	0.836	56%	0.563	S	S	*	*			trans	-134.4	56.2	-168.2	-65.3	-174.9	152.1	0	0	112.9	S347	S347-E349 PolarHBondContact O-N 3.25Å
350	S	33.8	Very low	56.6	Low	82 Å²	82	108.5 Å²	108.5	57%	0.573	59%	0.586	S	S	*	*			trans	-158.5	118.8	159.1	60.3	0	0	0	0	112.3	Q352	S350-Q352 VanDerWaalsContact C-N 3.31Å; S350-Q352 PolarHBondContact O-N 2.75Å
351	T	37.3	Very low	56.5	Low	158 Å²	158	108.2 Å²	108.2	97%	0.969	59%	0.592	S	S	*	*			trans	-90.1	53.9	179.9	40	0	0	0	0	112.8
352	Q	36.1	Very low	56.5	Low	161 Å²	161	111.1 Å²	111.1	75%	0.752	60%	0.604	S	S	*	*	S	Bend	trans	-139.4	152.1	169.7	-72.6	-168	-6.7	0	0	110.1	S350 A354	S350-Q352 VanDerWaalsContact C-N 3.31Å; S350-Q352 PolarHBondContact O-N 2.75Å; Q352-A354 PolarHBondContact O-N 2.98Å
353	P	37.1	Very low	56.7	Low	134 Å²	134	112 Å²	112	87%	0.87	61%	0.61	S	S	*	*			trans	-67.6	93.2	179.1	28.1	-34.7	0	0	0	110.2	E355	P353-E355 PolarHBondContact O-N 2.89Å
354	A	37.5	Very low	57.1	Low	74 Å²	74	110.5 Å²	110.5	61%	0.612	60%	0.604	S	S	*	*			trans	-72.2	120.2	-174	0	0	0	0	0	111.7	Q352 R356	Q352-A354 PolarHBondContact O-N 2.98Å; A354-R356 PolarHBondContact O-N 3.41Å
355	E	40.9	Very low	57.8	Low	186 Å²	186	107.4 Å²	107.4	87%	0.869	59%	0.585	S	S	*	*			trans	-53.7	121.5	160.8	-65.3	-174.4	142	0	0	108.8	P353 S357	P353-E355 PolarHBondContact O-N 2.89Å; E355-S357 PolarHBondContact O-N 3.4Å
356	R	47.3	Very low	59	Low	228 Å²	228	105 Å²	105	86%	0.86	57%	0.567	S	S	*	*			trans	-62.9	107	-178.9	-69.1	-179.6	178.2	176.2	-0.6	108.9	A354 T358	A354-R356 PolarHBondContact O-N 3.41Å; R356-T358 HydrophobicContact CB-CG2 4.37Å; R356-T358 PolarHBondContact O-N 3.4Å
357	S	58.2	Low	60.7	Low	86 Å²	86	104.2 Å²	104.2	60%	0.601	55%	0.55	S	S	*	*			trans	-74.8	64.4	-177.9	48.2	0	0	0	0	112.4	V344 E355 M359	V344-S357 WeakPolarHBondContact CG2-O 3.38Å; E355-S357 PolarHBondContact O-N 3.4Å; S357-M359 PolarHBondContact O-N 3.38Å
358	T	69.3	Low	62	Low	59 Å²	59	108.4 Å²	108.4	36%	0.362	56%	0.56	S	S	.	*			trans	-65.6	116	179	59.5	0	0	0	0	110.5	I341 R356	I341-T358 HydrophobicContact CG2-CG2 4.33Å; R356-T358 HydrophobicContact CB-CG2 4.37Å; R356-T358 PolarHBondContact O-N 3.4Å
359	M	78.9	Confident	63	Low	99 Å²	99	103.6 Å²	103.6	49%	0.488	55%	0.55	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	139.1	167	-72.9	-172.1	174.7	0	0	109.3	V319 I341 Y342 S357	V319-M359 HydrophobicContact CG2-SD 4.14Å; I341-M359 CarbonylContact C-O 3.53Å; I341-M359 WeakPolarHBondContact CA-O 3.48Å; Y342-M359 PolarHBondContact N-O 3.38Å; Y342-M359 PolarHBondContact O-N 2.85Å; Y342-M359 VanDerWaalsContact O-N 3.07Å; S357-M359 PolarHBondContact O-N 3.38Å
360	K	83.8	Confident	64	Low	153 Å²	153	101.1 Å²	101.1	67%	0.665	55%	0.553	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-122.8	148.8	176.5	-51.2	-168.2	-178.8	-178.6	0	109.8	W340 I341	W340-K360 WeakPolarHBondContact O-CA 3.35Å; I341-K360 HydrophobicContact CD1-CD 4.17Å; I341-K360 HydrophobicContact CD1-CG 4.39Å; I341-K360 HydrophobicContact CG1-CD 4.32Å; I341-K360 HydrophobicContact CG1-CG 4.07Å
361	G	84.4	Confident	65.7	Low	23 Å²	23	100.9 Å²	100.9	24%	0.237	54%	0.542	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	171.2	175.5	0	0	0	0	0	112.4	H339 W340	H339-G361 WeakPolarHBondContact CA-O 3.46Å; W340-G361 PolarHBondContact N-O 2.92Å; W340-G361 PolarHBondContact O-N 2.92Å
362	K	86.3	Confident	67.3	Low	97 Å²	97	99.8 Å²	99.8	42%	0.422	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	152.1	174.9	75.4	177.9	-169.9	167.3	0	112.7	Y337 I338 H339	Y337-K362 HydrophobicContact CD1-CD 4.04Å; Y337-K362 HydrophobicContact CD1-CG 4.03Å; Y337-K362 HydrophobicContact CD2-CD 4.43Å; Y337-K362 HydrophobicContact CG-CD 3.86Å; Y337-K362 HydrophobicContact CG-CG 4.3Å; I338-K362 WeakPolarHBondContact O-CA 3.47Å; H339-K362 WeakPolarHBondContact CD2-CB 3.42Å; H339-K362 WeakPolarHBondContact NE2-CD 3.4Å
363	V	85.6	Confident	69.2	Low	23 Å²	23	98.1 Å²	98.1	14%	0.139	53%	0.533	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	137.8	-177.8	-175.8	0	0	0	0	108	Y312 Y337 I338	Y312-V363 HydrophobicContact CD1-CG1 4.45Å; Y337-V363 CarbonylContact C-O 3.49Å; Y337-V363 WeakPolarHBondContact CA-O 3.43Å; I338-V363 HydrophobicContact CG2-CB 4.38Å; I338-V363 PolarHBondContact N-O 3.08Å; I338-V363 PolarHBondContact O-N 3.47Å
364	P	85.9	Confident	71.5	Confident	42 Å²	42	93.2 Å²	93.2	27%	0.273	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	143.9	178.2	27.7	-35.9	0	0	0	111.4	Y337 M366	Y337-P364 HydrophobicContact CD1-CB 4.13Å; Y337-P364 HydrophobicContact CE1-CB 4Å; P364-M366 VanDerWaalsContact C-N 3.34Å
365	L	84.8	Confident	73.9	Confident	0 Å²	0	94.4 Å²	94.4	0%	0	49%	0.493	C	S	.	.	S	Bend	trans	-74.5	-23.4	178.3	-78.7	165.9	0	0	0	113.3	Y253 A256 L257 M260 P310 Y312 T333 G336 I338	Y253-L365 HydrophobicContact CD2-CD2 3.79Å; Y253-L365 HydrophobicContact CE2-CD2 3.71Å; A256-L365 HydrophobicContact CB-CD1 3.87Å; L257-L365 HydrophobicContact CD2-CB 4.19Å; L257-L365 HydrophobicContact CD2-CD2 4.27Å; M260-L365 HydrophobicContact CE-CB 3.71Å; M260-L365 HydrophobicContact CE-CD1 3.68Å; M260-L365 HydrophobicContact CE-CG 4.34Å; P310-L365 WeakPolarHBondContact CD-O 3.49Å; P310-L365 WeakPolarHBondContact CG-O 3.38Å; Y312-L365 HydrophobicContact CE1-CD2 4.04Å; T333-L365 HydrophobicContact CG2-CD1 3.85Å; T333-L365 HydrophobicContact CG2-CD2 4.29Å; G336-L365 WeakPolarHBondContact O-CB 3.24Å; G336-L365 PolarHBondContact O-N 2.67Å; I338-L365 HydrophobicContact CB-CD2 3.85Å; I338-L365 HydrophobicContact CB-CG 4.25Å; I338-L365 HydrophobicContact CD1-CD2 4.44Å; I338-L365 HydrophobicContact CG2-CD2 4.18Å
366	M	83	Confident	76.3	Confident	36 Å²	36	86.2 Å²	86.2	18%	0.177	46%	0.456	C	S	.	.	S	Bend	trans	-124.2	161.2	179.9	-63.4	-59.3	-72.5	0	0	111.5	L257 M260 E261 L309 P364	L257-M366 HydrophobicContact CD2-SD 4.16Å; M260-M366 HydrophobicContact CB-CG 3.85Å; M260-M366 HydrophobicContact CB-SD 4.25Å; M260-M366 HydrophobicContact CE-CG 4.36Å; M260-M366 HydrophobicContact CG-CG 4.42Å; M260-M366 HydrophobicContact SD-CG 3.8Å; E261-M366 HydrophobicContact CB-CE 3.87Å; E261-M366 HydrophobicContact CB-SD 4.34Å; E261-M366 HydrophobicContact CG-CE 4.35Å; E261-M366 WeakPolarHBondContact OE2-CE 3.29Å; L309-M366 HydrophobicContact CD2-CE 3.85Å; L309-M366 HydrophobicContact CD2-SD 3.49Å; L309-M366 WeakPolarHBondContact CD2-SD 3.34Å; P364-M366 VanDerWaalsContact C-N 3.34Å
367	F	81.9	Confident	78.3	Confident	89 Å²	89	75.4 Å²	75.4	39%	0.39	42%	0.415	S	S	.	.			trans	-69	142.4	167.9	-66.2	-68.6	0	0	0	111.1	P307 L308 P310 S369	P307-F367 HydrophobicContact CB-CE2 4.24Å; P307-F367 HydrophobicContact CB-CZ 4.22Å; P307-F367 HydrophobicContact CG-CE2 4.3Å; P307-F367 HydrophobicContact CG-CZ 4Å; P307-F367 VanDerWaalsContact O-CE2 3.3Å; P307-F367 WeakPolarHBondContact O-CE2 3.49Å; L308-F367 WeakPolarHBondContact O-CD2 3.49Å; P310-F367 HydrophobicContact CB-CD1 4.22Å; P310-F367 HydrophobicContact CB-CE1 3.83Å; P310-F367 HydrophobicContact CB-CE2 4.38Å; P310-F367 HydrophobicContact CB-CZ 3.92Å; F367-S369 PolarHBondContact O-N 3.33Å
368	Q	67.9	Low	79.9	Confident	178 Å²	178	73.5 Å²	73.5	83%	0.832	40%	0.398	S	S	*	.	S	Bend	trans	-75.2	-3.2	-179	-66.6	-179.3	-29.7	0	0	114.1
369	S	63.8	Low	81	Confident	88 Å²	88	70.7 Å²	70.7	62%	0.615	38%	0.381	S	S	*	.	S	Bend	trans	-123.9	127.4	178.9	55	0	0	0	0	109.4	F367 H371	F367-S369 PolarHBondContact O-N 3.33Å; S369-H371 PolarHBondContact O-N 2.93Å
370	S	59.9	Low	81.7	Confident	128 Å²	128	66 Å²	66	90%	0.895	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-56	132.5	174.5	-51.1	0	0	0	0	111.4
371	H	70.3	Confident	82.1	Confident	76 Å²	76	59 Å²	59	35%	0.352	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-76.2	164.1	172.9	53.5	-108.5	0	0	0	111.3	E261 L308 S369	E261-H371 IonicContact OE2-CE1 2.66Å; E261-H371 PolarHBondContact OE2-CE1 3.45Å; E261-H371 VanDerWaalsContact OE2-CE1 3.27Å; L308-H371 HydrophobicContact CD2-CB 3.83Å; S369-H371 PolarHBondContact O-N 2.93Å
372	L	71.6	Confident	82.4	Confident	135 Å²	135	61.1 Å²	61.1	71%	0.707	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-64.2	139.4	170.5	-76.8	162.8	0	0	0	109.9	V374	L372-V374 WeakPolarHBondContact O-CG2 3.4Å; L372-V374 PolarHBondContact O-N 3Å
373	P	75.4	Confident	82.8	Confident	126 Å²	126	56.7 Å²	56.7	82%	0.818	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-62.2	125.4	-178.1	25.9	-34.2	0	0	0	111.1
374	V	84.3	Confident	83.2	Confident	32 Å²	32	55.7 Å²	55.7	19%	0.194	31%	0.306	C	S	.	.			trans	-117.7	135.6	176.6	-167.7	0	0	0	0	109	L372 L378 L379	L372-V374 WeakPolarHBondContact O-CG2 3.4Å; L372-V374 PolarHBondContact O-N 3Å; V374-L378 HydrophobicContact CG1-CD2 4.19Å; V374-L379 HydrophobicContact CB-CD1 4.43Å; V374-L379 HydrophobicContact CB-CG 4.48Å; V374-L379 HydrophobicContact CG1-CD1 4.32Å; V374-L379 HydrophobicContact CG1-CD2 3.9Å; V374-L379 HydrophobicContact CG1-CG 3.85Å
375	E	88.6	Confident	83.4	Confident	98 Å²	98	56.8 Å²	56.8	46%	0.458	31%	0.305	S	S	.	.			trans	-75.8	140.3	175.7	-72.4	-175.6	-142.2	0	0	112.1	I122 G377 L378 L379	I122-E375 HydrophobicContact CG2-CB 3.64Å; I122-E375 HydrophobicContact CG2-CG 4.47Å; E375-G377 VanDerWaalsContact C-N 3.32Å; E375-G377 PolarHBondContact O-N 3.31Å; E375-L378 PolarHBondContact O-N 3.23Å; E375-L378 VanDerWaalsContact O-N 3.12Å; E375-L379 PolarHBondContact O-N 2.93Å
376	V	90.6	Very high	83.8	Confident	15 Å²	15	58 Å²	58	9%	0.091	31%	0.31	C	S	.	.	H	α-helix	trans	-58.5	-41.7	-175.9	-178.7	0	0	0	0	111.6	T126 L129 L263 P266 L267 L378 L379 W380	T126-V376 HydrophobicContact CG2-CB 4.26Å; L129-V376 HydrophobicContact CD1-CG1 3.78Å; L263-V376 HydrophobicContact CD2-CG2 3.79Å; P266-V376 HydrophobicContact CB-CG1 3.95Å; L267-V376 HydrophobicContact CD2-CG1 3.81Å; L267-V376 HydrophobicContact CG-CG1 4.06Å; V376-L378 PolarHBondContact O-N 3.26Å; V376-L379 PolarHBondContact O-N 3.12Å; V376-L379 VanDerWaalsContact O-N 3.13Å; V376-W380 PolarHBondContact O-N 2.85Å
377	G	89.6	Confident	84.3	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.6	-29.4	179.6	0	0	0	0	0	113.9	T126 E375 I381	T126-G377 WeakPolarHBondContact OG1-CA 3.35Å; T126-G377 PolarHBondContact OG1-N 3.4Å; E375-G377 VanDerWaalsContact C-N 3.32Å; E375-G377 PolarHBondContact O-N 3.31Å; G377-I381 WeakPolarHBondContact O-CD1 3.49Å; G377-I381 VanDerWaalsContact O-CG1 3.31Å; G377-I381 WeakPolarHBondContact O-CG1 3.48Å; G377-I381 PolarHBondContact O-N 2.99Å
378	L	91.7	Very high	84.6	Confident	47 Å²	47	52.9 Å²	52.9	25%	0.246	29%	0.288	C	S	.	.	H	α-helix	trans	-72.7	-44.6	174.2	179.2	60.9	0	0	0	110.6	P117 I122 V374 E375 V376 W380 I381 E382	P117-L378 HydrophobicContact CG-CD1 4.14Å; I122-L378 HydrophobicContact CD1-CB 4.28Å; I122-L378 HydrophobicContact CD1-CD1 4.19Å; I122-L378 HydrophobicContact CG1-CB 4.41Å; I122-L378 HydrophobicContact CG2-CB 3.95Å; V374-L378 HydrophobicContact CG1-CD2 4.19Å; E375-L378 PolarHBondContact O-N 3.23Å; E375-L378 VanDerWaalsContact O-N 3.12Å; V376-L378 PolarHBondContact O-N 3.26Å; L378-W380 VanDerWaalsContact C-N 3.26Å; L378-W380 PolarHBondContact O-N 2.97Å; L378-I381 PolarHBondContact O-N 2.85Å; L378-E382 HydrophobicContact CD1-CG 4.25Å; L378-E382 HydrophobicContact CG-CG 4.45Å; L378-E382 WeakPolarHBondContact O-CB 3.5Å; L378-E382 WeakPolarHBondContact O-CG 3.37Å; L378-E382 PolarHBondContact O-N 2.74Å
379	L	92.4	Very high	85.5	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-61.3	-35.7	175.8	-64.7	174.5	0	0	0	112	L263 L267 L301 L308 V374 E375 V376 M383	L263-L379 HydrophobicContact CB-CD1 4.35Å; L263-L379 HydrophobicContact CD1-CD1 4Å; L263-L379 HydrophobicContact CD2-CD1 4.42Å; L263-L379 HydrophobicContact CG-CD1 4.5Å; L267-L379 HydrophobicContact CD1-CB 3.97Å; L267-L379 HydrophobicContact CD1-CD1 4.23Å; L267-L379 HydrophobicContact CD2-CB 4.19Å; L301-L379 HydrophobicContact CD2-CD1 4.4Å; L308-L379 HydrophobicContact CD1-CD1 3.91Å; L308-L379 HydrophobicContact CD1-CD2 3.84Å; V374-L379 HydrophobicContact CB-CD1 4.43Å; V374-L379 HydrophobicContact CB-CG 4.48Å; V374-L379 HydrophobicContact CG1-CD1 4.32Å; V374-L379 HydrophobicContact CG1-CD2 3.9Å; V374-L379 HydrophobicContact CG1-CG 3.85Å; E375-L379 PolarHBondContact O-N 2.93Å; V376-L379 PolarHBondContact O-N 3.12Å; V376-L379 VanDerWaalsContact O-N 3.13Å; L379-M383 WeakPolarHBondContact O-CB 3.29Å; L379-M383 PolarHBondContact O-N 2.68Å
380	W	93.8	Very high	86.7	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-62.8	-51.7	174.3	180	-107.7	0	0	0	112.3	V125 L129 L267 G270 L271 W274 V376 L378 M383 L384 F454 F637	V125-W380 HydrophobicContact CG1-CG 4.32Å; L129-W380 HydrophobicContact CD1-CB 3.71Å; L129-W380 HydrophobicContact CD1-CD2 4.08Å; L129-W380 HydrophobicContact CD1-CE3 4.45Å; L129-W380 HydrophobicContact CD1-CG 3.77Å; L129-W380 HydrophobicContact CD2-CD2 3.92Å; L129-W380 HydrophobicContact CD2-CE3 3.96Å; L129-W380 HydrophobicContact CD2-CG 4.42Å; L129-W380 HydrophobicContact CD2-CH2 4.43Å; L129-W380 HydrophobicContact CD2-CZ2 4.38Å; L129-W380 HydrophobicContact CD2-CZ3 4.22Å; L267-W380 HydrophobicContact CD2-CB 4.03Å; L267-W380 HydrophobicContact CD2-CE3 4.17Å; G270-W380 VanDerWaalsContact C-CH2 3.43Å; G270-W380 WeakPolarHBondContact O-CH2 3.32Å; L271-W380 HydrophobicContact CB-CH2 4.34Å; L271-W380 HydrophobicContact CB-CZ3 3.98Å; L271-W380 HydrophobicContact CD1-CH2 4.35Å; L271-W380 HydrophobicContact CD1-CZ3 4.41Å; W274-W380 HydrophobicContact CB-CH2 4.38Å; V376-W380 PolarHBondContact O-N 2.85Å; L378-W380 VanDerWaalsContact C-N 3.26Å; L378-W380 PolarHBondContact O-N 2.97Å; W380-M383 HydrophobicContact CE3-CE 3.61Å; W380-M383 HydrophobicContact CZ3-CE 3.68Å; W380-M383 PolarHBondContact O-N 2.77Å; W380-L384 HydrophobicContact CD2-CD1 4.28Å; W380-L384 HydrophobicContact CG-CD1 4.33Å; W380-L384 HydrophobicContact CZ2-CD1 4.24Å; W380-L384 WeakPolarHBondContact O-CB 3.39Å; W380-L384 WeakPolarHBondContact O-CG 3.42Å; W380-L384 PolarHBondContact O-N 2.9Å; W380-F454 AromaticContact CE2-CE2 3.99Å; W380-F454 HydrophobicContact CZ2-CD2 4.48Å; W380-F454 AromaticContact CZ2-CE2 4Å; W380-F454 HydrophobicContact CZ2-CE2 4Å; W380-F454 AromaticContact NE1-CD1 3.95Å; W380-F454 AromaticContact NE1-CD2 3.21Å; W380-F454 AromaticContact NE1-CE2 3.34Å; W380-F454 VanDerWaalsContact NE1-CE2 3.34Å; W380-F454 AromaticContact NE1-CG 3.53Å; W380-F454 AromaticContact NE1-CZ 3.77Å; W380-F637 HydrophobicContact CH2-CE1 4.47Å; W380-F637 HydrophobicContact CH2-CZ 4.47Å; W380-F637 HydrophobicContact CZ2-CE1 4.2Å; W380-F637 AromaticContact CZ2-CZ 3.98Å; W380-F637 HydrophobicContact CZ2-CZ 3.98Å
381	I	91.6	Very high	88.1	Confident	7 Å²	7	41.5 Å²	41.5	4%	0.036	21%	0.211	C	C	.	.	H	α-helix	trans	-64.6	-42.1	178.9	-64.2	165.5	0	0	0	111	P117 V125 G377 L378 L384 R385 Y451 F454 A455	P117-I381 HydrophobicContact CB-CD1 4.03Å; P117-I381 HydrophobicContact CG-CD1 3.83Å; P117-I381 HydrophobicContact CG-CG2 4.46Å; V125-I381 HydrophobicContact CG2-CD1 4.31Å; G377-I381 WeakPolarHBondContact O-CD1 3.49Å; G377-I381 VanDerWaalsContact O-CG1 3.31Å; G377-I381 WeakPolarHBondContact O-CG1 3.48Å; G377-I381 PolarHBondContact O-N 2.99Å; L378-I381 PolarHBondContact O-N 2.85Å; I381-L384 PolarHBondContact O-N 3.41Å; I381-R385 WeakPolarHBondContact O-CB 3.49Å; I381-R385 PolarHBondContact O-N 2.69Å; I381-Y451 HydrophobicContact CG2-CE2 4.06Å; I381-F454 WeakPolarHBondContact CD1-O 3.4Å; I381-F454 HydrophobicContact CG1-CB 4.24Å; I381-F454 WeakPolarHBondContact CG1-O 3.33Å; I381-A455 HydrophobicContact CG2-CB 4.31Å
382	E	92.1	Very high	88.8	Confident	67 Å²	67	42.8 Å²	42.8	31%	0.313	22%	0.22	S	C	.	.	H	α-helix	trans	-63.8	-39.5	175	-76.8	-173.8	173.1	0	0	112.6	Y300 R304 L378 R385 F386	Y300-E382 HydrophobicContact CE2-CB 4.25Å; Y300-E382 WeakPolarHBondContact OH-CB 3.41Å; Y300-E382 PolarHBondContact OH-OE2 2.75Å; R304-E382 IonicContact CZ-OE2 3.93Å; R304-E382 VanDerWaalsContact CZ-OE2 3.27Å; R304-E382 IonicContact NE-OE2 2.75Å; R304-E382 PolarHBondContact NE-OE2 2.74Å; R304-E382 IonicContact NH2-OE1 3.93Å; R304-E382 PolarHBondContact NH2-OE1 3.09Å; R304-E382 IonicContact NH2-OE2 3.11Å; R304-E382 PolarHBondContact NH2-OE2 3.24Å; L378-E382 HydrophobicContact CD1-CG 4.25Å; L378-E382 HydrophobicContact CG-CG 4.45Å; L378-E382 WeakPolarHBondContact O-CB 3.5Å; L378-E382 WeakPolarHBondContact O-CG 3.37Å; L378-E382 PolarHBondContact O-N 2.74Å; E382-R385 PolarHBondContact O-N 3.33Å; E382-F386 WeakPolarHBondContact O-CB 3.25Å; E382-F386 PolarHBondContact O-N 2.95Å
383	M	94.6	Very high	89.5	Confident	3 Å²	3	37 Å²	37	2%	0.015	19%	0.189	C	C	.	.	H	α-helix	trans	-65.9	-45.2	176.9	-178.7	179.9	69.8	0	0	111.7	L271 V297 Y300 L379 W380 R385 F386 Y387	L271-M383 HydrophobicContact CB-CE 4.42Å; L271-M383 HydrophobicContact CD1-CE 4.15Å; L271-M383 HydrophobicContact CD2-CE 4.12Å; L271-M383 HydrophobicContact CD2-SD 4.4Å; L271-M383 HydrophobicContact CG-CE 4.47Å; V297-M383 HydrophobicContact CB-SD 4.34Å; V297-M383 HydrophobicContact CG1-SD 4.48Å; V297-M383 HydrophobicContact CG2-CE 4.38Å; V297-M383 HydrophobicContact CG2-SD 3.74Å; Y300-M383 HydrophobicContact CD1-CB 3.69Å; Y300-M383 HydrophobicContact CD1-CG 3.81Å; Y300-M383 HydrophobicContact CD1-SD 4.21Å; Y300-M383 HydrophobicContact CD2-CB 4.15Å; Y300-M383 HydrophobicContact CD2-CG 4.34Å; Y300-M383 HydrophobicContact CE1-CB 3.75Å; Y300-M383 HydrophobicContact CE1-CG 4.39Å; Y300-M383 HydrophobicContact CE2-CB 4.19Å; Y300-M383 HydrophobicContact CG-CB 3.92Å; Y300-M383 HydrophobicContact CG-CG 3.8Å; L379-M383 WeakPolarHBondContact O-CB 3.29Å; L379-M383 PolarHBondContact O-N 2.68Å; W380-M383 HydrophobicContact CE3-CE 3.61Å; W380-M383 HydrophobicContact CZ3-CE 3.68Å; W380-M383 PolarHBondContact O-N 2.77Å; M383-R385 VanDerWaalsContact C-N 3.32Å; M383-R385 PolarHBondContact O-N 2.86Å; M383-F386 PolarHBondContact O-N 3.37Å; M383-Y387 HydrophobicContact CG-CD2 3.95Å; M383-Y387 HydrophobicContact CG-CE2 4.04Å; M383-Y387 PolarHBondContact O-N 3.26Å
384	L	92.9	Very high	89.8	Confident	2 Å²	2	32.4 Å²	32.4	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-61.6	-40.7	175.3	-73.7	171.4	0	0	0	111	W380 I381 S388 L447 T450 Y451 F454	W380-L384 HydrophobicContact CD2-CD1 4.28Å; W380-L384 HydrophobicContact CG-CD1 4.33Å; W380-L384 HydrophobicContact CZ2-CD1 4.24Å; W380-L384 WeakPolarHBondContact O-CB 3.39Å; W380-L384 WeakPolarHBondContact O-CG 3.42Å; W380-L384 PolarHBondContact O-N 2.9Å; I381-L384 PolarHBondContact O-N 3.41Å; L384-S388 WeakPolarHBondContact O-CB 3.42Å; L384-S388 PolarHBondContact O-N 3.31Å; L384-S388 PolarHBondContact O-OG 3.25Å; L384-L447 HydrophobicContact CD2-CD2 4.15Å; L384-T450 HydrophobicContact CD1-CG2 3.93Å; L384-T450 HydrophobicContact CD2-CG2 3.95Å; L384-Y451 HydrophobicContact CB-CD2 3.93Å; L384-Y451 HydrophobicContact CB-CG 4.35Å; L384-F454 HydrophobicContact CD1-CB 4.33Å; L384-F454 HydrophobicContact CD1-CD2 3.88Å
385	R	91.6	Very high	89.8	Confident	66 Å²	66	34.3 Å²	34.3	25%	0.249	17%	0.171	C	C	.	.	H	α-helix	trans	-62	-46.9	172.3	-167.7	-177.9	173.3	98.2	-0.8	111.9	A112 I381 E382 M383 Y387 S388 L389 E390 Y451	A112-R385 PolarHBondContact O-NH1 2.92Å; A112-R385 PolarHBondContact O-NH2 2.85Å; I381-R385 WeakPolarHBondContact O-CB 3.49Å; I381-R385 PolarHBondContact O-N 2.69Å; E382-R385 PolarHBondContact O-N 3.33Å; M383-R385 VanDerWaalsContact C-N 3.32Å; M383-R385 PolarHBondContact O-N 2.86Å; R385-Y387 PolarHBondContact O-N 3.3Å; R385-S388 PolarHBondContact O-N 3.17Å; R385-L389 HydrophobicContact CG-CD1 4Å; R385-L389 WeakPolarHBondContact O-CB 3.09Å; R385-L389 PolarHBondContact O-N 3.35Å; R385-E390 IonicContact NE-OE1 2.67Å; R385-E390 PolarHBondContact NE-OE1 3.31Å; R385-Y451 HydrophobicContact CB-CD2 4.05Å; R385-Y451 HydrophobicContact CB-CE2 3.52Å; R385-Y451 HydrophobicContact CG-CE1 4.32Å; R385-Y451 HydrophobicContact CG-CE2 4Å; R385-Y451 PolarHBondContact NH1-OH 2.84Å
386	F	92.9	Very high	89.9	Confident	26 Å²	26	31.2 Å²	31.2	11%	0.114	16%	0.158	C	C	.	.	I	π-helix	trans	-57.4	-51.1	-178.3	175	-101.5	0	0	0	111.4	F299 Y300 K303 E382 M383 E390 F391	F299-F386 HydrophobicContact CD1-CE1 4.15Å; F299-F386 HydrophobicContact CD1-CZ 4.41Å; F299-F386 HydrophobicContact CE1-CE1 4.11Å; F299-F386 HydrophobicContact CE1-CZ 4.04Å; Y300-F386 HydrophobicContact CD2-CB 3.88Å; Y300-F386 AromaticContact CD2-CD1 3.92Å; Y300-F386 HydrophobicContact CD2-CD1 3.92Å; Y300-F386 AromaticContact CD2-CG 3.88Å; Y300-F386 HydrophobicContact CD2-CG 3.88Å; Y300-F386 HydrophobicContact CE2-CB 4.17Å; K303-F386 HydrophobicContact CB-CE2 4.32Å; K303-F386 HydrophobicContact CB-CZ 4.03Å; K303-F386 HydrophobicContact CG-CZ 4.42Å; E382-F386 WeakPolarHBondContact O-CB 3.25Å; E382-F386 PolarHBondContact O-N 2.95Å; M383-F386 PolarHBondContact O-N 3.37Å; F386-E390 HydrophobicContact CD2-CB 4.2Å; F386-E390 PolarHBondContact O-N 3.23Å; F386-F391 HydrophobicContact CD1-CB 4.14Å; F386-F391 HydrophobicContact CD2-CB 4.44Å; F386-F391 HydrophobicContact CE1-CB 3.76Å; F386-F391 HydrophobicContact CE1-CD2 4.41Å; F386-F391 HydrophobicContact CE1-CG 4.03Å; F386-F391 HydrophobicContact CE2-CB 4.08Å; F386-F391 HydrophobicContact CG-CB 4.47Å; F386-F391 HydrophobicContact CZ-CB 3.73Å; F386-F391 AromaticContact CZ-CD2 3.97Å; F386-F391 HydrophobicContact CZ-CD2 3.97Å; F386-F391 AromaticContact CZ-CG 3.99Å; F386-F391 HydrophobicContact CZ-CG 3.99Å; F386-F391 PolarHBondContact O-N 2.9Å
387	Y	92.8	Very high	89.9	Confident	5 Å²	5	30.5 Å²	30.5	2%	0.02	15%	0.153	C	C	.	.	I	π-helix	trans	-74.9	-25	179	-74.7	-63.1	0	0	0	114.3	M296 F299 M383 R385 F391 M393 I398	M296-Y387 WeakPolarHBondContact CA-OH 3.48Å; M296-Y387 HydrophobicContact CB-CE2 4.12Å; M296-Y387 HydrophobicContact CE-CD1 4Å; M296-Y387 HydrophobicContact CE-CD2 4.11Å; M296-Y387 HydrophobicContact CE-CE1 3.95Å; M296-Y387 HydrophobicContact CE-CE2 4.04Å; M296-Y387 HydrophobicContact CE-CG 4.09Å; M296-Y387 PolarHBondContact O-OH 2.95Å; F299-Y387 WeakPolarHBondContact CD1-OH 3.45Å; M383-Y387 HydrophobicContact CG-CD2 3.95Å; M383-Y387 HydrophobicContact CG-CE2 4.04Å; M383-Y387 PolarHBondContact O-N 3.26Å; R385-Y387 PolarHBondContact O-N 3.3Å; Y387-F391 HydrophobicContact CD1-CD1 4.03Å; Y387-F391 AromaticContact CE1-CD1 3.95Å; Y387-F391 HydrophobicContact CE1-CD1 3.95Å; Y387-F391 HydrophobicContact CE1-CE1 4.45Å; Y387-M393 HydrophobicContact CD1-CG 4.42Å; Y387-M393 HydrophobicContact CD1-SD 4.11Å; Y387-I398 HydrophobicContact CE1-CD1 3.63Å; Y387-I398 HydrophobicContact CE1-CG1 4.48Å
388	S	89.3	Confident	90	Very high	11 Å²	11	30.6 Å²	30.6	8%	0.077	15%	0.154	C	C	.	.	I	π-helix	trans	-82.7	-31.7	178.3	-59.2	0	0	0	0	114.1	L384 R385 L447	L384-S388 WeakPolarHBondContact O-CB 3.42Å; L384-S388 PolarHBondContact O-N 3.31Å; L384-S388 PolarHBondContact O-OG 3.25Å; R385-S388 PolarHBondContact O-N 3.17Å; S388-L447 PolarHBondContact OG-O 3.29Å
389	L	86.7	Confident	90	Very high	30 Å²	30	28.4 Å²	28.4	16%	0.157	14%	0.142	C	C	.	.	I	π-helix	trans	-131.5	-32.8	-167.2	-56.6	-179.8	0	0	0	115.4	Q108 L111 A112 R385 Y451	Q108-L389 HydrophobicContact CG-CD2 3.85Å; L111-L389 HydrophobicContact CB-CD1 4.03Å; L111-L389 HydrophobicContact CB-CD2 3.83Å; L111-L389 HydrophobicContact CB-CG 4.46Å; L111-L389 HydrophobicContact CD1-CD2 4.24Å; A112-L389 HydrophobicContact CB-CD1 4.36Å; R385-L389 HydrophobicContact CG-CD1 4Å; R385-L389 WeakPolarHBondContact O-CB 3.09Å; R385-L389 PolarHBondContact O-N 3.35Å; L389-Y451 HydrophobicContact CD1-CE1 3.97Å
390	E	88.1	Confident	89.9	Confident	107 Å²	107	28.5 Å²	28.5	50%	0.5	14%	0.143	S	C	.	.	I	π-helix	trans	-102.5	-34.3	-166.9	-52.2	-167.4	174.5	0	0	113.2	R385 F386	R385-E390 IonicContact NE-OE1 2.67Å; R385-E390 PolarHBondContact NE-OE1 3.31Å; F386-E390 HydrophobicContact CD2-CB 4.2Å; F386-E390 PolarHBondContact O-N 3.23Å
391	F	89.7	Confident	89.7	Confident	18 Å²	18	28.6 Å²	28.6	8%	0.079	14%	0.143	C	C	.	.	S	Bend	trans	-101.5	110	-178.5	-176	-105.6	0	0	0	112.1	F299 F386 Y387 M393 N396 I398 V405	F299-F391 HydrophobicContact CE1-CD2 4.07Å; F299-F391 HydrophobicContact CE1-CE1 4.39Å; F299-F391 AromaticContact CE1-CE2 3.69Å; F299-F391 HydrophobicContact CE1-CE2 3.69Å; F299-F391 AromaticContact CE1-CZ 3.87Å; F299-F391 HydrophobicContact CE1-CZ 3.87Å; F299-F391 HydrophobicContact CZ-CD2 4.49Å; F299-F391 AromaticContact CZ-CE2 3.76Å; F299-F391 HydrophobicContact CZ-CE2 3.76Å; F299-F391 HydrophobicContact CZ-CZ 4Å; F386-F391 HydrophobicContact CD1-CB 4.14Å; F386-F391 HydrophobicContact CD2-CB 4.44Å; F386-F391 HydrophobicContact CE1-CB 3.76Å; F386-F391 HydrophobicContact CE1-CD2 4.41Å; F386-F391 HydrophobicContact CE1-CG 4.03Å; F386-F391 HydrophobicContact CE2-CB 4.08Å; F386-F391 HydrophobicContact CG-CB 4.47Å; F386-F391 HydrophobicContact CZ-CB 3.73Å; F386-F391 AromaticContact CZ-CD2 3.97Å; F386-F391 HydrophobicContact CZ-CD2 3.97Å; F386-F391 AromaticContact CZ-CG 3.99Å; F386-F391 HydrophobicContact CZ-CG 3.99Å; F386-F391 PolarHBondContact O-N 2.9Å; Y387-F391 HydrophobicContact CD1-CD1 4.03Å; Y387-F391 AromaticContact CE1-CD1 3.95Å; Y387-F391 HydrophobicContact CE1-CD1 3.95Å; Y387-F391 HydrophobicContact CE1-CE1 4.45Å; F391-M393 HydrophobicContact CD1-CB 4.5Å; F391-M393 HydrophobicContact CD1-CG 3.58Å; F391-M393 HydrophobicContact CE1-CG 3.83Å; F391-M393 PolarHBondContact O-N 2.87Å; F391-N396 HydrophobicContact CE2-CB 3.75Å; F391-N396 HydrophobicContact CZ-CB 3.63Å; F391-I398 HydrophobicContact CE1-CD1 4Å; F391-I398 HydrophobicContact CE1-CG1 3.5Å; F391-I398 VanDerWaalsContact CE1-CG1 3.5Å; F391-I398 HydrophobicContact CZ-CG1 3.77Å; F391-V405 HydrophobicContact CE2-CG1 4.25Å
392	I	85.7	Confident	89.5	Confident	103 Å²	103	28.4 Å²	28.4	53%	0.528	14%	0.143	S	C	.	.			trans	-73.5	88	179	-52.1	173.9	0	0	0	109.7	A394 D395 N396	I392-A394 PolarHBondContact O-N 3.27Å; I392-D395 HydrophobicContact CG2-CB 4.32Å; I392-D395 PolarHBondContact O-N 2.71Å; I392-N396 PolarHBondContact O-N 3.13Å; I392-N396 PolarHBondContact O-ND2 2.88Å
393	M	85.6	Confident	89.1	Confident	14 Å²	14	30 Å²	30	7%	0.069	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-30.3	-178.4	-74.8	-166.1	-82.7	0	0	113.7	Y387 F391 D395 R408 F440 L444 L447	Y387-M393 HydrophobicContact CD1-CG 4.42Å; Y387-M393 HydrophobicContact CD1-SD 4.11Å; F391-M393 HydrophobicContact CD1-CB 4.5Å; F391-M393 HydrophobicContact CD1-CG 3.58Å; F391-M393 HydrophobicContact CE1-CG 3.83Å; F391-M393 PolarHBondContact O-N 2.87Å; M393-D395 VanDerWaalsContact C-N 3.34Å; M393-D395 PolarHBondContact O-N 2.88Å; M393-R408 PolarHBondContact O-NH2 2.89Å; M393-F440 HydrophobicContact CB-CE2 4.47Å; M393-L444 HydrophobicContact CE-CD1 4.07Å; M393-L447 HydrophobicContact CE-CD1 3.73Å
394	A	81.9	Confident	88.6	Confident	30 Å²	30	31.2 Å²	31.2	25%	0.248	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-26.8	-174.7	0	0	0	0	0	114.8	I392 R408 F440	I392-A394 PolarHBondContact O-N 3.27Å; A394-R408 WeakPolarHBondContact O-CD 3.06Å; A394-R408 PolarHBondContact O-NE 3.45Å; A394-F440 HydrophobicContact CB-CZ 4.09Å
395	D	84.9	Confident	88.2	Confident	72 Å²	72	34.8 Å²	34.8	39%	0.385	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.6	-25.4	-173.2	-67.3	-53.8	0	0	0	113.8	I392 M393 R408	I392-D395 HydrophobicContact CG2-CB 4.32Å; I392-D395 PolarHBondContact O-N 2.71Å; M393-D395 VanDerWaalsContact C-N 3.34Å; M393-D395 PolarHBondContact O-N 2.88Å; D395-R408 WeakPolarHBondContact O-CD 3.44Å; D395-R408 VanDerWaalsContact O-CG 3.32Å; D395-R408 WeakPolarHBondContact O-CG 3.2Å; D395-R408 PolarHBondContact O-N 2.89Å
396	N	90.1	Very high	87.9	Confident	33 Å²	33	31.8 Å²	31.8	18%	0.176	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	169.3	-177.2	-60.6	-76.1	0	0	0	112	F391 I392 V405 L406 R408	F391-N396 HydrophobicContact CE2-CB 3.75Å; F391-N396 HydrophobicContact CZ-CB 3.63Å; I392-N396 PolarHBondContact O-N 3.13Å; I392-N396 PolarHBondContact O-ND2 2.88Å; N396-V405 HydrophobicContact CB-CG1 4Å; N396-V405 VanDerWaalsContact OD1-CG1 3.25Å; N396-V405 WeakPolarHBondContact OD1-CG1 3.39Å; N396-L406 CarbonylContact C-O 3.6Å; N396-L406 WeakPolarHBondContact CA-O 3.44Å; N396-R408 PolarHBondContact O-NE 3.42Å; N396-R408 PolarHBondContact O-NH2 3.34Å
397	V	89.9	Confident	87.6	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	131.8	174.5	-177.5	0	0	0	0	109.9	S399 L406 R408 W413 A419 E421	V397-S399 PolarHBondContact O-N 2.97Å; V397-L406 HydrophobicContact CB-CB 4.28Å; V397-L406 PolarHBondContact N-O 2.8Å; V397-R408 HydrophobicContact CG2-CG 3.84Å; V397-W413 HydrophobicContact CB-CZ3 4.49Å; V397-W413 HydrophobicContact CG1-CE3 4.24Å; V397-W413 HydrophobicContact CG1-CH2 4.34Å; V397-W413 HydrophobicContact CG1-CZ3 3.57Å; V397-W413 HydrophobicContact CG2-CE3 3.85Å; V397-W413 HydrophobicContact CG2-CZ3 4.07Å; V397-A419 HydrophobicContact CB-CB 4.39Å; V397-A419 HydrophobicContact CG1-CB 4.32Å; V397-A419 HydrophobicContact CG2-CB 3.99Å; V397-E421 HydrophobicContact CG1-CB 4.1Å
398	I	92.3	Very high	87.1	Confident	1 Å²	1	32 Å²	32	1%	0.005	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-76.6	115.7	171	-61.7	-178.9	0	0	0	107.5	M296 F299 Y387 F391 A419 V420 E421	M296-I398 HydrophobicContact CG-CD1 3.89Å; F299-I398 HydrophobicContact CB-CG2 3.61Å; F299-I398 HydrophobicContact CD1-CB 4.44Å; F299-I398 HydrophobicContact CD1-CG1 4.33Å; F299-I398 HydrophobicContact CD1-CG2 3.86Å; F299-I398 HydrophobicContact CD2-CG2 3.95Å; F299-I398 HydrophobicContact CE1-CG1 4.25Å; F299-I398 HydrophobicContact CE1-CG2 4.44Å; F299-I398 HydrophobicContact CG-CB 4.42Å; F299-I398 HydrophobicContact CG-CG2 3.56Å; Y387-I398 HydrophobicContact CE1-CD1 3.63Å; Y387-I398 HydrophobicContact CE1-CG1 4.48Å; F391-I398 HydrophobicContact CE1-CD1 4Å; F391-I398 HydrophobicContact CE1-CG1 3.5Å; F391-I398 VanDerWaalsContact CE1-CG1 3.5Å; F391-I398 HydrophobicContact CZ-CG1 3.77Å; I398-A419 PolarHBondContact N-O 3.32Å; I398-V420 HydrophobicContact CB-CB 4.32Å; I398-V420 HydrophobicContact CB-CG1 4.18Å; I398-V420 HydrophobicContact CB-CG2 3.99Å; I398-V420 HydrophobicContact CD1-CG2 4.11Å; I398-V420 HydrophobicContact CG1-CG2 4.43Å; I398-V420 HydrophobicContact CG2-CG1 4.05Å; I398-V420 HydrophobicContact CG2-CG2 4.42Å; I398-V420 CarbonylContact O-C 3.49Å; I398-V420 WeakPolarHBondContact O-CA 3.49Å; I398-E421 PolarHBondContact O-N 3.39Å
399	S	91.6	Very high	86.7	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.007	21%	0.206	C	C	.	.			trans	-139.8	114.7	-176.7	170.1	0	0	0	0	110.4	F299 V397 R401 E421	F299-S399 VanDerWaalsContact CD2-O 3.27Å; F299-S399 WeakPolarHBondContact CD2-O 3.15Å; F299-S399 VanDerWaalsContact CE2-N 3.25Å; F299-S399 WeakPolarHBondContact CE2-O 3.34Å; V397-S399 PolarHBondContact O-N 2.97Å; S399-R401 PolarHBondContact O-N 2.81Å; S399-R401 PolarHBondContact OG-N 3.44Å; S399-E421 VanDerWaalsContact CB-OE2 3.23Å; S399-E421 WeakPolarHBondContact CB-OE2 3.41Å; S399-E421 PolarHBondContact OG-OE2 3.19Å
400	V	90.9	Very high	86.3	Confident	3 Å²	3	41.5 Å²	41.5	2%	0.018	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-3.8	177.6	-59	0	0	0	0	113.4	Y253 L295 I298 F299 Q302 P423	Y253-V400 HydrophobicContact CE1-CG2 4.47Å; L295-V400 HydrophobicContact CD2-CG1 4.21Å; L295-V400 HydrophobicContact CD2-CG2 4.16Å; I298-V400 HydrophobicContact CB-CG1 4.09Å; I298-V400 HydrophobicContact CG2-CB 4.11Å; I298-V400 HydrophobicContact CG2-CG1 3.64Å; F299-V400 HydrophobicContact CB-CG1 4.18Å; Q302-V400 PolarHBondContact NE2-O 3.34Å; Q302-V400 PolarHBondContact OE1-O 2.97Å; V400-P423 HydrophobicContact CG2-CB 3.93Å; V400-P423 HydrophobicContact CG2-CG 4.36Å
401	R	89.3	Confident	85.8	Confident	1 Å²	1	38.2 Å²	38.2	0%	0.004	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-31.2	-172	-67.3	174.8	59.4	-116.9	0.4	113.2	Y312 L313 L325 F328 L330 S399 E421 P423 V426	Y312-R401 PolarHBondContact N-O 3.21Å; L313-R401 WeakPolarHBondContact CB-O 3.41Å; L313-R401 HydrophobicContact CD1-CB 4.4Å; L313-R401 PolarHBondContact N-O 3.16Å; L325-R401 PolarHBondContact O-NH2 3.34Å; F328-R401 PolarHBondContact O-NH2 2.93Å; L330-R401 HydrophobicContact CD1-CG 3.94Å; S399-R401 PolarHBondContact O-N 2.81Å; S399-R401 PolarHBondContact OG-N 3.44Å; R401-E421 WeakPolarHBondContact CD-OE2 3.39Å; R401-E421 IonicContact CZ-OE1 3.84Å; R401-E421 IonicContact NH1-OE1 2.65Å; R401-E421 PolarHBondContact NH1-OE1 2.84Å; R401-E421 IonicContact NH1-OE2 3.85Å; R401-E421 PolarHBondContact NH1-OE2 3.38Å; R401-P423 HydrophobicContact CG-CB 4.45Å; R401-V426 VanDerWaalsContact CZ-CG1 3.47Å
402	T	86.7	Confident	85.2	Confident	4 Å²	4	44.9 Å²	44.9	3%	0.025	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-144.3	155.4	-171.5	-168.6	0	0	0	0	113.7	K303 L313 L325 A404 L406	K303-T402 PolarHBondContact NZ-O 2.99Å; L313-T402 WeakPolarHBondContact O-CB 3.34Å; L313-T402 PolarHBondContact O-OG1 3.49Å; L325-T402 HydrophobicContact CD2-CG2 4Å; T402-A404 VanDerWaalsContact C-N 3.34Å; T402-A404 HydrophobicContact CG2-CB 4.16Å; T402-L406 HydrophobicContact CG2-CD1 4.47Å; T402-L406 HydrophobicContact CG2-CD2 4.32Å; T402-L406 HydrophobicContact CG2-CG 4.45Å
403	N	84	Confident	85	Confident	100 Å²	100	42 Å²	42	54%	0.535	23%	0.226	S	C	.	.	S	Bend	trans	-75.7	-19.3	177.7	-155.9	4.3	0	0	0	113.8	K303 T311	K303-N403 PolarHBondContact NZ-O 3.44Å; T311-N403 HydrophobicContact CG2-CB 4.2Å; T311-N403 WeakPolarHBondContact OG1-CB 3.33Å
404	A	83.9	Confident	84.4	Confident	29 Å²	29	45.3 Å²	45.3	24%	0.24	25%	0.249	C	C	.	.	S	Bend	trans	-59.2	147.5	170.4	0	0	0	0	0	111.2	K303 L322 T402 L406	K303-A404 PolarHBondContact NZ-O 3.23Å; L322-A404 HydrophobicContact CD1-CB 3.91Å; L322-A404 HydrophobicContact CD2-CB 3.54Å; L322-A404 HydrophobicContact CG-CB 4.4Å; T402-A404 VanDerWaalsContact C-N 3.34Å; T402-A404 HydrophobicContact CG2-CB 4.16Å; A404-L406 HydrophobicContact CB-CD2 4.35Å
405	V	84.3	Confident	83.4	Confident	77 Å²	77	48.9 Å²	48.9	47%	0.467	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-85.2	127	159.3	-179.6	0	0	0	0	106.1	F391 N396	F391-V405 HydrophobicContact CE2-CG1 4.25Å; N396-V405 HydrophobicContact CB-CG1 4Å; N396-V405 VanDerWaalsContact OD1-CG1 3.25Å; N396-V405 WeakPolarHBondContact OD1-CG1 3.39Å
406	L	85.9	Confident	82.2	Confident	3 Å²	3	52.6 Å²	52.6	2%	0.016	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	127.2	-179.3	-58	177.5	0	0	0	108.9	L325 N396 V397 T402 A404 M410	L325-L406 HydrophobicContact CD2-CD1 3.76Å; L325-L406 HydrophobicContact CD2-CD2 3.87Å; L325-L406 HydrophobicContact CD2-CG 4.46Å; N396-L406 CarbonylContact C-O 3.6Å; N396-L406 WeakPolarHBondContact CA-O 3.44Å; V397-L406 HydrophobicContact CB-CB 4.28Å; V397-L406 PolarHBondContact N-O 2.8Å; T402-L406 HydrophobicContact CG2-CD1 4.47Å; T402-L406 HydrophobicContact CG2-CD2 4.32Å; T402-L406 HydrophobicContact CG2-CG 4.45Å; A404-L406 HydrophobicContact CB-CD2 4.35Å; L406-M410 HydrophobicContact CD2-CE 4.05Å; L406-M410 HydrophobicContact CD2-SD 4.47Å
407	S	86.1	Confident	81.4	Confident	33 Å²	33	55.7 Å²	55.7	23%	0.231	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	155.9	165.5	71.7	0	0	0	0	109.9	E409 M410	S407-E409 PolarHBondContact O-N 3.42Å; S407-M410 WeakPolarHBondContact O-CB 3.35Å; S407-M410 PolarHBondContact O-N 2.84Å; S407-M410 VanDerWaalsContact O-N 3.15Å
408	R	82	Confident	81.2	Confident	3 Å²	3	55.9 Å²	55.9	1%	0.011	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-63	-29	176.4	-72.5	163.5	-172.8	-115.9	-1	113.7	M393 A394 D395 N396 V397 M410 K411 D412 W413 P414 R417 A419	M393-R408 PolarHBondContact O-NH2 2.89Å; A394-R408 WeakPolarHBondContact O-CD 3.06Å; A394-R408 PolarHBondContact O-NE 3.45Å; D395-R408 WeakPolarHBondContact O-CD 3.44Å; D395-R408 VanDerWaalsContact O-CG 3.32Å; D395-R408 WeakPolarHBondContact O-CG 3.2Å; D395-R408 PolarHBondContact O-N 2.89Å; N396-R408 PolarHBondContact O-NE 3.42Å; N396-R408 PolarHBondContact O-NH2 3.34Å; V397-R408 HydrophobicContact CG2-CG 3.84Å; R408-M410 VanDerWaalsContact C-N 3.25Å; R408-M410 PolarHBondContact O-N 3.11Å; R408-K411 CarbonylContact O-C 3.52Å; R408-K411 WeakPolarHBondContact O-CA 3.42Å; R408-K411 PolarHBondContact O-N 2.96Å; R408-D412 PolarHBondContact O-N 3.36Å; R408-W413 HydrophobicContact CB-CB 4.24Å; R408-W413 WeakPolarHBondContact CB-O 3.27Å; R408-W413 HydrophobicContact CG-CB 4.4Å; R408-W413 PolarHBondContact O-N 3.1Å; R408-P414 PolarHBondContact NH1-O 3.41Å; R408-R417 VanDerWaalsContact CZ-O 3.28Å; R408-R417 PolarHBondContact NH1-O 3.4Å; R408-R417 PolarHBondContact NH2-O 3.04Å; R408-A419 VanDerWaalsContact CZ-CB 3.42Å; R408-A419 VanDerWaalsContact NH2-N 3.18Å
409	E	80.5	Confident	81.1	Confident	134 Å²	134	55.9 Å²	55.9	63%	0.626	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-61.7	-33.3	175.3	-62.1	167	170.1	0	0	111.6	S407 K411 D412 K415	S407-E409 PolarHBondContact O-N 3.42Å; E409-K411 PolarHBondContact O-N 2.79Å; E409-D412 PolarHBondContact O-N 2.73Å; E409-K415 WeakPolarHBondContact OE1-CE 3.23Å; E409-K415 IonicContact OE1-NZ 3.8Å; E409-K415 PolarHBondContact OE1-NZ 3.36Å
410	M	78.6	Confident	81	Confident	105 Å²	105	55.9 Å²	55.9	52%	0.517	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-72.4	-6.6	173.8	-64.8	178.5	63.4	0	0	113.9	L322 L406 S407 R408	L322-M410 HydrophobicContact CB-CE 4.24Å; L406-M410 HydrophobicContact CD2-CE 4.05Å; L406-M410 HydrophobicContact CD2-SD 4.47Å; S407-M410 WeakPolarHBondContact O-CB 3.35Å; S407-M410 PolarHBondContact O-N 2.84Å; S407-M410 VanDerWaalsContact O-N 3.15Å; R408-M410 VanDerWaalsContact C-N 3.25Å; R408-M410 PolarHBondContact O-N 3.11Å
411	K	78.4	Confident	81	Confident	39 Å²	39	55.9 Å²	55.9	17%	0.17	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-119.3	-3.9	-179	-82.7	-70.1	-168.3	175.4	0	113.5	R408 E409 W413 E421 V426	R408-K411 CarbonylContact O-C 3.52Å; R408-K411 WeakPolarHBondContact O-CA 3.42Å; R408-K411 PolarHBondContact O-N 2.96Å; E409-K411 PolarHBondContact O-N 2.79Å; K411-W413 VanDerWaalsContact C-N 3.26Å; K411-W413 HydrophobicContact CB-CB 4.31Å; K411-W413 HydrophobicContact CB-CD2 3.84Å; K411-W413 HydrophobicContact CB-CE3 4.36Å; K411-W413 HydrophobicContact CB-CG 3.81Å; K411-W413 HydrophobicContact CD-CZ2 4.33Å; K411-W413 HydrophobicContact CG-CD2 4.44Å; K411-W413 PolarHBondContact O-N 2.82Å; K411-W413 PolarHBondContact O-NE1 3.29Å; K411-E421 VanDerWaalsContact CE-OE1 3.3Å; K411-E421 WeakPolarHBondContact CE-OE1 3.45Å; K411-E421 IonicContact NZ-OE1 2.85Å; K411-E421 PolarHBondContact NZ-OE1 2.98Å; K411-V426 PolarHBondContact NZ-O 3.13Å
412	D	77.3	Confident	80.9	Confident	157 Å²	157	55.9 Å²	55.9	84%	0.84	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	42	-168.8	-150.8	14.4	0	0	0	113.1	R408 E409	R408-D412 PolarHBondContact O-N 3.36Å; E409-D412 PolarHBondContact O-N 2.73Å
413	W	81	Confident	81	Confident	42 Å²	42	55.7 Å²	55.7	16%	0.159	28%	0.281	C	S	.	.			trans	-105.4	145.6	-177.7	-73.2	0.4	0	0	0	112.3	V397 R408 K411 A419 E421 K427 R428 N429	V397-W413 HydrophobicContact CB-CZ3 4.49Å; V397-W413 HydrophobicContact CG1-CE3 4.24Å; V397-W413 HydrophobicContact CG1-CH2 4.34Å; V397-W413 HydrophobicContact CG1-CZ3 3.57Å; V397-W413 HydrophobicContact CG2-CE3 3.85Å; V397-W413 HydrophobicContact CG2-CZ3 4.07Å; R408-W413 HydrophobicContact CB-CB 4.24Å; R408-W413 WeakPolarHBondContact CB-O 3.27Å; R408-W413 HydrophobicContact CG-CB 4.4Å; R408-W413 PolarHBondContact O-N 3.1Å; K411-W413 VanDerWaalsContact C-N 3.26Å; K411-W413 HydrophobicContact CB-CB 4.31Å; K411-W413 HydrophobicContact CB-CD2 3.84Å; K411-W413 HydrophobicContact CB-CE3 4.36Å; K411-W413 HydrophobicContact CB-CG 3.81Å; K411-W413 HydrophobicContact CD-CZ2 4.33Å; K411-W413 HydrophobicContact CG-CD2 4.44Å; K411-W413 PolarHBondContact O-N 2.82Å; K411-W413 PolarHBondContact O-NE1 3.29Å; W413-A419 HydrophobicContact CE3-CB 3.85Å; W413-A419 HydrophobicContact CZ3-CB 4Å; W413-E421 HydrophobicContact CH2-CB 4.42Å; W413-K427 WeakPolarHBondContact CZ2-O 3.47Å; W413-R428 WeakPolarHBondContact CH2-O 3.48Å; W413-N429 HydrophobicContact CD2-CB 4.31Å; W413-N429 HydrophobicContact CE3-CB 4.04Å; W413-N429 HydrophobicContact CH2-CB 3.68Å; W413-N429 HydrophobicContact CZ2-CB 3.97Å; W413-N429 HydrophobicContact CZ3-CB 3.7Å
414	P	72.5	Confident	81.2	Confident	85 Å²	85	51.5 Å²	51.5	55%	0.552	26%	0.258	S	S	*	.			trans	-66.5	139	179.8	25.7	-33.8	0	0	0	112.7	R408	R408-P414 PolarHBondContact NH1-O 3.41Å
415	K	62.3	Low	81.2	Confident	104 Å²	104	51.2 Å²	51.2	45%	0.452	26%	0.256	S	S	.	.	S	Bend	trans	-71.8	162	168.1	-55.9	-176.4	-177.3	-176.3	0	109.9	E409	E409-K415 WeakPolarHBondContact OE1-CE 3.23Å; E409-K415 IonicContact OE1-NZ 3.8Å; E409-K415 PolarHBondContact OE1-NZ 3.36Å
416	K	59.7	Low	81.2	Confident	151 Å²	151	48 Å²	48	66%	0.657	24%	0.236	S	C	*	.	S	Bend	trans	83.3	17.8	-179.3	-45	171.1	-176.8	172	0	118.7
417	R	72.7	Confident	81	Confident	98 Å²	98	54.5 Å²	54.5	37%	0.37	26%	0.264	S	S	.	.	S	Bend	trans	-132.6	-176.4	175.9	-70.2	-178.3	173.8	162.5	-4.7	111	R408 V434 N435 F440	R408-R417 VanDerWaalsContact CZ-O 3.28Å; R408-R417 PolarHBondContact NH1-O 3.4Å; R408-R417 PolarHBondContact NH2-O 3.04Å; R417-V434 WeakPolarHBondContact CD-O 3.46Å; R417-V434 WeakPolarHBondContact CG-O 3.38Å; R417-N435 VanDerWaalsContact CZ-O 3.24Å; R417-N435 PolarHBondContact NE-O 3.02Å; R417-N435 PolarHBondContact NH2-O 2.97Å; R417-F440 WeakPolarHBondContact O-CE2 3.37Å
418	I	85.9	Confident	80.8	Confident	3 Å²	3	54 Å²	54	2%	0.015	26%	0.257	C	S	.	.			trans	-80.7	149.9	160.8	-60	-178.2	0	0	0	108.7	L288 V420 N429 A431 V434 F440 I443	L288-I418 HydrophobicContact CD1-CD1 4.01Å; L288-I418 HydrophobicContact CD2-CD1 4.39Å; I418-V420 HydrophobicContact CG2-CG2 4.06Å; I418-N429 PolarHBondContact O-ND2 3Å; I418-N429 VanDerWaalsContact O-ND2 3.14Å; I418-A431 HydrophobicContact CB-CB 3.85Å; I418-A431 HydrophobicContact CG2-CB 3.58Å; I418-V434 HydrophobicContact CD1-CG1 4.47Å; I418-V434 HydrophobicContact CG1-CG1 4.37Å; I418-F440 HydrophobicContact CG1-CD2 3.75Å; I418-F440 HydrophobicContact CG1-CE2 3.92Å; I418-I443 HydrophobicContact CD1-CD1 3.88Å; I418-I443 HydrophobicContact CD1-CG2 4.05Å
419	A	88.9	Confident	81.1	Confident	2 Å²	2	55.2 Å²	55.2	2%	0.017	26%	0.264	C	S	.	.			trans	-139.2	119.9	175.3	0	0	0	0	0	111.4	V397 I398 R408 W413 N429	V397-A419 HydrophobicContact CB-CB 4.39Å; V397-A419 HydrophobicContact CG1-CB 4.32Å; V397-A419 HydrophobicContact CG2-CB 3.99Å; I398-A419 PolarHBondContact N-O 3.32Å; R408-A419 VanDerWaalsContact CZ-CB 3.42Å; R408-A419 VanDerWaalsContact NH2-N 3.18Å; W413-A419 HydrophobicContact CE3-CB 3.85Å; W413-A419 HydrophobicContact CZ3-CB 4Å; A419-N429 WeakPolarHBondContact CA-OD1 3.34Å
420	V	90.5	Very high	81.3	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.006	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-132.6	125.3	177.9	-174.3	0	0	0	0	108.2	V292 L295 I398 I418 N429 V430 A431	V292-V420 HydrophobicContact CG1-CB 4.2Å; V292-V420 HydrophobicContact CG1-CG1 4.26Å; V292-V420 HydrophobicContact CG1-CG2 3.7Å; L295-V420 HydrophobicContact CB-CG1 4.2Å; L295-V420 HydrophobicContact CD1-CG1 4.09Å; I398-V420 HydrophobicContact CB-CB 4.32Å; I398-V420 HydrophobicContact CB-CG1 4.18Å; I398-V420 HydrophobicContact CB-CG2 3.99Å; I398-V420 HydrophobicContact CD1-CG2 4.11Å; I398-V420 HydrophobicContact CG1-CG2 4.43Å; I398-V420 HydrophobicContact CG2-CG1 4.05Å; I398-V420 HydrophobicContact CG2-CG2 4.42Å; I398-V420 CarbonylContact O-C 3.49Å; I398-V420 WeakPolarHBondContact O-CA 3.49Å; I418-V420 HydrophobicContact CG2-CG2 4.06Å; V420-N429 PolarHBondContact N-OD1 3.04Å; V420-N429 WeakPolarHBondContact O-CA 3.43Å; V420-N429 PolarHBondContact O-OD1 2.85Å; V420-V430 HydrophobicContact CB-CG2 3.6Å; V420-V430 HydrophobicContact CG1-CG2 3.7Å; V420-V430 PolarHBondContact O-N 3.36Å; V420-A431 HydrophobicContact CB-CB 4.48Å; V420-A431 HydrophobicContact CG2-CB 4.07Å
421	E	90.2	Very high	81.6	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.009	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-81.6	128.3	178.5	-173.9	-172.9	-147.6	0	0	110.7	V397 I398 S399 R401 K411 W413	V397-E421 HydrophobicContact CG1-CB 4.1Å; I398-E421 PolarHBondContact O-N 3.39Å; S399-E421 VanDerWaalsContact CB-OE2 3.23Å; S399-E421 WeakPolarHBondContact CB-OE2 3.41Å; S399-E421 PolarHBondContact OG-OE2 3.19Å; R401-E421 WeakPolarHBondContact CD-OE2 3.39Å; R401-E421 IonicContact CZ-OE1 3.84Å; R401-E421 IonicContact NH1-OE1 2.65Å; R401-E421 PolarHBondContact NH1-OE1 2.84Å; R401-E421 IonicContact NH1-OE2 3.85Å; R401-E421 PolarHBondContact NH1-OE2 3.38Å; K411-E421 VanDerWaalsContact CE-OE1 3.3Å; K411-E421 WeakPolarHBondContact CE-OE1 3.45Å; K411-E421 IonicContact NZ-OE1 2.85Å; K411-E421 PolarHBondContact NZ-OE1 2.98Å; W413-E421 HydrophobicContact CH2-CB 4.42Å
422	D	88.6	Confident	81.8	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	22%	0.222	C	C	.	.			trans	-64.5	124.7	168.3	-170.3	-47.2	0	0	0	110.2	F424 A425 R428 V430	D422-F424 PolarHBondContact O-N 3.49Å; D422-F424 PolarHBondContact OD1-N 3.35Å; D422-A425 HydrophobicContact CB-CB 4.05Å; D422-A425 PolarHBondContact OD1-N 2.97Å; D422-R428 HydrophobicContact CB-CB 3.98Å; D422-R428 HydrophobicContact CB-CG 4.43Å; D422-R428 PolarHBondContact N-O 3.47Å; D422-R428 VanDerWaalsContact OD2-CD 3.24Å; D422-R428 WeakPolarHBondContact OD2-CD 3.46Å; D422-R428 IonicContact OD2-CZ 3.27Å; D422-R428 IonicContact OD2-NE 2.64Å; D422-R428 IonicContact OD2-NH1 3.94Å; D422-R428 PolarHBondContact OD2-NH1 2.69Å; D422-R428 VanDerWaalsContact OD2-NH1 3.11Å; D422-V430 HydrophobicContact CB-CG1 3.78Å
423	P	87.6	Confident	81.9	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	19%	0.191	C	C	.	.	S	Bend	trans	-63.1	-27.4	-177.4	19.7	-27.5	0	0	0	114	L295 L330 V400 R401	L295-P423 HydrophobicContact CD2-CG 4.18Å; L330-P423 HydrophobicContact CD1-CB 4.1Å; L330-P423 WeakPolarHBondContact CD1-O 3.44Å; V400-P423 HydrophobicContact CG2-CB 3.93Å; V400-P423 HydrophobicContact CG2-CG 4.36Å; R401-P423 HydrophobicContact CG-CB 4.45Å
424	F	88.1	Confident	81.9	Confident	12 Å²	12	39.5 Å²	39.5	5%	0.053	18%	0.184	C	C	.	.	S	Bend	trans	-104.8	-43.1	-178.4	-65.3	-86.5	0	0	0	111.4	Q249 T250 Y253 L330 I338 D422 V426	Q249-F424 HydrophobicContact CB-CD1 3.95Å; Q249-F424 HydrophobicContact CB-CE1 3.9Å; Q249-F424 HydrophobicContact CB-CE2 4.5Å; Q249-F424 HydrophobicContact CB-CG 4.29Å; Q249-F424 HydrophobicContact CB-CZ 4.19Å; T250-F424 WeakPolarHBondContact OG1-CD2 3.48Å; Y253-F424 HydrophobicContact CD1-CE2 4.34Å; Y253-F424 HydrophobicContact CG-CE2 4.2Å; Y253-F424 HydrophobicContact CG-CZ 4.39Å; L330-F424 HydrophobicContact CB-CD1 3.96Å; L330-F424 HydrophobicContact CB-CE1 3.78Å; L330-F424 HydrophobicContact CB-CZ 4.37Å; L330-F424 WeakPolarHBondContact O-CD1 3.45Å; I338-F424 HydrophobicContact CD1-CZ 4.34Å; D422-F424 PolarHBondContact O-N 3.49Å; D422-F424 PolarHBondContact OD1-N 3.35Å; F424-V426 PolarHBondContact O-N 3.35Å
425	A	84.6	Confident	81.9	Confident	24 Å²	24	36.1 Å²	36.1	20%	0.198	16%	0.161	C	C	.	.	S	Bend	trans	-94.3	63.4	177.7	0	0	0	0	0	113	D422 K427 R428	D422-A425 HydrophobicContact CB-CB 4.05Å; D422-A425 PolarHBondContact OD1-N 2.97Å; A425-K427 PolarHBondContact O-N 2.91Å; A425-R428 HydrophobicContact CB-CB 4.29Å; A425-R428 WeakPolarHBondContact O-CB 3.36Å; A425-R428 PolarHBondContact O-N 3.25Å
426	V	82.8	Confident	82.7	Confident	10 Å²	10	32 Å²	32	6%	0.061	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-11.5	-164.9	-51.3	0	0	0	0	118	R401 K411 F424	R401-V426 VanDerWaalsContact CZ-CG1 3.47Å; K411-V426 PolarHBondContact NZ-O 3.13Å; F424-V426 PolarHBondContact O-N 3.35Å
427	K	83.3	Confident	83.7	Confident	139 Å²	139	28.8 Å²	28.8	60%	0.604	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-18.2	171.9	-63.4	176.5	-174.3	167.2	0	113	W413 A425 D576	W413-K427 WeakPolarHBondContact CZ2-O 3.47Å; A425-K427 PolarHBondContact O-N 2.91Å; K427-D576 IonicContact NZ-OD2 2.72Å; K427-D576 PolarHBondContact NZ-OD2 3.48Å
428	R	82.3	Confident	84.2	Confident	22 Å²	22	28.4 Å²	28.4	8%	0.083	14%	0.135	C	C	.	.			trans	-86.7	132.5	-169.2	-172.8	-169.4	-161.1	154.7	18.3	112.7	R222 W413 D422 A425 V430 S579 G580 E581	R222-R428 VanDerWaalsContact NH1-NH2 3.16Å; W413-R428 WeakPolarHBondContact CH2-O 3.48Å; D422-R428 HydrophobicContact CB-CB 3.98Å; D422-R428 HydrophobicContact CB-CG 4.43Å; D422-R428 PolarHBondContact N-O 3.47Å; D422-R428 VanDerWaalsContact OD2-CD 3.24Å; D422-R428 WeakPolarHBondContact OD2-CD 3.46Å; D422-R428 IonicContact OD2-CZ 3.27Å; D422-R428 IonicContact OD2-NE 2.64Å; D422-R428 IonicContact OD2-NH1 3.94Å; D422-R428 PolarHBondContact OD2-NH1 2.69Å; D422-R428 VanDerWaalsContact OD2-NH1 3.11Å; A425-R428 HydrophobicContact CB-CB 4.29Å; A425-R428 WeakPolarHBondContact O-CB 3.36Å; A425-R428 PolarHBondContact O-N 3.25Å; R428-V430 HydrophobicContact CG-CG1 4.09Å; R428-S579 PolarHBondContact NH1-O 3Å; R428-S579 PolarHBondContact NH1-OG 3.19Å; R428-S579 PolarHBondContact NH2-O 2.73Å; R428-G580 PolarHBondContact NH1-O 2.97Å; R428-G580 VanDerWaalsContact NH2-C 3.3Å; R428-G580 PolarHBondContact NH2-O 3.01Å; R428-E581 IonicContact CZ-OE1 3.73Å; R428-E581 IonicContact CZ-OE2 3.35Å; R428-E581 IonicContact NE-OE1 2.83Å; R428-E581 PolarHBondContact NE-OE1 3.34Å; R428-E581 IonicContact NE-OE2 3.22Å; R428-E581 IonicContact NH2-OE1 3.77Å; R428-E581 PolarHBondContact NH2-OE1 3.02Å; R428-E581 IonicContact NH2-OE2 2.67Å; R428-E581 PolarHBondContact NH2-OE2 2.89Å
429	N	87.1	Confident	84.1	Confident	28 Å²	28	28.4 Å²	28.4	15%	0.15	14%	0.135	C	C	.	.	B	Isolated β-bridge	trans	-91.3	113.9	158	-179.8	10.4	0	0	0	109.2	W413 I418 A419 V420 A431 R432	W413-N429 HydrophobicContact CD2-CB 4.31Å; W413-N429 HydrophobicContact CE3-CB 4.04Å; W413-N429 HydrophobicContact CH2-CB 3.68Å; W413-N429 HydrophobicContact CZ2-CB 3.97Å; W413-N429 HydrophobicContact CZ3-CB 3.7Å; I418-N429 PolarHBondContact O-ND2 3Å; I418-N429 VanDerWaalsContact O-ND2 3.14Å; A419-N429 WeakPolarHBondContact CA-OD1 3.34Å; V420-N429 PolarHBondContact N-OD1 3.04Å; V420-N429 WeakPolarHBondContact O-CA 3.43Å; V420-N429 PolarHBondContact O-OD1 2.85Å; N429-A431 VanDerWaalsContact C-N 3.3Å; N429-A431 PolarHBondContact OD1-N 2.82Å; N429-R432 WeakPolarHBondContact O-CB 3.46Å; N429-R432 WeakPolarHBondContact O-CD 3.44Å; N429-R432 WeakPolarHBondContact O-CG 3.46Å; N429-R432 PolarHBondContact O-N 3.47Å
430	V	84.3	Confident	84.1	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-15	-178.9	-58.3	0	0	0	0	113	Y291 V292 L295 V420 D422 R428 R432	Y291-V430 HydrophobicContact CE2-CB 4.3Å; Y291-V430 HydrophobicContact CE2-CG1 4.11Å; Y291-V430 HydrophobicContact CE2-CG2 4.35Å; Y291-V430 WeakPolarHBondContact OH-CB 3.21Å; Y291-V430 WeakPolarHBondContact OH-CG1 3.28Å; V292-V430 HydrophobicContact CG1-CG2 4.43Å; V292-V430 HydrophobicContact CG2-CB 4.18Å; V292-V430 HydrophobicContact CG2-CG2 3.64Å; L295-V430 HydrophobicContact CD1-CG2 4.47Å; V420-V430 HydrophobicContact CB-CG2 3.6Å; V420-V430 HydrophobicContact CG1-CG2 3.7Å; V420-V430 PolarHBondContact O-N 3.36Å; D422-V430 HydrophobicContact CB-CG1 3.78Å; R428-V430 HydrophobicContact CG-CG1 4.09Å; V430-R432 VanDerWaalsContact C-N 3.29Å; V430-R432 PolarHBondContact O-N 3.49Å
431	A	85.7	Confident	83.8	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	19.2	173.7	0	0	0	0	0	113.3	L288 I418 V420 N429 T433 V434	L288-A431 HydrophobicContact CD2-CB 3.6Å; I418-A431 HydrophobicContact CB-CB 3.85Å; I418-A431 HydrophobicContact CG2-CB 3.58Å; V420-A431 HydrophobicContact CB-CB 4.48Å; V420-A431 HydrophobicContact CG2-CB 4.07Å; N429-A431 VanDerWaalsContact C-N 3.3Å; N429-A431 PolarHBondContact OD1-N 2.82Å; A431-T433 PolarHBondContact O-N 3.07Å; A431-V434 PolarHBondContact O-N 2.8Å
432	R	81.9	Confident	83.8	Confident	117 Å²	117	32.3 Å²	32.3	44%	0.442	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-18.6	-178.8	63	-172.4	-176	107.3	14.6	114.7	N429 V430 E581	N429-R432 WeakPolarHBondContact O-CB 3.46Å; N429-R432 WeakPolarHBondContact O-CD 3.44Å; N429-R432 WeakPolarHBondContact O-CG 3.46Å; N429-R432 PolarHBondContact O-N 3.47Å; V430-R432 VanDerWaalsContact C-N 3.29Å; V430-R432 PolarHBondContact O-N 3.49Å; R432-E581 IonicContact CZ-OE2 3.67Å; R432-E581 IonicContact NE-OE1 2.81Å; R432-E581 PolarHBondContact NE-OE1 2.84Å; R432-E581 IonicContact NE-OE2 2.72Å; R432-E581 PolarHBondContact NE-OE2 3.45Å; R432-E581 IonicContact NH2-OE2 2.66Å; R432-E581 PolarHBondContact NH2-OE2 2.92Å
433	T	79.4	Confident	83.8	Confident	30 Å²	30	32.5 Å²	32.5	18%	0.184	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-38.7	176	44.8	0	0	0	0	112.3	P283 G286 G287 A431 N435	P283-T433 HydrophobicContact CB-CG2 4.14Å; G286-T433 CarbonylContact O-C 3.55Å; G287-T433 WeakPolarHBondContact O-CB 3.47Å; G287-T433 PolarHBondContact O-OG1 3.06Å; A431-T433 PolarHBondContact O-N 3.07Å; T433-N435 PolarHBondContact O-N 3.44Å; T433-N435 PolarHBondContact O-ND2 3.28Å
434	V	80.7	Confident	83.9	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.166	C	C	.	.			trans	-70.9	79.8	174.6	-177.7	0	0	0	0	109.6	G286 L288 R417 I418 A431 M439 F440 I443	G286-V434 VanDerWaalsContact O-CA 3.28Å; G286-V434 WeakPolarHBondContact O-CA 3.3Å; G286-V434 WeakPolarHBondContact O-CG2 3.31Å; G286-V434 PolarHBondContact O-N 2.92Å; L288-V434 HydrophobicContact CD2-CG2 3.51Å; L288-V434 HydrophobicContact CG-CG2 3.78Å; R417-V434 WeakPolarHBondContact CD-O 3.46Å; R417-V434 WeakPolarHBondContact CG-O 3.38Å; I418-V434 HydrophobicContact CD1-CG1 4.47Å; I418-V434 HydrophobicContact CG1-CG1 4.37Å; A431-V434 PolarHBondContact O-N 2.8Å; V434-M439 HydrophobicContact CG1-CB 4.41Å; V434-M439 HydrophobicContact CG1-CG 4.08Å; V434-M439 HydrophobicContact CG2-CG 4.41Å; V434-F440 HydrophobicContact CG1-CB 4.31Å; V434-I443 HydrophobicContact CG1-CD1 4.19Å; V434-I443 HydrophobicContact CG2-CD1 3.86Å
435	N	72.9	Confident	83.9	Confident	15 Å²	15	35.4 Å²	35.4	8%	0.08	17%	0.17	C	C	.	.			trans	-101.8	-29.8	-169.6	74.7	87.2	0	0	0	113.2	R417 T433	R417-N435 VanDerWaalsContact CZ-O 3.24Å; R417-N435 PolarHBondContact NE-O 3.02Å; R417-N435 PolarHBondContact NH2-O 2.97Å; T433-N435 PolarHBondContact O-N 3.44Å; T433-N435 PolarHBondContact O-ND2 3.28Å
436	S	78.6	Confident	84.2	Confident	17 Å²	17	34.2 Å²	34.2	12%	0.119	16%	0.16	C	C	.	.	S	Bend	trans	-84.7	142.6	174.4	-175.7	0	0	0	0	111.6	Q438 F440 D658	S436-Q438 PolarHBondContact O-N 2.83Å; S436-Q438 PolarHBondContact OG-N 2.97Å; S436-F440 PolarHBondContact O-N 2.83Å; S436-D658 PolarHBondContact OG-OD1 3.03Å
437	Q	81.5	Confident	84.6	Confident	84 Å²	84	34 Å²	34	39%	0.393	16%	0.158	S	C	.	.	H	α-helix	trans	-63.9	-27.8	172.8	-175.6	67.4	63.1	0	0	111.5	F440 D441	Q437-F440 PolarHBondContact O-N 3.45Å; Q437-D441 PolarHBondContact NE2-OD1 2.86Å; Q437-D441 PolarHBondContact O-N 2.94Å
438	Q	82.8	Confident	84.9	Confident	89 Å²	89	28.7 Å²	28.7	42%	0.416	14%	0.135	S	C	.	.	H	α-helix	trans	-68	-45.5	-178.5	-51.8	-158	51.8	0	0	111.5	S436 F440 D441 Y442 D658	S436-Q438 PolarHBondContact O-N 2.83Å; S436-Q438 PolarHBondContact OG-N 2.97Å; Q438-F440 VanDerWaalsContact C-N 3.32Å; Q438-F440 PolarHBondContact O-N 2.84Å; Q438-D441 PolarHBondContact O-N 3.34Å; Q438-Y442 WeakPolarHBondContact O-CB 3.41Å; Q438-Y442 PolarHBondContact O-N 3Å; Q438-D658 PolarHBondContact NE2-OD2 3.24Å
439	M	85.2	Confident	85.3	Confident	3 Å²	3	27.9 Å²	27.9	2%	0.015	13%	0.133	C	C	.	.	H	α-helix	trans	-62.8	-37.9	173.8	-178.3	59.9	78.7	0	0	111.6	V434 Y442 I443 H648	V434-M439 HydrophobicContact CG1-CB 4.41Å; V434-M439 HydrophobicContact CG1-CG 4.08Å; V434-M439 HydrophobicContact CG2-CG 4.41Å; M439-Y442 PolarHBondContact O-N 2.87Å; M439-Y442 HydrophobicContact SD-CD1 4.11Å; M439-I443 HydrophobicContact CG-CD1 3.98Å; M439-I443 VanDerWaalsContact O-CG1 3.25Å; M439-I443 WeakPolarHBondContact O-CG1 3.35Å; M439-I443 PolarHBondContact O-N 2.8Å; M439-I443 HydrophobicContact SD-CD1 4.15Å; M439-I443 HydrophobicContact SD-CG1 4.18Å; M439-H648 HydrophobicContact CE-CB 3.96Å; M439-H648 VanDerWaalsContact CE-CD2 3.48Å; M439-H648 WeakPolarHBondContact CE-CD2 3.37Å; M439-H648 HydrophobicContact SD-CB 4.4Å
440	F	87.4	Confident	85.5	Confident	16 Å²	16	26.6 Å²	26.6	7%	0.07	13%	0.126	C	C	.	.	H	α-helix	trans	-62.1	-49.4	173.2	-179.9	-84.6	0	0	0	112.5	M393 A394 R417 I418 V434 S436 Q437 Q438 Y442 I443 L444	M393-F440 HydrophobicContact CB-CE2 4.47Å; A394-F440 HydrophobicContact CB-CZ 4.09Å; R417-F440 WeakPolarHBondContact O-CE2 3.37Å; I418-F440 HydrophobicContact CG1-CD2 3.75Å; I418-F440 HydrophobicContact CG1-CE2 3.92Å; V434-F440 HydrophobicContact CG1-CB 4.31Å; S436-F440 PolarHBondContact O-N 2.83Å; Q437-F440 PolarHBondContact O-N 3.45Å; Q438-F440 VanDerWaalsContact C-N 3.32Å; Q438-F440 PolarHBondContact O-N 2.84Å; F440-Y442 VanDerWaalsContact C-N 3.28Å; F440-Y442 PolarHBondContact O-N 3.45Å; F440-I443 PolarHBondContact O-N 3.15Å; F440-L444 PolarHBondContact O-N 3.33Å
441	D	85.8	Confident	85.8	Confident	57 Å²	57	26.9 Å²	26.9	31%	0.305	13%	0.127	S	C	.	.	H	α-helix	trans	-61.4	-37.1	177.3	-81.5	32.8	0	0	0	111	K100 Q437 Q438 H445	K100-D441 IonicContact NZ-OD2 2.69Å; K100-D441 PolarHBondContact NZ-OD2 3.05Å; Q437-D441 PolarHBondContact NE2-OD1 2.86Å; Q437-D441 PolarHBondContact O-N 2.94Å; Q438-D441 PolarHBondContact O-N 3.34Å; D441-H445 WeakPolarHBondContact O-CB 3.46Å; D441-H445 PolarHBondContact O-N 2.86Å
442	Y	88.6	Confident	86	Confident	14 Å²	14	30.9 Å²	30.9	6%	0.055	15%	0.145	C	C	.	.	H	α-helix	trans	-66.7	-49.6	176.7	176.9	-107.1	0	0	0	112.8	C278 I280 Q438 M439 F440 L444 H445 C446 K646 H648	C278-Y442 WeakPolarHBondContact O-CE1 3.43Å; C278-Y442 PolarHBondContact O-OH 3.37Å; I280-Y442 HydrophobicContact CD1-CE1 4.23Å; I280-Y442 HydrophobicContact CG1-CD1 4.19Å; I280-Y442 HydrophobicContact CG1-CE1 3.77Å; Q438-Y442 WeakPolarHBondContact O-CB 3.41Å; Q438-Y442 PolarHBondContact O-N 3Å; M439-Y442 PolarHBondContact O-N 2.87Å; M439-Y442 HydrophobicContact SD-CD1 4.11Å; F440-Y442 VanDerWaalsContact C-N 3.28Å; F440-Y442 PolarHBondContact O-N 3.45Å; Y442-L444 VanDerWaalsContact C-N 3.25Å; Y442-L444 PolarHBondContact O-N 3.03Å; Y442-H445 WeakPolarHBondContact O-CB 3.5Å; Y442-H445 PolarHBondContact O-N 3.05Å; Y442-H445 VanDerWaalsContact O-N 3.08Å; Y442-C446 PolarHBondContact O-N 2.97Å; Y442-C446 PolarHBondContact O-SG 3.08Å; Y442-C446 VanDerWaalsContact O-SG 3.38Å; Y442-K646 HydrophobicContact CE2-CB 4.48Å; Y442-H648 HydrophobicContact CD1-CB 3.77Å; Y442-H648 HydrophobicContact CD2-CB 4.38Å; Y442-H648 HydrophobicContact CE1-CB 3.92Å; Y442-H648 AromaticContact CE1-ND1 3.9Å; Y442-H648 HydrophobicContact CG-CB 4Å
443	I	89.7	Confident	86.4	Confident	5 Å²	5	27.6 Å²	27.6	3%	0.026	13%	0.133	C	C	.	.	H	α-helix	trans	-57.4	-41.4	177.1	-66.8	166.9	0	0	0	110.7	I280 L288 I418 V434 M439 F440 C446 L447	I280-I443 HydrophobicContact CD1-CG1 4.09Å; I280-I443 HydrophobicContact CG1-CG1 4.12Å; I280-I443 HydrophobicContact CG2-CD1 3.97Å; I280-I443 HydrophobicContact CG2-CG1 3.74Å; L288-I443 HydrophobicContact CD1-CD1 4.29Å; L288-I443 HydrophobicContact CG-CD1 4.35Å; I418-I443 HydrophobicContact CD1-CD1 3.88Å; I418-I443 HydrophobicContact CD1-CG2 4.05Å; V434-I443 HydrophobicContact CG1-CD1 4.19Å; V434-I443 HydrophobicContact CG2-CD1 3.86Å; M439-I443 HydrophobicContact CG-CD1 3.98Å; M439-I443 VanDerWaalsContact O-CG1 3.25Å; M439-I443 WeakPolarHBondContact O-CG1 3.35Å; M439-I443 PolarHBondContact O-N 2.8Å; M439-I443 HydrophobicContact SD-CD1 4.15Å; M439-I443 HydrophobicContact SD-CG1 4.18Å; F440-I443 PolarHBondContact O-N 3.15Å; I443-C446 PolarHBondContact O-N 3.47Å; I443-L447 HydrophobicContact CG2-CD1 4.18Å; I443-L447 WeakPolarHBondContact O-CG 3.34Å; I443-L447 PolarHBondContact O-N 3.09Å
444	L	88.9	Confident	86.8	Confident	46 Å²	46	26.2 Å²	26.2	24%	0.241	12%	0.124	C	C	.	.	H	α-helix	trans	-69.7	-36.3	177.1	-174.9	60.5	0	0	0	112.8	M393 F440 Y442 K448	M393-L444 HydrophobicContact CE-CD1 4.07Å; F440-L444 PolarHBondContact O-N 3.33Å; Y442-L444 VanDerWaalsContact C-N 3.25Å; Y442-L444 PolarHBondContact O-N 3.03Å; L444-K448 HydrophobicContact CG-CD 4.48Å; L444-K448 WeakPolarHBondContact O-CB 3.45Å; L444-K448 VanDerWaalsContact O-CG 3.31Å; L444-K448 WeakPolarHBondContact O-CG 3.45Å; L444-K448 PolarHBondContact O-N 2.66Å; L444-K448 VanDerWaalsContact O-N 3.08Å
445	H	88.6	Confident	87.1	Confident	27 Å²	27	26.5 Å²	26.5	13%	0.125	13%	0.126	C	C	.	.	H	α-helix	trans	-61.2	-47.3	171	165	92.4	0	0	0	111.3	D441 Y442 L447 K448 T449 T643 K646	D441-H445 WeakPolarHBondContact O-CB 3.46Å; D441-H445 PolarHBondContact O-N 2.86Å; Y442-H445 WeakPolarHBondContact O-CB 3.5Å; Y442-H445 PolarHBondContact O-N 3.05Å; Y442-H445 VanDerWaalsContact O-N 3.08Å; H445-L447 PolarHBondContact O-N 3.27Å; H445-K448 PolarHBondContact O-N 3.03Å; H445-T449 WeakPolarHBondContact O-CG2 3.35Å; H445-T449 PolarHBondContact O-N 3.38Å; H445-T449 PolarHBondContact O-OG1 2.94Å; H445-T643 PolarHBondContact NE2-O 3.36Å; H445-K646 VanDerWaalsContact CE1-CE 3.46Å; H445-K646 WeakPolarHBondContact CE1-CE 3.36Å; H445-K646 PolarHBondContact CE1-NZ 2.91Å; H445-K646 PolarHBondContact ND1-NZ 2.92Å
446	C	91	Very high	87.6	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63.8	-38.4	179.3	-65.7	0	0	0	0	111.9	W274 I280 Y442 I443 T449 T450 F642	W274-C446 HydrophobicContact CH2-CB 4.49Å; W274-C446 HydrophobicContact CZ2-CB 3.7Å; I280-C446 HydrophobicContact CD1-CB 3.87Å; Y442-C446 PolarHBondContact O-N 2.97Å; Y442-C446 PolarHBondContact O-SG 3.08Å; Y442-C446 VanDerWaalsContact O-SG 3.38Å; I443-C446 PolarHBondContact O-N 3.47Å; C446-T449 WeakPolarHBondContact CA-OG1 3.18Å; C446-T449 PolarHBondContact O-OG1 3.43Å; C446-T450 WeakPolarHBondContact O-CB 3.36Å; C446-T450 PolarHBondContact O-N 3.25Å; C446-T450 PolarHBondContact O-OG1 2.94Å; C446-F642 WeakPolarHBondContact CA-O 3.38Å
447	L	91.4	Very high	87.5	Confident	4 Å²	4	31.7 Å²	31.7	2%	0.021	16%	0.157	C	C	.	.	H	α-helix	trans	-64.1	-46.5	174.2	-75	166.1	0	0	0	112	W274 L384 S388 M393 I443 H445 T450 Y451	W274-L447 HydrophobicContact CH2-CD2 3.63Å; W274-L447 HydrophobicContact CH2-CG 3.75Å; W274-L447 HydrophobicContact CZ2-CD2 3.87Å; W274-L447 HydrophobicContact CZ2-CG 3.95Å; W274-L447 HydrophobicContact CZ3-CD2 4.27Å; L384-L447 HydrophobicContact CD2-CD2 4.15Å; S388-L447 PolarHBondContact OG-O 3.29Å; M393-L447 HydrophobicContact CE-CD1 3.73Å; I443-L447 HydrophobicContact CG2-CD1 4.18Å; I443-L447 WeakPolarHBondContact O-CG 3.34Å; I443-L447 PolarHBondContact O-N 3.09Å; H445-L447 PolarHBondContact O-N 3.27Å; L447-T450 PolarHBondContact O-N 3.01Å; L447-Y451 WeakPolarHBondContact O-CB 3.39Å; L447-Y451 PolarHBondContact O-N 3.44Å
448	K	89.9	Confident	87	Confident	28 Å²	28	30.7 Å²	30.7	12%	0.122	15%	0.154	C	C	.	.	H	α-helix	trans	-63.3	-43.9	179.4	-78.1	171.8	161.6	-167.5	0	113.5	E107 L111 L444 H445 K452	E107-K448 WeakPolarHBondContact OE2-CD 3.06Å; E107-K448 WeakPolarHBondContact OE2-CE 3.47Å; E107-K448 IonicContact OE2-NZ 2.83Å; E107-K448 PolarHBondContact OE2-NZ 3.26Å; L111-K448 HydrophobicContact CD1-CB 3.99Å; L111-K448 HydrophobicContact CD1-CD 4.4Å; L111-K448 HydrophobicContact CD1-CG 3.92Å; L444-K448 HydrophobicContact CG-CD 4.48Å; L444-K448 WeakPolarHBondContact O-CB 3.45Å; L444-K448 VanDerWaalsContact O-CG 3.31Å; L444-K448 WeakPolarHBondContact O-CG 3.45Å; L444-K448 PolarHBondContact O-N 2.66Å; L444-K448 VanDerWaalsContact O-N 3.08Å; H445-K448 PolarHBondContact O-N 3.03Å; K448-K452 WeakPolarHBondContact O-CB 3.41Å; K448-K452 PolarHBondContact O-N 2.83Å
449	T	89.3	Confident	85.6	Confident	6 Å²	6	31.8 Å²	31.8	4%	0.037	16%	0.162	C	C	.	.	H	α-helix	trans	-67.7	-42.8	178.4	44.3	0	0	0	0	111.3	H445 C446 K452 Y453 F642 K644	H445-T449 WeakPolarHBondContact O-CG2 3.35Å; H445-T449 PolarHBondContact O-N 3.38Å; H445-T449 PolarHBondContact O-OG1 2.94Å; C446-T449 WeakPolarHBondContact CA-OG1 3.18Å; C446-T449 PolarHBondContact O-OG1 3.43Å; T449-K452 WeakPolarHBondContact O-CB 3.33Å; T449-K452 PolarHBondContact O-N 3.1Å; T449-K452 VanDerWaalsContact O-N 3.14Å; T449-Y453 PolarHBondContact O-N 3.03Å; T449-F642 PolarHBondContact OG1-O 3.48Å; T449-K644 HydrophobicContact CG2-CD 3.89Å; T449-K644 HydrophobicContact CG2-CG 4.09Å
450	T	91.3	Very high	83.7	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.5	-40.6	175.3	-57.2	0	0	0	0	111.6	W274 L384 C446 L447 Y453 F454 F642	W274-T450 PolarHBondContact NE1-OG1 2.93Å; L384-T450 HydrophobicContact CD1-CG2 3.93Å; L384-T450 HydrophobicContact CD2-CG2 3.95Å; C446-T450 WeakPolarHBondContact O-CB 3.36Å; C446-T450 PolarHBondContact O-N 3.25Å; C446-T450 PolarHBondContact O-OG1 2.94Å; L447-T450 PolarHBondContact O-N 3.01Å; T450-Y453 PolarHBondContact O-N 3.34Å; T450-F454 HydrophobicContact CG2-CD2 3.69Å; T450-F454 HydrophobicContact CG2-CE2 3.72Å; T450-F454 WeakPolarHBondContact O-CD2 3.28Å; T450-F454 PolarHBondContact O-N 2.97Å; T450-F642 HydrophobicContact CG2-CD1 3.83Å; T450-F642 HydrophobicContact CG2-CE1 3.93Å; T450-F642 WeakPolarHBondContact OG1-CD1 3.37Å
451	Y	92	Very high	81.2	Confident	6 Å²	6	40.3 Å²	40.3	2%	0.024	22%	0.22	C	C	.	.	H	α-helix	trans	-59.2	-47.3	169	177.2	-120.7	0	0	0	111.4	L111 I114 I381 L384 R385 L389 L447 Y453 F454 A455	L111-Y451 HydrophobicContact CB-CD1 4.37Å; L111-Y451 HydrophobicContact CB-CE1 4.15Å; L111-Y451 HydrophobicContact CD2-CD1 4.13Å; L111-Y451 HydrophobicContact CD2-CE1 4.44Å; L111-Y451 WeakPolarHBondContact O-CE1 3.39Å; L111-Y451 PolarHBondContact O-OH 3.24Å; I114-Y451 HydrophobicContact CD1-CE1 4.12Å; I381-Y451 HydrophobicContact CG2-CE2 4.06Å; L384-Y451 HydrophobicContact CB-CD2 3.93Å; L384-Y451 HydrophobicContact CB-CG 4.35Å; R385-Y451 HydrophobicContact CB-CD2 4.05Å; R385-Y451 HydrophobicContact CB-CE2 3.52Å; R385-Y451 HydrophobicContact CG-CE1 4.32Å; R385-Y451 HydrophobicContact CG-CE2 4Å; R385-Y451 PolarHBondContact NH1-OH 2.84Å; L389-Y451 HydrophobicContact CD1-CE1 3.97Å; L447-Y451 WeakPolarHBondContact O-CB 3.39Å; L447-Y451 PolarHBondContact O-N 3.44Å; Y451-Y453 VanDerWaalsContact C-N 3.29Å; Y451-Y453 PolarHBondContact O-N 3.06Å; Y451-F454 PolarHBondContact O-N 2.86Å; Y451-A455 HydrophobicContact CD2-CB 4.1Å; Y451-A455 HydrophobicContact CE2-CB 3.71Å; Y451-A455 WeakPolarHBondContact O-CB 3.45Å; Y451-A455 PolarHBondContact O-N 3.06Å
452	K	88.9	Confident	78.5	Confident	85 Å²	85	42.4 Å²	42.4	37%	0.37	25%	0.246	S	C	.	.	H	α-helix	trans	-60.9	-36.3	177.6	-171.2	168.4	179.5	169.3	0	112.8	L111 K448 T449 L456	L111-K452 HydrophobicContact CD2-CB 3.81Å; L111-K452 HydrophobicContact CD2-CD 4.24Å; L111-K452 HydrophobicContact CD2-CG 4.18Å; K448-K452 WeakPolarHBondContact O-CB 3.41Å; K448-K452 PolarHBondContact O-N 2.83Å; T449-K452 WeakPolarHBondContact O-CB 3.33Å; T449-K452 PolarHBondContact O-N 3.1Å; T449-K452 VanDerWaalsContact O-N 3.14Å; K452-L456 HydrophobicContact CG-CD1 3.81Å; K452-L456 WeakPolarHBondContact O-CD1 3.48Å; K452-L456 VanDerWaalsContact O-CG 3.27Å; K452-L456 WeakPolarHBondContact O-CG 3.41Å
453	Y	89.7	Confident	75.8	Confident	47 Å²	47	45.3 Å²	45.3	18%	0.184	27%	0.272	C	S	.	.	H	α-helix	trans	-67.7	-55	177.1	177.7	-111	0	0	0	111.7	T449 T450 Y451 A455 L456 L458 Y635 E636 A641 F642	T449-Y453 PolarHBondContact O-N 3.03Å; T450-Y453 PolarHBondContact O-N 3.34Å; Y451-Y453 VanDerWaalsContact C-N 3.29Å; Y451-Y453 PolarHBondContact O-N 3.06Å; Y453-A455 VanDerWaalsContact C-N 3.33Å; Y453-A455 PolarHBondContact O-N 3.36Å; Y453-L456 PolarHBondContact O-N 3.16Å; Y453-L458 HydrophobicContact CE2-CD1 3.76Å; Y453-L458 HydrophobicContact CE2-CD2 4.44Å; Y453-Y635 HydrophobicContact CD1-CD1 4.35Å; Y453-Y635 AromaticContact CE1-CD1 3.94Å; Y453-Y635 HydrophobicContact CE1-CD1 3.94Å; Y453-E636 WeakPolarHBondContact CE1-O 3.23Å; Y453-E636 PolarHBondContact OH-N 2.81Å; Y453-E636 VanDerWaalsContact OH-N 3.08Å; Y453-E636 PolarHBondContact OH-O 3.13Å; Y453-A641 HydrophobicContact CD1-CB 4.13Å; Y453-A641 HydrophobicContact CD2-CB 3.92Å; Y453-A641 HydrophobicContact CE1-CB 4.08Å; Y453-A641 HydrophobicContact CE2-CB 3.89Å; Y453-A641 HydrophobicContact CG-CB 4.03Å; Y453-F642 HydrophobicContact CD1-CE1 4.11Å; Y453-F642 HydrophobicContact CE1-CE1 4.31Å
454	F	89.1	Confident	73	Confident	1 Å²	1	52.4 Å²	52.4	0%	0.004	31%	0.31	C	S	.	.	H	α-helix	trans	-77.8	-8.8	-178.4	-70.3	-68.6	0	0	0	114.9	H121 V125 W380 I381 L384 T450 Y451 Y635 F637 F642	H121-F454 PolarHBondContact CE1-O 2.79Å; H121-F454 VanDerWaalsContact CE1-O 3.24Å; H121-F454 PolarHBondContact NE2-O 3.45Å; V125-F454 HydrophobicContact CG1-CD1 4.04Å; V125-F454 HydrophobicContact CG1-CE1 4.48Å; V125-F454 HydrophobicContact CG2-CD1 4.03Å; W380-F454 AromaticContact CE2-CE2 3.99Å; W380-F454 HydrophobicContact CZ2-CD2 4.48Å; W380-F454 AromaticContact CZ2-CE2 4Å; W380-F454 HydrophobicContact CZ2-CE2 4Å; W380-F454 AromaticContact NE1-CD1 3.95Å; W380-F454 AromaticContact NE1-CD2 3.21Å; W380-F454 AromaticContact NE1-CE2 3.34Å; W380-F454 VanDerWaalsContact NE1-CE2 3.34Å; W380-F454 AromaticContact NE1-CG 3.53Å; W380-F454 AromaticContact NE1-CZ 3.77Å; I381-F454 WeakPolarHBondContact CD1-O 3.4Å; I381-F454 HydrophobicContact CG1-CB 4.24Å; I381-F454 WeakPolarHBondContact CG1-O 3.33Å; L384-F454 HydrophobicContact CD1-CB 4.33Å; L384-F454 HydrophobicContact CD1-CD2 3.88Å; T450-F454 HydrophobicContact CG2-CD2 3.69Å; T450-F454 HydrophobicContact CG2-CE2 3.72Å; T450-F454 WeakPolarHBondContact O-CD2 3.28Å; T450-F454 PolarHBondContact O-N 2.97Å; Y451-F454 PolarHBondContact O-N 2.86Å; F454-Y635 AromaticContact CD1-CD1 3.72Å; F454-Y635 HydrophobicContact CD1-CD1 3.72Å; F454-Y635 HydrophobicContact CD1-CE1 4.4Å; F454-Y635 HydrophobicContact CD1-CG 4.16Å; F454-Y635 HydrophobicContact CE1-CD1 4.04Å; F454-Y635 HydrophobicContact CE1-CG 4.21Å; F454-F637 HydrophobicContact CE1-CE2 4.32Å; F454-F637 HydrophobicContact CE2-CZ 4.44Å; F454-F637 HydrophobicContact CZ-CD2 4.24Å; F454-F637 AromaticContact CZ-CE2 3.68Å; F454-F637 HydrophobicContact CZ-CE2 3.68Å; F454-F637 AromaticContact CZ-CZ 3.86Å; F454-F637 HydrophobicContact CZ-CZ 3.86Å; F454-F642 AromaticContact CE2-CE1 3.64Å; F454-F642 HydrophobicContact CE2-CE1 3.64Å; F454-F642 HydrophobicContact CE2-CZ 4.06Å; F454-F642 HydrophobicContact CZ-CE1 4.08Å; F454-F642 HydrophobicContact CZ-CZ 4.21Å
455	A	85.9	Confident	70.3	Confident	6 Å²	6	59.3 Å²	59.3	5%	0.05	34%	0.341	C	S	.	.	H	α-helix	trans	-95.4	-9.7	175.4	0	0	0	0	0	113.6	I114 I381 Y451 Y453	I114-A455 HydrophobicContact CD1-CB 4.08Å; I114-A455 HydrophobicContact CG2-CB 3.89Å; I114-A455 WeakPolarHBondContact CG2-O 3.48Å; I381-A455 HydrophobicContact CG2-CB 4.31Å; Y451-A455 HydrophobicContact CD2-CB 4.1Å; Y451-A455 HydrophobicContact CE2-CB 3.71Å; Y451-A455 WeakPolarHBondContact O-CB 3.45Å; Y451-A455 PolarHBondContact O-N 3.06Å; Y453-A455 VanDerWaalsContact C-N 3.33Å; Y453-A455 PolarHBondContact O-N 3.36Å
456	L	84.9	Confident	67.5	Low	71 Å²	71	69 Å²	69	37%	0.372	38%	0.377	S	S	.	.	S	Bend	trans	-107.4	130.8	179.3	-66.9	176.3	0	0	0	111.3	I114 K452 Y453 L458 Y635	I114-L456 HydrophobicContact CG2-CD2 4.17Å; K452-L456 HydrophobicContact CG-CD1 3.81Å; K452-L456 WeakPolarHBondContact O-CD1 3.48Å; K452-L456 VanDerWaalsContact O-CG 3.27Å; K452-L456 WeakPolarHBondContact O-CG 3.41Å; Y453-L456 PolarHBondContact O-N 3.16Å; L456-L458 PolarHBondContact O-N 2.89Å; L456-Y635 PolarHBondContact O-OH 2.84Å
457	P	74.8	Confident	64.6	Low	71 Å²	71	76.6 Å²	76.6	46%	0.461	42%	0.417	S	S	.	.			trans	-64.5	121.6	176.2	-22.5	33.9	0	0	0	112.8	N459 Y633 Y635	P457-N459 PolarHBondContact O-N 3.42Å; P457-Y633 HydrophobicContact CB-CD1 4.28Å; P457-Y633 HydrophobicContact CB-CE1 3.7Å; P457-Y635 WeakPolarHBondContact CA-OH 3.46Å
458	L	72.6	Confident	61.7	Low	63 Å²	63	86 Å²	86	33%	0.33	46%	0.461	S	S	.	.			trans	-82.7	91	176.5	-69.4	175.4	0	0	0	111.5	Y453 L456 T460 Y633 A634 Y635	Y453-L458 HydrophobicContact CE2-CD1 3.76Å; Y453-L458 HydrophobicContact CE2-CD2 4.44Å; L456-L458 PolarHBondContact O-N 2.89Å; L458-T460 PolarHBondContact O-N 3.3Å; L458-T460 VanDerWaalsContact O-N 3.12Å; L458-Y633 WeakPolarHBondContact O-CD1 3.43Å; L458-A634 VanDerWaalsContact CD1-O 3.32Å; L458-A634 WeakPolarHBondContact CD1-O 3.29Å; L458-Y635 HydrophobicContact CB-CE1 4.43Å; L458-Y635 HydrophobicContact CD1-CD1 3.5Å; L458-Y635 VanDerWaalsContact CD1-CD1 3.5Å; L458-Y635 HydrophobicContact CD1-CE1 3.4Å; L458-Y635 VanDerWaalsContact CD1-CE1 3.4Å; L458-Y635 HydrophobicContact CD1-CG 4.1Å; L458-Y635 HydrophobicContact CG-CD1 4.26Å; L458-Y635 HydrophobicContact CG-CE1 3.64Å; L458-Y635 PolarHBondContact N-OH 2.8Å
459	N	52	Low	58.9	Low	111 Å²	111	88.8 Å²	88.8	59%	0.594	49%	0.489	S	S	*	.			trans	-64.9	110.7	175	-78.2	-9.3	0	0	0	111.4	P457 S461	P457-N459 PolarHBondContact O-N 3.42Å; N459-S461 VanDerWaalsContact C-N 3.28Å; N459-S461 PolarHBondContact O-N 3.21Å
460	T	46.1	Very low	56	Low	89 Å²	89	98.6 Å²	98.6	55%	0.546	53%	0.531	S	S	.	.	S	Bend	trans	-69.3	73.6	179.2	14.6	0	0	0	0	112.6	L458 Q632	L458-T460 PolarHBondContact O-N 3.3Å; L458-T460 VanDerWaalsContact O-N 3.12Å; T460-Q632 PolarHBondContact OG1-O 3.1Å; T460-Q632 VanDerWaalsContact OG1-O 3.11Å
461	S	33.8	Very low	52.8	Low	109 Å²	109	108.3 Å²	108.3	76%	0.762	58%	0.576	S	S	*	*	S	Bend	trans	-143.4	12.4	178.2	61.8	0	0	0	0	115.3	N459	N459-S461 VanDerWaalsContact C-N 3.28Å; N459-S461 PolarHBondContact O-N 3.21Å
462	A	30.5	Very low	49.6	Very low	101 Å²	101	111.4 Å²	111.4	84%	0.835	61%	0.61	S	S	*	*	S	Bend	trans	-127.1	1.8	-176.9	0	0	0	0	0	115.4
463	A	32	Very low	46.6	Very low	75 Å²	75	115.2 Å²	115.2	62%	0.62	63%	0.634	S	S	*	*	S	Bend	trans	-98.5	-23.4	-173	0	0	0	0	0	115.3	H465	A463-H465 PolarHBondContact O-N 3.38Å
464	N	30.2	Very low	43.5	Very low	154 Å²	154	120.8 Å²	120.8	82%	0.824	67%	0.667	S	S	*	*	S	Bend	trans	-98.2	24.8	-167.9	-74.1	12.6	0	0	0	115.2
465	H	32.7	Very low	40.5	Very low	192 Å²	192	129.2 Å²	129.2	89%	0.889	71%	0.706	S	S	*	*	S	Bend	trans	-141.8	51.9	175.2	-81.5	-42.1	0	0	0	113	A463	A463-H465 PolarHBondContact O-N 3.38Å
466	R	30.4	Very low	37.6	Very low	231 Å²	231	132.8 Å²	132.8	87%	0.872	74%	0.744	S	S	*	*	S	Bend	trans	-145.9	1.4	164.9	-117.1	170.2	-163.3	-164.2	3	118.7
467	D	28.8	Very low	34.6	Very low	158 Å²	158	134 Å²	134	85%	0.845	77%	0.765	S	S	*	*	S	Bend	trans	-117.2	27.1	-176.8	-73.7	-65.1	0	0	0	116
468	E	30.3	Very low	32.1	Very low	203 Å²	203	136.3 Å²	136.3	95%	0.949	78%	0.782	S	S	*	*	S	Bend	trans	-119.1	40.6	168.2	-73.4	-161.8	142.1	0	0	112.8
469	A	31.6	Very low	29.7	Very low	85 Å²	85	137.8 Å²	137.8	70%	0.702	80%	0.797	S	S	*	*	S	Bend	trans	-157	57.7	175.5	0	0	0	0	0	115.7
470	K	28.2	Very low	28.3	Very low	212 Å²	212	139.6 Å²	139.6	92%	0.922	81%	0.807	S	S	*	*			trans	179.3	69.7	152.1	-99.8	155.5	-173	-177.7	0	114.8
471	Q	25.1	Very low	27.1	Very low	204 Å²	204	139.9 Å²	139.9	95%	0.953	81%	0.812	S	S	*	*			trans	-132.8	116	145.1	-78.2	-165.7	-6.5	0	0	108
472	G	24.2	Very low	26.6	Very low	71 Å²	71	142.4 Å²	142.4	73%	0.732	82%	0.817	S	S	*	*			trans	168.4	85.8	-170.9	0	0	0	0	0	113.3
473	L	26	Very low	26.2	Very low	166 Å²	166	146.6 Å²	146.6	87%	0.869	82%	0.817	S	S	*	*			trans	66.2	119.7	159	-59.1	160.7	0	0	0	117.8
474	N	24.3	Very low	25.9	Very low	164 Å²	164	147.2 Å²	147.2	88%	0.877	82%	0.817	S	S	*	*			trans	-136.5	89	149.1	-169.3	21.6	0	0	0	108.6
475	E	26.4	Very low	25.6	Very low	177 Å²	177	147.2 Å²	147.2	83%	0.827	81%	0.812	S	S	*	*			trans	-131.3	148.4	167.9	-82	-164.6	146.5	0	0	108.3
476	G	24.4	Very low	25.1	Very low	82 Å²	82	144.8 Å²	144.8	85%	0.845	81%	0.805	S	S	*	*			trans	85.9	107.9	169.5	0	0	0	0	0	114.5
477	A	22.8	Very low	24.7	Very low	97 Å²	97	138.2 Å²	138.2	80%	0.802	79%	0.794	S	S	*	*			trans	-91.3	170.2	178.1	0	0	0	0	0	113.5
478	S	20.8	Very low	24.5	Very low	119 Å²	119	137.9 Å²	137.9	83%	0.832	79%	0.791	S	S	*	*			trans	97.7	150.4	152.7	82.5	0	0	0	0	120.7
479	S	22.1	Very low	24.1	Very low	93 Å²	93	137 Å²	137	65%	0.65	79%	0.787	S	S	*	*			trans	96.8	105.2	152.4	-165.8	0	0	0	0	120.2
480	L	23.6	Very low	23.8	Very low	150 Å²	150	138.3 Å²	138.3	79%	0.785	79%	0.791	S	S	*	*			trans	58.8	105.5	138.3	-58.3	175.9	0	0	0	118
481	S	21.8	Very low	23.9	Very low	95 Å²	95	133.8 Å²	133.8	66%	0.664	78%	0.784	S	S	*	*				70.3	116.8	75	76.6	0	0	0	0	115.5
482	D	21.8	Very low	23.8	Very low	161 Å²	161	129 Å²	129	86%	0.861	77%	0.773	S	S	*	*				-160.4	166.8	113.9	-128.9	-31.9	0	0	0	114.7
483	F	22.9	Very low	23.9	Very low	189 Å²	189	134.9 Å²	134.9	83%	0.829	78%	0.781	S	S	*	*			trans	-83.7	171.4	-168	-116.8	-98.6	0	0	0	115.7
484	S	24.6	Very low	23.9	Very low	89 Å²	89	134.1 Å²	134.1	62%	0.622	78%	0.783	S	S	*	*			trans	76.2	151.1	150.4	-66	0	0	0	0	118.5
485	Q	24	Very low	23.9	Very low	154 Å²	154	138.3 Å²	138.3	72%	0.72	79%	0.787	S	S	*	*			cis	-167	163	-4.7	-121.3	175.8	18.5	0	0	112.5
486	L	23.5	Very low	23.9	Very low	141 Å²	141	133.7 Å²	133.7	74%	0.738	79%	0.787	S	S	*	*			trans	64.9	164.4	152.4	-63.6	161.1	0	0	0	118.7
487	S	21.4	Very low	24	Very low	92 Å²	92	134.7 Å²	134.7	64%	0.643	79%	0.787	S	S	*	*			cis	-174.7	145.7	-49.8	-101.7	0	0	0	0	111.6
488	L	24	Very low	24.3	Very low	151 Å²	151	137.4 Å²	137.4	79%	0.791	79%	0.788	S	S	*	*			trans	70.8	145.9	146.4	-76.5	167.2	0	0	0	122.9
489	Q	22.6	Very low	24.6	Very low	184 Å²	184	139.1 Å²	139.1	86%	0.86	79%	0.788	S	S	*	*			trans	86.1	141.7	147.2	-79.6	171	11.4	0	0	122
490	S	25.7	Very low	24.8	Very low	113 Å²	113	137.9 Å²	137.9	79%	0.79	79%	0.79	S	S	*	*			trans	-132.5	150.5	-175.5	54.7	0	0	0	0	111.4
491	P	29.7	Very low	26	Very low	118 Å²	118	136.6 Å²	136.6	77%	0.766	79%	0.791	S	S	*	*			trans	-128	127.1	155.3	23.9	-5.4	0	0	0	110.8
492	S	23.4	Very low	26.2	Very low	104 Å²	104	139.8 Å²	139.8	73%	0.727	80%	0.8	S	S	*	*				89	104.6	56.6	77.7	0	0	0	0	115.2
493	Q	25.3	Very low	26.4	Very low	193 Å²	193	139.3 Å²	139.3	90%	0.902	80%	0.797	S	S	*	*			trans	48.4	129.8	148.6	-59.1	-174.7	4.4	0	0	122
494	T	26.9	Very low	26.8	Very low	150 Å²	150	136.1 Å²	136.1	92%	0.92	80%	0.799	S	S	*	*			trans	-151	167	136.8	-4.8	0	0	0	0	111
495	R	24.4	Very low	26.8	Very low	253 Å²	253	140 Å²	140	96%	0.955	81%	0.812	S	S	*	*			trans	-109.2	151.6	-175.6	-65	175.8	175.4	170.9	-3.5	112
496	G	25.6	Very low	26.9	Very low	79 Å²	79	138.3 Å²	138.3	81%	0.814	82%	0.817	S	S	*	*			trans	-168.9	151.7	163.6	0	0	0	0	0	110.1
497	A	27.6	Very low	27	Very low	103 Å²	103	138.8 Å²	138.8	85%	0.851	82%	0.818	S	S	*	*			trans	-153.8	136.6	177.6	0	0	0	0	0	110.4
498	D	27.8	Very low	27.3	Very low	155 Å²	155	141 Å²	141	83%	0.829	82%	0.821	S	S	*	*			trans	-164.7	169.1	134.9	-126.7	-23.2	0	0	0	110.8
499	D	28.4	Very low	27.5	Very low	154 Å²	154	142.6 Å²	142.6	82%	0.824	83%	0.825	S	S	*	*			trans	14.7	142.9	167.4	-75.7	-32.2	0	0	0	123.2
500	G	26.2	Very low	27.7	Very low	67 Å²	67	142.4 Å²	142.4	69%	0.691	82%	0.824	S	S	*	*			trans	-121.8	-150.1	158.9	0	0	0	0	0	110.5
501	P	48	Very low	27.9	Very low	124 Å²	124	146.4 Å²	146.4	81%	0.805	83%	0.83	S	S	*	*			cis	-126	169.8	-13.5	41.5	-28.5	0	0	0	113.3
502	D	26.3	Very low	27.7	Very low	161 Å²	161	149.9 Å²	149.9	86%	0.861	84%	0.836	S	S	*	*			trans	-170.6	168	135.5	-124.2	-22.4	0	0	0	113.8
503	D	27.2	Very low	27.9	Very low	151 Å²	151	154.1 Å²	154.1	81%	0.807	84%	0.844	S	S	*	*			trans	-75.4	141.5	-171.3	-67.3	-33.7	0	0	0	116.4
504	S	30	Very low	27.9	Very low	122 Å²	122	150.5 Å²	150.5	85%	0.853	84%	0.835	S	S	*	*			trans	-171.2	107.9	142.2	-87.1	0	0	0	0	113.3
505	D	25.3	Very low	28.1	Very low	171 Å²	171	152.7 Å²	152.7	91%	0.914	84%	0.835	S	S	*	*			trans	-84.9	124.8	168.8	-78.2	-30.1	0	0	0	111.4
506	C	24.7	Very low	28.1	Very low	119 Å²	119	149.2 Å²	149.2	80%	0.804	83%	0.83	S	S	*	*			trans	-158.9	170.9	169.4	-94.6	0	0	0	0	109.4
507	I	25.9	Very low	28.1	Very low	151 Å²	151	151.1 Å²	151.1	77%	0.774	83%	0.829	S	S	*	*			trans	78.2	119	-173.3	-54.2	166.8	0	0	0	110.2
508	I	27.8	Very low	28	Very low	137 Å²	137	151.5 Å²	151.5	70%	0.703	83%	0.825	S	S	*	*			cis	84.4	92.9	37.3	-53.8	163	0	0	0	112.8	E510	I508-E510 HydrophobicContact CG2-CG 4.36Å
509	E	28.1	Very low	27.9	Very low	186 Å²	186	151.4 Å²	151.4	87%	0.869	83%	0.825	S	S	*	*			trans	-140	109.5	158.1	-60.9	178	163.5	0	0	102.7
510	E	27.8	Very low	27.8	Very low	180 Å²	180	149.7 Å²	149.7	84%	0.841	83%	0.825	S	S	*	*				62.3	109	62.8	-59.8	-159.4	164.1	0	0	112	I508	I508-E510 HydrophobicContact CG2-CG 4.36Å
511	E	29.1	Very low	27.9	Very low	196 Å²	196	154 Å²	154	92%	0.916	83%	0.832	S	S	*	*			trans	-100.1	113.1	-176.6	-64.8	178.1	131.9	0	0	109
512	E	25.3	Very low	26.8	Very low	191 Å²	191	156.3 Å²	156.3	89%	0.893	83%	0.832	S	S	*	*			trans	-91.3	122	161.7	-73.2	-167.8	140.2	0	0	109.3
513	E	27.7	Very low	26.9	Very low	194 Å²	194	155.9 Å²	155.9	91%	0.907	83%	0.825	S	S	*	*			trans	-85.5	129.6	170.2	-66.1	-173.6	135.4	0	0	109.6
514	V	26.4	Very low	26.8	Very low	117 Å²	117	155.3 Å²	155.3	71%	0.709	82%	0.817	S	S	*	*			trans	-118.8	109.3	171.5	-180	0	0	0	0	108.2	E516	V514-E516 HydrophobicContact CG1-CG 4.13Å
515	E	30.1	Very low	26.6	Very low	195 Å²	195	157.5 Å²	157.5	91%	0.911	81%	0.814	S	S	*	*			trans	-77.8	127.1	158.5	-69	-163.9	146.1	0	0	109
516	E	25.2	Very low	26.6	Very low	181 Å²	181	159.5 Å²	159.5	85%	0.846	82%	0.815	S	S	*	*			trans	-123.6	113.6	158.2	-81.2	-170.5	151.4	0	0	108.8	V514	V514-E516 HydrophobicContact CG1-CG 4.13Å
517	C	25.8	Very low	26.6	Very low	118 Å²	118	161.3 Å²	161.3	80%	0.797	81%	0.811	S	S	*	*			trans	-99.3	133.7	163.3	-178	0	0	0	0	107.9
518	S	24.7	Very low	26.7	Very low	111 Å²	111	162 Å²	162	78%	0.776	81%	0.809	S	S	*	*			trans	-149.4	117.7	166.5	43.8	0	0	0	0	110.8
519	D	26.8	Very low	26.5	Very low	154 Å²	154	161.6 Å²	161.6	82%	0.824	81%	0.813	S	S	*	*			trans	-80.5	146	159.4	-67.8	-52.6	0	0	0	109.7
520	S	26.2	Very low	26.4	Very low	117 Å²	117	159.1 Å²	159.1	82%	0.818	81%	0.805	S	S	*	*			trans	-166.5	120.1	145.4	59.9	0	0	0	0	110.3
521	D	27.8	Very low	26.3	Very low	157 Å²	157	158.7 Å²	158.7	84%	0.84	81%	0.806	S	S	*	*			trans	-63.8	159.5	160.4	-64.9	-72.7	0	0	0	111.3
522	E	25.4	Very low	26.1	Very low	174 Å²	174	152.6 Å²	152.6	81%	0.813	80%	0.795	S	S	*	*				177.9	126.7	123.8	-96.3	-178.3	-174.7	0	0	111.3
523	E	26.8	Very low	26.1	Very low	152 Å²	152	153.1 Å²	153.1	71%	0.71	79%	0.794	S	S	*	*			trans	53.9	150.5	135.4	-54.1	-147.8	141.5	0	0	122.5
524	Q	25	Very low	25.9	Very low	138 Å²	138	149 Å²	149	65%	0.645	79%	0.787	S	S	*	*			cis	-160.2	161.9	-14.4	-113.8	-176.2	28.7	0	0	109.5
525	E	26.1	Very low	25.9	Very low	168 Å²	168	147.7 Å²	147.7	79%	0.785	78%	0.783	S	S	*	*			trans	23.3	127	154.6	-57.4	-168.5	165.8	0	0	122.5
526	K	25.6	Very low	25.6	Very low	214 Å²	214	148 Å²	148	93%	0.93	78%	0.782	S	S	*	*				-155.1	117.9	123.4	-117.6	155.6	-166.3	151.4	0	115
527	E	25.7	Very low	25.7	Very low	156 Å²	156	143.7 Å²	143.7	73%	0.729	77%	0.772	S	S	*	*			trans	-85.9	140.7	174.7	-171.6	-158	-123.6	0	0	111
528	K	26.8	Very low	25.8	Very low	166 Å²	166	147.1 Å²	147.1	72%	0.722	78%	0.776	S	S	*	*				167.9	145	120.9	-91.9	172.8	-170.4	-179.2	0	118.3
529	T	24.5	Very low	25.8	Very low	128 Å²	128	149 Å²	149	79%	0.785	78%	0.778	S	S	*	*			trans	60.5	98.1	150	52.6	0	0	0	0	120.5
530	D	26	Very low	25.9	Very low	134 Å²	134	150 Å²	150	72%	0.717	78%	0.777	S	S	*	*				-0.5	131.6	124.7	178.7	42.3	0	0	0	118.7
531	M	24.8	Very low	25.9	Very low	172 Å²	172	154.2 Å²	154.2	85%	0.847	78%	0.784	S	S	*	*				-170.1	138	124.7	-98	-71.3	153.8	0	0	109.5
532	G	25	Very low	25.8	Very low	67 Å²	67	153.6 Å²	153.6	69%	0.691	78%	0.781	S	S	*	*			trans	-95.1	-172.4	-167.7	0	0	0	0	0	117.9
533	K	26.2	Very low	26	Very low	202 Å²	202	154.9 Å²	154.9	88%	0.878	79%	0.787	S	S	*	*			trans	87.3	106.4	172.4	-63.5	-176.1	176.1	178.1	0	119.5
534	S	22.7	Very low	26	Very low	108 Å²	108	155.2 Å²	155.2	76%	0.755	79%	0.788	S	S	*	*				99.3	139.3	116.5	77.2	0	0	0	0	121.8
535	S	26.9	Very low	26.1	Very low	89 Å²	89	158.2 Å²	158.2	62%	0.622	80%	0.802	S	S	*	*			trans	103.3	140.5	141.1	-47.7	0	0	0	0	119.2
536	F	23.3	Very low	26.2	Very low	202 Å²	202	158 Å²	158	89%	0.886	80%	0.801	S	S	*	*			trans	70.7	141.7	168.2	-59.2	-73.3	0	0	0	118.4
537	S	27.6	Very low	26.3	Very low	91 Å²	91	155 Å²	155	64%	0.636	80%	0.795	S	S	*	*			cis	-144.2	152.2	-11	47.4	0	0	0	0	112.1
538	E	28	Very low	26.4	Very low	189 Å²	189	157.1 Å²	157.1	88%	0.883	81%	0.805	S	S	*	*			trans	-91.1	141.2	157.6	-65.5	162.9	146.4	0	0	107
539	D	24.7	Very low	26.6	Very low	152 Å²	152	156.3 Å²	156.3	81%	0.813	81%	0.809	S	S	*	*			trans	-139.9	109.7	164	-76.4	-64.5	0	0	0	106.7
540	E	29.6	Very low	26.7	Very low	175 Å²	175	157.7 Å²	157.7	82%	0.818	81%	0.811	S	S	*	*			trans	-103.3	144.2	171	-64.5	-177.6	134.3	0	0	108.3
541	E	25.7	Very low	26.7	Very low	204 Å²	204	158 Å²	158	95%	0.953	81%	0.812	S	S	*	*			trans	-128.3	109.7	163.5	-73.3	-169.7	148.8	0	0	108.8
542	D	26.3	Very low	26.8	Very low	145 Å²	145	155.6 Å²	155.6	78%	0.775	81%	0.807	S	S	*	*			trans	-75.8	156.5	166.4	-66.8	-63.9	0	0	0	110.8
543	E	27.9	Very low	26.7	Very low	201 Å²	201	159 Å²	159	94%	0.939	81%	0.809	S	S	*	*			trans	-132.1	149.7	143.2	-83.1	-158.7	148.7	0	0	110
544	E	27.5	Very low	26.6	Very low	158 Å²	158	153.6 Å²	153.6	74%	0.738	80%	0.797	S	S	*	*			trans	-100.2	149.4	-161.2	-49.7	175	131.9	0	0	112.9
545	E	27.1	Very low	26.7	Very low	201 Å²	201	157.5 Å²	157.5	94%	0.939	80%	0.803	S	S	*	*			trans	-129.4	135.8	150.2	-71.6	-166.9	156.7	0	0	108.8
546	Q	27.9	Very low	26.7	Very low	165 Å²	165	158.2 Å²	158.2	77%	0.771	81%	0.806	S	S	*	*			trans	-116.1	156.9	177.9	-73.7	-175.1	16.4	0	0	111.3
547	D	27.5	Very low	26.7	Very low	149 Å²	149	157.6 Å²	157.6	80%	0.797	81%	0.805	S	S	*	*			trans	-77	152.1	-166.2	-41.6	-92.3	0	0	0	115.4
548	E	29	Very low	26.7	Very low	202 Å²	202	160.8 Å²	160.8	94%	0.944	82%	0.815	S	S	*	*			trans	-134.9	121.1	141.3	-76	-161.2	155.1	0	0	109.8
549	D	29.6	Very low	26.5	Very low	149 Å²	149	162.5 Å²	162.5	80%	0.797	81%	0.814	S	S	*	*			trans	-79.6	158.5	175.8	-84.2	-54.7	0	0	0	113
550	L	26.9	Very low	26.5	Very low	157 Å²	157	163.9 Å²	163.9	82%	0.822	82%	0.815	S	S	*	*				176.1	101.9	124.2	-93.9	164.7	0	0	0	115.1
551	D	25.8	Very low	26.2	Very low	140 Å²	140	164.1 Å²	164.1	75%	0.749	82%	0.816	S	S	*	*			trans	57.2	136	134.7	-94	-36.5	0	0	0	125.9
552	V	26.8	Very low	26.2	Very low	122 Å²	122	161.2 Å²	161.2	74%	0.739	81%	0.806	S	S	*	*			trans	70.6	130.2	146.7	174.4	0	0	0	0	117.9
553	D	23.3	Very low	26.2	Very low	137 Å²	137	161 Å²	161	73%	0.733	81%	0.805	S	S	*	*			cis	-153.9	164.9	27.7	-148.1	-18.7	0	0	0	115.8
554	S	23.9	Very low	26.1	Very low	89 Å²	89	155.2 Å²	155.2	62%	0.622	79%	0.787	S	S	*	*			trans	32.3	119.4	151.4	63.4	0	0	0	0	125.4
555	Q	24.7	Very low	26	Very low	190 Å²	190	155.8 Å²	155.8	89%	0.888	79%	0.794	S	S	*	*			trans	82.2	151.4	133.9	-73	-162.6	-4.7	0	0	122.1
556	P	26.8	Very low	26	Very low	105 Å²	105	149.8 Å²	149.8	68%	0.682	77%	0.771	S	S	*	*			trans	-106.5	158.8	-160	40.4	-33	0	0	0	114.8
557	H	23.7	Very low	26.1	Very low	188 Å²	188	148 Å²	148	87%	0.87	77%	0.772	S	S	*	*			trans	-128.7	131.4	158.7	-84.5	-59.6	0	0	0	110.2
558	D	27.3	Very low	26.2	Very low	159 Å²	159	149.6 Å²	149.6	85%	0.85	77%	0.774	S	S	*	*			trans	-63.4	141.9	-175.2	-58.9	-81.2	0	0	0	113.1
559	R	24.3	Very low	26.3	Very low	224 Å²	224	145.5 Å²	145.5	85%	0.845	76%	0.759	S	S	*	*			trans	-129.5	107.9	166.8	-83.1	-173.6	166.5	178.3	-2.5	109.7	H561	R559-H561 PolarHBondContact O-N 2.8Å
560	E	24.5	Very low	26.5	Very low	181 Å²	181	147.1 Å²	147.1	85%	0.846	76%	0.762	S	S	*	*			trans	-59.2	103.3	169.7	-59.7	176.8	152.4	0	0	109.9
561	H	24.3	Very low	26.7	Very low	180 Å²	180	147.1 Å²	147.1	83%	0.833	76%	0.763	S	S	*	*			trans	-90.3	107.6	172.8	-107.7	-83.3	0	0	0	109.8	R559	R559-H561 PolarHBondContact O-N 2.8Å
562	L	26.2	Very low	26.7	Very low	144 Å²	144	148 Å²	148	75%	0.754	77%	0.766	S	S	*	*			trans	-81.9	124.1	173.9	-152.9	79.5	0	0	0	110.2
563	D	24.9	Very low	26.6	Very low	139 Å²	139	150 Å²	150	74%	0.743	77%	0.765	S	S	*	*			trans	28	122.8	163.4	-57.1	-43.1	0	0	0	121.6	L565	D563-L565 PolarHBondContact O-N 3.29Å
564	S	26.5	Very low	26.7	Very low	81 Å²	81	148.5 Å²	148.5	57%	0.566	76%	0.763	S	S	*	*			trans	-83.4	87.4	174.2	174.4	0	0	0	0	111.4
565	L	26	Very low	27.2	Very low	170 Å²	170	151.5 Å²	151.5	89%	0.89	78%	0.777	S	S	*	*			trans	-59.9	147.2	163.7	-70.6	176.3	0	0	0	111.1	D563	D563-L565 PolarHBondContact O-N 3.29Å
566	T	27	Very low	27.1	Very low	74 Å²	74	148.1 Å²	148.1	45%	0.454	77%	0.765	S	S	.	*			trans	-142.8	147.8	176.9	50.5	0	0	0	0	110.4	F1044	T566-F1044 HydrophobicContact CG2-CD1 3.92Å; T566-F1044 HydrophobicContact CG2-CD2 4.14Å; T566-F1044 HydrophobicContact CG2-CE1 3.44Å; T566-F1044 VanDerWaalsContact CG2-CE1 3.44Å; T566-F1044 HydrophobicContact CG2-CE2 3.65Å; T566-F1044 HydrophobicContact CG2-CG 4.27Å; T566-F1044 HydrophobicContact CG2-CZ 3.3Å; T566-F1044 WeakPolarHBondContact OG1-CE1 3.31Å; T566-F1044 WeakPolarHBondContact OG1-CZ 3.45Å
567	T	29.2	Very low	27.2	Very low	128 Å²	128	151.4 Å²	151.4	79%	0.785	77%	0.771	S	S	*	*	S	Bend	trans	-74.4	158.1	-170.4	48	0	0	0	0	113.4
568	E	29.4	Very low	27.4	Very low	182 Å²	182	145.9 Å²	145.9	85%	0.85	75%	0.747	S	S	*	*	S	Bend	trans	78.3	58.4	170.7	-58.2	176.4	-151.7	0	0	116.6
569	D	30.6	Very low	27.6	Very low	116 Å²	116	139.2 Å²	139.2	62%	0.62	71%	0.713	S	S	*	*				-166.1	109.3	125.6	-100.1	-22.7	0	0	0	109.7	D571 R1033	D569-D571 VanDerWaalsContact C-N 3.31Å; D569-D571 PolarHBondContact O-N 3.29Å; D569-R1033 IonicContact OD2-CZ 2.7Å; D569-R1033 IonicContact OD2-NE 3.46Å; D569-R1033 IonicContact OD2-NH2 2.76Å; D569-R1033 PolarHBondContact OD2-NH2 3.02Å
570	E	34.2	Very low	28.2	Very low	184 Å²	184	129 Å²	129	86%	0.86	68%	0.677	S	S	*	*			trans	-79.4	69.1	177.9	-86.1	-92.3	126.7	0	0	111.4
571	D	32.3	Very low	28.8	Very low	156 Å²	156	121.7 Å²	121.7	83%	0.834	64%	0.643	S	S	*	*			trans	-152.8	33.5	174	-114.8	-21.6	0	0	0	113.9	D569	D569-D571 VanDerWaalsContact C-N 3.31Å; D569-D571 PolarHBondContact O-N 3.29Å
572	I	25.4	Very low	29.3	Very low	158 Å²	158	114.8 Å²	114.8	81%	0.81	61%	0.611	S	S	*	*			trans	-134.2	91.5	167.9	-50.8	179.8	0	0	0	111
573	F	24.7	Very low	29.6	Very low	164 Å²	164	111.5 Å²	111.5	72%	0.719	59%	0.594	S	S	*	*			trans	-111.7	137.3	149.4	-84.1	-81.5	0	0	0	108.4
574	P	25.2	Very low	29.9	Very low	106 Å²	106	106.4 Å²	106.4	69%	0.688	57%	0.567	S	S	*	*			trans	-67	163	171.4	30.8	-35.4	0	0	0	110.9	D576	P574-D576 PolarHBondContact O-N 3.2Å; P574-D576 VanDerWaalsContact O-N 3.11Å
575	V	33.4	Very low	30	Very low	153 Å²	153	105.5 Å²	105.5	93%	0.927	56%	0.56	S	S	*	*			trans	-52	112.3	-173.2	-173.9	0	0	0	0	112.4
576	D	23.2	Very low	30	Very low	118 Å²	118	104.2 Å²	104.2	63%	0.631	56%	0.555	S	S	*	*			trans	-125.9	154.9	167.6	-105.4	-16.5	0	0	0	107	K427 P574	K427-D576 IonicContact NZ-OD2 2.72Å; K427-D576 PolarHBondContact NZ-OD2 3.48Å; P574-D576 PolarHBondContact O-N 3.2Å; P574-D576 VanDerWaalsContact O-N 3.11Å
577	E	28.4	Very low	30	Very low	174 Å²	174	108.8 Å²	108.8	81%	0.813	57%	0.571	S	S	*	*			trans	-57	144	-161.6	-62.9	168.7	144.6	0	0	116.7	S579	E577-S579 PolarHBondContact O-N 2.81Å
578	I	29.2	Very low	29.9	Very low	73 Å²	73	111 Å²	111	37%	0.374	57%	0.572	S	S	.	*			trans	-62.5	129.5	-179.6	-59.6	177.2	0	0	0	110.7	N246	N246-I578 PolarHBondContact ND2-O 3.21Å
579	S	31.2	Very low	29.6	Very low	19 Å²	19	107.1 Å²	107.1	13%	0.133	56%	0.563	C	S	.	*			trans	-138	112	179.3	-177.9	0	0	0	0	112	N246 R428 E577	N246-S579 WeakPolarHBondContact CB-OG 3.47Å; R428-S579 PolarHBondContact NH1-O 3Å; R428-S579 PolarHBondContact NH1-OG 3.19Å; R428-S579 PolarHBondContact NH2-O 2.73Å; E577-S579 PolarHBondContact O-N 2.81Å
580	G	36.6	Very low	29.5	Very low	9 Å²	9	107.4 Å²	107.4	9%	0.093	57%	0.571	C	S	.	*			trans	-67.3	148.7	-174.1	0	0	0	0	0	115.4	V223 N244 R428	V223-G580 VanDerWaalsContact CG2-CA 3.44Å; N244-G580 WeakPolarHBondContact OD1-CA 3.41Å; N244-G580 PolarHBondContact OD1-N 3.1Å; R428-G580 PolarHBondContact NH1-O 2.97Å; R428-G580 VanDerWaalsContact NH2-C 3.3Å; R428-G580 PolarHBondContact NH2-O 3.01Å
581	E	36.8	Very low	29.1	Very low	28 Å²	28	106.4 Å²	106.4	13%	0.131	57%	0.572	C	S	.	*			trans	-115.4	146.5	152.2	-99.5	142.2	-179.2	0	0	105.2	R222 Y291 R428 R432	R222-E581 IonicContact NH1-OE2 3.41Å; R222-E581 PolarHBondContact NH1-OE2 2.84Å; Y291-E581 HydrophobicContact CE1-CG 4.2Å; Y291-E581 WeakPolarHBondContact OH-CG 3.23Å; R428-E581 IonicContact CZ-OE1 3.73Å; R428-E581 IonicContact CZ-OE2 3.35Å; R428-E581 IonicContact NE-OE1 2.83Å; R428-E581 PolarHBondContact NE-OE1 3.34Å; R428-E581 IonicContact NE-OE2 3.22Å; R428-E581 IonicContact NH2-OE1 3.77Å; R428-E581 PolarHBondContact NH2-OE1 3.02Å; R428-E581 IonicContact NH2-OE2 2.67Å; R428-E581 PolarHBondContact NH2-OE2 2.89Å; R432-E581 IonicContact CZ-OE2 3.67Å; R432-E581 IonicContact NE-OE1 2.81Å; R432-E581 PolarHBondContact NE-OE1 2.84Å; R432-E581 IonicContact NE-OE2 2.72Å; R432-E581 PolarHBondContact NE-OE2 3.45Å; R432-E581 IonicContact NH2-OE2 2.66Å; R432-E581 PolarHBondContact NH2-OE2 2.92Å
582	E	35.9	Very low	29.1	Very low	35 Å²	35	106.3 Å²	106.3	16%	0.164	57%	0.57	C	S	.	*	P	Polyproline II helix	trans	-71.4	132	174.9	-62.3	171.5	128.5	0	0	109.8	N184	N184-E582 PolarHBondContact ND2-OE1 2.91Å; N184-E582 VanDerWaalsContact ND2-OE1 3.13Å
583	L	32.4	Very low	29.1	Very low	74 Å²	74	106 Å²	106	39%	0.387	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-103.8	131.2	169.8	-68.1	177.8	0	0	0	109.5	A221 K239	A221-L583 HydrophobicContact CB-CD1 3.73Å; K239-L583 PolarHBondContact NZ-O 3.23Å
584	L	30.6	Very low	29.2	Very low	32 Å²	32	105 Å²	105	17%	0.168	58%	0.577	C	S	.	*	P	Polyproline II helix	trans	-101.3	129.2	-169.4	-81.3	176.9	0	0	0	112.6	D281 P290	D281-L584 WeakPolarHBondContact O-CD1 3.4Å; P290-L584 HydrophobicContact CG-CD1 3.71Å; P290-L584 HydrophobicContact CG-CD2 4.29Å; P290-L584 HydrophobicContact CG-CG 4.33Å
585	S	28.6	Very low	29.3	Very low	62 Å²	62	105.8 Å²	105.8	43%	0.434	58%	0.583	S	S	.	*			trans	31.5	95.4	139.3	63.8	0	0	0	0	119	K239	K239-S585 VanDerWaalsContact NZ-N 3.16Å
586	D	26.1	Very low	28.8	Very low	144 Å²	144	102 Å²	102	77%	0.77	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-76.1	116.2	151.6	-66	-76.2	0	0	0	109.2
587	E	26.4	Very low	28.8	Very low	170 Å²	170	101.6 Å²	101.6	79%	0.794	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-94.6	118.5	162.1	-74	-83.9	118	0	0	107.2
588	E	26.8	Very low	28.6	Very low	173 Å²	173	100.1 Å²	100.1	81%	0.808	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-70.1	132.8	176.1	-65.8	179.9	116.8	0	0	110.4
589	P	24.5	Very low	28.4	Very low	102 Å²	102	103.2 Å²	103.2	66%	0.662	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-69.6	143.3	168.5	31.2	-33.5	0	0	0	109.7	D591	P589-D591 PolarHBondContact O-N 3.45Å
590	P	27.3	Very low	28.2	Very low	121 Å²	121	112 Å²	112	79%	0.786	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-70.1	126.1	175.3	28.7	-33.5	0	0	0	110.7
591	D	26.4	Very low	27.7	Very low	164 Å²	164	120.3 Å²	120.3	88%	0.877	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-60.1	142.2	174.9	-77.5	-41.5	0	0	0	112.1	P589	P589-D591 PolarHBondContact O-N 3.45Å
592	L	32.3	Very low	27.1	Very low	154 Å²	154	128.1 Å²	128.1	81%	0.806	71%	0.707	S	S	*	*			trans	-120.3	149.2	167.5	-80	171.1	0	0	0	109.9
593	D	25.3	Very low	26.6	Very low	152 Å²	152	135 Å²	135	81%	0.813	74%	0.739	S	S	*	*			trans	65.2	96.4	171.2	-60.7	-27.6	0	0	0	118.8
594	T	26.6	Very low	26.2	Very low	141 Å²	141	141.2 Å²	141.2	87%	0.865	77%	0.766	S	S	*	*				-147.4	131.7	128.2	-71.9	0	0	0	0	108.9
595	P	28.3	Very low	25.8	Very low	124 Å²	124	146.8 Å²	146.8	81%	0.805	79%	0.792	S	S	*	*			trans	-98.8	135.1	-162.6	35.6	-34.8	0	0	0	116.1
596	G	22.3	Very low	25.6	Very low	74 Å²	74	150.9 Å²	150.9	76%	0.763	81%	0.808	S	S	*	*			trans	70	130.8	142.2	0	0	0	0	0	120.4
597	S	23	Very low	25.5	Very low	109 Å²	109	147.6 Å²	147.6	76%	0.762	80%	0.801	S	S	*	*				172.7	158.1	99.4	58.3	0	0	0	0	113.1
598	L	25	Very low	25.4	Very low	142 Å²	142	147.7 Å²	147.7	74%	0.743	80%	0.801	S	S	*	*			trans	62.7	93.9	158.7	-62.1	167.9	0	0	0	118.8
599	D	24.5	Very low	25.2	Very low	139 Å²	139	145.1 Å²	145.1	74%	0.743	80%	0.797	S	S	*	*				41	123.6	109.8	-40.3	-18.1	0	0	0	119.9
600	E	27.4	Very low	25	Very low	203 Å²	203	151 Å²	151	95%	0.949	81%	0.806	S	S	*	*				-157	147.8	117.6	-111.3	171.8	-158.5	0	0	110
601	E	25	Very low	24.7	Very low	184 Å²	184	152.1 Å²	152.1	86%	0.86	80%	0.804	S	S	*	*			trans	-119.3	155.9	-168.6	-60.1	179.3	130.9	0	0	112.5
602	E	24.7	Very low	24.7	Very low	192 Å²	192	149.3 Å²	149.3	90%	0.897	80%	0.798	S	S	*	*			trans	162.1	97.8	151.1	-94.8	176.9	-171	0	0	107.1
603	E	24.3	Very low	24.5	Very low	178 Å²	178	148 Å²	148	83%	0.832	80%	0.798	S	S	*	*				65.5	114.5	73.3	-69.9	-147.6	141.2	0	0	116.6
604	E	24.3	Very low	24.4	Very low	205 Å²	205	145.7 Å²	145.7	96%	0.958	79%	0.794	S	S	*	*			trans	-153.8	150.2	132.1	-127.5	-177.1	-157.7	0	0	110
605	E	23.6	Very low	24.2	Very low	150 Å²	150	147.4 Å²	147.4	70%	0.701	80%	0.795	S	S	*	*			trans	-104.7	160.6	-157.9	-75	-161.2	109.5	0	0	117.4
606	L	24.2	Very low	24	Very low	147 Å²	147	146.1 Å²	146.1	77%	0.77	79%	0.789	S	S	*	*			trans	44.5	140.6	140.5	-64.7	165.8	0	0	0	120.3
607	A	23.6	Very low	24.1	Very low	76 Å²	76	153 Å²	153	63%	0.628	80%	0.797	S	S	*	*			cis	-172.9	159.2	43.9	0	0	0	0	0	115.7
608	H	23.5	Very low	24.1	Very low	171 Å²	171	154.2 Å²	154.2	79%	0.792	80%	0.8	S	S	*	*			trans	56.8	100.9	144.4	-65.1	-40.8	0	0	0	124.9
609	V	22.3	Very low	24.1	Very low	120 Å²	120	156.9 Å²	156.9	73%	0.727	81%	0.806	S	S	*	*				55.6	106.3	104	173.3	0	0	0	0	120.5
610	R	21.4	Very low	24.1	Very low	226 Å²	226	158.1 Å²	158.1	85%	0.853	81%	0.812	S	S	*	*				176.6	123.1	115.1	-107.9	172.7	-179.7	175.4	1.3	118.5
611	L	21.3	Very low	24	Very low	143 Å²	143	157.1 Å²	157.1	75%	0.749	81%	0.808	S	S	*	*				52.1	117.4	126.7	-79.8	-179.6	0	0	0	124.5
612	S	25.3	Very low	24.1	Very low	105 Å²	105	153.6 Å²	153.6	73%	0.734	80%	0.804	S	S	*	*			trans	72.9	165.2	142.9	13.3	0	0	0	0	119
613	P	28.7	Very low	24.1	Very low	126 Å²	126	151 Å²	151	82%	0.818	80%	0.801	S	S	*	*			cis	-130.4	166.1	23.4	42.1	-26	0	0	0	118.7
614	S	22.9	Very low	24.6	Very low	104 Å²	104	152.8 Å²	152.8	73%	0.727	81%	0.806	S	S	*	*			trans	-112.1	141.3	167.3	62.7	0	0	0	0	111.8
615	M	22.5	Very low	24.5	Very low	178 Å²	178	147 Å²	147	88%	0.877	79%	0.788	S	S	*	*			trans	-145.8	146.5	166.9	-75.5	-78.8	97.4	0	0	107.7
616	S	24.9	Very low	25	Very low	97 Å²	97	149.5 Å²	149.5	68%	0.678	80%	0.8	S	S	*	*			cis	-161.2	139.2	-11.8	49.6	0	0	0	0	108.6
617	K	24	Very low	25.2	Very low	218 Å²	218	152.1 Å²	152.1	95%	0.948	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-86.5	129.7	175.3	-72.1	-175.9	178.5	179.5	0	111.5
618	T	23.1	Very low	25.6	Very low	134 Å²	134	156.7 Å²	156.7	82%	0.822	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-103.7	128.7	164.6	-41.5	0	0	0	0	108.9
619	K	25.6	Very low	26.1	Very low	198 Å²	198	158.1 Å²	158.1	86%	0.861	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-82.7	148.8	168.1	-74.1	-177.2	175.4	-178.5	0	109.7
620	N	24	Very low	26.8	Very low	165 Å²	165	159 Å²	159	88%	0.882	81%	0.812	S	S	*	*			trans	-145.3	165.1	147.8	-121.4	-3.5	0	0	0	110.1
621	E	24.9	Very low	27.8	Very low	183 Å²	183	150.9 Å²	150.9	86%	0.855	79%	0.791	S	S	*	*			trans	-91.7	173.1	-155.6	-65.2	-176.1	114.5	0	0	115.9
622	S	26.3	Very low	29.5	Very low	110 Å²	110	152.2 Å²	152.2	77%	0.769	79%	0.793	S	S	*	*			trans	-55.5	140.3	-172.9	55.1	0	0	0	0	116.7
623	T	25.3	Very low	31.3	Very low	137 Å²	137	149.4 Å²	149.4	84%	0.84	77%	0.767	S	S	*	*			trans	-125.2	129.1	137.2	33.6	0	0	0	0	109.5	S625	T623-S625 PolarHBondContact O-N 2.69Å
624	K	34.1	Very low	33.5	Very low	216 Å²	216	146.1 Å²	146.1	94%	0.939	75%	0.75	S	S	*	*			trans	-82	106.5	168.3	-76.7	-177.4	175.4	-179.3	0	108.6
625	S	23.8	Very low	36.4	Very low	83 Å²	83	141.9 Å²	141.9	58%	0.58	72%	0.718	S	S	*	*			trans	-105.5	133.1	156.6	48.2	0	0	0	0	108.8	T623 Y627	T623-S625 PolarHBondContact O-N 2.69Å; S625-Y627 PolarHBondContact O-N 2.96Å
626	Q	33.8	Very low	39.4	Very low	203 Å²	203	139.7 Å²	139.7	95%	0.949	71%	0.706	S	S	*	*			trans	-76.7	112.3	170.5	-67.4	166.9	-73.8	0	0	107.6
627	Y	28.3	Very low	42.4	Very low	202 Å²	202	136.5 Å²	136.5	79%	0.792	68%	0.68	S	S	*	*			trans	-111.6	138.5	163.9	-86.2	-85.9	0	0	0	109.1	S625	S625-Y627 PolarHBondContact O-N 2.96Å
628	Q	32.6	Very low	45.4	Very low	171 Å²	171	128.6 Å²	128.6	80%	0.799	65%	0.65	S	S	*	*			trans	-69.3	144.7	-177.5	-68.1	149.2	-90.2	0	0	110.1	Q630	Q628-Q630 VanDerWaalsContact C-N 3.27Å; Q628-Q630 PolarHBondContact O-N 2.75Å
629	Q	33.6	Very low	48.3	Very low	201 Å²	201	126 Å²	126	94%	0.939	63%	0.627	S	S	*	*			trans	-70.5	89	161.8	-70.5	174.8	-75.8	0	0	108.1	S631	Q629-S631 PolarHBondContact O-N 3.08Å
630	Q	36.4	Very low	51.1	Low	138 Å²	138	123.1 Å²	123.1	65%	0.645	62%	0.617	S	S	*	*			trans	-69.8	120.8	160	-77.5	175.2	-77.2	0	0	107.5	E120 Q628 Q632	E120-Q630 PolarHBondContact OE1-NE2 2.89Å; Q628-Q630 VanDerWaalsContact C-N 3.27Å; Q628-Q630 PolarHBondContact O-N 2.75Å; Q630-Q632 PolarHBondContact O-N 3.29Å
631	S	42.5	Very low	54	Low	57 Å²	57	116.1 Å²	116.1	40%	0.399	58%	0.582	S	S	.	*			trans	-67.3	99.1	172.8	47.8	0	0	0	0	108.6	Q629 Y633	Q629-S631 PolarHBondContact O-N 3.08Å; S631-Y633 PolarHBondContact O-N 3.06Å; S631-Y633 VanDerWaalsContact O-N 3.1Å
632	Q	56.9	Low	57	Low	171 Å²	171	107.4 Å²	107.4	80%	0.799	54%	0.541	S	S	*	.			trans	-71.3	109.8	-178.4	-158.8	166.2	10.9	0	0	108.8	T460 Q630	T460-Q632 PolarHBondContact OG1-O 3.1Å; T460-Q632 VanDerWaalsContact OG1-O 3.11Å; Q630-Q632 PolarHBondContact O-N 3.29Å
633	Y	63.1	Low	59.7	Low	46 Å²	46	102.2 Å²	102.2	18%	0.18	51%	0.505	C	S	.	.			trans	-65	133	171.8	-56.3	-80.1	0	0	0	109	E120 A124 P457 L458 S631	E120-Y633 HydrophobicContact CB-CD2 4.26Å; E120-Y633 HydrophobicContact CB-CE2 4.06Å; A124-Y633 WeakPolarHBondContact CB-O 3.34Å; P457-Y633 HydrophobicContact CB-CD1 4.28Å; P457-Y633 HydrophobicContact CB-CE1 3.7Å; L458-Y633 WeakPolarHBondContact O-CD1 3.43Å; S631-Y633 PolarHBondContact O-N 3.06Å; S631-Y633 VanDerWaalsContact O-N 3.1Å
634	A	75	Confident	62.3	Low	57 Å²	57	101.5 Å²	101.5	47%	0.471	49%	0.49	S	S	.	.			trans	-126.7	134.6	176.3	0	0	0	0	0	109	L458	L458-A634 VanDerWaalsContact CD1-O 3.32Å; L458-A634 WeakPolarHBondContact CD1-O 3.29Å
635	Y	84.1	Confident	64.3	Low	14 Å²	14	93.9 Å²	93.9	6%	0.055	47%	0.473	C	S	.	.			trans	-126.6	129	179.3	-70.5	-94	0	0	0	109.1	H121 A124 V125 A128 Y453 F454 L456 P457 L458	H121-Y635 AromaticContact CD2-CE2 3.63Å; H121-Y635 AromaticContact CD2-CZ 3.58Å; H121-Y635 PolarHBondContact CD2-OH 3.21Å; H121-Y635 VanDerWaalsContact CD2-OH 3.24Å; H121-Y635 AromaticContact NE2-CE2 3.94Å; H121-Y635 AromaticContact NE2-CZ 3.41Å; H121-Y635 PolarHBondContact NE2-OH 2.93Å; A124-Y635 HydrophobicContact CB-CD2 4.1Å; A124-Y635 HydrophobicContact CB-CE2 4.19Å; V125-Y635 HydrophobicContact CG2-CD2 3.97Å; V125-Y635 HydrophobicContact CG2-CE2 4.08Å; V125-Y635 HydrophobicContact CG2-CG 4.28Å; A128-Y635 VanDerWaalsContact CB-O 3.31Å; A128-Y635 WeakPolarHBondContact CB-O 3.25Å; Y453-Y635 HydrophobicContact CD1-CD1 4.35Å; Y453-Y635 AromaticContact CE1-CD1 3.94Å; Y453-Y635 HydrophobicContact CE1-CD1 3.94Å; F454-Y635 AromaticContact CD1-CD1 3.72Å; F454-Y635 HydrophobicContact CD1-CD1 3.72Å; F454-Y635 HydrophobicContact CD1-CE1 4.4Å; F454-Y635 HydrophobicContact CD1-CG 4.16Å; F454-Y635 HydrophobicContact CE1-CD1 4.04Å; F454-Y635 HydrophobicContact CE1-CG 4.21Å; L456-Y635 PolarHBondContact O-OH 2.84Å; P457-Y635 WeakPolarHBondContact CA-OH 3.46Å; L458-Y635 HydrophobicContact CB-CE1 4.43Å; L458-Y635 HydrophobicContact CD1-CD1 3.5Å; L458-Y635 VanDerWaalsContact CD1-CD1 3.5Å; L458-Y635 HydrophobicContact CD1-CE1 3.4Å; L458-Y635 VanDerWaalsContact CD1-CE1 3.4Å; L458-Y635 HydrophobicContact CD1-CG 4.1Å; L458-Y635 HydrophobicContact CG-CD1 4.26Å; L458-Y635 HydrophobicContact CG-CE1 3.64Å; L458-Y635 PolarHBondContact N-OH 2.8Å
636	E	84.2	Confident	66.9	Low	133 Å²	133	95.2 Å²	95.2	62%	0.621	47%	0.469	S	S	*	.			trans	-118.4	149.1	-179.4	-66.8	175.5	-175.8	0	0	111	Y453 T638	Y453-E636 WeakPolarHBondContact CE1-O 3.23Å; Y453-E636 PolarHBondContact OH-N 2.81Å; Y453-E636 VanDerWaalsContact OH-N 3.08Å; Y453-E636 PolarHBondContact OH-O 3.13Å; E636-T638 HydrophobicContact CB-CG2 4.12Å; E636-T638 PolarHBondContact O-N 3.25Å
637	F	88.4	Confident	68.8	Low	29 Å²	29	89.9 Å²	89.9	13%	0.127	45%	0.454	C	S	.	.			trans	-89.4	100.1	178.4	-85.3	-114.5	0	0	0	109.4	A128 L129 V132 H273 W274 I277 W380 F454 F642	A128-F637 HydrophobicContact CB-CE2 4.47Å; L129-F637 HydrophobicContact CD2-CE2 4.42Å; L129-F637 HydrophobicContact CD2-CZ 3.85Å; V132-F637 HydrophobicContact CG2-CD1 4.31Å; V132-F637 HydrophobicContact CG2-CD2 3.8Å; V132-F637 HydrophobicContact CG2-CE1 4.45Å; V132-F637 HydrophobicContact CG2-CE2 3.94Å; V132-F637 HydrophobicContact CG2-CG 4.01Å; V132-F637 HydrophobicContact CG2-CZ 4.29Å; H273-F637 AromaticContact CD2-CD1 3.75Å; W274-F637 HydrophobicContact CB-CE1 4.27Å; I277-F637 HydrophobicContact CD1-CB 3.76Å; I277-F637 HydrophobicContact CD1-CD1 4.39Å; W380-F637 HydrophobicContact CH2-CE1 4.47Å; W380-F637 HydrophobicContact CH2-CZ 4.47Å; W380-F637 HydrophobicContact CZ2-CE1 4.2Å; W380-F637 AromaticContact CZ2-CZ 3.98Å; W380-F637 HydrophobicContact CZ2-CZ 3.98Å; F454-F637 HydrophobicContact CE1-CE2 4.32Å; F454-F637 HydrophobicContact CE2-CZ 4.44Å; F454-F637 HydrophobicContact CZ-CD2 4.24Å; F454-F637 AromaticContact CZ-CE2 3.68Å; F454-F637 HydrophobicContact CZ-CE2 3.68Å; F454-F637 AromaticContact CZ-CZ 3.86Å; F454-F637 HydrophobicContact CZ-CZ 3.86Å; F637-F642 HydrophobicContact CB-CE2 4Å; F637-F642 HydrophobicContact CB-CZ 4Å; F637-F642 AromaticContact CD1-CE2 3.61Å; F637-F642 HydrophobicContact CD1-CE2 3.61Å; F637-F642 AromaticContact CD1-CZ 3.54Å; F637-F642 HydrophobicContact CD1-CZ 3.54Å; F637-F642 HydrophobicContact CD2-CZ 4.42Å; F637-F642 HydrophobicContact CE1-CE2 4.36Å; F637-F642 HydrophobicContact CE1-CZ 4.05Å; F637-F642 HydrophobicContact CG-CE2 4.02Å; F637-F642 AromaticContact CG-CZ 3.73Å; F637-F642 HydrophobicContact CG-CZ 3.73Å
638	T	86.9	Confident	71	Confident	52 Å²	52	81.3 Å²	81.3	32%	0.319	42%	0.421	S	S	.	.			trans	-134.3	145	-174.4	66.6	0	0	0	0	112.6	E636 Q640 A641 F642	E636-T638 HydrophobicContact CB-CG2 4.12Å; E636-T638 PolarHBondContact O-N 3.25Å; T638-Q640 PolarHBondContact O-N 3.4Å; T638-A641 PolarHBondContact O-N 3.44Å; T638-A641 VanDerWaalsContact O-N 3.14Å; T638-A641 WeakPolarHBondContact OG1-CB 3.47Å; T638-A641 PolarHBondContact OG1-N 2.9Å; T638-F642 WeakPolarHBondContact O-CD2 3.1Å; T638-F642 PolarHBondContact O-N 2.69Å
639	K	85	Confident	72.8	Confident	80 Å²	80	77.5 Å²	77.5	35%	0.348	40%	0.404	S	S	.	.	H	α-helix	trans	-59.6	-33.8	179.3	-165.8	168	-170.5	179.1	0	112.1	I277 E279 F642 T643	I277-K639 HydrophobicContact CG2-CB 3.9Å; I277-K639 HydrophobicContact CG2-CG 4.5Å; I277-K639 WeakPolarHBondContact O-CG 3.28Å; E279-K639 IonicContact OE1-NZ 2.71Å; E279-K639 PolarHBondContact OE1-NZ 3.34Å; E279-K639 IonicContact OE2-NZ 3.93Å; E279-K639 PolarHBondContact OE2-NZ 3.26Å; K639-F642 PolarHBondContact O-N 3.5Å; K639-T643 HydrophobicContact CG-CG2 3.86Å; K639-T643 WeakPolarHBondContact O-CB 3.19Å; K639-T643 PolarHBondContact O-N 2.88Å; K639-T643 PolarHBondContact O-OG1 2.83Å
640	Q	84.6	Confident	74.8	Confident	137 Å²	137	69.8 Å²	69.8	64%	0.64	37%	0.371	S	S	*	.	H	α-helix	trans	-65.4	-40.9	177.1	-165.2	66.8	-2.4	0	0	112.6	T638 K644	T638-Q640 PolarHBondContact O-N 3.4Å; Q640-K644 WeakPolarHBondContact O-CA 3.37Å; Q640-K644 PolarHBondContact O-N 3.3Å; Q640-K644 VanDerWaalsContact O-N 3.1Å
641	A	83.4	Confident	76.3	Confident	18 Å²	18	63.2 Å²	63.2	15%	0.149	34%	0.34	C	S	.	.	H	α-helix	trans	-66.9	-38.6	177.3	0	0	0	0	0	112.6	Y453 T638	Y453-A641 HydrophobicContact CD1-CB 4.13Å; Y453-A641 HydrophobicContact CD2-CB 3.92Å; Y453-A641 HydrophobicContact CE1-CB 4.08Å; Y453-A641 HydrophobicContact CE2-CB 3.89Å; Y453-A641 HydrophobicContact CG-CB 4.03Å; T638-A641 PolarHBondContact O-N 3.44Å; T638-A641 VanDerWaalsContact O-N 3.14Å; T638-A641 WeakPolarHBondContact OG1-CB 3.47Å; T638-A641 PolarHBondContact OG1-N 2.9Å
642	F	87.9	Confident	77.5	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-92.5	-27.7	-172.4	-53.3	-28.4	0	0	0	114.8	W274 I277 C278 C446 T449 T450 Y453 F454 F637 T638 K639	W274-F642 AromaticContact CD1-CD2 3.58Å; W274-F642 AromaticContact CD1-CE2 3.89Å; W274-F642 AromaticContact CD1-CG 3.67Å; W274-F642 HydrophobicContact CG-CD2 4.5Å; I277-F642 HydrophobicContact CB-CD2 4.22Å; I277-F642 HydrophobicContact CB-CE2 4.5Å; I277-F642 HydrophobicContact CD1-CE2 4.17Å; I277-F642 HydrophobicContact CG2-CD2 3.71Å; I277-F642 HydrophobicContact CG2-CE2 4.19Å; C278-F642 VanDerWaalsContact SG-CB 3.52Å; C446-F642 WeakPolarHBondContact CA-O 3.38Å; T449-F642 PolarHBondContact OG1-O 3.48Å; T450-F642 HydrophobicContact CG2-CD1 3.83Å; T450-F642 HydrophobicContact CG2-CE1 3.93Å; T450-F642 WeakPolarHBondContact OG1-CD1 3.37Å; Y453-F642 HydrophobicContact CD1-CE1 4.11Å; Y453-F642 HydrophobicContact CE1-CE1 4.31Å; F454-F642 AromaticContact CE2-CE1 3.64Å; F454-F642 HydrophobicContact CE2-CE1 3.64Å; F454-F642 HydrophobicContact CE2-CZ 4.06Å; F454-F642 HydrophobicContact CZ-CE1 4.08Å; F454-F642 HydrophobicContact CZ-CZ 4.21Å; F637-F642 HydrophobicContact CB-CE2 4Å; F637-F642 HydrophobicContact CB-CZ 4Å; F637-F642 AromaticContact CD1-CE2 3.61Å; F637-F642 HydrophobicContact CD1-CE2 3.61Å; F637-F642 AromaticContact CD1-CZ 3.54Å; F637-F642 HydrophobicContact CD1-CZ 3.54Å; F637-F642 HydrophobicContact CD2-CZ 4.42Å; F637-F642 HydrophobicContact CE1-CE2 4.36Å; F637-F642 HydrophobicContact CE1-CZ 4.05Å; F637-F642 HydrophobicContact CG-CE2 4.02Å; F637-F642 AromaticContact CG-CZ 3.73Å; F637-F642 HydrophobicContact CG-CZ 3.73Å; T638-F642 WeakPolarHBondContact O-CD2 3.1Å; T638-F642 PolarHBondContact O-N 2.69Å; K639-F642 PolarHBondContact O-N 3.5Å
643	T	83.8	Confident	77.8	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.006	29%	0.293	C	S	.	.	H	α-helix	trans	-109	-23.6	-179.7	70.6	0	0	0	0	113.3	H445 K639 G645 K646	H445-T643 PolarHBondContact NE2-O 3.36Å; K639-T643 HydrophobicContact CG-CG2 3.86Å; K639-T643 WeakPolarHBondContact O-CB 3.19Å; K639-T643 PolarHBondContact O-N 2.88Å; K639-T643 PolarHBondContact O-OG1 2.83Å; T643-G645 VanDerWaalsContact C-N 3.29Å; T643-G645 PolarHBondContact OG1-N 3.48Å; T643-G645 VanDerWaalsContact OG1-N 3.14Å; T643-K646 VanDerWaalsContact CB-O 3.27Å; T643-K646 WeakPolarHBondContact CB-O 3.42Å; T643-K646 PolarHBondContact O-N 3.22Å
644	K	80.3	Confident	77.9	Confident	122 Å²	122	53.7 Å²	53.7	53%	0.53	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.1	43.3	-164.5	-59.3	-178.9	171.3	-176.1	0	113.2	T449 Q640 K646	T449-K644 HydrophobicContact CG2-CD 3.89Å; T449-K644 HydrophobicContact CG2-CG 4.09Å; Q640-K644 WeakPolarHBondContact O-CA 3.37Å; Q640-K644 PolarHBondContact O-N 3.3Å; Q640-K644 VanDerWaalsContact O-N 3.1Å; K644-K646 PolarHBondContact O-N 3.02Å
645	G	75	Confident	77.4	Confident	57 Å²	57	51.9 Å²	51.9	59%	0.588	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	-2.8	177.9	0	0	0	0	0	115.4	T643	T643-G645 VanDerWaalsContact C-N 3.29Å; T643-G645 PolarHBondContact OG1-N 3.48Å; T643-G645 VanDerWaalsContact OG1-N 3.14Å
646	K	78.1	Confident	76.6	Confident	111 Å²	111	56.6 Å²	56.6	48%	0.483	30%	0.299	S	S	.	.			trans	-74.7	142.5	172.8	-62.2	-170.6	-170.9	169.1	0	111.4	Y442 H445 T643 K644	Y442-K646 HydrophobicContact CE2-CB 4.48Å; H445-K646 VanDerWaalsContact CE1-CE 3.46Å; H445-K646 WeakPolarHBondContact CE1-CE 3.36Å; H445-K646 PolarHBondContact CE1-NZ 2.91Å; H445-K646 PolarHBondContact ND1-NZ 2.92Å; T643-K646 VanDerWaalsContact CB-O 3.27Å; T643-K646 WeakPolarHBondContact CB-O 3.42Å; T643-K646 PolarHBondContact O-N 3.22Å; K644-K646 PolarHBondContact O-N 3.02Å
647	S	74.9	Confident	75.8	Confident	91 Å²	91	56.7 Å²	56.7	64%	0.636	29%	0.294	S	S	*	.			trans	-105.9	164.5	161.8	49.8	0	0	0	0	110.9
648	H	74.6	Confident	75.3	Confident	22 Å²	22	58 Å²	58	10%	0.102	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-85.1	160.2	162.5	57.1	-67.9	0	0	0	110.8	E279 E285 M439 Y442	E279-H648 VanDerWaalsContact CB-CE1 3.48Å; E279-H648 WeakPolarHBondContact CB-CE1 3.37Å; E279-H648 IonicContact OE2-CE1 3.74Å; E285-H648 IonicContact OE2-CD2 3.27Å; E285-H648 IonicContact OE2-CE1 2.96Å; E285-H648 IonicContact OE2-NE2 3.98Å; E285-H648 PolarHBondContact OE2-NE2 2.97Å; M439-H648 HydrophobicContact CE-CB 3.96Å; M439-H648 VanDerWaalsContact CE-CD2 3.48Å; M439-H648 WeakPolarHBondContact CE-CD2 3.37Å; M439-H648 HydrophobicContact SD-CB 4.4Å; Y442-H648 HydrophobicContact CD1-CB 3.77Å; Y442-H648 HydrophobicContact CD2-CB 4.38Å; Y442-H648 HydrophobicContact CE1-CB 3.92Å; Y442-H648 AromaticContact CE1-ND1 3.9Å; Y442-H648 HydrophobicContact CG-CB 4Å
649	M	69.6	Low	74.6	Confident	91 Å²	91	58.4 Å²	58.4	45%	0.448	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-84.7	134.9	160	-67.4	-140.4	-69.5	0	0	109.5	D658	M649-D658 HydrophobicContact CE-CB 3.85Å
650	V	76.1	Confident	74.1	Confident	39 Å²	39	56.5 Å²	56.5	24%	0.236	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-64	134.7	172.1	177.6	0	0	0	0	109.4	E285 D658 G659 L661	E285-V650 HydrophobicContact CB-CG1 4.34Å; E285-V650 HydrophobicContact CG-CG1 4.25Å; E285-V650 HydrophobicContact CG-CG2 4.46Å; V650-D658 CarbonylContact O-C 3.41Å; V650-G659 PolarHBondContact O-N 2.89Å; V650-L661 HydrophobicContact CG1-CD2 3.6Å; V650-L661 HydrophobicContact CG1-CG 4.01Å
651	V	67.4	Low	73.6	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-117.9	120.7	-178.7	-170.4	0	0	0	0	109.9	E285 S653	E285-V651 PolarHBondContact O-N 3.22Å; E285-V651 VanDerWaalsContact O-N 3.08Å; V651-S653 PolarHBondContact O-N 2.79Å; V651-S653 VanDerWaalsContact O-N 3.12Å
652	C	67.7	Low	72.8	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.302	C	S	.	.			trans	-63.1	117.3	-176.2	172.6	0	0	0	0	111.5	L654 C655 K656 R657 H660	C652-L654 PolarHBondContact O-N 3.44Å; C652-L654 VanDerWaalsContact O-N 3.1Å; C652-L654 PolarHBondContact SG-N 2.97Å; C652-L654 VanDerWaalsContact SG-N 3.41Å; C652-C655 PolarHBondContact SG-N 2.97Å; C652-C655 VanDerWaalsContact SG-SG 3.61Å; C652-K656 WeakPolarHBondContact O-CA 3.28Å; C652-K656 PolarHBondContact O-N 3.49Å; C652-R657 PolarHBondContact N-O 3Å; C652-H660 VanDerWaalsContact CA-O 3.25Å; C652-H660 WeakPolarHBondContact CA-O 3.27Å; C652-H660 WeakPolarHBondContact CB-NE2 3.44Å; C652-H660 VanDerWaalsContact CB-O 3.3Å; C652-H660 WeakPolarHBondContact CB-O 3.28Å; C652-H660 PolarHBondContact N-O 3.27Å
653	S	64.2	Low	71.8	Confident	31 Å²	31	62.1 Å²	62.1	22%	0.217	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-15.7	-178.9	75.8	0	0	0	0	113.9	V651 K656	V651-S653 PolarHBondContact O-N 2.79Å; V651-S653 VanDerWaalsContact O-N 3.12Å; S653-K656 WeakPolarHBondContact O-CE 3.38Å; S653-K656 PolarHBondContact O-NZ 3.13Å
654	L	65.7	Low	70.9	Confident	43 Å²	43	65.8 Å²	65.8	23%	0.225	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-76.9	170.2	-66.3	178.2	0	0	0	113.7	C652 K656 K662 C665 D668	C652-L654 PolarHBondContact O-N 3.44Å; C652-L654 VanDerWaalsContact O-N 3.1Å; C652-L654 PolarHBondContact SG-N 2.97Å; C652-L654 VanDerWaalsContact SG-N 3.41Å; L654-K656 VanDerWaalsContact C-N 3.31Å; L654-K656 PolarHBondContact O-N 2.56Å; L654-K662 HydrophobicContact CD1-CG 3.84Å; L654-K662 HydrophobicContact CG-CB 4.42Å; L654-K662 HydrophobicContact CG-CG 3.93Å; L654-C665 HydrophobicContact CB-CB 4.45Å; L654-C665 HydrophobicContact CD1-CB 4.26Å; L654-D668 HydrophobicContact CD1-CB 3.62Å; L654-D668 WeakPolarHBondContact CD1-OD2 3.33Å
655	C	63.2	Low	70.1	Confident	18 Å²	18	60.1 Å²	60.1	12%	0.122	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-5.9	-172.2	71.4	0	0	0	0	115.5	C652 R657 H660 E667	C652-C655 PolarHBondContact SG-N 2.97Å; C652-C655 VanDerWaalsContact SG-SG 3.61Å; C655-R657 HydrophobicContact CB-CG 4.3Å; C655-R657 PolarHBondContact O-N 3.1Å; C655-R657 VanDerWaalsContact SG-CG 3.58Å; C655-H660 VanDerWaalsContact SG-CE1 3.55Å; C655-H660 PolarHBondContact SG-NE2 2.9Å; C655-E667 HydrophobicContact CB-CB 4.17Å; C655-E667 VanDerWaalsContact CB-CD 3.43Å; C655-E667 HydrophobicContact CB-CG 4Å; C655-E667 WeakPolarHBondContact CB-OE2 3.47Å
656	K	67.8	Low	69.5	Low	113 Å²	113	62.1 Å²	62.1	49%	0.491	33%	0.329	S	S	.	.			trans	60.4	21	-179.6	-42.9	-53.9	-177.5	-178.7	0	114.9	C652 S653 L654	C652-K656 WeakPolarHBondContact O-CA 3.28Å; C652-K656 PolarHBondContact O-N 3.49Å; S653-K656 WeakPolarHBondContact O-CE 3.38Å; S653-K656 PolarHBondContact O-NZ 3.13Å; L654-K656 VanDerWaalsContact C-N 3.31Å; L654-K656 PolarHBondContact O-N 2.56Å
657	R	68.3	Low	68.7	Low	135 Å²	135	59.8 Å²	59.8	51%	0.509	32%	0.319	S	S	.	.			trans	-92.8	149.9	171.2	-52.9	176.9	-167.2	-157	6.3	109.6	C652 C655 E667	C652-R657 PolarHBondContact N-O 3Å; C655-R657 HydrophobicContact CB-CG 4.3Å; C655-R657 PolarHBondContact O-N 3.1Å; C655-R657 VanDerWaalsContact SG-CG 3.58Å; R657-E667 IonicContact CZ-OE1 3.44Å; R657-E667 IonicContact NE-OE1 3.85Å; R657-E667 PolarHBondContact NE-OE1 3.48Å; R657-E667 IonicContact NH2-OE1 2.83Å; R657-E667 PolarHBondContact NH2-OE1 3.25Å
658	D	76.4	Confident	68.2	Low	57 Å²	57	57.4 Å²	57.4	31%	0.305	30%	0.3	S	S	.	.	B	Isolated β-bridge	trans	-76	160.5	175.5	-53.1	-42.1	0	0	0	110.9	S436 Q438 M649 V650	S436-D658 PolarHBondContact OG-OD1 3.03Å; Q438-D658 PolarHBondContact NE2-OD2 3.24Å; M649-D658 HydrophobicContact CE-CB 3.85Å; V650-D658 CarbonylContact O-C 3.41Å
659	G	73.4	Confident	67.4	Low	61 Å²	61	57.6 Å²	57.6	63%	0.629	30%	0.3	S	S	*	.	S	Bend	trans	97	-1.1	166.2	0	0	0	0	0	117.6	V650	V650-G659 PolarHBondContact O-N 2.89Å
660	H	74.1	Confident	66.9	Low	39 Å²	39	58.2 Å²	58.2	18%	0.181	30%	0.3	C	S	.	.	S	Bend	trans	-155.6	161.1	178	61.9	-80	0	0	0	112.8	C652 C655 D664	C652-H660 VanDerWaalsContact CA-O 3.25Å; C652-H660 WeakPolarHBondContact CA-O 3.27Å; C652-H660 WeakPolarHBondContact CB-NE2 3.44Å; C652-H660 VanDerWaalsContact CB-O 3.3Å; C652-H660 WeakPolarHBondContact CB-O 3.28Å; C652-H660 PolarHBondContact N-O 3.27Å; C655-H660 VanDerWaalsContact SG-CE1 3.55Å; C655-H660 PolarHBondContact SG-NE2 2.9Å; H660-D664 HydrophobicContact CB-CB 4.45Å; H660-D664 PolarHBondContact CD2-O 3.11Å
661	L	74.1	Confident	66.2	Low	55 Å²	55	62.3 Å²	62.3	29%	0.288	32%	0.315	S	S	.	.			trans	-84.4	165	177.5	-71.6	168.4	0	0	0	112.2	E285 V650 K663 D664 C665	E285-L661 HydrophobicContact CG-CD2 3.94Å; V650-L661 HydrophobicContact CG1-CD2 3.6Å; V650-L661 HydrophobicContact CG1-CG 4.01Å; L661-K663 HydrophobicContact CB-CG 4.03Å; L661-K663 HydrophobicContact CD1-CG 4.45Å; L661-K663 PolarHBondContact O-N 2.92Å; L661-D664 CarbonylContact O-C 3.55Å; L661-D664 PolarHBondContact O-N 2.84Å; L661-C665 PolarHBondContact O-N 2.85Å
662	K	65.9	Low	66.3	Low	81 Å²	81	66.1 Å²	66.1	35%	0.352	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-45.2	-49.2	167.9	163.8	177.7	170.8	-157.4	0	111.9	L654 D664 C665	L654-K662 HydrophobicContact CD1-CG 3.84Å; L654-K662 HydrophobicContact CG-CB 4.42Å; L654-K662 HydrophobicContact CG-CG 3.93Å; K662-D664 PolarHBondContact O-N 3Å; K662-D664 VanDerWaalsContact O-N 3.1Å; K662-C665 VanDerWaalsContact O-CB 3.24Å; K662-C665 WeakPolarHBondContact O-CB 3.49Å; K662-C665 PolarHBondContact O-N 2.95Å
663	K	66.3	Low	66.6	Low	137 Å²	137	75.2 Å²	75.2	60%	0.596	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-65.7	-8.7	-177.6	72.5	177.5	-174.4	178.8	0	114.4	L661 K670	L661-K663 HydrophobicContact CB-CG 4.03Å; L661-K663 HydrophobicContact CD1-CG 4.45Å; L661-K663 PolarHBondContact O-N 2.92Å; K663-K670 WeakPolarHBondContact O-CE 3.28Å; K663-K670 PolarHBondContact O-NZ 3.08Å
664	D	65.4	Low	67.5	Low	78 Å²	78	75.7 Å²	75.7	42%	0.417	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-126	20.8	-179.7	-62.2	-52	0	0	0	112.8	H660 L661 K662 K670	H660-D664 HydrophobicContact CB-CB 4.45Å; H660-D664 PolarHBondContact CD2-O 3.11Å; L661-D664 CarbonylContact O-C 3.55Å; L661-D664 PolarHBondContact O-N 2.84Å; K662-D664 PolarHBondContact O-N 3Å; K662-D664 VanDerWaalsContact O-N 3.1Å; D664-K670 IonicContact OD1-NZ 3.74Å; D664-K670 PolarHBondContact OD1-NZ 3.31Å
665	C	64.1	Low	68.3	Low	3 Å²	3	80 Å²	80	2%	0.02	40%	0.404	C	S	.	.			trans	-74.1	122	-179.6	-179.3	0	0	0	0	112.1	L654 L661 K662 E667 D668	L654-C665 HydrophobicContact CB-CB 4.45Å; L654-C665 HydrophobicContact CD1-CB 4.26Å; L661-C665 PolarHBondContact O-N 2.85Å; K662-C665 VanDerWaalsContact O-CB 3.24Å; K662-C665 WeakPolarHBondContact O-CB 3.49Å; K662-C665 PolarHBondContact O-N 2.95Å; C665-E667 PolarHBondContact O-N 2.97Å; C665-E667 PolarHBondContact SG-N 3.49Å; C665-E667 VanDerWaalsContact SG-N 3.44Å; C665-D668 HydrophobicContact CB-CB 3.92Å; C665-D668 PolarHBondContact O-N 3.24Å; C665-D668 PolarHBondContact SG-N 3.09Å
666	P	62.8	Low	69.4	Low	99 Å²	99	84.9 Å²	84.9	64%	0.643	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-7	175.5	31	-35.8	0	0	0	113.4
667	E	60.5	Low	70.4	Confident	62 Å²	62	81.4 Å²	81.4	29%	0.29	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-7.6	168.5	-60.1	-177.2	-177.2	0	0	113.2	C655 R657 C665	C655-E667 HydrophobicContact CB-CB 4.17Å; C655-E667 VanDerWaalsContact CB-CD 3.43Å; C655-E667 HydrophobicContact CB-CG 4Å; C655-E667 WeakPolarHBondContact CB-OE2 3.47Å; R657-E667 IonicContact CZ-OE1 3.44Å; R657-E667 IonicContact NE-OE1 3.85Å; R657-E667 PolarHBondContact NE-OE1 3.48Å; R657-E667 IonicContact NH2-OE1 2.83Å; R657-E667 PolarHBondContact NH2-OE1 3.25Å; C665-E667 PolarHBondContact O-N 2.97Å; C665-E667 PolarHBondContact SG-N 3.49Å; C665-E667 VanDerWaalsContact SG-N 3.44Å
668	D	64.8	Low	71.2	Confident	41 Å²	41	77.5 Å²	77.5	22%	0.219	41%	0.414	C	S	.	.	S	Bend	trans	-85.6	131.7	166.9	-164	-3.3	0	0	0	108.5	L654 C665 K670 R940	L654-D668 HydrophobicContact CD1-CB 3.62Å; L654-D668 WeakPolarHBondContact CD1-OD2 3.33Å; C665-D668 HydrophobicContact CB-CB 3.92Å; C665-D668 PolarHBondContact O-N 3.24Å; C665-D668 PolarHBondContact SG-N 3.09Å; D668-K670 VanDerWaalsContact C-N 3.27Å; D668-K670 PolarHBondContact O-N 3.49Å; D668-R940 IonicContact OD1-CZ 2.67Å; D668-R940 IonicContact OD1-NH1 3.39Å; D668-R940 IonicContact OD1-NH2 2.63Å; D668-R940 PolarHBondContact OD1-NH2 3.37Å; D668-R940 IonicContact OD2-NH1 3.37Å; D668-R940 IonicContact OD2-NH2 3.16Å
669	F	58.1	Low	71.6	Confident	26 Å²	26	80.2 Å²	80.2	11%	0.114	44%	0.435	C	S	.	.			trans	-78	83.8	175.8	-169.3	-92.6	0	0	0	108.8	R940 Y963 M989 I993	F669-R940 PolarHBondContact O-NH2 3.24Å; F669-Y963 AromaticContact CD1-CE1 3.91Å; F669-Y963 HydrophobicContact CD1-CE1 3.91Å; F669-Y963 AromaticContact CD1-CE2 3.96Å; F669-Y963 HydrophobicContact CD1-CE2 3.96Å; F669-Y963 AromaticContact CD1-CZ 3.48Å; F669-Y963 VanDerWaalsContact CD1-CZ 3.48Å; F669-Y963 WeakPolarHBondContact CD1-OH 3.42Å; F669-Y963 HydrophobicContact CE1-CE1 4.16Å; F669-Y963 AromaticContact CE1-CZ 3.87Å; F669-Y963 WeakPolarHBondContact CE1-OH 3.47Å; F669-M989 HydrophobicContact CD2-CB 4.32Å; F669-M989 HydrophobicContact CE1-CB 4.41Å; F669-M989 HydrophobicContact CE1-CE 4.16Å; F669-M989 HydrophobicContact CE1-CG 4.3Å; F669-M989 HydrophobicContact CE2-CB 3.5Å; F669-M989 HydrophobicContact CE2-CG 4.07Å; F669-M989 HydrophobicContact CZ-CB 3.57Å; F669-M989 HydrophobicContact CZ-CE 4.09Å; F669-M989 HydrophobicContact CZ-CG 3.93Å; F669-I993 HydrophobicContact CZ-CD1 4.29Å
670	K	58.4	Low	72	Confident	104 Å²	104	80.7 Å²	80.7	45%	0.452	42%	0.423	S	S	.	.			trans	-54.6	137.5	159	-65.9	-166.6	-179.5	-162.3	0	107.6	K663 D664 D668 V672	K663-K670 WeakPolarHBondContact O-CE 3.28Å; K663-K670 PolarHBondContact O-NZ 3.08Å; D664-K670 IonicContact OD1-NZ 3.74Å; D664-K670 PolarHBondContact OD1-NZ 3.31Å; D668-K670 VanDerWaalsContact C-N 3.27Å; D668-K670 PolarHBondContact O-N 3.49Å; K670-V672 PolarHBondContact O-N 3.37Å
671	K	61.3	Low	72.6	Confident	125 Å²	125	81.8 Å²	81.8	54%	0.543	43%	0.432	S	S	.	.			trans	-64.2	105.5	167.9	-173.9	176.1	-176.4	176.2	0	106.9	E673 E935	K671-E673 PolarHBondContact O-N 2.84Å; K671-E935 WeakPolarHBondContact CE-O 3.34Å; K671-E935 PolarHBondContact NZ-O 2.84Å
672	V	69.8	Low	73.2	Confident	81 Å²	81	84.2 Å²	84.2	49%	0.491	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-63.7	132.5	-178.3	-175.9	0	0	0	0	108.3	K670 L674	K670-V672 PolarHBondContact O-N 3.37Å; V672-L674 HydrophobicContact CB-CD2 4.05Å; V672-L674 HydrophobicContact CG1-CD2 4.05Å; V672-L674 WeakPolarHBondContact O-CG 3.47Å; V672-L674 PolarHBondContact O-N 2.79Å
673	E	73.1	Confident	74.2	Confident	191 Å²	191	86.4 Å²	86.4	89%	0.893	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-68.5	118.5	169.7	-66.2	-173.7	172	0	0	108.4	K671	K671-E673 PolarHBondContact O-N 2.84Å
674	L	84.6	Confident	75.3	Confident	41 Å²	41	80.3 Å²	80.3	22%	0.215	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-100.9	133.3	-172.5	-55.9	-178.6	0	0	0	110.3	V672 E935 I993	V672-L674 HydrophobicContact CB-CD2 4.05Å; V672-L674 HydrophobicContact CG1-CD2 4.05Å; V672-L674 WeakPolarHBondContact O-CG 3.47Å; V672-L674 PolarHBondContact O-N 2.79Å; L674-E935 HydrophobicContact CD1-CG 4.42Å; L674-I993 HydrophobicContact CD1-CG1 4.34Å; L674-I993 HydrophobicContact CD2-CD1 4.12Å; L674-I993 HydrophobicContact CD2-CG1 4.1Å; L674-I993 HydrophobicContact CD2-CG2 3.82Å
675	D	81.1	Confident	76.4	Confident	134 Å²	134	78.1 Å²	78.1	72%	0.717	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-49.2	137.7	175.7	-67.3	-60.3	0	0	0	111.5	L677 R996	D675-L677 PolarHBondContact O-N 3.42Å; D675-R996 VanDerWaalsContact O-CZ 3.3Å; D675-R996 PolarHBondContact O-NH1 3.07Å; D675-R996 PolarHBondContact O-NH2 3.41Å
676	P	87.1	Confident	77.6	Confident	119 Å²	119	81.2 Å²	81.2	77%	0.773	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-64.3	126.4	175.9	27	-33.6	0	0	0	109.6
677	L	88.3	Confident	78.9	Confident	40 Å²	40	77.6 Å²	77.6	21%	0.209	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-66.2	141.7	177.2	-68.6	175.8	0	0	0	110.7	D675 L927 R931 R996	D675-L677 PolarHBondContact O-N 3.42Å; L677-L927 HydrophobicContact CD1-CD1 4.13Å; L677-R931 HydrophobicContact CD1-CG 3.98Å; L677-R996 HydrophobicContact CD1-CG 4.09Å
678	P	86.6	Confident	80.3	Confident	53 Å²	53	74.7 Å²	74.7	34%	0.344	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-62.8	155.8	173.6	28.4	-36.6	0	0	0	111.5	L680 P1002	P678-L680 PolarHBondContact O-N 3.34Å; P678-P1002 HydrophobicContact CG-CG 4.37Å
679	P	83.4	Confident	81.6	Confident	115 Å²	115	74.3 Å²	74.3	75%	0.747	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-63.4	132.3	-179.9	26.5	-34.7	0	0	0	111.5	T681	P679-T681 PolarHBondContact O-N 2.83Å
680	L	83.3	Confident	83.1	Confident	71 Å²	71	77.8 Å²	77.8	37%	0.372	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-69.5	121.5	-179.1	-63.2	167	0	0	0	110.4	P678 F684 L685 L927	P678-L680 PolarHBondContact O-N 3.34Å; L680-F684 HydrophobicContact CD2-CD1 3.78Å; L680-F684 HydrophobicContact CD2-CE1 3.92Å; L680-L685 HydrophobicContact CB-CD1 4.39Å; L680-L685 HydrophobicContact CB-CD2 4.11Å; L680-L685 HydrophobicContact CB-CG 4.16Å; L680-L685 HydrophobicContact CD1-CD2 4.06Å; L680-L685 HydrophobicContact CD2-CD2 4.46Å; L680-L685 HydrophobicContact CG-CD2 4.43Å; L680-L927 HydrophobicContact CD1-CD2 3.84Å; L680-L927 HydrophobicContact CD2-CD2 3.6Å; L680-L927 HydrophobicContact CG-CD2 4.3Å
681	T	86.3	Confident	84.6	Confident	61 Å²	61	72.9 Å²	72.9	37%	0.374	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-85.2	150	173.2	63.4	0	0	0	0	110.6	P679 D683 F684 L685	P679-T681 PolarHBondContact O-N 2.83Å; T681-D683 PolarHBondContact O-N 3.14Å; T681-F684 PolarHBondContact O-N 3.41Å; T681-F684 VanDerWaalsContact O-N 3.12Å; T681-F684 WeakPolarHBondContact OG1-CB 3.24Å; T681-F684 PolarHBondContact OG1-N 2.75Å; T681-L685 PolarHBondContact O-N 3.31Å
682	P	86.3	Confident	86	Confident	106 Å²	106	67.1 Å²	67.1	69%	0.688	38%	0.377	S	S	*	.	H	α-helix	trans	-56.3	-35.4	175.8	-26.9	35.9	0	0	0	113.3	L685 S686	P682-L685 PolarHBondContact O-N 2.88Å; P682-S686 PolarHBondContact O-N 2.66Å
683	D	86.3	Confident	86.8	Confident	128 Å²	128	66.3 Å²	66.3	68%	0.684	37%	0.368	S	S	*	.	H	α-helix	trans	-65.4	-44	177.1	-54.5	-49.2	0	0	0	111.6	T681 S686 V687	T681-D683 PolarHBondContact O-N 3.14Å; D683-S686 WeakPolarHBondContact O-CB 3.46Å; D683-S686 PolarHBondContact O-N 2.66Å; D683-S686 VanDerWaalsContact O-N 3.16Å; D683-V687 WeakPolarHBondContact O-CG2 3.39Å; D683-V687 PolarHBondContact O-N 3.41Å
684	F	89	Confident	87.5	Confident	8 Å²	8	60.5 Å²	60.5	4%	0.035	34%	0.34	C	S	.	.	H	α-helix	trans	-68.9	-37.5	176.7	-175.7	-117.3	0	0	0	111.9	L680 T681 S686 V687 L688 F999 T1001 P1002 M1003 F1017	L680-F684 HydrophobicContact CD2-CD1 3.78Å; L680-F684 HydrophobicContact CD2-CE1 3.92Å; T681-F684 PolarHBondContact O-N 3.41Å; T681-F684 VanDerWaalsContact O-N 3.12Å; T681-F684 WeakPolarHBondContact OG1-CB 3.24Å; T681-F684 PolarHBondContact OG1-N 2.75Å; F684-S686 PolarHBondContact O-N 2.72Å; F684-V687 WeakPolarHBondContact O-CB 3.37Å; F684-V687 PolarHBondContact O-N 2.73Å; F684-V687 VanDerWaalsContact O-N 3.1Å; F684-L688 HydrophobicContact CD1-CD1 4.02Å; F684-L688 HydrophobicContact CD1-CG 4.31Å; F684-L688 HydrophobicContact CE1-CD1 3.7Å; F684-L688 HydrophobicContact CE1-CD2 4.3Å; F684-L688 HydrophobicContact CE1-CG 4.03Å; F684-L688 HydrophobicContact CE2-CD2 4.38Å; F684-L688 HydrophobicContact CE2-CG 4.45Å; F684-L688 HydrophobicContact CZ-CD1 4.22Å; F684-L688 HydrophobicContact CZ-CD2 3.97Å; F684-L688 HydrophobicContact CZ-CG 4.1Å; F684-L688 WeakPolarHBondContact O-CG 3.13Å; F684-L688 PolarHBondContact O-N 3.37Å; F684-F999 WeakPolarHBondContact CE1-O 3.45Å; F684-F999 WeakPolarHBondContact CZ-O 3.35Å; F684-T1001 WeakPolarHBondContact CZ-O 3.33Å; F684-P1002 HydrophobicContact CB-CB 4.29Å; F684-P1002 HydrophobicContact CB-CG 4.38Å; F684-P1002 HydrophobicContact CD1-CB 4.28Å; F684-P1002 HydrophobicContact CD1-CG 3.8Å; F684-P1002 HydrophobicContact CD2-CB 4.16Å; F684-P1002 HydrophobicContact CE1-CG 4.16Å; F684-P1002 HydrophobicContact CG-CB 3.99Å; F684-P1002 HydrophobicContact CG-CG 4.01Å; F684-M1003 HydrophobicContact CD2-CG 4.45Å; F684-M1003 HydrophobicContact CE2-CG 4.22Å; F684-F1017 HydrophobicContact CE2-CE1 4.44Å; F684-F1017 AromaticContact CE2-CZ 3.98Å; F684-F1017 HydrophobicContact CE2-CZ 3.98Å; F684-F1017 HydrophobicContact CZ-CE1 4.47Å; F684-F1017 HydrophobicContact CZ-CZ 4.43Å
685	L	89	Confident	87.3	Confident	32 Å²	32	58.5 Å²	58.5	17%	0.168	33%	0.33	C	S	.	.	H	α-helix	trans	-60.8	-34.7	170	-70.1	178.7	0	0	0	111.9	L680 T681 P682 L688 N689 E924	L680-L685 HydrophobicContact CB-CD1 4.39Å; L680-L685 HydrophobicContact CB-CD2 4.11Å; L680-L685 HydrophobicContact CB-CG 4.16Å; L680-L685 HydrophobicContact CD1-CD2 4.06Å; L680-L685 HydrophobicContact CD2-CD2 4.46Å; L680-L685 HydrophobicContact CG-CD2 4.43Å; T681-L685 PolarHBondContact O-N 3.31Å; P682-L685 PolarHBondContact O-N 2.88Å; L685-L688 HydrophobicContact CD2-CD1 4.4Å; L685-N689 WeakPolarHBondContact O-CB 3.42Å; L685-N689 PolarHBondContact O-N 3.47Å; L685-N689 PolarHBondContact O-ND2 2.7Å; L685-E924 HydrophobicContact CD1-CG 4.31Å; L685-E924 HydrophobicContact CD2-CG 3.73Å
686	S	89.3	Confident	87.4	Confident	68 Å²	68	54.2 Å²	54.2	48%	0.476	30%	0.304	S	S	.	.	H	α-helix	trans	-68.1	-35.8	172.8	-170.9	0	0	0	0	112.6	P682 D683 F684 R690	P682-S686 PolarHBondContact O-N 2.66Å; D683-S686 WeakPolarHBondContact O-CB 3.46Å; D683-S686 PolarHBondContact O-N 2.66Å; D683-S686 VanDerWaalsContact O-N 3.16Å; F684-S686 PolarHBondContact O-N 2.72Å; S686-R690 WeakPolarHBondContact O-CB 3.43Å; S686-R690 PolarHBondContact O-N 2.53Å
687	V	89.9	Confident	87	Confident	23 Å²	23	55 Å²	55	14%	0.139	29%	0.293	C	S	.	.	H	α-helix	trans	-64.5	-52.3	172.3	175.5	0	0	0	0	110.2	D683 F684 N689 R690 V691 M1003 F1017	D683-V687 WeakPolarHBondContact O-CG2 3.39Å; D683-V687 PolarHBondContact O-N 3.41Å; F684-V687 WeakPolarHBondContact O-CB 3.37Å; F684-V687 PolarHBondContact O-N 2.73Å; F684-V687 VanDerWaalsContact O-N 3.1Å; V687-N689 VanDerWaalsContact C-N 3.34Å; V687-N689 PolarHBondContact O-N 3.17Å; V687-R690 WeakPolarHBondContact O-CB 3.24Å; V687-R690 PolarHBondContact O-N 2.73Å; V687-R690 VanDerWaalsContact O-N 3.08Å; V687-V691 HydrophobicContact CG1-CG2 4.28Å; V687-V691 WeakPolarHBondContact O-CG2 3.42Å; V687-V691 PolarHBondContact O-N 2.99Å; V687-M1003 HydrophobicContact CG1-SD 4.37Å; V687-F1017 HydrophobicContact CG1-CE2 3.85Å; V687-F1017 HydrophobicContact CG1-CZ 4.24Å
688	L	90.8	Very high	86.2	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-56.5	-46.9	179.1	-69.1	-179.8	0	0	0	111.6	F684 L685 R690 V691 C692 L927 F999 F1017	F684-L688 HydrophobicContact CD1-CD1 4.02Å; F684-L688 HydrophobicContact CD1-CG 4.31Å; F684-L688 HydrophobicContact CE1-CD1 3.7Å; F684-L688 HydrophobicContact CE1-CD2 4.3Å; F684-L688 HydrophobicContact CE1-CG 4.03Å; F684-L688 HydrophobicContact CE2-CD2 4.38Å; F684-L688 HydrophobicContact CE2-CG 4.45Å; F684-L688 HydrophobicContact CZ-CD1 4.22Å; F684-L688 HydrophobicContact CZ-CD2 3.97Å; F684-L688 HydrophobicContact CZ-CG 4.1Å; F684-L688 WeakPolarHBondContact O-CG 3.13Å; F684-L688 PolarHBondContact O-N 3.37Å; L685-L688 HydrophobicContact CD2-CD1 4.4Å; L688-R690 PolarHBondContact O-N 3.5Å; L688-V691 PolarHBondContact O-N 3.3Å; L688-C692 VanDerWaalsContact O-CB 3.31Å; L688-C692 WeakPolarHBondContact O-CB 3.34Å; L688-C692 PolarHBondContact O-N 3.32Å; L688-C692 PolarHBondContact O-SG 3Å; L688-L927 HydrophobicContact CD1-CD2 4.44Å; L688-F999 HydrophobicContact CD2-CB 4.44Å; L688-F999 HydrophobicContact CD2-CD1 3.94Å; L688-F1017 HydrophobicContact CD2-CE1 3.94Å; L688-F1017 HydrophobicContact CD2-CZ 4.04Å
689	N	91.6	Very high	85.2	Confident	34 Å²	34	58.2 Å²	58.2	18%	0.182	30%	0.304	C	S	.	.	H	α-helix	trans	-61.9	-40.6	175.9	-82.4	-70.7	0	0	0	113.1	L685 V687 C692 E693 S921 V922 G923	L685-N689 WeakPolarHBondContact O-CB 3.42Å; L685-N689 PolarHBondContact O-N 3.47Å; L685-N689 PolarHBondContact O-ND2 2.7Å; V687-N689 VanDerWaalsContact C-N 3.34Å; V687-N689 PolarHBondContact O-N 3.17Å; N689-C692 PolarHBondContact O-N 2.87Å; N689-E693 PolarHBondContact O-N 3.48Å; N689-S921 WeakPolarHBondContact ND2-CB 3.25Å; N689-S921 PolarHBondContact ND2-OG 2.99Å; N689-S921 VanDerWaalsContact OD1-CB 3.24Å; N689-S921 WeakPolarHBondContact OD1-CB 3.28Å; N689-S921 PolarHBondContact OD1-OG 3.39Å; N689-V922 PolarHBondContact OD1-N 3.02Å; N689-G923 PolarHBondContact OD1-N 3.06Å
690	R	90.3	Very high	84	Confident	99 Å²	99	57 Å²	57	37%	0.374	29%	0.288	S	S	.	.	H	α-helix	trans	-61	-48.7	175.2	173.6	170.8	63.5	-118	6.3	111.2	S686 V687 L688 C692 E693 Q694 E1013	S686-R690 WeakPolarHBondContact O-CB 3.43Å; S686-R690 PolarHBondContact O-N 2.53Å; V687-R690 WeakPolarHBondContact O-CB 3.24Å; V687-R690 PolarHBondContact O-N 2.73Å; V687-R690 VanDerWaalsContact O-N 3.08Å; L688-R690 PolarHBondContact O-N 3.5Å; R690-C692 VanDerWaalsContact C-N 3.35Å; R690-C692 PolarHBondContact O-N 3.25Å; R690-E693 PolarHBondContact O-N 2.83Å; R690-Q694 HydrophobicContact CG-CG 4.15Å; R690-Q694 WeakPolarHBondContact O-CB 3.33Å; R690-Q694 VanDerWaalsContact O-CG 3.23Å; R690-Q694 WeakPolarHBondContact O-CG 3.19Å; R690-Q694 PolarHBondContact O-N 3.27Å; R690-E1013 IonicContact CZ-OE1 3.6Å; R690-E1013 IonicContact CZ-OE2 2.71Å; R690-E1013 VanDerWaalsContact CZ-OE2 3.27Å; R690-E1013 IonicContact NE-OE1 3.53Å; R690-E1013 IonicContact NE-OE2 3.8Å; R690-E1013 PolarHBondContact NE-OE2 3Å; R690-E1013 IonicContact NH2-OE1 2.7Å; R690-E1013 PolarHBondContact NH2-OE1 2.65Å; R690-E1013 IonicContact NH2-OE2 3.62Å; R690-E1013 PolarHBondContact NH2-OE2 2.67Å
691	V	90	Very high	83.2	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.006	28%	0.281	C	S	.	.	H	α-helix	trans	-61.7	-42.9	178.3	169.8	0	0	0	0	110.8	V687 L688 Q694 C695 F999 E1013 M1014 F1017 F1018	V687-V691 HydrophobicContact CG1-CG2 4.28Å; V687-V691 WeakPolarHBondContact O-CG2 3.42Å; V687-V691 PolarHBondContact O-N 2.99Å; L688-V691 PolarHBondContact O-N 3.3Å; V691-Q694 PolarHBondContact O-N 3.46Å; V691-C695 VanDerWaalsContact O-CB 3.3Å; V691-C695 WeakPolarHBondContact O-CB 3.47Å; V691-C695 PolarHBondContact O-N 2.9Å; V691-F999 HydrophobicContact CG1-CE1 4.47Å; V691-E1013 HydrophobicContact CG2-CB 3.82Å; V691-M1014 HydrophobicContact CG1-SD 3.87Å; V691-F1017 HydrophobicContact CB-CD2 4.33Å; V691-F1017 HydrophobicContact CG1-CB 4.17Å; V691-F1017 HydrophobicContact CG1-CD2 3.92Å; V691-F1017 HydrophobicContact CG1-CG 4.21Å; V691-F1017 HydrophobicContact CG2-CD2 3.69Å; V691-F1017 HydrophobicContact CG2-CE2 3.89Å; V691-F1018 HydrophobicContact CG1-CE2 4.03Å
692	C	89.6	Confident	82.4	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.02	27%	0.269	C	S	.	.	H	α-helix	trans	-60.5	-47.7	175.3	-72.5	0	0	0	0	112.9	L688 N689 R690 C695 Y696 I834 I838 V922	L688-C692 VanDerWaalsContact O-CB 3.31Å; L688-C692 WeakPolarHBondContact O-CB 3.34Å; L688-C692 PolarHBondContact O-N 3.32Å; L688-C692 PolarHBondContact O-SG 3Å; N689-C692 PolarHBondContact O-N 2.87Å; R690-C692 VanDerWaalsContact C-N 3.35Å; R690-C692 PolarHBondContact O-N 3.25Å; C692-C695 WeakPolarHBondContact O-CB 3.18Å; C692-Y696 PolarHBondContact O-N 3.43Å; C692-I834 HydrophobicContact CB-CG2 4.45Å; C692-I834 VanDerWaalsContact O-CG2 3.24Å; C692-I834 WeakPolarHBondContact O-CG2 3.23Å; C692-I838 HydrophobicContact CB-CD1 3.53Å; C692-V922 HydrophobicContact CB-CB 4.12Å; C692-V922 HydrophobicContact CB-CG1 3.64Å
693	E	88.1	Confident	81.9	Confident	64 Å²	64	50.9 Å²	50.9	30%	0.299	25%	0.253	S	S	.	.	H	α-helix	trans	-70	-41.3	176.8	-69.1	-145.2	-175.8	0	0	112.3	N689 R690 C695 Y696 Y697 R830 I834	N689-E693 PolarHBondContact O-N 3.48Å; R690-E693 PolarHBondContact O-N 2.83Å; E693-C695 VanDerWaalsContact C-N 3.29Å; E693-C695 PolarHBondContact O-N 3.23Å; E693-Y696 WeakPolarHBondContact O-CB 3.47Å; E693-Y696 PolarHBondContact O-N 3.43Å; E693-Y696 VanDerWaalsContact O-N 3.11Å; E693-Y697 HydrophobicContact CB-CE2 4.44Å; E693-Y697 WeakPolarHBondContact O-CD2 3.47Å; E693-Y697 PolarHBondContact O-N 2.94Å; E693-Y697 VanDerWaalsContact O-N 3.14Å; E693-R830 VanDerWaalsContact CD-NH1 3.31Å; E693-R830 VanDerWaalsContact CD-NH2 3.28Å; E693-R830 IonicContact OE1-CZ 2.83Å; E693-R830 IonicContact OE1-NH1 2.74Å; E693-R830 PolarHBondContact OE1-NH1 3.15Å; E693-R830 IonicContact OE1-NH2 3.43Å; E693-R830 IonicContact OE2-CZ 3.15Å; E693-R830 IonicContact OE2-NH1 2.95Å; E693-R830 PolarHBondContact OE2-NH1 3.27Å; E693-R830 IonicContact OE2-NH2 2.69Å; E693-R830 PolarHBondContact OE2-NH2 3.43Å; E693-I834 HydrophobicContact CG-CD1 4.38Å
694	Q	86	Confident	81.6	Confident	69 Å²	69	52 Å²	52	32%	0.322	26%	0.259	S	S	.	.	H	α-helix	trans	-57	-42.4	174.3	-80.3	175.7	-18.8	0	0	111.3	R690 V691 Y696 Y697 L698 M1014	R690-Q694 HydrophobicContact CG-CG 4.15Å; R690-Q694 WeakPolarHBondContact O-CB 3.33Å; R690-Q694 VanDerWaalsContact O-CG 3.23Å; R690-Q694 WeakPolarHBondContact O-CG 3.19Å; R690-Q694 PolarHBondContact O-N 3.27Å; V691-Q694 PolarHBondContact O-N 3.46Å; Q694-Y696 VanDerWaalsContact C-N 3.29Å; Q694-Y696 PolarHBondContact O-N 3.47Å; Q694-Y697 PolarHBondContact O-N 2.93Å; Q694-Y697 VanDerWaalsContact O-N 3.15Å; Q694-L698 HydrophobicContact CB-CD1 4.01Å; Q694-L698 VanDerWaalsContact O-CB 3.23Å; Q694-L698 WeakPolarHBondContact O-CB 3.3Å; Q694-L698 VanDerWaalsContact O-CG 3.25Å; Q694-L698 WeakPolarHBondContact O-CG 3.37Å; Q694-L698 PolarHBondContact O-N 3.01Å; Q694-M1014 HydrophobicContact CB-SD 4.11Å
695	C	82	Confident	81.3	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-55.2	-43.6	175.2	-172.4	0	0	0	0	112.2	V691 C692 E693 F699 I838 M1014	V691-C695 VanDerWaalsContact O-CB 3.3Å; V691-C695 WeakPolarHBondContact O-CB 3.47Å; V691-C695 PolarHBondContact O-N 2.9Å; C692-C695 WeakPolarHBondContact O-CB 3.18Å; E693-C695 VanDerWaalsContact C-N 3.29Å; E693-C695 PolarHBondContact O-N 3.23Å; C695-F699 WeakPolarHBondContact O-CB 3.35Å; C695-F699 WeakPolarHBondContact O-CD2 3.26Å; C695-F699 PolarHBondContact O-N 3.01Å; C695-I838 HydrophobicContact CB-CG1 3.92Å; C695-M1014 HydrophobicContact CB-CE 3.86Å; C695-M1014 HydrophobicContact CB-SD 4.4Å
696	Y	81.9	Confident	81.1	Confident	43 Å²	43	59 Å²	59	17%	0.169	29%	0.294	C	S	.	.	H	α-helix	trans	-67.2	-35.3	177.9	175.1	-103.5	0	0	0	113.3	C692 E693 Q694 A701 K833 I834 Y837	C692-Y696 PolarHBondContact O-N 3.43Å; E693-Y696 WeakPolarHBondContact O-CB 3.47Å; E693-Y696 PolarHBondContact O-N 3.43Å; E693-Y696 VanDerWaalsContact O-N 3.11Å; Q694-Y696 VanDerWaalsContact C-N 3.29Å; Q694-Y696 PolarHBondContact O-N 3.47Å; Y696-A701 HydrophobicContact CE2-CB 4.27Å; Y696-K833 HydrophobicContact CE2-CB 4.24Å; Y696-I834 HydrophobicContact CD1-CG1 4.32Å; Y696-I834 HydrophobicContact CD2-CG1 4.3Å; Y696-I834 HydrophobicContact CG-CG1 3.98Å; Y696-Y837 AromaticContact CD2-CD1 3.94Å; Y696-Y837 HydrophobicContact CD2-CD1 3.94Å; Y696-Y837 HydrophobicContact CD2-CD2 4.07Å; Y696-Y837 HydrophobicContact CD2-CE1 4.23Å; Y696-Y837 HydrophobicContact CD2-CE2 4.29Å; Y696-Y837 AromaticContact CD2-CG 3.85Å; Y696-Y837 HydrophobicContact CD2-CG 3.85Å; Y696-Y837 HydrophobicContact CE2-CD1 4.38Å; Y696-Y837 HydrophobicContact CE2-CD2 4.22Å; Y696-Y837 HydrophobicContact CE2-CE1 4.23Å; Y696-Y837 AromaticContact CE2-CE2 3.99Å; Y696-Y837 HydrophobicContact CE2-CE2 3.99Å; Y696-Y837 HydrophobicContact CE2-CG 4.38Å
697	Y	79.2	Confident	80.8	Confident	135 Å²	135	58.1 Å²	58.1	53%	0.529	28%	0.284	S	S	.	.	H	α-helix	trans	-83.2	-39.9	178.9	-69.5	-65.2	0	0	0	113.7	E693 Q694 Q700 R830	E693-Y697 HydrophobicContact CB-CE2 4.44Å; E693-Y697 WeakPolarHBondContact O-CD2 3.47Å; E693-Y697 PolarHBondContact O-N 2.94Å; E693-Y697 VanDerWaalsContact O-N 3.14Å; Q694-Y697 PolarHBondContact O-N 2.93Å; Q694-Y697 VanDerWaalsContact O-N 3.15Å; Y697-Q700 WeakPolarHBondContact O-CG 3.4Å; Y697-Q700 PolarHBondContact O-N 3.47Å; Y697-R830 PolarHBondContact OH-NH2 2.76Å
698	L	72	Confident	80.7	Confident	100 Å²	100	58.4 Å²	58.4	52%	0.524	29%	0.292	S	S	.	.	H	α-helix	trans	-73.8	-41.1	-176.4	-69.9	171.3	0	0	0	112.7	Q694 Q700 M1014	Q694-L698 HydrophobicContact CB-CD1 4.01Å; Q694-L698 VanDerWaalsContact O-CB 3.23Å; Q694-L698 WeakPolarHBondContact O-CB 3.3Å; Q694-L698 VanDerWaalsContact O-CG 3.25Å; Q694-L698 WeakPolarHBondContact O-CG 3.37Å; Q694-L698 PolarHBondContact O-N 3.01Å; L698-Q700 WeakPolarHBondContact O-CG 3.39Å; L698-Q700 PolarHBondContact O-N 3.5Å; L698-M1014 HydrophobicContact CD1-CG 3.81Å; L698-M1014 HydrophobicContact CD1-SD 4.4Å
699	F	65.7	Low	80.6	Confident	61 Å²	61	60.8 Å²	60.8	27%	0.268	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	9.2	174.6	-68.6	-76.1	0	0	0	113.7	C695 V841 M1014	C695-F699 WeakPolarHBondContact O-CB 3.35Å; C695-F699 WeakPolarHBondContact O-CD2 3.26Å; C695-F699 PolarHBondContact O-N 3.01Å; F699-V841 HydrophobicContact CB-CG2 4.08Å; F699-V841 HydrophobicContact CD1-CG2 4.21Å; F699-V841 HydrophobicContact CD2-CB 4.44Å; F699-V841 HydrophobicContact CD2-CG1 4.09Å; F699-V841 HydrophobicContact CD2-CG2 3.49Å; F699-V841 VanDerWaalsContact CD2-CG2 3.49Å; F699-V841 HydrophobicContact CE2-CB 4.42Å; F699-V841 HydrophobicContact CE2-CG1 3.59Å; F699-V841 HydrophobicContact CE2-CG2 3.9Å; F699-V841 HydrophobicContact CG-CG2 3.64Å; F699-V841 HydrophobicContact CZ-CG1 3.85Å; F699-V841 HydrophobicContact CZ-CG2 4.43Å; F699-M1014 HydrophobicContact CD2-CE 4.41Å; F699-M1014 HydrophobicContact CE2-CE 3.73Å
700	Q	58.3	Low	80.5	Confident	89 Å²	89	59.5 Å²	59.5	42%	0.416	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	91.6	161.6	-67.5	161	23.4	0	0	113.4	Y697 L698 R743	Y697-Q700 WeakPolarHBondContact O-CG 3.4Å; Y697-Q700 PolarHBondContact O-N 3.47Å; L698-Q700 WeakPolarHBondContact O-CG 3.39Å; L698-Q700 PolarHBondContact O-N 3.5Å; Q700-R743 HydrophobicContact CB-CG 3.95Å; Q700-R743 WeakPolarHBondContact O-CG 3.47Å; Q700-R743 PolarHBondContact O-N 2.86Å; Q700-R743 VanDerWaalsContact OE1-CD 3.27Å
701	A	66	Low	80.6	Confident	28 Å²	28	57.6 Å²	57.6	23%	0.231	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-51.3	131.1	157.4	0	0	0	0	0	109.3	Y696 D703 Y837	Y696-A701 HydrophobicContact CE2-CB 4.27Å; A701-D703 PolarHBondContact O-N 2.82Å; A701-Y837 HydrophobicContact CB-CE1 3.8Å; A701-Y837 WeakPolarHBondContact CB-OH 3.45Å
702	P	69.3	Low	80.6	Confident	18 Å²	18	62.7 Å²	62.7	12%	0.117	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-52.2	126.9	176.3	-26.9	32.8	0	0	0	110.7	E706 N707 G741	P702-E706 WeakPolarHBondContact CA-OE2 3.35Å; P702-E706 HydrophobicContact CB-CB 4.2Å; P702-N707 PolarHBondContact O-ND2 2.57Å; P702-G741 WeakPolarHBondContact CD-O 3.31Å
703	D	75.4	Confident	80.7	Confident	65 Å²	65	63 Å²	63	35%	0.348	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-75.5	172.1	179.3	68.1	42.4	0	0	0	111.8	A701 L705 E706 N707 R743	A701-D703 PolarHBondContact O-N 2.82Å; D703-L705 PolarHBondContact O-N 3.22Å; D703-L705 WeakPolarHBondContact OD1-CA 3.38Å; D703-L705 VanDerWaalsContact OD1-CB 3.26Å; D703-L705 WeakPolarHBondContact OD1-CB 3.36Å; D703-L705 PolarHBondContact OD1-N 2.77Å; D703-E706 PolarHBondContact N-OE2 3.39Å; D703-E706 PolarHBondContact O-N 3Å; D703-E706 PolarHBondContact OD1-N 3.31Å; D703-N707 WeakPolarHBondContact O-CB 3.27Å; D703-N707 PolarHBondContact O-N 2.84Å; D703-N707 PolarHBondContact O-ND2 3.36Å; D703-R743 IonicContact OD2-NH2 2.85Å; D703-R743 PolarHBondContact OD2-NH2 3.09Å
704	D	80.2	Confident	80.9	Confident	152 Å²	152	60.6 Å²	60.6	81%	0.813	31%	0.312	S	S	*	.	H	α-helix	trans	-62.2	-25.9	-177.3	-67.5	-38.6	0	0	0	112.9	G708	D704-G708 PolarHBondContact O-N 2.67Å
705	L	83.8	Confident	81.2	Confident	134 Å²	134	62.2 Å²	62.2	70%	0.702	32%	0.319	S	S	*	.	H	α-helix	trans	-75.2	-44.9	175.1	175.1	65	0	0	0	110.7	D703 G708 V709	D703-L705 PolarHBondContact O-N 3.22Å; D703-L705 WeakPolarHBondContact OD1-CA 3.38Å; D703-L705 VanDerWaalsContact OD1-CB 3.26Å; D703-L705 WeakPolarHBondContact OD1-CB 3.36Å; D703-L705 PolarHBondContact OD1-N 2.77Å; L705-G708 CarbonylContact O-C 3.57Å; L705-G708 WeakPolarHBondContact O-CA 3.2Å; L705-G708 PolarHBondContact O-N 2.83Å; L705-G708 VanDerWaalsContact O-N 3.15Å; L705-V709 WeakPolarHBondContact O-CG2 3.37Å; L705-V709 PolarHBondContact O-N 3.07Å
706	E	83.4	Confident	81.7	Confident	51 Å²	51	64.7 Å²	64.7	24%	0.238	33%	0.332	C	S	.	.	H	α-helix	trans	-64	-41.9	176.1	-68.3	175.3	113.9	0	0	112	P702 D703 G708 V709 R710 R743	P702-E706 WeakPolarHBondContact CA-OE2 3.35Å; P702-E706 HydrophobicContact CB-CB 4.2Å; D703-E706 PolarHBondContact N-OE2 3.39Å; D703-E706 PolarHBondContact O-N 3Å; D703-E706 PolarHBondContact OD1-N 3.31Å; E706-G708 VanDerWaalsContact C-N 3.29Å; E706-G708 PolarHBondContact O-N 3.28Å; E706-V709 WeakPolarHBondContact O-CB 3.24Å; E706-V709 PolarHBondContact O-N 2.98Å; E706-V709 VanDerWaalsContact O-N 3.11Å; E706-R710 WeakPolarHBondContact O-CG 3.37Å; E706-R710 PolarHBondContact O-N 3.48Å; E706-R743 WeakPolarHBondContact OE1-CD 3.25Å; E706-R743 WeakPolarHBondContact OE1-CG 3.48Å; E706-R743 IonicContact OE1-CZ 3.82Å; E706-R743 IonicContact OE1-NE 2.73Å; E706-R743 PolarHBondContact OE1-NE 2.78Å; E706-R743 IonicContact OE1-NH2 3.58Å; E706-R743 IonicContact OE2-CZ 3.7Å; E706-R743 IonicContact OE2-NE 3.98Å; E706-R743 PolarHBondContact OE2-NE 3.11Å; E706-R743 IonicContact OE2-NH2 3.04Å; E706-R743 PolarHBondContact OE2-NH2 3.29Å
707	N	83.9	Confident	82.2	Confident	50 Å²	50	62.7 Å²	62.7	27%	0.267	33%	0.325	S	S	.	.	H	α-helix	trans	-61.9	-38.2	171.9	-71	-55.5	0	0	0	111.5	P702 D703 R710 E711	P702-N707 PolarHBondContact O-ND2 2.57Å; D703-N707 WeakPolarHBondContact O-CB 3.27Å; D703-N707 PolarHBondContact O-N 2.84Å; D703-N707 PolarHBondContact O-ND2 3.36Å; N707-R710 PolarHBondContact O-N 2.88Å; N707-E711 PolarHBondContact O-N 2.9Å; N707-E711 VanDerWaalsContact O-N 3.14Å
708	G	86.8	Confident	82.9	Confident	30 Å²	30	57.7 Å²	57.7	31%	0.309	31%	0.306	S	S	.	.	H	α-helix	trans	-61.4	-39.9	170	0	0	0	0	0	113.2	D704 L705 E706 E711 L712	D704-G708 PolarHBondContact O-N 2.67Å; L705-G708 CarbonylContact O-C 3.57Å; L705-G708 WeakPolarHBondContact O-CA 3.2Å; L705-G708 PolarHBondContact O-N 2.83Å; L705-G708 VanDerWaalsContact O-N 3.15Å; E706-G708 VanDerWaalsContact C-N 3.29Å; E706-G708 PolarHBondContact O-N 3.28Å; G708-E711 PolarHBondContact O-N 2.88Å; G708-L712 WeakPolarHBondContact O-CG 3.04Å; G708-L712 PolarHBondContact O-N 3.2Å
709	V	88.8	Confident	83.8	Confident	51 Å²	51	56.1 Å²	56.1	31%	0.309	30%	0.303	S	S	.	.	H	α-helix	trans	-65.9	-39.4	175	170.8	0	0	0	0	111.5	L705 E706 E711 L712 I713 T802	L705-V709 WeakPolarHBondContact O-CG2 3.37Å; L705-V709 PolarHBondContact O-N 3.07Å; E706-V709 WeakPolarHBondContact O-CB 3.24Å; E706-V709 PolarHBondContact O-N 2.98Å; E706-V709 VanDerWaalsContact O-N 3.11Å; V709-E711 VanDerWaalsContact C-N 3.32Å; V709-E711 PolarHBondContact O-N 3.4Å; V709-L712 PolarHBondContact O-N 2.94Å; V709-I713 HydrophobicContact CG1-CD1 4.12Å; V709-I713 WeakPolarHBondContact O-CG1 3.3Å; V709-I713 PolarHBondContact O-N 2.83Å; V709-T802 HydrophobicContact CG1-CG2 3.74Å
710	R	91	Very high	85	Confident	7 Å²	7	54.3 Å²	54.3	3%	0.026	30%	0.296	C	S	.	.	H	α-helix	trans	-59.3	-42.3	173.7	-65.6	-176.2	174	-104.8	-11.5	111.5	E706 N707 I713 L714 L732 S736 F742 R743 S745 D746 L747	E706-R710 WeakPolarHBondContact O-CG 3.37Å; E706-R710 PolarHBondContact O-N 3.48Å; N707-R710 PolarHBondContact O-N 2.88Å; R710-I713 PolarHBondContact O-N 2.91Å; R710-L714 PolarHBondContact O-N 2.86Å; R710-L714 VanDerWaalsContact O-N 3.09Å; R710-L732 HydrophobicContact CB-CD1 4.25Å; R710-S736 PolarHBondContact NH1-OG 2.93Å; R710-F742 PolarHBondContact NH2-O 3.39Å; R710-R743 PolarHBondContact NH2-O 2.91Å; R710-S745 VanDerWaalsContact CZ-O 3.27Å; R710-S745 PolarHBondContact NH1-O 3.36Å; R710-S745 PolarHBondContact NH2-O 3.46Å; R710-D746 PolarHBondContact NH1-O 3.02Å; R710-L747 HydrophobicContact CB-CD2 3.94Å; R710-L747 HydrophobicContact CG-CD2 3.82Å
711	E	90.4	Very high	86.5	Confident	59 Å²	59	50.3 Å²	50.3	28%	0.276	28%	0.277	S	S	.	.	H	α-helix	trans	-67.7	-38.9	174.7	-72.5	-74	-168.1	0	0	113.4	N707 G708 V709 I713 L714 Q715 L732 K737	N707-E711 PolarHBondContact O-N 2.9Å; N707-E711 VanDerWaalsContact O-N 3.14Å; G708-E711 PolarHBondContact O-N 2.88Å; V709-E711 VanDerWaalsContact C-N 3.32Å; V709-E711 PolarHBondContact O-N 3.4Å; E711-I713 VanDerWaalsContact C-N 3.29Å; E711-I713 PolarHBondContact O-N 3.45Å; E711-L714 WeakPolarHBondContact O-CB 3.43Å; E711-L714 PolarHBondContact O-N 3.47Å; E711-Q715 WeakPolarHBondContact O-CG 3.4Å; E711-Q715 PolarHBondContact O-N 2.84Å; E711-L732 HydrophobicContact CG-CD1 4.47Å; E711-K737 WeakPolarHBondContact OE1-CE 3.22Å; E711-K737 IonicContact OE1-NZ 3.54Å; E711-K737 PolarHBondContact OE1-NZ 3.26Å
712	L	91.8	Very high	87.6	Confident	108 Å²	108	53.7 Å²	53.7	57%	0.565	28%	0.284	S	S	*	.	H	α-helix	trans	-63.9	-35	175.2	-72.4	169.6	0	0	0	112	G708 V709 Q715 D716	G708-L712 WeakPolarHBondContact O-CG 3.04Å; G708-L712 PolarHBondContact O-N 3.2Å; V709-L712 PolarHBondContact O-N 2.94Å; L712-Q715 PolarHBondContact O-N 3.24Å; L712-D716 WeakPolarHBondContact O-CB 3.49Å; L712-D716 PolarHBondContact O-N 3.33Å
713	I	91	Very high	88.4	Confident	8 Å²	8	60.3 Å²	60.3	4%	0.041	31%	0.307	C	S	.	.	H	α-helix	trans	-66.4	-43.4	172.2	-65.2	163.9	0	0	0	110.6	V709 R710 E711 Q715 D716 L717 L747 H799 T802	V709-I713 HydrophobicContact CG1-CD1 4.12Å; V709-I713 WeakPolarHBondContact O-CG1 3.3Å; V709-I713 PolarHBondContact O-N 2.83Å; R710-I713 PolarHBondContact O-N 2.91Å; E711-I713 VanDerWaalsContact C-N 3.29Å; E711-I713 PolarHBondContact O-N 3.45Å; I713-Q715 VanDerWaalsContact C-N 3.3Å; I713-Q715 PolarHBondContact O-N 2.73Å; I713-D716 PolarHBondContact O-N 3.42Å; I713-L717 HydrophobicContact CG2-CD1 3.84Å; I713-L717 HydrophobicContact CG2-CG 4.28Å; I713-L717 WeakPolarHBondContact O-CB 3.38Å; I713-L717 VanDerWaalsContact O-CG 3.28Å; I713-L717 WeakPolarHBondContact O-CG 3.43Å; I713-L717 PolarHBondContact O-N 2.85Å; I713-L747 HydrophobicContact CB-CD1 4.48Å; I713-L747 HydrophobicContact CD1-CD1 4.04Å; I713-L747 HydrophobicContact CG2-CD1 3.87Å; I713-H799 WeakPolarHBondContact CD1-ND1 3.44Å; I713-T802 HydrophobicContact CD1-CG2 3.98Å
714	L	92.9	Very high	88.7	Confident	15 Å²	15	62.1 Å²	62.1	8%	0.079	31%	0.313	C	S	.	.	H	α-helix	trans	-57.4	-43.8	175	-172.7	71.8	0	0	0	111.4	R710 E711 L717 E718 L730 L732 I749	R710-L714 PolarHBondContact O-N 2.86Å; R710-L714 VanDerWaalsContact O-N 3.09Å; E711-L714 WeakPolarHBondContact O-CB 3.43Å; E711-L714 PolarHBondContact O-N 3.47Å; L714-L717 PolarHBondContact O-N 2.88Å; L714-E718 VanDerWaalsContact O-CB 3.25Å; L714-E718 WeakPolarHBondContact O-CB 3.37Å; L714-E718 PolarHBondContact O-N 3.37Å; L714-L730 HydrophobicContact CD1-CB 3.52Å; L714-L730 HydrophobicContact CD1-CD1 4.4Å; L714-L730 HydrophobicContact CG-CB 4.23Å; L714-L732 HydrophobicContact CB-CD1 4.29Å; L714-L732 HydrophobicContact CB-CG 4.32Å; L714-L732 HydrophobicContact CD1-CG 4.09Å; L714-L732 HydrophobicContact CD2-CD1 4.27Å; L714-L732 HydrophobicContact CD2-CG 4.01Å; L714-L732 HydrophobicContact CG-CG 4.36Å; L714-I749 HydrophobicContact CD1-CD1 4.19Å; L714-I749 HydrophobicContact CD1-CG1 4.11Å; L714-I749 HydrophobicContact CD1-CG2 4.02Å
715	Q	92.5	Very high	88.8	Confident	102 Å²	102	56.9 Å²	56.9	48%	0.477	28%	0.283	S	S	.	.	H	α-helix	trans	-69.1	-38.3	-179.7	-69.2	170.6	26.8	0	0	113.2	E711 L712 I713 S719	E711-Q715 WeakPolarHBondContact O-CG 3.4Å; E711-Q715 PolarHBondContact O-N 2.84Å; L712-Q715 PolarHBondContact O-N 3.24Å; I713-Q715 VanDerWaalsContact C-N 3.3Å; I713-Q715 PolarHBondContact O-N 2.73Å; Q715-S719 WeakPolarHBondContact O-CB 3.45Å; Q715-S719 PolarHBondContact O-N 2.86Å; Q715-S719 PolarHBondContact O-OG 3.08Å
716	D	92.5	Very high	88.6	Confident	52 Å²	52	55 Å²	55	28%	0.278	29%	0.287	S	S	.	.	H	α-helix	trans	-63.2	-47.9	173.9	-165.7	19.5	0	0	0	110.3	L712 I713 S719 F720 H778 R801	L712-D716 WeakPolarHBondContact O-CB 3.49Å; L712-D716 PolarHBondContact O-N 3.33Å; I713-D716 PolarHBondContact O-N 3.42Å; D716-S719 PolarHBondContact O-N 3.13Å; D716-F720 WeakPolarHBondContact O-CB 3.46Å; D716-F720 PolarHBondContact O-N 2.87Å; D716-H778 IonicContact OD1-NE2 3.49Å; D716-H778 IonicContact OD2-CE1 2.82Å; D716-R801 IonicContact OD2-CZ 3.36Å; D716-R801 IonicContact OD2-NH2 3.45Å; D716-R801 PolarHBondContact OD2-NH2 3.39Å
717	L	92	Very high	88.5	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-63.9	-44.9	176.5	-68.9	175.1	0	0	0	112.5	I713 L714 F720 V721 L730 I749 L775 L781 F797	I713-L717 HydrophobicContact CG2-CD1 3.84Å; I713-L717 HydrophobicContact CG2-CG 4.28Å; I713-L717 WeakPolarHBondContact O-CB 3.38Å; I713-L717 VanDerWaalsContact O-CG 3.28Å; I713-L717 WeakPolarHBondContact O-CG 3.43Å; I713-L717 PolarHBondContact O-N 2.85Å; L714-L717 PolarHBondContact O-N 2.88Å; L717-F720 PolarHBondContact O-N 3.33Å; L717-F720 VanDerWaalsContact O-N 3.14Å; L717-V721 WeakPolarHBondContact O-CB 3.38Å; L717-V721 VanDerWaalsContact O-CG2 3.32Å; L717-V721 WeakPolarHBondContact O-CG2 3.47Å; L717-V721 PolarHBondContact O-N 3.35Å; L717-L730 HydrophobicContact CB-CD1 3.78Å; L717-I749 HydrophobicContact CD1-CD1 3.75Å; L717-L775 HydrophobicContact CD2-CD2 4.31Å; L717-L781 HydrophobicContact CD2-CD1 3.96Å; L717-L781 HydrophobicContact CD2-CD2 4.45Å; L717-F797 HydrophobicContact CD1-CE1 4.2Å; L717-F797 HydrophobicContact CD1-CE2 4.38Å; L717-F797 HydrophobicContact CD1-CZ 3.7Å
718	E	92.4	Very high	88.6	Confident	30 Å²	30	51.5 Å²	51.5	14%	0.14	28%	0.276	C	S	.	.	H	α-helix	trans	-64.2	-44.1	178.9	-171.2	-179.2	-126.3	0	0	110.6	L714 F720 V721 R722 R729 L730	L714-E718 VanDerWaalsContact O-CB 3.25Å; L714-E718 WeakPolarHBondContact O-CB 3.37Å; L714-E718 PolarHBondContact O-N 3.37Å; E718-F720 PolarHBondContact O-N 2.79Å; E718-V721 PolarHBondContact O-N 3.49Å; E718-R722 HydrophobicContact CG-CG 4.41Å; E718-R722 VanDerWaalsContact O-CB 3.31Å; E718-R722 WeakPolarHBondContact O-CB 3.47Å; E718-R722 WeakPolarHBondContact O-CG 3.22Å; E718-R722 PolarHBondContact O-N 2.88Å; E718-R722 IonicContact OE1-CZ 3.4Å; E718-R722 IonicContact OE1-NH1 3.6Å; E718-R722 IonicContact OE1-NH2 2.81Å; E718-R722 PolarHBondContact OE1-NH2 3.44Å; E718-R722 IonicContact OE2-CZ 3.32Å; E718-R722 VanDerWaalsContact OE2-CZ 3.32Å; E718-R722 IonicContact OE2-NH1 2.68Å; E718-R722 PolarHBondContact OE2-NH1 3.43Å; E718-R722 IonicContact OE2-NH2 3.38Å; E718-R722 PolarHBondContact OE2-NH2 3.13Å; E718-R729 VanDerWaalsContact OE1-CA 3.26Å; E718-R729 WeakPolarHBondContact OE1-CA 3.38Å; E718-R729 WeakPolarHBondContact OE1-CG 3.43Å; E718-L730 HydrophobicContact CB-CB 4.18Å; E718-L730 HydrophobicContact CB-CD1 3.97Å; E718-L730 HydrophobicContact CB-CG 3.96Å; E718-L730 HydrophobicContact CG-CB 4.34Å; E718-L730 HydrophobicContact CG-CG 4.15Å; E718-L730 PolarHBondContact OE1-N 2.94Å
719	S	90.8	Very high	88.8	Confident	66 Å²	66	55.7 Å²	55.7	46%	0.462	28%	0.283	S	S	.	.	H	α-helix	trans	-63.8	-25.4	174.8	-60.7	0	0	0	0	112.9	Q715 D716 R723	Q715-S719 WeakPolarHBondContact O-CB 3.45Å; Q715-S719 PolarHBondContact O-N 2.86Å; Q715-S719 PolarHBondContact O-OG 3.08Å; D716-S719 PolarHBondContact O-N 3.13Å; S719-R723 PolarHBondContact O-NE 2.85Å; S719-R723 PolarHBondContact O-NH2 3.33Å
720	F	91.1	Very high	88.9	Confident	24 Å²	24	53.6 Å²	53.6	11%	0.105	27%	0.269	C	S	.	.	H	α-helix	trans	-81.3	-47.2	172.2	-176.8	-100.2	0	0	0	112.8	D716 L717 E718 R723 Q774 L775 K777 H778	D716-F720 WeakPolarHBondContact O-CB 3.46Å; D716-F720 PolarHBondContact O-N 2.87Å; L717-F720 PolarHBondContact O-N 3.33Å; L717-F720 VanDerWaalsContact O-N 3.14Å; E718-F720 PolarHBondContact O-N 2.79Å; F720-R723 WeakPolarHBondContact O-CB 3.42Å; F720-R723 PolarHBondContact O-N 3.37Å; F720-Q774 HydrophobicContact CE1-CB 4.44Å; F720-Q774 WeakPolarHBondContact CE1-O 3.14Å; F720-Q774 WeakPolarHBondContact CZ-O 3.22Å; F720-L775 HydrophobicContact CD1-CD2 4.28Å; F720-L775 HydrophobicContact CE1-CD2 4.41Å; F720-K777 HydrophobicContact CZ-CB 4.26Å; F720-H778 AromaticContact CD1-CD2 3.94Å; F720-H778 AromaticContact CD2-CD2 3.52Å; F720-H778 HydrophobicContact CE1-CB 4.23Å; F720-H778 AromaticContact CE2-CD2 3.9Å; F720-H778 AromaticContact CG-CD2 3.52Å; F720-H778 HydrophobicContact CZ-CB 4.23Å
721	V	89.7	Confident	88.9	Confident	5 Å²	5	56 Å²	56	3%	0.03	28%	0.281	C	S	.	.	H	α-helix	trans	-64.8	-41.5	-179.4	174	0	0	0	0	111.1	L717 E718 R723 Q724 F725 A728 M751 L771 L775	L717-V721 WeakPolarHBondContact O-CB 3.38Å; L717-V721 VanDerWaalsContact O-CG2 3.32Å; L717-V721 WeakPolarHBondContact O-CG2 3.47Å; L717-V721 PolarHBondContact O-N 3.35Å; E718-V721 PolarHBondContact O-N 3.49Å; V721-R723 PolarHBondContact O-N 2.63Å; V721-R723 VanDerWaalsContact O-N 3.13Å; V721-Q724 PolarHBondContact O-N 2.82Å; V721-F725 HydrophobicContact CG1-CB 4.32Å; V721-F725 HydrophobicContact CG1-CD2 3.9Å; V721-F725 PolarHBondContact O-N 3.43Å; V721-A728 HydrophobicContact CG1-CB 3.75Å; V721-M751 HydrophobicContact CG1-CE 3.8Å; V721-M751 HydrophobicContact CG1-SD 3.91Å; V721-L771 HydrophobicContact CG1-CD1 4.21Å; V721-L771 HydrophobicContact CG2-CD1 3.77Å; V721-L775 HydrophobicContact CG2-CD2 4.39Å
722	R	89.1	Confident	89.1	Confident	98 Å²	98	53.9 Å²	53.9	37%	0.37	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-25.6	175.6	-80.7	-175.1	173.5	130.3	13.6	114.4	E718 Q724 F725 A728	E718-R722 HydrophobicContact CG-CG 4.41Å; E718-R722 VanDerWaalsContact O-CB 3.31Å; E718-R722 WeakPolarHBondContact O-CB 3.47Å; E718-R722 WeakPolarHBondContact O-CG 3.22Å; E718-R722 PolarHBondContact O-N 2.88Å; E718-R722 IonicContact OE1-CZ 3.4Å; E718-R722 IonicContact OE1-NH1 3.6Å; E718-R722 IonicContact OE1-NH2 2.81Å; E718-R722 PolarHBondContact OE1-NH2 3.44Å; E718-R722 IonicContact OE2-CZ 3.32Å; E718-R722 VanDerWaalsContact OE2-CZ 3.32Å; E718-R722 IonicContact OE2-NH1 2.68Å; E718-R722 PolarHBondContact OE2-NH1 3.43Å; E718-R722 IonicContact OE2-NH2 3.38Å; E718-R722 PolarHBondContact OE2-NH2 3.13Å; R722-Q724 PolarHBondContact O-N 3.22Å; R722-F725 WeakPolarHBondContact CA-O 3.47Å; R722-A728 HydrophobicContact CG-CB 4.38Å; R722-A728 WeakPolarHBondContact CG-O 3.45Å; R722-A728 PolarHBondContact NE-O 3.02Å; R722-A728 PolarHBondContact NH2-O 3.29Å
723	R	87.3	Confident	89.1	Confident	157 Å²	157	49.9 Å²	49.9	59%	0.592	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-9.1	175.5	-77.1	176.6	-86.1	174.2	-7.4	113.6	S719 F720 V721	S719-R723 PolarHBondContact O-NE 2.85Å; S719-R723 PolarHBondContact O-NH2 3.33Å; F720-R723 WeakPolarHBondContact O-CB 3.42Å; F720-R723 PolarHBondContact O-N 3.37Å; V721-R723 PolarHBondContact O-N 2.63Å; V721-R723 VanDerWaalsContact O-N 3.13Å
724	Q	80.8	Confident	89	Confident	104 Å²	104	50.1 Å²	50.1	49%	0.486	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127	-29.1	178.7	-61.1	-66.9	-78	0	0	112.5	V721 R722 Q774	V721-Q724 PolarHBondContact O-N 2.82Å; R722-Q724 PolarHBondContact O-N 3.22Å; Q724-Q774 HydrophobicContact CB-CG 4.13Å; Q724-Q774 HydrophobicContact CG-CB 4.43Å; Q724-Q774 HydrophobicContact CG-CG 4.02Å
725	F	82.9	Confident	88.7	Confident	41 Å²	41	50.2 Å²	50.2	18%	0.18	26%	0.256	C	S	.	.	S	Bend	trans	-120.4	94.1	176.1	-60.8	-87.5	0	0	0	108.9	V721 R722 A728 M751 L753 I767 L771 Q774	V721-F725 HydrophobicContact CG1-CB 4.32Å; V721-F725 HydrophobicContact CG1-CD2 3.9Å; V721-F725 PolarHBondContact O-N 3.43Å; R722-F725 WeakPolarHBondContact CA-O 3.47Å; F725-A728 HydrophobicContact CB-CB 3.89Å; F725-A728 WeakPolarHBondContact O-CB 3.4Å; F725-A728 PolarHBondContact O-N 3.15Å; F725-A728 VanDerWaalsContact O-N 3.12Å; F725-M751 HydrophobicContact CB-CE 4.19Å; F725-M751 HydrophobicContact CD1-CE 4.44Å; F725-M751 HydrophobicContact CD2-CE 4.28Å; F725-M751 HydrophobicContact CG-CE 4.07Å; F725-L753 HydrophobicContact CB-CD2 4.32Å; F725-I767 HydrophobicContact CE1-CG2 4.18Å; F725-L771 HydrophobicContact CE2-CB 4.47Å; F725-L771 HydrophobicContact CE2-CD1 4.37Å; F725-Q774 HydrophobicContact CE2-CG 4.25Å
726	A	79.4	Confident	88.5	Confident	96 Å²	96	45.9 Å²	45.9	79%	0.793	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	139.2	174.9	0	0	0	0	0	110.2	A728	A726-A728 PolarHBondContact O-N 2.85Å
727	G	81.9	Confident	88.3	Confident	25 Å²	25	47.5 Å²	47.5	26%	0.258	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.1	0.8	-173.6	0	0	0	0	0	115.1	R729 E754	G727-R729 PolarHBondContact O-N 2.87Å; G727-E754 WeakPolarHBondContact O-CB 3.49Å; G727-E754 WeakPolarHBondContact O-CG 3.21Å; G727-E754 PolarHBondContact O-N 2.85Å
728	A	86.5	Confident	88.1	Confident	1 Å²	1	48 Å²	48	1%	0.008	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	134.6	174	0	0	0	0	0	111.8	V721 R722 F725 A726 M751 L753	V721-A728 HydrophobicContact CG1-CB 3.75Å; R722-A728 HydrophobicContact CG-CB 4.38Å; R722-A728 WeakPolarHBondContact CG-O 3.45Å; R722-A728 PolarHBondContact NE-O 3.02Å; R722-A728 PolarHBondContact NH2-O 3.29Å; F725-A728 HydrophobicContact CB-CB 3.89Å; F725-A728 WeakPolarHBondContact O-CB 3.4Å; F725-A728 PolarHBondContact O-N 3.15Å; F725-A728 VanDerWaalsContact O-N 3.12Å; A726-A728 PolarHBondContact O-N 2.85Å; A728-M751 HydrophobicContact CB-CE 4.01Å; A728-L753 HydrophobicContact CB-CD2 3.89Å
729	R	89.4	Confident	87.7	Confident	119 Å²	119	48 Å²	48	45%	0.449	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	134.4	172.4	-179.2	173.6	172.5	-174.5	-4.9	109.3	E718 G727 M751 V752	E718-R729 VanDerWaalsContact OE1-CA 3.26Å; E718-R729 WeakPolarHBondContact OE1-CA 3.38Å; E718-R729 WeakPolarHBondContact OE1-CG 3.43Å; G727-R729 PolarHBondContact O-N 2.87Å; R729-M751 WeakPolarHBondContact O-CA 3.28Å; R729-V752 PolarHBondContact N-O 3.37Å; R729-V752 PolarHBondContact O-N 3.46Å
730	L	92	Very high	87.5	Confident	6 Å²	6	44.9 Å²	44.9	3%	0.031	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	144.7	176.3	-56	-173.1	0	0	0	110.2	L714 L717 E718 I749 C750 M751	L714-L730 HydrophobicContact CD1-CB 3.52Å; L714-L730 HydrophobicContact CD1-CD1 4.4Å; L714-L730 HydrophobicContact CG-CB 4.23Å; L717-L730 HydrophobicContact CB-CD1 3.78Å; E718-L730 HydrophobicContact CB-CB 4.18Å; E718-L730 HydrophobicContact CB-CD1 3.97Å; E718-L730 HydrophobicContact CB-CG 3.96Å; E718-L730 HydrophobicContact CG-CB 4.34Å; E718-L730 HydrophobicContact CG-CG 4.15Å; E718-L730 PolarHBondContact OE1-N 2.94Å; L730-I749 HydrophobicContact CB-CG2 4.04Å; L730-I749 HydrophobicContact CD1-CG2 4.32Å; L730-I749 HydrophobicContact CD2-CG2 4.21Å; L730-I749 HydrophobicContact CG-CG2 4.43Å; L730-C750 CarbonylContact C-O 3.59Å; L730-C750 WeakPolarHBondContact CA-O 3.22Å; L730-M751 HydrophobicContact CD2-CB 3.56Å; L730-M751 HydrophobicContact CD2-CG 3.74Å; L730-M751 HydrophobicContact CD2-SD 4.24Å
731	Q	91.4	Very high	87.1	Confident	59 Å²	59	44 Å²	44	28%	0.276	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	128.6	176.3	-57.8	-172.6	32.3	0	0	109.6	C750 L816	Q731-C750 PolarHBondContact N-O 2.92Å; Q731-C750 PolarHBondContact O-N 3.43Å; Q731-L816 HydrophobicContact CB-CD2 3.85Å
732	L	92.8	Very high	86.9	Confident	14 Å²	14	44.9 Å²	44.9	7%	0.073	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	137.7	168.8	-76.1	164.1	0	0	0	109.7	R710 E711 L714 K737 L747 D748 I749	R710-L732 HydrophobicContact CB-CD1 4.25Å; E711-L732 HydrophobicContact CG-CD1 4.47Å; L714-L732 HydrophobicContact CB-CD1 4.29Å; L714-L732 HydrophobicContact CB-CG 4.32Å; L714-L732 HydrophobicContact CD1-CG 4.09Å; L714-L732 HydrophobicContact CD2-CD1 4.27Å; L714-L732 HydrophobicContact CD2-CG 4.01Å; L714-L732 HydrophobicContact CG-CG 4.36Å; L732-K737 HydrophobicContact CB-CG 3.78Å; L732-L747 HydrophobicContact CD2-CD2 3.99Å; L732-D748 WeakPolarHBondContact CA-O 3.46Å; L732-I749 HydrophobicContact CD2-CG1 3.93Å
733	F	92.6	Very high	86.5	Confident	24 Å²	24	44 Å²	44	11%	0.105	23%	0.227	C	C	.	.			trans	-130.4	-161.3	172.7	75.8	-85.1	0	0	0	110.5	S736 D748 I749 C750 A815 L816	F733-S736 PolarHBondContact O-N 3.42Å; F733-D748 VanDerWaalsContact CD1-C 3.48Å; F733-D748 HydrophobicContact CD1-CB 3.88Å; F733-D748 WeakPolarHBondContact CD1-O 3.42Å; F733-D748 HydrophobicContact CD2-CB 4.09Å; F733-D748 HydrophobicContact CE1-CB 3.86Å; F733-D748 HydrophobicContact CE2-CB 4.05Å; F733-D748 HydrophobicContact CG-CB 3.99Å; F733-D748 HydrophobicContact CZ-CB 3.94Å; F733-D748 PolarHBondContact N-O 3.08Å; F733-I749 VanDerWaalsContact CE1-C 3.42Å; F733-C750 HydrophobicContact CD1-CB 3.96Å; F733-C750 HydrophobicContact CE1-CB 4.29Å; F733-A815 HydrophobicContact CD2-CB 3.55Å; F733-A815 HydrophobicContact CE2-CB 3.6Å; F733-A815 HydrophobicContact CG-CB 4.41Å; F733-A815 HydrophobicContact CZ-CB 4.46Å; F733-L816 HydrophobicContact CB-CD2 3.75Å; F733-L816 HydrophobicContact CB-CG 4.36Å
734	G	89.4	Confident	86.2	Confident	12 Å²	12	43.2 Å²	43.2	12%	0.124	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	59.7	-138.9	165.6	0	0	0	0	0	113.2	S736 K737 N738 D748 T819	G734-S736 PolarHBondContact O-N 2.83Å; G734-K737 PolarHBondContact O-N 3.15Å; G734-K737 VanDerWaalsContact O-N 3.15Å; G734-N738 VanDerWaalsContact O-CB 3.24Å; G734-N738 WeakPolarHBondContact O-CB 3.23Å; G734-N738 PolarHBondContact O-N 3.38Å; G734-N738 PolarHBondContact O-ND2 2.86Å; G734-N738 PolarHBondContact O-OD1 2.93Å; G734-D748 WeakPolarHBondContact CA-OD2 3.48Å; G734-T819 PolarHBondContact N-OG1 3.37Å
735	S	86.8	Confident	86.5	Confident	18 Å²	18	39 Å²	39	13%	0.126	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-62.8	-27.9	-175.2	66.3	0	0	0	0	113.3	K737 G741 D748	S735-K737 VanDerWaalsContact C-N 3.26Å; S735-K737 PolarHBondContact O-N 3.12Å; S735-G741 VanDerWaalsContact O-CA 3.23Å; S735-G741 WeakPolarHBondContact O-CA 3.49Å; S735-G741 PolarHBondContact O-N 2.99Å; S735-G741 VanDerWaalsContact O-N 3.13Å; S735-D748 PolarHBondContact N-OD2 2.94Å; S735-D748 PolarHBondContact OG-OD2 3.13Å
736	S	87.4	Confident	86.8	Confident	10 Å²	10	39.9 Å²	39.9	7%	0.07	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-72.9	-13.2	178.9	-67.4	0	0	0	0	114	R710 F733 G734 D746	R710-S736 PolarHBondContact NH1-OG 2.93Å; F733-S736 PolarHBondContact O-N 3.42Å; G734-S736 PolarHBondContact O-N 2.83Å; S736-D746 PolarHBondContact OG-O 3.4Å
737	K	89.1	Confident	87.3	Confident	87 Å²	87	35.4 Å²	35.4	38%	0.378	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-137.7	-15.1	-175.8	-73.6	-60.9	-176.6	-171.8	0	115.7	E711 L732 G734 S735 G739 T819	E711-K737 WeakPolarHBondContact OE1-CE 3.22Å; E711-K737 IonicContact OE1-NZ 3.54Å; E711-K737 PolarHBondContact OE1-NZ 3.26Å; L732-K737 HydrophobicContact CB-CG 3.78Å; G734-K737 PolarHBondContact O-N 3.15Å; G734-K737 VanDerWaalsContact O-N 3.15Å; S735-K737 VanDerWaalsContact C-N 3.26Å; S735-K737 PolarHBondContact O-N 3.12Å; K737-G739 VanDerWaalsContact C-N 3.26Å; K737-G739 PolarHBondContact O-N 2.8Å; K737-T819 HydrophobicContact CB-CG2 3.48Å; K737-T819 VanDerWaalsContact CB-CG2 3.48Å
738	N	86.6	Confident	87.8	Confident	12 Å²	12	35.8 Å²	35.8	6%	0.064	18%	0.178	C	C	.	.	S	Bend	trans	-78.9	-3.1	178.8	73.5	2.5	0	0	0	114.6	G734 F740 T819 L822 A823	G734-N738 VanDerWaalsContact O-CB 3.24Å; G734-N738 WeakPolarHBondContact O-CB 3.23Å; G734-N738 PolarHBondContact O-N 3.38Å; G734-N738 PolarHBondContact O-ND2 2.86Å; G734-N738 PolarHBondContact O-OD1 2.93Å; N738-F740 HydrophobicContact CB-CD2 4.37Å; N738-F740 WeakPolarHBondContact OD1-CB 3.31Å; N738-F740 PolarHBondContact OD1-N 3Å; N738-T819 HydrophobicContact CB-CG2 4.12Å; N738-L822 HydrophobicContact CB-CB 3.84Å; N738-L822 HydrophobicContact CB-CD2 4.44Å; N738-A823 WeakPolarHBondContact O-CA 3.43Å
739	G	84.6	Confident	88.1	Confident	29 Å²	29	35.8 Å²	35.8	30%	0.299	18%	0.178	S	C	.	.	S	Bend	trans	85.8	1.3	-179.2	0	0	0	0	0	115.5	K737 Y837	K737-G739 VanDerWaalsContact C-N 3.26Å; K737-G739 PolarHBondContact O-N 2.8Å; G739-Y837 WeakPolarHBondContact O-CE2 3.5Å; G739-Y837 PolarHBondContact O-OH 2.92Å
740	F	86.6	Confident	88.2	Confident	2 Å²	2	30.1 Å²	30.1	1%	0.009	16%	0.156	C	C	.	.			trans	-117.7	19.1	-175.3	-49.4	-57.6	0	0	0	114.4	N738 L822 A826 V832 K833 C836 Y837 K840 T862	N738-F740 HydrophobicContact CB-CD2 4.37Å; N738-F740 WeakPolarHBondContact OD1-CB 3.31Å; N738-F740 PolarHBondContact OD1-N 3Å; F740-L822 HydrophobicContact CD2-CB 4.45Å; F740-L822 HydrophobicContact CD2-CD2 4.37Å; F740-L822 HydrophobicContact CE2-CB 3.91Å; F740-L822 HydrophobicContact CE2-CD2 4.28Å; F740-L822 HydrophobicContact CE2-CG 4.08Å; F740-A826 HydrophobicContact CD1-CB 4.48Å; F740-A826 HydrophobicContact CE1-CB 3.65Å; F740-A826 HydrophobicContact CE2-CB 4.33Å; F740-A826 HydrophobicContact CZ-CB 3.57Å; F740-V832 HydrophobicContact CE1-CG1 4.3Å; F740-V832 HydrophobicContact CZ-CG1 4.09Å; F740-K833 HydrophobicContact CE1-CG 4.16Å; F740-C836 HydrophobicContact CD1-CB 3.46Å; F740-C836 VanDerWaalsContact CD1-CB 3.46Å; F740-C836 HydrophobicContact CE1-CB 3.59Å; F740-C836 HydrophobicContact CG-CB 4.01Å; F740-C836 HydrophobicContact CZ-CB 4.22Å; F740-Y837 HydrophobicContact CB-CE2 4.5Å; F740-Y837 HydrophobicContact CD1-CE2 4.38Å; F740-K840 PolarHBondContact O-NZ 2.85Å; F740-T862 HydrophobicContact CD2-CG2 3.66Å; F740-T862 HydrophobicContact CE2-CG2 3.58Å; F740-T862 HydrophobicContact CZ-CG2 4.39Å
741	G	83.4	Confident	88.1	Confident	4 Å²	4	29.9 Å²	29.9	4%	0.041	16%	0.155	C	C	.	.			trans	-74.3	152.2	175.7	0	0	0	0	0	113.7	P702 S735 Y837	P702-G741 WeakPolarHBondContact CD-O 3.31Å; S735-G741 VanDerWaalsContact O-CA 3.23Å; S735-G741 WeakPolarHBondContact O-CA 3.49Å; S735-G741 PolarHBondContact O-N 2.99Å; S735-G741 VanDerWaalsContact O-N 3.13Å; G741-Y837 PolarHBondContact O-OH 3.48Å
742	F	84.6	Confident	87.9	Confident	24 Å²	24	28.7 Å²	28.7	11%	0.105	15%	0.152	C	C	.	.			trans	-98.4	163.2	162.7	-61.6	-19.6	0	0	0	109.5	R710 Q744 S745 Y837 K840 V841	R710-F742 PolarHBondContact NH2-O 3.39Å; F742-Q744 PolarHBondContact O-N 2.88Å; F742-Q744 VanDerWaalsContact O-N 3.16Å; F742-S745 PolarHBondContact N-OG 3.27Å; F742-S745 WeakPolarHBondContact O-CB 3.46Å; F742-S745 PolarHBondContact O-N 3.11Å; F742-S745 PolarHBondContact O-OG 2.89Å; F742-Y837 AromaticContact CD1-CD1 3.92Å; F742-Y837 HydrophobicContact CD1-CD1 3.92Å; F742-Y837 AromaticContact CD1-CE1 3.98Å; F742-Y837 HydrophobicContact CD1-CE1 3.98Å; F742-Y837 AromaticContact CE1-CD1 3.64Å; F742-Y837 HydrophobicContact CE1-CD1 3.64Å; F742-Y837 HydrophobicContact CE1-CE1 4.18Å; F742-Y837 HydrophobicContact CE1-CG 4.12Å; F742-K840 HydrophobicContact CD1-CD 4.13Å; F742-K840 HydrophobicContact CD2-CD 4.02Å; F742-K840 HydrophobicContact CD2-CG 4.5Å; F742-K840 HydrophobicContact CE1-CB 4.26Å; F742-K840 HydrophobicContact CE1-CD 3.7Å; F742-K840 HydrophobicContact CE1-CG 4.15Å; F742-K840 HydrophobicContact CE2-CB 4.37Å; F742-K840 HydrophobicContact CE2-CD 3.59Å; F742-K840 HydrophobicContact CE2-CG 3.63Å; F742-K840 HydrophobicContact CG-CD 4.28Å; F742-K840 HydrophobicContact CZ-CB 3.68Å; F742-K840 HydrophobicContact CZ-CD 3.43Å; F742-K840 VanDerWaalsContact CZ-CD 3.43Å; F742-K840 HydrophobicContact CZ-CG 3.42Å; F742-K840 VanDerWaalsContact CZ-CG 3.42Å; F742-V841 HydrophobicContact CE1-CG2 4.48Å; F742-V841 HydrophobicContact CE2-CG2 4.33Å; F742-V841 HydrophobicContact CZ-CG2 3.69Å
743	R	80.7	Confident	87.5	Confident	79 Å²	79	29.2 Å²	29.2	30%	0.298	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-46	-46.2	174.5	-72.3	-171.7	158.7	-174.1	-24.2	113.7	Q700 D703 E706 R710	Q700-R743 HydrophobicContact CB-CG 3.95Å; Q700-R743 WeakPolarHBondContact O-CG 3.47Å; Q700-R743 PolarHBondContact O-N 2.86Å; Q700-R743 VanDerWaalsContact OE1-CD 3.27Å; D703-R743 IonicContact OD2-NH2 2.85Å; D703-R743 PolarHBondContact OD2-NH2 3.09Å; E706-R743 WeakPolarHBondContact OE1-CD 3.25Å; E706-R743 WeakPolarHBondContact OE1-CG 3.48Å; E706-R743 IonicContact OE1-CZ 3.82Å; E706-R743 IonicContact OE1-NE 2.73Å; E706-R743 PolarHBondContact OE1-NE 2.78Å; E706-R743 IonicContact OE1-NH2 3.58Å; E706-R743 IonicContact OE2-CZ 3.7Å; E706-R743 IonicContact OE2-NE 3.98Å; E706-R743 PolarHBondContact OE2-NE 3.11Å; E706-R743 IonicContact OE2-NH2 3.04Å; E706-R743 PolarHBondContact OE2-NH2 3.29Å; R710-R743 PolarHBondContact NH2-O 2.91Å
744	Q	82.2	Confident	86.5	Confident	141 Å²	141	33.7 Å²	33.7	66%	0.659	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.8	17.8	-179.5	-58	-64.2	-2.2	0	0	114.6	F742	F742-Q744 PolarHBondContact O-N 2.88Å; F742-Q744 VanDerWaalsContact O-N 3.16Å
745	S	86.3	Confident	85.3	Confident	16 Å²	16	37 Å²	37	11%	0.112	21%	0.209	C	C	.	.			trans	-74.2	143.5	172.2	-66.5	0	0	0	0	111.9	R710 F742	R710-S745 VanDerWaalsContact CZ-O 3.27Å; R710-S745 PolarHBondContact NH1-O 3.36Å; R710-S745 PolarHBondContact NH2-O 3.46Å; F742-S745 PolarHBondContact N-OG 3.27Å; F742-S745 WeakPolarHBondContact O-CB 3.46Å; F742-S745 PolarHBondContact O-N 3.11Å; F742-S745 PolarHBondContact O-OG 2.89Å
746	D	88.4	Confident	84.2	Confident	60 Å²	60	40.8 Å²	40.8	32%	0.321	22%	0.224	S	C	.	.			trans	-50.6	156.3	179.7	-58	37.3	0	0	0	114	R710 S736 D748 K796 E805	R710-D746 PolarHBondContact NH1-O 3.02Å; S736-D746 PolarHBondContact OG-O 3.4Å; D746-D748 PolarHBondContact O-N 2.94Å; D746-K796 IonicContact OD2-NZ 3.86Å; D746-K796 PolarHBondContact OD2-NZ 2.82Å; D746-E805 WeakPolarHBondContact CA-O 3.46Å
747	L	90	Very high	82.6	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	86	171.4	-70.1	167.6	0	0	0	110.7	R710 I713 L732 I749 L804 E805 G806 D807	R710-L747 HydrophobicContact CB-CD2 3.94Å; R710-L747 HydrophobicContact CG-CD2 3.82Å; I713-L747 HydrophobicContact CB-CD1 4.48Å; I713-L747 HydrophobicContact CD1-CD1 4.04Å; I713-L747 HydrophobicContact CG2-CD1 3.87Å; L732-L747 HydrophobicContact CD2-CD2 3.99Å; L747-I749 HydrophobicContact CB-CD1 4.45Å; L747-I749 PolarHBondContact O-N 2.74Å; L747-L804 HydrophobicContact CD1-CB 4.15Å; L747-L804 HydrophobicContact CD1-CD1 4.09Å; L747-L804 HydrophobicContact CD2-CD1 4.37Å; L747-L804 HydrophobicContact CG-CB 4.41Å; L747-L804 HydrophobicContact CG-CD1 4.13Å; L747-E805 PolarHBondContact N-O 2.95Å; L747-G806 WeakPolarHBondContact O-CA 3.47Å; L747-D807 PolarHBondContact O-N 3.32Å
748	D	92.3	Very high	80.9	Confident	34 Å²	34	48.7 Å²	48.7	18%	0.182	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	108.7	171.1	-57.7	-64.6	0	0	0	110.8	L732 F733 G734 S735 D746	L732-D748 WeakPolarHBondContact CA-O 3.46Å; F733-D748 VanDerWaalsContact CD1-C 3.48Å; F733-D748 HydrophobicContact CD1-CB 3.88Å; F733-D748 WeakPolarHBondContact CD1-O 3.42Å; F733-D748 HydrophobicContact CD2-CB 4.09Å; F733-D748 HydrophobicContact CE1-CB 3.86Å; F733-D748 HydrophobicContact CE2-CB 4.05Å; F733-D748 HydrophobicContact CG-CB 3.99Å; F733-D748 HydrophobicContact CZ-CB 3.94Å; F733-D748 PolarHBondContact N-O 3.08Å; G734-D748 WeakPolarHBondContact CA-OD2 3.48Å; S735-D748 PolarHBondContact N-OD2 2.94Å; S735-D748 PolarHBondContact OG-OD2 3.13Å; D746-D748 PolarHBondContact O-N 2.94Å
749	I	93.7	Very high	79.3	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	128.5	-177.6	-62.4	170.9	0	0	0	111.8	L714 L717 L730 L732 F733 L747 F797 D807 I808 S809	L714-I749 HydrophobicContact CD1-CD1 4.19Å; L714-I749 HydrophobicContact CD1-CG1 4.11Å; L714-I749 HydrophobicContact CD1-CG2 4.02Å; L717-I749 HydrophobicContact CD1-CD1 3.75Å; L730-I749 HydrophobicContact CB-CG2 4.04Å; L730-I749 HydrophobicContact CD1-CG2 4.32Å; L730-I749 HydrophobicContact CD2-CG2 4.21Å; L730-I749 HydrophobicContact CG-CG2 4.43Å; L732-I749 HydrophobicContact CD2-CG1 3.93Å; F733-I749 VanDerWaalsContact CE1-C 3.42Å; L747-I749 HydrophobicContact CB-CD1 4.45Å; L747-I749 PolarHBondContact O-N 2.74Å; I749-F797 HydrophobicContact CD1-CE1 4.32Å; I749-F797 HydrophobicContact CD1-CZ 4.16Å; I749-D807 PolarHBondContact N-O 3.27Å; I749-I808 HydrophobicContact CB-CG1 4.15Å; I749-I808 HydrophobicContact CD1-CG1 4.41Å; I749-I808 HydrophobicContact CG2-CG1 4.24Å; I749-I808 HydrophobicContact CG2-CG2 4.28Å; I749-I808 WeakPolarHBondContact O-CA 3.3Å; I749-S809 PolarHBondContact O-N 3.41Å; I749-S809 PolarHBondContact O-OG 3.39Å; I749-S809 VanDerWaalsContact O-OG 3.07Å
750	C	91.9	Very high	77.9	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	127.1	170.4	-179.7	0	0	0	0	110	L730 Q731 F733 N812 L816	L730-C750 CarbonylContact C-O 3.59Å; L730-C750 WeakPolarHBondContact CA-O 3.22Å; Q731-C750 PolarHBondContact N-O 2.92Å; Q731-C750 PolarHBondContact O-N 3.43Å; F733-C750 HydrophobicContact CD1-CB 3.96Å; F733-C750 HydrophobicContact CE1-CB 4.29Å; C750-N812 PolarHBondContact SG-N 3.48Å; C750-L816 HydrophobicContact CB-CD1 4.13Å; C750-L816 HydrophobicContact CB-CD2 4.45Å; C750-L816 HydrophobicContact CB-CG 4.3Å
751	M	90.2	Very high	76.1	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	128.4	173.9	175.6	172.6	165.1	0	0	110.5	V721 F725 A728 R729 L730 L753 L771 I808 S809 L810 Y811	V721-M751 HydrophobicContact CG1-CE 3.8Å; V721-M751 HydrophobicContact CG1-SD 3.91Å; F725-M751 HydrophobicContact CB-CE 4.19Å; F725-M751 HydrophobicContact CD1-CE 4.44Å; F725-M751 HydrophobicContact CD2-CE 4.28Å; F725-M751 HydrophobicContact CG-CE 4.07Å; A728-M751 HydrophobicContact CB-CE 4.01Å; R729-M751 WeakPolarHBondContact O-CA 3.28Å; L730-M751 HydrophobicContact CD2-CB 3.56Å; L730-M751 HydrophobicContact CD2-CG 3.74Å; L730-M751 HydrophobicContact CD2-SD 4.24Å; M751-L753 HydrophobicContact CE-CD2 3.64Å; M751-L771 HydrophobicContact SD-CD1 4.22Å; M751-L771 HydrophobicContact SD-CD2 3.98Å; M751-I808 HydrophobicContact CB-CG2 3.86Å; M751-S809 WeakPolarHBondContact CB-O 3.47Å; M751-S809 PolarHBondContact N-O 3.27Å; M751-L810 HydrophobicContact CB-CD2 4.01Å; M751-L810 HydrophobicContact CE-CD2 4.33Å; M751-L810 HydrophobicContact CG-CD2 3.85Å; M751-L810 WeakPolarHBondContact O-CA 3.31Å; M751-L810 HydrophobicContact SD-CD2 3.98Å; M751-Y811 PolarHBondContact O-N 3.48Å
752	V	87.3	Confident	74.9	Confident	35 Å²	35	64.8 Å²	64.8	21%	0.212	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	147.7	177.6	-177.9	0	0	0	0	108.3	R729 Y811	R729-V752 PolarHBondContact N-O 3.37Å; R729-V752 PolarHBondContact O-N 3.46Å; V752-Y811 HydrophobicContact CG1-CD1 4.33Å; V752-Y811 HydrophobicContact CG1-CE1 3.87Å
753	L	83	Confident	74.3	Confident	24 Å²	24	67.9 Å²	67.9	13%	0.126	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	118.7	172.9	-55.4	173.6	0	0	0	109.9	F725 A728 M751 G755 K756 I767 Y811	F725-L753 HydrophobicContact CB-CD2 4.32Å; A728-L753 HydrophobicContact CB-CD2 3.89Å; M751-L753 HydrophobicContact CE-CD2 3.64Å; L753-G755 PolarHBondContact O-N 3.08Å; L753-K756 PolarHBondContact O-N 3.41Å; L753-I767 HydrophobicContact CD1-CD1 4.05Å; L753-Y811 WeakPolarHBondContact CB-OH 3.35Å; L753-Y811 PolarHBondContact N-OH 2.82Å; L753-Y811 PolarHBondContact O-OH 3.07Å
754	E	72.3	Confident	74	Confident	118 Å²	118	65 Å²	65	55%	0.551	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	130.4	176.6	-68.1	170	175.2	0	0	110.5	G727	G727-E754 WeakPolarHBondContact O-CB 3.49Å; G727-E754 WeakPolarHBondContact O-CG 3.21Å; G727-E754 PolarHBondContact O-N 2.85Å
755	G	64.4	Low	73.9	Confident	81 Å²	81	61.7 Å²	61.7	84%	0.835	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.9	6.8	-175.3	0	0	0	0	0	115.6	L753	L753-G755 PolarHBondContact O-N 3.08Å
756	K	64.1	Low	73.8	Confident	98 Å²	98	65 Å²	65	43%	0.426	36%	0.355	S	S	.	.			trans	-133.1	118.9	165.6	-74.8	-160.2	170.6	-155.5	0	110.4	L753 D761 V762 Y811	L753-K756 PolarHBondContact O-N 3.41Å; K756-D761 PolarHBondContact NZ-O 3.2Å; K756-V762 HydrophobicContact CD-CG2 3.73Å; K756-Y811 WeakPolarHBondContact CB-OH 3.46Å; K756-Y811 WeakPolarHBondContact O-CE1 3.11Å; K756-Y811 PolarHBondContact O-OH 3.21Å
757	E	53.7	Low	73.6	Confident	189 Å²	189	63.6 Å²	63.6	88%	0.883	35%	0.348	S	S	*	.			trans	-101.7	-12.9	-168.4	-61.1	-174.2	156.1	0	0	114.6
758	T	51.8	Low	73.5	Confident	74 Å²	74	63.6 Å²	63.6	45%	0.454	35%	0.347	S	S	.	.			trans	-133.6	159.5	-178.2	54.8	0	0	0	0	112.7
759	M	53.8	Low	73.2	Confident	85 Å²	85	66.2 Å²	66.2	42%	0.419	36%	0.357	S	S	.	.	S	Bend	trans	-76.6	-29.5	-178	-71	-172.8	67.3	0	0	114.4	D761 V762 Y811	M759-D761 VanDerWaalsContact C-N 3.27Å; M759-D761 PolarHBondContact O-N 2.66Å; M759-V762 WeakPolarHBondContact O-CB 3.39Å; M759-V762 PolarHBondContact O-N 3.05Å; M759-Y811 HydrophobicContact CG-CG 4.37Å
760	D	54.4	Low	72.9	Confident	155 Å²	155	66.7 Å²	66.7	83%	0.829	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-28.5	-166.6	-57.3	-49.5	0	0	0	114	V762	D760-V762 VanDerWaalsContact C-N 3.27Å; D760-V762 PolarHBondContact O-N 3.04Å
761	D	49	Very low	72.8	Confident	129 Å²	129	66.7 Å²	66.7	69%	0.69	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	16.2	176.1	-81.1	-37.3	0	0	0	113.5	K756 M759	K756-D761 PolarHBondContact NZ-O 3.2Å; M759-D761 VanDerWaalsContact C-N 3.27Å; M759-D761 PolarHBondContact O-N 2.66Å
762	V	58.9	Low	72.8	Confident	16 Å²	16	66.8 Å²	66.8	10%	0.097	36%	0.363	C	S	.	.			trans	-136.6	111.8	-169.9	-170.5	0	0	0	0	112.7	K756 M759 D760 C764 I767 Y811	K756-V762 HydrophobicContact CD-CG2 3.73Å; M759-V762 WeakPolarHBondContact O-CB 3.39Å; M759-V762 PolarHBondContact O-N 3.05Å; D760-V762 VanDerWaalsContact C-N 3.27Å; D760-V762 PolarHBondContact O-N 3.04Å; V762-C764 PolarHBondContact O-N 3.31Å; V762-C764 PolarHBondContact O-SG 3.39Å; V762-I767 HydrophobicContact CG1-CD1 3.47Å; V762-I767 VanDerWaalsContact CG1-CD1 3.47Å; V762-I767 HydrophobicContact CG1-CG1 4.49Å; V762-Y811 HydrophobicContact CG1-CE2 4.5Å; V762-Y811 HydrophobicContact CG2-CE2 4.45Å
763	D	71.4	Confident	72.9	Confident	90 Å²	90	73.2 Å²	73.2	48%	0.481	38%	0.383	S	S	.	.			trans	-68.3	80.2	167.8	-174.5	-19.8	0	0	0	110.8	I765 N766 I767	D763-I765 PolarHBondContact O-N 3.29Å; D763-I765 PolarHBondContact OD1-N 3.02Å; D763-N766 HydrophobicContact CB-CB 4.43Å; D763-N766 PolarHBondContact O-N 3.48Å; D763-N766 WeakPolarHBondContact OD1-CB 3.25Å; D763-N766 PolarHBondContact OD1-N 2.8Å; D763-N766 WeakPolarHBondContact OD2-CB 3.43Å; D763-N766 PolarHBondContact OD2-ND2 3.01Å; D763-I767 WeakPolarHBondContact O-CG1 3.46Å; D763-I767 PolarHBondContact O-N 2.69Å
764	C	75.4	Confident	73.2	Confident	18 Å²	18	73.9 Å²	73.9	12%	0.122	39%	0.386	C	S	.	.	H	α-helix	trans	-61.3	-32	-176	-68.7	0	0	0	0	111.8	V762 I767 I768 L810	V762-C764 PolarHBondContact O-N 3.31Å; V762-C764 PolarHBondContact O-SG 3.39Å; C764-I767 PolarHBondContact O-N 3.06Å; C764-I768 WeakPolarHBondContact O-CB 3.34Å; C764-I768 VanDerWaalsContact O-CG1 3.25Å; C764-I768 WeakPolarHBondContact O-CG1 3.32Å; C764-I768 PolarHBondContact O-N 3.05Å; C764-L810 HydrophobicContact CB-CD1 3.98Å; C764-L810 WeakPolarHBondContact O-CD1 3.32Å
765	I	80.3	Confident	74.1	Confident	72 Å²	72	68.3 Å²	68.3	37%	0.369	36%	0.36	S	S	.	.	H	α-helix	trans	-66.9	-46.1	177.8	-66.9	176.1	0	0	0	110.4	D763 I768 K769 T788	D763-I765 PolarHBondContact O-N 3.29Å; D763-I765 PolarHBondContact OD1-N 3.02Å; I765-I768 PolarHBondContact O-N 3.15Å; I765-K769 HydrophobicContact CG2-CD 4Å; I765-K769 VanDerWaalsContact CG2-CE 3.45Å; I765-K769 WeakPolarHBondContact O-CB 3.45Å; I765-K769 VanDerWaalsContact O-CG 3.26Å; I765-K769 WeakPolarHBondContact O-CG 3.43Å; I765-K769 PolarHBondContact O-N 3.37Å; I765-T788 HydrophobicContact CG2-CG2 4.2Å
766	N	83	Confident	75.3	Confident	84 Å²	84	70.9 Å²	70.9	45%	0.449	35%	0.348	S	S	.	.	H	α-helix	trans	-74.7	-26.2	177.7	-77.4	-36.2	0	0	0	113.2	D763 G770	D763-N766 HydrophobicContact CB-CB 4.43Å; D763-N766 PolarHBondContact O-N 3.48Å; D763-N766 WeakPolarHBondContact OD1-CB 3.25Å; D763-N766 PolarHBondContact OD1-N 2.8Å; D763-N766 WeakPolarHBondContact OD2-CB 3.43Å; D763-N766 PolarHBondContact OD2-ND2 3.01Å; N766-G770 PolarHBondContact O-N 3.34Å
767	I	85.1	Confident	76.6	Confident	32 Å²	32	72.8 Å²	72.8	16%	0.164	36%	0.357	C	S	.	.	H	α-helix	trans	-68.5	-45.3	167.4	-63.8	-173.5	0	0	0	111.1	F725 L753 V762 D763 C764 K769 G770 L771 L810	F725-I767 HydrophobicContact CE1-CG2 4.18Å; L753-I767 HydrophobicContact CD1-CD1 4.05Å; V762-I767 HydrophobicContact CG1-CD1 3.47Å; V762-I767 VanDerWaalsContact CG1-CD1 3.47Å; V762-I767 HydrophobicContact CG1-CG1 4.49Å; D763-I767 WeakPolarHBondContact O-CG1 3.46Å; D763-I767 PolarHBondContact O-N 2.69Å; C764-I767 PolarHBondContact O-N 3.06Å; I767-K769 PolarHBondContact O-N 3.3Å; I767-G770 CarbonylContact O-C 3.54Å; I767-G770 WeakPolarHBondContact O-CA 3.46Å; I767-G770 PolarHBondContact O-N 3.23Å; I767-L771 VanDerWaalsContact O-CB 3.31Å; I767-L771 WeakPolarHBondContact O-CB 3.34Å; I767-L771 PolarHBondContact O-N 3.23Å; I767-L810 HydrophobicContact CB-CD1 3.77Å; I767-L810 HydrophobicContact CG2-CD1 3.66Å; I767-L810 HydrophobicContact CG2-CD2 3.93Å; I767-L810 HydrophobicContact CG2-CG 4.43Å
768	I	87	Confident	78.3	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-58.3	-45.5	174.2	-74.4	-69.6	0	0	0	111.2	C764 I765 G770 L771 A772 P786 T788 P793 V795 L810	C764-I768 WeakPolarHBondContact O-CB 3.34Å; C764-I768 VanDerWaalsContact O-CG1 3.25Å; C764-I768 WeakPolarHBondContact O-CG1 3.32Å; C764-I768 PolarHBondContact O-N 3.05Å; I765-I768 PolarHBondContact O-N 3.15Å; I768-G770 VanDerWaalsContact C-N 3.31Å; I768-G770 PolarHBondContact O-N 2.98Å; I768-L771 PolarHBondContact O-N 3.27Å; I768-A772 WeakPolarHBondContact O-CB 3.35Å; I768-A772 PolarHBondContact O-N 3.27Å; I768-P786 HydrophobicContact CG2-CB 3.92Å; I768-T788 HydrophobicContact CB-CG2 4.34Å; I768-T788 HydrophobicContact CG2-CG2 3.6Å; I768-P793 HydrophobicContact CG1-CB 4.11Å; I768-V795 HydrophobicContact CD1-CG2 4.01Å; I768-V795 HydrophobicContact CG2-CG2 3.8Å; I768-L810 HydrophobicContact CD1-CD1 4.1Å; I768-L810 HydrophobicContact CD1-CG 4.04Å; I768-L810 HydrophobicContact CG1-CD1 3.79Å; I768-L810 HydrophobicContact CG1-CG 4.28Å
769	K	86.3	Confident	80.1	Confident	90 Å²	90	65.7 Å²	65.7	39%	0.391	33%	0.327	S	S	.	.	H	α-helix	trans	-65.2	-30.8	173.4	-69.5	167.4	-178.5	171.4	0	112.8	I765 I767 R773 T788	I765-K769 HydrophobicContact CG2-CD 4Å; I765-K769 VanDerWaalsContact CG2-CE 3.45Å; I765-K769 WeakPolarHBondContact O-CB 3.45Å; I765-K769 VanDerWaalsContact O-CG 3.26Å; I765-K769 WeakPolarHBondContact O-CG 3.43Å; I765-K769 PolarHBondContact O-N 3.37Å; I767-K769 PolarHBondContact O-N 3.3Å; K769-R773 WeakPolarHBondContact O-CG 3.44Å; K769-R773 PolarHBondContact O-N 3.46Å; K769-R773 PolarHBondContact O-NE 2.86Å; K769-T788 HydrophobicContact CG-CG2 4.38Å
770	G	87.6	Confident	81.7	Confident	10 Å²	10	62.1 Å²	62.1	10%	0.103	31%	0.312	C	S	.	.	H	α-helix	trans	-68.7	-54	172.7	0	0	0	0	0	111.8	N766 I767 I768 A772 R773 Q774	N766-G770 PolarHBondContact O-N 3.34Å; I767-G770 CarbonylContact O-C 3.54Å; I767-G770 WeakPolarHBondContact O-CA 3.46Å; I767-G770 PolarHBondContact O-N 3.23Å; I768-G770 VanDerWaalsContact C-N 3.31Å; I768-G770 PolarHBondContact O-N 2.98Å; G770-A772 PolarHBondContact O-N 3.4Å; G770-R773 WeakPolarHBondContact O-CB 3.28Å; G770-R773 PolarHBondContact O-N 2.86Å; G770-Q774 WeakPolarHBondContact O-CG 3.47Å; G770-Q774 PolarHBondContact O-N 3.04Å; G770-Q774 VanDerWaalsContact O-N 3.09Å
771	L	89.2	Confident	83.5	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-54.8	-49.6	177.7	179.2	63.7	0	0	0	111.2	V721 F725 M751 I767 I768 R773 Q774 L775 V795 I808	V721-L771 HydrophobicContact CG1-CD1 4.21Å; V721-L771 HydrophobicContact CG2-CD1 3.77Å; F725-L771 HydrophobicContact CE2-CB 4.47Å; F725-L771 HydrophobicContact CE2-CD1 4.37Å; M751-L771 HydrophobicContact SD-CD1 4.22Å; M751-L771 HydrophobicContact SD-CD2 3.98Å; I767-L771 VanDerWaalsContact O-CB 3.31Å; I767-L771 WeakPolarHBondContact O-CB 3.34Å; I767-L771 PolarHBondContact O-N 3.23Å; I768-L771 PolarHBondContact O-N 3.27Å; L771-R773 VanDerWaalsContact C-N 3.29Å; L771-R773 PolarHBondContact O-N 3.4Å; L771-Q774 PolarHBondContact O-N 3.13Å; L771-L775 HydrophobicContact CD1-CD1 3.97Å; L771-L775 HydrophobicContact CD1-CD2 4.42Å; L771-L775 HydrophobicContact CD1-CG 4.01Å; L771-L775 HydrophobicContact CD2-CD1 4.39Å; L771-L775 HydrophobicContact CG-CD1 3.75Å; L771-L775 HydrophobicContact CG-CG 4.22Å; L771-L775 WeakPolarHBondContact O-CG 3.16Å; L771-L775 PolarHBondContact O-N 2.93Å; L771-V795 HydrophobicContact CD2-CG2 4.1Å; L771-V795 HydrophobicContact CG-CG2 4.36Å; L771-I808 HydrophobicContact CD2-CB 4.12Å; L771-I808 HydrophobicContact CD2-CD1 4.44Å; L771-I808 HydrophobicContact CD2-CG2 3.74Å
772	A	90.9	Very high	85.5	Confident	3 Å²	3	54.8 Å²	54.8	3%	0.025	26%	0.263	C	S	.	.	H	α-helix	trans	-59.3	-35.5	176.3	0	0	0	0	0	113.3	I768 G770 Q774 K776 I784 P786 V795	I768-A772 WeakPolarHBondContact O-CB 3.35Å; I768-A772 PolarHBondContact O-N 3.27Å; G770-A772 PolarHBondContact O-N 3.4Å; A772-Q774 VanDerWaalsContact C-N 3.34Å; A772-K776 VanDerWaalsContact O-CG 3.26Å; A772-K776 WeakPolarHBondContact O-CG 3.41Å; A772-K776 PolarHBondContact O-N 3.35Å; A772-I784 HydrophobicContact CB-CG2 4.1Å; A772-P786 HydrophobicContact CB-CB 3.93Å; A772-P786 HydrophobicContact CB-CG 3.96Å; A772-V795 HydrophobicContact CB-CG1 3.99Å; A772-V795 HydrophobicContact CB-CG2 4.06Å
773	R	89.6	Confident	86.9	Confident	169 Å²	169	59.1 Å²	59.1	64%	0.638	29%	0.286	S	S	*	.	H	α-helix	trans	-69.7	-27.9	173.7	-75.9	178.7	-69.3	166.7	-1.7	113.1	K769 G770 L771	K769-R773 WeakPolarHBondContact O-CG 3.44Å; K769-R773 PolarHBondContact O-N 3.46Å; K769-R773 PolarHBondContact O-NE 2.86Å; G770-R773 WeakPolarHBondContact O-CB 3.28Å; G770-R773 PolarHBondContact O-N 2.86Å; L771-R773 VanDerWaalsContact C-N 3.29Å; L771-R773 PolarHBondContact O-N 3.4Å
774	Q	89.5	Confident	87.8	Confident	39 Å²	39	55.7 Å²	55.7	18%	0.182	27%	0.267	C	S	.	.	H	α-helix	trans	-82.2	-47.2	175.9	-58.6	-64	6.7	0	0	111.7	F720 Q724 F725 G770 L771 A772 K776 K777	F720-Q774 HydrophobicContact CE1-CB 4.44Å; F720-Q774 WeakPolarHBondContact CE1-O 3.14Å; F720-Q774 WeakPolarHBondContact CZ-O 3.22Å; Q724-Q774 HydrophobicContact CB-CG 4.13Å; Q724-Q774 HydrophobicContact CG-CB 4.43Å; Q724-Q774 HydrophobicContact CG-CG 4.02Å; F725-Q774 HydrophobicContact CE2-CG 4.25Å; G770-Q774 WeakPolarHBondContact O-CG 3.47Å; G770-Q774 PolarHBondContact O-N 3.04Å; G770-Q774 VanDerWaalsContact O-N 3.09Å; L771-Q774 PolarHBondContact O-N 3.13Å; A772-Q774 VanDerWaalsContact C-N 3.34Å; Q774-K776 PolarHBondContact O-N 3.4Å; Q774-K776 VanDerWaalsContact O-N 3.16Å; Q774-K777 VanDerWaalsContact O-CB 3.31Å; Q774-K777 WeakPolarHBondContact O-CB 3.48Å; Q774-K777 PolarHBondContact O-N 2.82Å
775	L	91	Very high	88.4	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-57.2	-31.1	177.9	-67.9	171.6	0	0	0	112.2	L717 F720 V721 L771 K777 H778 L781 I784 V795 I808	L717-L775 HydrophobicContact CD2-CD2 4.31Å; F720-L775 HydrophobicContact CD1-CD2 4.28Å; F720-L775 HydrophobicContact CE1-CD2 4.41Å; V721-L775 HydrophobicContact CG2-CD2 4.39Å; L771-L775 HydrophobicContact CD1-CD1 3.97Å; L771-L775 HydrophobicContact CD1-CD2 4.42Å; L771-L775 HydrophobicContact CD1-CG 4.01Å; L771-L775 HydrophobicContact CD2-CD1 4.39Å; L771-L775 HydrophobicContact CG-CD1 3.75Å; L771-L775 HydrophobicContact CG-CG 4.22Å; L771-L775 WeakPolarHBondContact O-CG 3.16Å; L771-L775 PolarHBondContact O-N 2.93Å; L775-K777 PolarHBondContact O-N 3.39Å; L775-H778 VanDerWaalsContact O-CB 3.24Å; L775-H778 WeakPolarHBondContact O-CB 3.42Å; L775-H778 PolarHBondContact O-N 3.37Å; L775-L781 HydrophobicContact CB-CD1 4.09Å; L775-L781 HydrophobicContact CD2-CD1 3.86Å; L775-L781 HydrophobicContact CG-CD1 4.47Å; L775-I784 HydrophobicContact CB-CD1 3.82Å; L775-I784 HydrophobicContact CB-CG1 4.44Å; L775-I784 HydrophobicContact CB-CG2 4.32Å; L775-I784 WeakPolarHBondContact O-CD1 3.32Å; L775-V795 HydrophobicContact CD1-CB 4.48Å; L775-V795 HydrophobicContact CD1-CG1 3.99Å; L775-I808 HydrophobicContact CD1-CD1 3.95Å
776	K	90.1	Very high	88.9	Confident	136 Å²	136	56.6 Å²	56.6	59%	0.591	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-12.4	173.9	-80.2	176.4	-177.7	-172.2	0	114.3	A772 Q774 I784	A772-K776 VanDerWaalsContact O-CG 3.26Å; A772-K776 WeakPolarHBondContact O-CG 3.41Å; A772-K776 PolarHBondContact O-N 3.35Å; Q774-K776 PolarHBondContact O-N 3.4Å; Q774-K776 VanDerWaalsContact O-N 3.16Å; K776-I784 HydrophobicContact CB-CD1 4.48Å; K776-I784 VanDerWaalsContact CE-O 3.31Å; K776-I784 WeakPolarHBondContact CE-O 3.5Å; K776-I784 HydrophobicContact CG-CB 4Å; K776-I784 HydrophobicContact CG-CD1 4.01Å; K776-I784 HydrophobicContact CG-CG2 4.08Å
777	K	90.5	Very high	88.9	Confident	138 Å²	138	55 Å²	55	60%	0.6	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-4.6	173.1	-50.1	170.1	-174.5	171	0	112.8	F720 Q774 L775	F720-K777 HydrophobicContact CZ-CB 4.26Å; Q774-K777 VanDerWaalsContact O-CB 3.31Å; Q774-K777 WeakPolarHBondContact O-CB 3.48Å; Q774-K777 PolarHBondContact O-N 2.82Å; L775-K777 PolarHBondContact O-N 3.39Å
778	H	90.2	Very high	88.9	Confident	11 Å²	11	55.5 Å²	55.5	5%	0.051	27%	0.269	C	S	.	.			trans	-76	126.4	-179.4	-161.3	-107.7	0	0	0	110.6	D716 F720 L775 G780 L781	D716-H778 IonicContact OD1-NE2 3.49Å; D716-H778 IonicContact OD2-CE1 2.82Å; F720-H778 AromaticContact CD1-CD2 3.94Å; F720-H778 AromaticContact CD2-CD2 3.52Å; F720-H778 HydrophobicContact CE1-CB 4.23Å; F720-H778 AromaticContact CE2-CD2 3.9Å; F720-H778 AromaticContact CG-CD2 3.52Å; F720-H778 HydrophobicContact CZ-CB 4.23Å; L775-H778 VanDerWaalsContact O-CB 3.24Å; L775-H778 WeakPolarHBondContact O-CB 3.42Å; L775-H778 PolarHBondContact O-N 3.37Å; H778-G780 VanDerWaalsContact C-N 3.27Å; H778-G780 PolarHBondContact O-N 3.43Å; H778-L781 HydrophobicContact CB-CB 4.23Å; H778-L781 HydrophobicContact CB-CD1 3.89Å; H778-L781 HydrophobicContact CB-CG 3.92Å; H778-L781 PolarHBondContact O-N 3.33Å
779	P	88.1	Confident	88.5	Confident	102 Å²	102	60.8 Å²	60.8	66%	0.662	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-34.4	-174.6	24.2	-33.6	0	0	0	112.6	R782	P779-R782 PolarHBondContact O-NH1 3.45Å
780	G	88.7	Confident	87.9	Confident	10 Å²	10	58.8 Å²	58.8	10%	0.103	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	2	-177.1	0	0	0	0	0	116.5	H778 H799 L800	H778-G780 VanDerWaalsContact C-N 3.27Å; H778-G780 PolarHBondContact O-N 3.43Å; G780-H799 PolarHBondContact O-CD2 2.87Å; G780-L800 WeakPolarHBondContact O-CB 3.37Å; G780-L800 PolarHBondContact O-N 3.17Å
781	L	92.3	Very high	87.2	Confident	5 Å²	5	65.3 Å²	65.3	3%	0.026	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	148.7	-175.9	-61.8	-175.8	0	0	0	113.7	L717 L775 H778 I784 F797 Y798 H799	L717-L781 HydrophobicContact CD2-CD1 3.96Å; L717-L781 HydrophobicContact CD2-CD2 4.45Å; L775-L781 HydrophobicContact CB-CD1 4.09Å; L775-L781 HydrophobicContact CD2-CD1 3.86Å; L775-L781 HydrophobicContact CG-CD1 4.47Å; H778-L781 HydrophobicContact CB-CB 4.23Å; H778-L781 HydrophobicContact CB-CD1 3.89Å; H778-L781 HydrophobicContact CB-CG 3.92Å; H778-L781 PolarHBondContact O-N 3.33Å; L781-I784 HydrophobicContact CB-CD1 3.77Å; L781-I784 HydrophobicContact CB-CG1 4.35Å; L781-I784 HydrophobicContact CD1-CD1 4.18Å; L781-F797 HydrophobicContact CD1-CB 4.42Å; L781-F797 HydrophobicContact CD1-CG 4.39Å; L781-F797 HydrophobicContact CD2-CB 4.48Å; L781-F797 HydrophobicContact CD2-CD2 3.48Å; L781-F797 VanDerWaalsContact CD2-CD2 3.48Å; L781-F797 HydrophobicContact CD2-CE2 3.93Å; L781-F797 HydrophobicContact CD2-CG 4.13Å; L781-Y798 CarbonylContact C-O 3.56Å; L781-Y798 WeakPolarHBondContact CA-O 3.42Å; L781-H799 HydrophobicContact CD2-CB 4.25Å
782	R	90.7	Very high	86.8	Confident	126 Å²	126	68 Å²	68	48%	0.475	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	175.3	170	-67.9	-61.4	-179.3	-92.5	1.3	111.3	P779 I784 Y798 L800	P779-R782 PolarHBondContact O-NH1 3.45Å; R782-I784 PolarHBondContact O-N 3.07Å; R782-I784 VanDerWaalsContact O-N 3.08Å; R782-Y798 PolarHBondContact N-O 2.76Å; R782-Y798 PolarHBondContact O-N 3.12Å; R782-L800 HydrophobicContact CG-CD1 3.92Å; R782-L800 HydrophobicContact CG-CD2 3.72Å; R782-L800 HydrophobicContact CG-CG 3.86Å
783	N	87.9	Confident	86.4	Confident	106 Å²	106	69.3 Å²	69.3	57%	0.567	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	53	30.6	173.3	-61	-3.7	0	0	0	115.5	L785	N783-L785 PolarHBondContact O-N 2.86Å; N783-L785 VanDerWaalsContact O-N 3.13Å
784	I	90.9	Very high	86.5	Confident	18 Å²	18	62.7 Å²	62.7	9%	0.092	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	111.8	-174.2	-67.3	154.6	0	0	0	111.5	A772 L775 K776 L781 R782 V795 K796 F797	A772-I784 HydrophobicContact CB-CG2 4.1Å; L775-I784 HydrophobicContact CB-CD1 3.82Å; L775-I784 HydrophobicContact CB-CG1 4.44Å; L775-I784 HydrophobicContact CB-CG2 4.32Å; L775-I784 WeakPolarHBondContact O-CD1 3.32Å; K776-I784 HydrophobicContact CB-CD1 4.48Å; K776-I784 VanDerWaalsContact CE-O 3.31Å; K776-I784 WeakPolarHBondContact CE-O 3.5Å; K776-I784 HydrophobicContact CG-CB 4Å; K776-I784 HydrophobicContact CG-CD1 4.01Å; K776-I784 HydrophobicContact CG-CG2 4.08Å; L781-I784 HydrophobicContact CB-CD1 3.77Å; L781-I784 HydrophobicContact CB-CG1 4.35Å; L781-I784 HydrophobicContact CD1-CD1 4.18Å; R782-I784 PolarHBondContact O-N 3.07Å; R782-I784 VanDerWaalsContact O-N 3.08Å; I784-V795 HydrophobicContact CG2-CG1 3.68Å; I784-K796 WeakPolarHBondContact CA-O 3.24Å; I784-F797 HydrophobicContact CG1-CB 3.84Å
785	L	88	Confident	86.6	Confident	64 Å²	64	60.8 Å²	60.8	34%	0.335	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	108.1	-172.6	179.3	64.5	0	0	0	110.2	N783 I787 K796 P1049	N783-L785 PolarHBondContact O-N 2.86Å; N783-L785 VanDerWaalsContact O-N 3.13Å; L785-I787 HydrophobicContact CD2-CD1 4.31Å; L785-I787 HydrophobicContact CD2-CG1 4.23Å; L785-I787 HydrophobicContact CG-CG1 4.1Å; L785-I787 PolarHBondContact O-N 3.2Å; L785-K796 PolarHBondContact N-O 2.95Å; L785-K796 PolarHBondContact O-N 3.45Å; L785-P1049 HydrophobicContact CD1-CB 4.3Å; L785-P1049 HydrophobicContact CD1-CG 3.99Å; L785-P1049 HydrophobicContact CD2-CB 4.32Å; L785-P1049 HydrophobicContact CD2-CG 3.93Å
786	P	89.3	Confident	86.7	Confident	45 Å²	45	62.8 Å²	62.8	29%	0.292	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	121.7	169.2	29.6	-30.6	0	0	0	110.1	I768 A772 I794 V795	I768-P786 HydrophobicContact CG2-CB 3.92Å; A772-P786 HydrophobicContact CB-CB 3.93Å; A772-P786 HydrophobicContact CB-CG 3.96Å; P786-I794 WeakPolarHBondContact CA-O 3.39Å; P786-V795 HydrophobicContact CB-CG2 4.49Å
787	I	84.6	Confident	86.8	Confident	52 Å²	52	56.5 Å²	56.5	27%	0.267	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	93.3	174.2	-54.9	179.4	0	0	0	107.1	L785 A790 P793 I794 K796	L785-I787 HydrophobicContact CD2-CD1 4.31Å; L785-I787 HydrophobicContact CD2-CG1 4.23Å; L785-I787 HydrophobicContact CG-CG1 4.1Å; L785-I787 PolarHBondContact O-N 3.2Å; I787-A790 HydrophobicContact CG2-CB 4.25Å; I787-P793 WeakPolarHBondContact O-CA 3.45Å; I787-I794 HydrophobicContact CB-CG1 3.97Å; I787-I794 HydrophobicContact CD1-CD1 4.33Å; I787-I794 PolarHBondContact N-O 3.11Å; I787-I794 PolarHBondContact O-N 3.41Å; I787-I794 VanDerWaalsContact O-N 3.08Å; I787-K796 HydrophobicContact CD1-CD 4.26Å; I787-K796 HydrophobicContact CD1-CG 4.08Å
788	T	84.8	Confident	86.9	Confident	41 Å²	41	53.8 Å²	53.8	25%	0.252	29%	0.288	S	S	.	.			trans	-95.6	4.1	-175.6	57.2	0	0	0	0	114.2	I765 I768 K769	I765-T788 HydrophobicContact CG2-CG2 4.2Å; I768-T788 HydrophobicContact CB-CG2 4.34Å; I768-T788 HydrophobicContact CG2-CG2 3.6Å; K769-T788 HydrophobicContact CG-CG2 4.38Å
789	T	78.3	Confident	87	Confident	112 Å²	112	53.5 Å²	53.5	69%	0.687	29%	0.287	S	S	*	.	S	Bend	trans	-105.8	-1.8	-175.9	51.4	0	0	0	0	114.2
790	A	74.1	Confident	87	Confident	48 Å²	48	52.7 Å²	52.7	40%	0.397	28%	0.277	S	S	.	.	S	Bend	trans	-86.9	160.1	177.6	0	0	0	0	0	112.1	I787 V792	I787-A790 HydrophobicContact CG2-CB 4.25Å; A790-V792 PolarHBondContact O-N 3.15Å; A790-V792 VanDerWaalsContact O-N 3.09Å
791	K	73.6	Confident	86.9	Confident	147 Å²	147	60.2 Å²	60.2	64%	0.639	30%	0.302	S	S	*	.	S	Bend	trans	-49.1	-37.9	175.8	-178.1	-174	171.8	-171	0	111.9	D971 H974	K791-D971 IonicContact NZ-OD2 3.81Å; K791-D971 PolarHBondContact NZ-OD2 2.84Å; K791-H974 PolarHBondContact NZ-CD2 3.47Å; K791-H974 VanDerWaalsContact NZ-CD2 3.29Å
792	V	79.8	Confident	86.6	Confident	55 Å²	55	62.2 Å²	62.2	33%	0.333	31%	0.314	S	S	.	.	S	Bend	trans	-115.7	111.1	169.9	-178.3	0	0	0	0	108.1	A790 I794	A790-V792 PolarHBondContact O-N 3.15Å; A790-V792 VanDerWaalsContact O-N 3.09Å; V792-I794 HydrophobicContact CG1-CG2 4.37Å
793	P	83.8	Confident	86.5	Confident	32 Å²	32	57.5 Å²	57.5	21%	0.208	31%	0.305	C	S	.	.			trans	-63.6	131.4	174.1	-27.1	37.4	0	0	0	112.4	I768 I787	I768-P793 HydrophobicContact CG1-CB 4.11Å; I787-P793 WeakPolarHBondContact O-CA 3.45Å
794	I	90.2	Very high	86.5	Confident	29 Å²	29	53.1 Å²	53.1	15%	0.149	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	159.6	-176.7	57.9	170.3	0	0	0	113	P786 I787 V792 K796 D807 I808	P786-I794 WeakPolarHBondContact CA-O 3.39Å; I787-I794 HydrophobicContact CB-CG1 3.97Å; I787-I794 HydrophobicContact CD1-CD1 4.33Å; I787-I794 PolarHBondContact N-O 3.11Å; I787-I794 PolarHBondContact O-N 3.41Å; I787-I794 VanDerWaalsContact O-N 3.08Å; V792-I794 HydrophobicContact CG1-CG2 4.37Å; I794-K796 HydrophobicContact CD1-CG 3.97Å; I794-D807 HydrophobicContact CD1-CB 4.39Å; I794-D807 VanDerWaalsContact CD1-OD2 3.27Å; I794-D807 WeakPolarHBondContact CD1-OD2 3.4Å; I794-I808 CarbonylContact C-O 3.58Å; I794-I808 VanDerWaalsContact CA-O 3.29Å; I794-I808 WeakPolarHBondContact CA-O 3.36Å
795	V	92.7	Very high	86.5	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	109.3	159.9	-173.5	0	0	0	0	109	I768 L771 A772 L775 I784 P786 I808	I768-V795 HydrophobicContact CD1-CG2 4.01Å; I768-V795 HydrophobicContact CG2-CG2 3.8Å; L771-V795 HydrophobicContact CD2-CG2 4.1Å; L771-V795 HydrophobicContact CG-CG2 4.36Å; A772-V795 HydrophobicContact CB-CG1 3.99Å; A772-V795 HydrophobicContact CB-CG2 4.06Å; L775-V795 HydrophobicContact CD1-CB 4.48Å; L775-V795 HydrophobicContact CD1-CG1 3.99Å; I784-V795 HydrophobicContact CG2-CG1 3.68Å; P786-V795 HydrophobicContact CB-CG2 4.49Å; V795-I808 PolarHBondContact N-O 2.93Å; V795-I808 PolarHBondContact O-N 3.4Å
796	K	91.6	Very high	86.7	Confident	42 Å²	42	53.4 Å²	53.4	18%	0.183	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	144.4	166.5	-69.3	-151.3	134.2	-86.1	0	110.1	D746 I784 L785 I787 I794 E805 G806 D807	D746-K796 IonicContact OD2-NZ 3.86Å; D746-K796 PolarHBondContact OD2-NZ 2.82Å; I784-K796 WeakPolarHBondContact CA-O 3.24Å; L785-K796 PolarHBondContact N-O 2.95Å; L785-K796 PolarHBondContact O-N 3.45Å; I787-K796 HydrophobicContact CD1-CD 4.26Å; I787-K796 HydrophobicContact CD1-CG 4.08Å; I794-K796 HydrophobicContact CD1-CG 3.97Å; K796-E805 IonicContact NZ-OE2 2.65Å; K796-E805 PolarHBondContact NZ-OE2 2.8Å; K796-G806 CarbonylContact C-O 3.58Å; K796-G806 WeakPolarHBondContact CA-O 3.36Å; K796-D807 VanDerWaalsContact CE-OD1 3.24Å; K796-D807 WeakPolarHBondContact CE-OD1 3.23Å; K796-D807 WeakPolarHBondContact CE-OD2 3.46Å; K796-D807 VanDerWaalsContact CG-OD1 3.31Å; K796-D807 WeakPolarHBondContact CG-OD1 3.06Å; K796-D807 IonicContact NZ-OD1 3.33Å; K796-D807 PolarHBondContact NZ-OD1 3.02Å; K796-D807 IonicContact NZ-OD2 2.75Å; K796-D807 PolarHBondContact NZ-OD2 2.92Å
797	F	93.4	Very high	86.9	Confident	3 Å²	3	52.4 Å²	52.4	1%	0.013	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	163.8	171.9	67.2	-99.1	0	0	0	111.4	L717 I749 L781 I784 H799 E805 G806 I808	L717-F797 HydrophobicContact CD1-CE1 4.2Å; L717-F797 HydrophobicContact CD1-CE2 4.38Å; L717-F797 HydrophobicContact CD1-CZ 3.7Å; I749-F797 HydrophobicContact CD1-CE1 4.32Å; I749-F797 HydrophobicContact CD1-CZ 4.16Å; L781-F797 HydrophobicContact CD1-CB 4.42Å; L781-F797 HydrophobicContact CD1-CG 4.39Å; L781-F797 HydrophobicContact CD2-CB 4.48Å; L781-F797 HydrophobicContact CD2-CD2 3.48Å; L781-F797 VanDerWaalsContact CD2-CD2 3.48Å; L781-F797 HydrophobicContact CD2-CE2 3.93Å; L781-F797 HydrophobicContact CD2-CG 4.13Å; I784-F797 HydrophobicContact CG1-CB 3.84Å; F797-H799 HydrophobicContact CE2-CB 4.26Å; F797-E805 CarbonylContact O-C 3.58Å; F797-E805 VanDerWaalsContact O-CA 3.3Å; F797-E805 WeakPolarHBondContact O-CA 3.5Å; F797-G806 WeakPolarHBondContact CD1-O 3.45Å; F797-G806 VanDerWaalsContact CE1-C 3.46Å; F797-G806 WeakPolarHBondContact CE1-O 3.12Å; F797-G806 PolarHBondContact N-O 2.98Å; F797-G806 PolarHBondContact O-N 3.14Å; F797-I808 HydrophobicContact CD1-CD1 4.37Å; F797-I808 HydrophobicContact CD1-CG1 4.22Å; F797-I808 HydrophobicContact CE1-CD1 4.02Å; F797-I808 HydrophobicContact CE1-CG1 3.77Å
798	Y	92.4	Very high	87.3	Confident	82 Å²	82	49.9 Å²	49.9	32%	0.322	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	126.7	171.1	-177.1	-93.7	0	0	0	110.4	L781 R782 L800 G803 E805	L781-Y798 CarbonylContact C-O 3.56Å; L781-Y798 WeakPolarHBondContact CA-O 3.42Å; R782-Y798 PolarHBondContact N-O 2.76Å; R782-Y798 PolarHBondContact O-N 3.12Å; Y798-L800 HydrophobicContact CE1-CD2 4.45Å; Y798-G803 WeakPolarHBondContact CE2-O 3.29Å; Y798-G803 WeakPolarHBondContact OH-CA 3.27Å; Y798-E805 HydrophobicContact CD2-CG 4.21Å
799	H	92.3	Very high	87.6	Confident	5 Å²	5	48 Å²	48	2%	0.023	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	112.3	-179.2	177.4	-118.5	0	0	0	112.4	I713 G780 L781 F797 R801 T802 G803 L804	I713-H799 WeakPolarHBondContact CD1-ND1 3.44Å; G780-H799 PolarHBondContact O-CD2 2.87Å; L781-H799 HydrophobicContact CD2-CB 4.25Å; F797-H799 HydrophobicContact CE2-CB 4.26Å; H799-R801 VanDerWaalsContact C-N 3.29Å; H799-R801 PolarHBondContact NE2-NE 3.07Å; H799-R801 VanDerWaalsContact NE2-NE 3.19Å; H799-R801 PolarHBondContact NE2-NH2 3.42Å; H799-R801 VanDerWaalsContact NE2-NH2 3.16Å; H799-R801 PolarHBondContact O-N 2.83Å; H799-R801 VanDerWaalsContact O-N 3.12Å; H799-T802 PolarHBondContact ND1-OG1 2.76Å; H799-T802 PolarHBondContact O-N 2.85Å; H799-G803 PolarHBondContact O-N 2.95Å; H799-L804 PolarHBondContact N-O 2.83Å
800	L	88.8	Confident	88	Confident	85 Å²	85	43.2 Å²	43.2	45%	0.445	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-28.5	-169.7	-78	174.3	0	0	0	115.9	G780 R782 Y798	G780-L800 WeakPolarHBondContact O-CB 3.37Å; G780-L800 PolarHBondContact O-N 3.17Å; R782-L800 HydrophobicContact CG-CD1 3.92Å; R782-L800 HydrophobicContact CG-CD2 3.72Å; R782-L800 HydrophobicContact CG-CG 3.86Å; Y798-L800 HydrophobicContact CE1-CD2 4.45Å
801	R	86.4	Confident	88.3	Confident	168 Å²	168	41.5 Å²	41.5	63%	0.634	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-14.1	-174.1	-65	175.7	-68.5	-164	-4.5	114	D716 H799	D716-R801 IonicContact OD2-CZ 3.36Å; D716-R801 IonicContact OD2-NH2 3.45Å; D716-R801 PolarHBondContact OD2-NH2 3.39Å; H799-R801 VanDerWaalsContact C-N 3.29Å; H799-R801 PolarHBondContact NE2-NE 3.07Å; H799-R801 VanDerWaalsContact NE2-NE 3.19Å; H799-R801 PolarHBondContact NE2-NH2 3.42Å; H799-R801 VanDerWaalsContact NE2-NH2 3.16Å; H799-R801 PolarHBondContact O-N 2.83Å; H799-R801 VanDerWaalsContact O-N 3.12Å
802	T	85.5	Confident	88.8	Confident	46 Å²	46	36.2 Å²	36.2	28%	0.282	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-129.9	-7.3	-177.2	58.6	0	0	0	0	114.1	V709 I713 H799 L804	V709-T802 HydrophobicContact CG1-CG2 3.74Å; I713-T802 HydrophobicContact CD1-CG2 3.98Å; H799-T802 PolarHBondContact ND1-OG1 2.76Å; H799-T802 PolarHBondContact O-N 2.85Å; T802-L804 PolarHBondContact O-N 2.96Å
803	G	88.2	Confident	89.2	Confident	28 Å²	28	35 Å²	35	29%	0.289	17%	0.174	S	C	.	.			trans	74	0.7	-178	0	0	0	0	0	115	Y798 H799	Y798-G803 WeakPolarHBondContact CE2-O 3.29Å; Y798-G803 WeakPolarHBondContact OH-CA 3.27Å; H799-G803 PolarHBondContact O-N 2.95Å
804	L	88.7	Confident	89.5	Confident	13 Å²	13	34.6 Å²	34.6	7%	0.068	17%	0.17	C	C	.	.			trans	-78.1	135.7	-177.6	-61	176.8	0	0	0	111.6	L747 H799 T802	L747-L804 HydrophobicContact CD1-CB 4.15Å; L747-L804 HydrophobicContact CD1-CD1 4.09Å; L747-L804 HydrophobicContact CD2-CD1 4.37Å; L747-L804 HydrophobicContact CG-CB 4.41Å; L747-L804 HydrophobicContact CG-CD1 4.13Å; H799-L804 PolarHBondContact N-O 2.83Å; T802-L804 PolarHBondContact O-N 2.96Å
805	E	91.3	Very high	89.4	Confident	88 Å²	88	34 Å²	34	41%	0.411	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	159.8	156.7	-69.9	-155.9	-179.7	0	0	111	D746 L747 K796 F797 Y798	D746-E805 WeakPolarHBondContact CA-O 3.46Å; L747-E805 PolarHBondContact N-O 2.95Å; K796-E805 IonicContact NZ-OE2 2.65Å; K796-E805 PolarHBondContact NZ-OE2 2.8Å; F797-E805 CarbonylContact O-C 3.58Å; F797-E805 VanDerWaalsContact O-CA 3.3Å; F797-E805 WeakPolarHBondContact O-CA 3.5Å; Y798-E805 HydrophobicContact CD2-CG 4.21Å
806	G	91.4	Very high	89.4	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	148	175.6	0	0	0	0	0	113.1	L747 K796 F797	L747-G806 WeakPolarHBondContact O-CA 3.47Å; K796-G806 CarbonylContact C-O 3.58Å; K796-G806 WeakPolarHBondContact CA-O 3.36Å; F797-G806 WeakPolarHBondContact CD1-O 3.45Å; F797-G806 VanDerWaalsContact CE1-C 3.46Å; F797-G806 WeakPolarHBondContact CE1-O 3.12Å; F797-G806 PolarHBondContact N-O 2.98Å; F797-G806 PolarHBondContact O-N 3.14Å
807	D	92.7	Very high	89.5	Confident	24 Å²	24	35.1 Å²	35.1	13%	0.128	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	111.6	-166.5	-73.9	22.1	0	0	0	109.1	L747 I749 I794 K796	L747-D807 PolarHBondContact O-N 3.32Å; I749-D807 PolarHBondContact N-O 3.27Å; I794-D807 HydrophobicContact CD1-CB 4.39Å; I794-D807 VanDerWaalsContact CD1-OD2 3.27Å; I794-D807 WeakPolarHBondContact CD1-OD2 3.4Å; K796-D807 VanDerWaalsContact CE-OD1 3.24Å; K796-D807 WeakPolarHBondContact CE-OD1 3.23Å; K796-D807 WeakPolarHBondContact CE-OD2 3.46Å; K796-D807 VanDerWaalsContact CG-OD1 3.31Å; K796-D807 WeakPolarHBondContact CG-OD1 3.06Å; K796-D807 IonicContact NZ-OD1 3.33Å; K796-D807 PolarHBondContact NZ-OD1 3.02Å; K796-D807 IonicContact NZ-OD2 2.75Å; K796-D807 PolarHBondContact NZ-OD2 2.92Å
808	I	93.2	Very high	89.5	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	114.4	176.1	-50.5	-178.9	0	0	0	109.8	I749 M751 L771 L775 I794 V795 F797	I749-I808 HydrophobicContact CB-CG1 4.15Å; I749-I808 HydrophobicContact CD1-CG1 4.41Å; I749-I808 HydrophobicContact CG2-CG1 4.24Å; I749-I808 HydrophobicContact CG2-CG2 4.28Å; I749-I808 WeakPolarHBondContact O-CA 3.3Å; M751-I808 HydrophobicContact CB-CG2 3.86Å; L771-I808 HydrophobicContact CD2-CB 4.12Å; L771-I808 HydrophobicContact CD2-CD1 4.44Å; L771-I808 HydrophobicContact CD2-CG2 3.74Å; L775-I808 HydrophobicContact CD1-CD1 3.95Å; I794-I808 CarbonylContact C-O 3.58Å; I794-I808 VanDerWaalsContact CA-O 3.29Å; I794-I808 WeakPolarHBondContact CA-O 3.36Å; V795-I808 PolarHBondContact N-O 2.93Å; V795-I808 PolarHBondContact O-N 3.4Å; F797-I808 HydrophobicContact CD1-CD1 4.37Å; F797-I808 HydrophobicContact CD1-CG1 4.22Å; F797-I808 HydrophobicContact CE1-CD1 4.02Å; F797-I808 HydrophobicContact CE1-CG1 3.77Å
809	S	91.4	Very high	89.6	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.014	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	157.2	171	58.2	0	0	0	0	111.1	I749 M751 N812	I749-S809 PolarHBondContact O-N 3.41Å; I749-S809 PolarHBondContact O-OG 3.39Å; I749-S809 VanDerWaalsContact O-OG 3.07Å; M751-S809 WeakPolarHBondContact CB-O 3.47Å; M751-S809 PolarHBondContact N-O 3.27Å; S809-N812 WeakPolarHBondContact OG-CB 3.18Å
810	L	86.3	Confident	89.7	Confident	11 Å²	11	37.7 Å²	37.7	6%	0.058	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	137.6	170.8	-71.5	170.9	0	0	0	110.1	M751 C764 I767 I768 N812	M751-L810 HydrophobicContact CB-CD2 4.01Å; M751-L810 HydrophobicContact CE-CD2 4.33Å; M751-L810 HydrophobicContact CG-CD2 3.85Å; M751-L810 WeakPolarHBondContact O-CA 3.31Å; M751-L810 HydrophobicContact SD-CD2 3.98Å; C764-L810 HydrophobicContact CB-CD1 3.98Å; C764-L810 WeakPolarHBondContact O-CD1 3.32Å; I767-L810 HydrophobicContact CB-CD1 3.77Å; I767-L810 HydrophobicContact CG2-CD1 3.66Å; I767-L810 HydrophobicContact CG2-CD2 3.93Å; I767-L810 HydrophobicContact CG2-CG 4.43Å; I768-L810 HydrophobicContact CD1-CD1 4.1Å; I768-L810 HydrophobicContact CD1-CG 4.04Å; I768-L810 HydrophobicContact CG1-CD1 3.79Å; I768-L810 HydrophobicContact CG1-CG 4.28Å; L810-N812 PolarHBondContact O-N 3.19Å
811	Y	81.2	Confident	90	Very high	12 Å²	12	33.6 Å²	33.6	5%	0.047	17%	0.165	C	C	.	.	S	Bend	trans	48.8	33.2	171.8	-68	-82.4	0	0	0	115.4	M751 V752 L753 K756 M759 V762 T813	M751-Y811 PolarHBondContact O-N 3.48Å; V752-Y811 HydrophobicContact CG1-CD1 4.33Å; V752-Y811 HydrophobicContact CG1-CE1 3.87Å; L753-Y811 WeakPolarHBondContact CB-OH 3.35Å; L753-Y811 PolarHBondContact N-OH 2.82Å; L753-Y811 PolarHBondContact O-OH 3.07Å; K756-Y811 WeakPolarHBondContact CB-OH 3.46Å; K756-Y811 WeakPolarHBondContact O-CE1 3.11Å; K756-Y811 PolarHBondContact O-OH 3.21Å; M759-Y811 HydrophobicContact CG-CG 4.37Å; V762-Y811 HydrophobicContact CG1-CE2 4.5Å; V762-Y811 HydrophobicContact CG2-CE2 4.45Å; Y811-T813 PolarHBondContact O-N 3.15Å
812	N	84.4	Confident	90.5	Very high	35 Å²	35	25.7 Å²	25.7	19%	0.187	14%	0.135	C	C	.	.			trans	-79.8	62.3	177.4	-164.5	2.5	0	0	0	111.2	C750 S809 L810 A815 L816	C750-N812 PolarHBondContact SG-N 3.48Å; S809-N812 WeakPolarHBondContact OG-CB 3.18Å; L810-N812 PolarHBondContact O-N 3.19Å; N812-A815 HydrophobicContact CB-CB 4.44Å; N812-A815 VanDerWaalsContact CG-CB 3.42Å; N812-A815 WeakPolarHBondContact ND2-CB 3.46Å; N812-A815 PolarHBondContact O-N 3.26Å; N812-A815 WeakPolarHBondContact OD1-CB 3.07Å; N812-L816 PolarHBondContact O-N 2.95Å
813	T	86.5	Confident	90.9	Very high	31 Å²	31	25 Å²	25	19%	0.19	14%	0.135	C	C	.	.	H	α-helix	trans	-64.7	-45.3	-171.9	71	0	0	0	0	111.6	Y811 A815 L816 H817 V894 D895	Y811-T813 PolarHBondContact O-N 3.15Å; T813-A815 VanDerWaalsContact C-N 3.25Å; T813-A815 PolarHBondContact O-N 3.43Å; T813-L816 WeakPolarHBondContact O-CB 3.42Å; T813-L816 PolarHBondContact O-N 2.82Å; T813-H817 PolarHBondContact O-CD2 3.39Å; T813-H817 PolarHBondContact O-N 3.11Å; T813-V894 HydrophobicContact CG2-CG1 4.47Å; T813-V894 WeakPolarHBondContact OG1-CG1 3.3Å; T813-D895 PolarHBondContact OG1-OD2 2.76Å
814	L	90.2	Very high	91.2	Very high	23 Å²	23	24.5 Å²	24.5	12%	0.12	13%	0.126	C	C	.	.	H	α-helix	trans	-59.9	-36.6	-179.9	-60.4	178	0	0	0	111.3	L816 H817 N818 V894 D895 W897 V899 F970 D971	L814-L816 VanDerWaalsContact C-N 3.35Å; L814-L816 PolarHBondContact O-N 2.7Å; L814-H817 PolarHBondContact O-N 3.2Å; L814-N818 WeakPolarHBondContact O-CB 3.47Å; L814-N818 PolarHBondContact O-N 3.41Å; L814-V894 HydrophobicContact CD2-CB 4.42Å; L814-V894 HydrophobicContact CD2-CG1 4.13Å; L814-D895 HydrophobicContact CD1-CB 4.35Å; L814-D895 HydrophobicContact CD2-CB 4.44Å; L814-D895 HydrophobicContact CG-CB 4.38Å; L814-W897 HydrophobicContact CD2-CB 4.42Å; L814-V899 HydrophobicContact CD2-CG1 3.75Å; L814-F970 HydrophobicContact CD2-CB 4.47Å; L814-D971 HydrophobicContact CD1-CB 4.28Å
815	A	89.7	Confident	91.6	Very high	16 Å²	16	23.9 Å²	23.9	13%	0.132	12%	0.123	C	C	.	.	H	α-helix	trans	-67.2	-31.7	175.4	0	0	0	0	0	113.2	F733 N812 T813 T819	F733-A815 HydrophobicContact CD2-CB 3.55Å; F733-A815 HydrophobicContact CE2-CB 3.6Å; F733-A815 HydrophobicContact CG-CB 4.41Å; F733-A815 HydrophobicContact CZ-CB 4.46Å; N812-A815 HydrophobicContact CB-CB 4.44Å; N812-A815 VanDerWaalsContact CG-CB 3.42Å; N812-A815 WeakPolarHBondContact ND2-CB 3.46Å; N812-A815 PolarHBondContact O-N 3.26Å; N812-A815 WeakPolarHBondContact OD1-CB 3.07Å; T813-A815 VanDerWaalsContact C-N 3.25Å; T813-A815 PolarHBondContact O-N 3.43Å; A815-T819 VanDerWaalsContact O-CB 3.28Å; A815-T819 WeakPolarHBondContact O-CB 3.46Å; A815-T819 PolarHBondContact O-N 3.48Å; A815-T819 PolarHBondContact O-OG1 3Å
816	L	91.1	Very high	91.7	Very high	28 Å²	28	19.9 Å²	19.9	15%	0.147	11%	0.105	C	C	.	.	H	α-helix	trans	-65.8	-39.4	171.2	-69	162.2	0	0	0	111.2	Q731 F733 C750 N812 T813 L814 T819 R820	Q731-L816 HydrophobicContact CB-CD2 3.85Å; F733-L816 HydrophobicContact CB-CD2 3.75Å; F733-L816 HydrophobicContact CB-CG 4.36Å; C750-L816 HydrophobicContact CB-CD1 4.13Å; C750-L816 HydrophobicContact CB-CD2 4.45Å; C750-L816 HydrophobicContact CB-CG 4.3Å; N812-L816 PolarHBondContact O-N 2.95Å; T813-L816 WeakPolarHBondContact O-CB 3.42Å; T813-L816 PolarHBondContact O-N 2.82Å; L814-L816 VanDerWaalsContact C-N 3.35Å; L814-L816 PolarHBondContact O-N 2.7Å; L816-T819 WeakPolarHBondContact O-CB 3.26Å; L816-T819 PolarHBondContact O-N 3.22Å; L816-R820 PolarHBondContact O-N 3.11Å; L816-R820 VanDerWaalsContact O-N 3.13Å
817	H	93.5	Very high	91.8	Very high	38 Å²	38	23 Å²	23	18%	0.176	13%	0.131	C	C	.	.	H	α-helix	trans	-68.3	-46.1	174.9	-78.9	-98.8	0	0	0	112.1	T813 L814 T819 R820 L821 V899 F970	T813-H817 PolarHBondContact O-CD2 3.39Å; T813-H817 PolarHBondContact O-N 3.11Å; L814-H817 PolarHBondContact O-N 3.2Å; H817-T819 PolarHBondContact O-N 2.84Å; H817-R820 PolarHBondContact O-N 3.4Å; H817-R820 VanDerWaalsContact O-N 3.08Å; H817-L821 PolarHBondContact O-N 3.36Å; H817-V899 HydrophobicContact CB-CB 4.12Å; H817-V899 HydrophobicContact CB-CG1 4.2Å; H817-V899 VanDerWaalsContact CE1-CG2 3.43Å; H817-V899 WeakPolarHBondContact CE1-CG2 3.27Å; H817-V899 WeakPolarHBondContact ND1-CB 3.41Å; H817-V899 VanDerWaalsContact ND1-CG2 3.33Å; H817-V899 WeakPolarHBondContact ND1-CG2 3.41Å; H817-F970 HydrophobicContact CB-CD2 3.99Å; H817-F970 HydrophobicContact CB-CE2 3.71Å
818	N	93.9	Very high	91.8	Very high	11 Å²	11	22.5 Å²	22.5	6%	0.059	13%	0.128	C	C	.	.	H	α-helix	trans	-57.6	-38.5	173.6	-80.9	-25	0	0	0	111.9	L814 L821 L822 Y859 D968 P969 F970	L814-N818 WeakPolarHBondContact O-CB 3.47Å; L814-N818 PolarHBondContact O-N 3.41Å; N818-L821 PolarHBondContact O-N 3.03Å; N818-L822 WeakPolarHBondContact O-CB 3.25Å; N818-L822 WeakPolarHBondContact O-CD1 3.32Å; N818-L822 PolarHBondContact O-N 2.69Å; N818-Y859 PolarHBondContact ND2-OH 2.6Å; N818-Y859 VanDerWaalsContact ND2-OH 3.12Å; N818-Y859 PolarHBondContact OD1-OH 2.72Å; N818-D968 PolarHBondContact ND2-OD1 2.93Å; N818-D968 PolarHBondContact ND2-OD2 3.31Å; N818-P969 WeakPolarHBondContact OD1-CG 3.41Å; N818-F970 WeakPolarHBondContact OD1-CD2 3.47Å; N818-F970 VanDerWaalsContact OD1-CE2 3.28Å; N818-F970 WeakPolarHBondContact OD1-CE2 3.32Å
819	T	94.4	Very high	91.8	Very high	12 Å²	12	24.3 Å²	24.3	7%	0.074	14%	0.138	C	C	.	.	H	α-helix	trans	-61.6	-44.2	174.6	-60	0	0	0	0	112	G734 K737 N738 A815 L816 H817 A823	G734-T819 PolarHBondContact N-OG1 3.37Å; K737-T819 HydrophobicContact CB-CG2 3.48Å; K737-T819 VanDerWaalsContact CB-CG2 3.48Å; N738-T819 HydrophobicContact CB-CG2 4.12Å; A815-T819 VanDerWaalsContact O-CB 3.28Å; A815-T819 WeakPolarHBondContact O-CB 3.46Å; A815-T819 PolarHBondContact O-N 3.48Å; A815-T819 PolarHBondContact O-OG1 3Å; L816-T819 WeakPolarHBondContact O-CB 3.26Å; L816-T819 PolarHBondContact O-N 3.22Å; H817-T819 PolarHBondContact O-N 2.84Å; T819-A823 VanDerWaalsContact O-CB 3.3Å; T819-A823 WeakPolarHBondContact O-CB 3.24Å; T819-A823 PolarHBondContact O-N 3.41Å
820	R	95.1	Very high	91.8	Very high	120 Å²	120	29.4 Å²	29.4	45%	0.453	16%	0.157	S	C	.	.	H	α-helix	trans	-67.4	-40.1	176.4	-70.7	175.9	58.5	-170.5	-2.3	112.7	L816 H817 A823 S824 F901 D903	L816-R820 PolarHBondContact O-N 3.11Å; L816-R820 VanDerWaalsContact O-N 3.13Å; H817-R820 PolarHBondContact O-N 3.4Å; H817-R820 VanDerWaalsContact O-N 3.08Å; R820-A823 PolarHBondContact O-N 3.47Å; R820-S824 WeakPolarHBondContact O-CB 3.33Å; R820-S824 PolarHBondContact O-N 3.32Å; R820-S824 PolarHBondContact O-OG 3.4Å; R820-F901 HydrophobicContact CB-CE1 4.33Å; R820-F901 HydrophobicContact CB-CZ 3.75Å; R820-D903 IonicContact CZ-OD2 3.65Å; R820-D903 IonicContact NH2-OD2 3.89Å; R820-D903 PolarHBondContact NH2-OD2 3.16Å
821	L	95.6	Very high	92.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.1	-50.4	177	176.9	64.4	0	0	0	110.7	H817 N818 S824 Y825 L880 F901 I946 P969 F970	H817-L821 PolarHBondContact O-N 3.36Å; N818-L821 PolarHBondContact O-N 3.03Å; L821-S824 WeakPolarHBondContact O-CB 3.36Å; L821-S824 PolarHBondContact O-N 2.9Å; L821-Y825 HydrophobicContact CD1-CD2 4.16Å; L821-Y825 HydrophobicContact CD1-CE2 3.52Å; L821-Y825 HydrophobicContact CD2-CE2 4.34Å; L821-Y825 HydrophobicContact CG-CD2 4.1Å; L821-Y825 HydrophobicContact CG-CE2 3.7Å; L821-Y825 VanDerWaalsContact O-CD2 3.28Å; L821-Y825 WeakPolarHBondContact O-CD2 3.41Å; L821-Y825 PolarHBondContact O-N 2.86Å; L821-L880 HydrophobicContact CD1-CB 4.25Å; L821-L880 HydrophobicContact CD1-CD1 4.34Å; L821-F901 HydrophobicContact CB-CD1 4.37Å; L821-F901 HydrophobicContact CB-CE1 4.27Å; L821-F901 HydrophobicContact CB-CE2 4.45Å; L821-F901 HydrophobicContact CB-CZ 4.33Å; L821-F901 HydrophobicContact CD1-CB 3.82Å; L821-F901 HydrophobicContact CD1-CD1 4.23Å; L821-F901 HydrophobicContact CD1-CD2 3.67Å; L821-F901 HydrophobicContact CD1-CE2 4.31Å; L821-F901 HydrophobicContact CD1-CG 3.64Å; L821-I946 HydrophobicContact CD2-CD1 4.35Å; L821-P969 HydrophobicContact CD2-CB 3.86Å; L821-P969 HydrophobicContact CD2-CG 3.75Å; L821-F970 HydrophobicContact CB-CE2 4.37Å; L821-F970 HydrophobicContact CB-CZ 4.35Å; L821-F970 HydrophobicContact CD2-CE2 4.13Å; L821-F970 HydrophobicContact CD2-CZ 3.88Å
822	L	96	Very high	92.8	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-64.2	-40.1	176.7	-91.4	59	0	0	0	112.5	N738 F740 N818 S824 Y825 A826 Y859 T862 L863 L866	N738-L822 HydrophobicContact CB-CB 3.84Å; N738-L822 HydrophobicContact CB-CD2 4.44Å; F740-L822 HydrophobicContact CD2-CB 4.45Å; F740-L822 HydrophobicContact CD2-CD2 4.37Å; F740-L822 HydrophobicContact CE2-CB 3.91Å; F740-L822 HydrophobicContact CE2-CD2 4.28Å; F740-L822 HydrophobicContact CE2-CG 4.08Å; N818-L822 WeakPolarHBondContact O-CB 3.25Å; N818-L822 WeakPolarHBondContact O-CD1 3.32Å; N818-L822 PolarHBondContact O-N 2.69Å; L822-S824 VanDerWaalsContact C-N 3.26Å; L822-S824 PolarHBondContact O-N 2.99Å; L822-Y825 PolarHBondContact O-N 3.37Å; L822-A826 WeakPolarHBondContact O-CB 3.48Å; L822-A826 PolarHBondContact O-N 3.04Å; L822-Y859 HydrophobicContact CD1-CE2 4.11Å; L822-Y859 HydrophobicContact CD2-CD2 3.74Å; L822-Y859 HydrophobicContact CD2-CE2 3.68Å; L822-T862 HydrophobicContact CD2-CG2 3.72Å; L822-T862 HydrophobicContact CG-CG2 4.2Å; L822-L863 HydrophobicContact CD1-CD2 4.12Å; L822-L866 HydrophobicContact CD1-CD1 4.05Å; L822-L866 HydrophobicContact CG-CD1 4.06Å
823	A	94.3	Very high	93.2	Very high	33 Å²	33	31.4 Å²	31.4	27%	0.273	16%	0.163	S	C	.	.	H	α-helix	trans	-61.1	-35.9	174.4	0	0	0	0	0	112.4	N738 T819 R820 A826 A827	N738-A823 WeakPolarHBondContact O-CA 3.43Å; T819-A823 VanDerWaalsContact O-CB 3.3Å; T819-A823 WeakPolarHBondContact O-CB 3.24Å; T819-A823 PolarHBondContact O-N 3.41Å; R820-A823 PolarHBondContact O-N 3.47Å; A823-A826 PolarHBondContact O-N 3.32Å; A823-A827 PolarHBondContact O-N 3.19Å
824	S	95.2	Very high	93.4	Very high	16 Å²	16	29.9 Å²	29.9	11%	0.112	15%	0.153	C	C	.	.	H	α-helix	trans	-68.4	-46.8	176.7	-57	0	0	0	0	110.9	R820 L821 L822 A826 A827 I828 L905	R820-S824 WeakPolarHBondContact O-CB 3.33Å; R820-S824 PolarHBondContact O-N 3.32Å; R820-S824 PolarHBondContact O-OG 3.4Å; L821-S824 WeakPolarHBondContact O-CB 3.36Å; L821-S824 PolarHBondContact O-N 2.9Å; L822-S824 VanDerWaalsContact C-N 3.26Å; L822-S824 PolarHBondContact O-N 2.99Å; S824-A826 VanDerWaalsContact C-N 3.32Å; S824-A826 PolarHBondContact O-N 3.04Å; S824-A827 PolarHBondContact O-N 2.95Å; S824-I828 PolarHBondContact O-N 2.86Å; S824-L905 WeakPolarHBondContact O-CD1 3.15Å
825	Y	96.1	Very high	93.7	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-57.8	-42.1	171.9	-73.7	-57.9	0	0	0	112.8	L821 L822 A827 I828 L866 Q870 I877 P878 L880 I946	L821-Y825 HydrophobicContact CD1-CD2 4.16Å; L821-Y825 HydrophobicContact CD1-CE2 3.52Å; L821-Y825 HydrophobicContact CD2-CE2 4.34Å; L821-Y825 HydrophobicContact CG-CD2 4.1Å; L821-Y825 HydrophobicContact CG-CE2 3.7Å; L821-Y825 VanDerWaalsContact O-CD2 3.28Å; L821-Y825 WeakPolarHBondContact O-CD2 3.41Å; L821-Y825 PolarHBondContact O-N 2.86Å; L822-Y825 PolarHBondContact O-N 3.37Å; Y825-A827 PolarHBondContact O-N 2.96Å; Y825-A827 VanDerWaalsContact O-N 3.12Å; Y825-I828 HydrophobicContact CD1-CD1 4.04Å; Y825-I828 PolarHBondContact O-N 2.98Å; Y825-L866 HydrophobicContact CD1-CD2 4.48Å; Y825-L866 HydrophobicContact CD2-CD1 3.83Å; Y825-L866 HydrophobicContact CD2-CD2 4.21Å; Y825-L866 HydrophobicContact CE2-CD1 4.41Å; Y825-L866 HydrophobicContact CG-CD1 4.36Å; Y825-L866 HydrophobicContact CG-CD2 3.9Å; Y825-Q870 PolarHBondContact OH-NE2 3.01Å; Y825-Q870 VanDerWaalsContact OH-NE2 3.15Å; Y825-I877 HydrophobicContact CD1-CB 4.33Å; Y825-I877 HydrophobicContact CD1-CD1 3.82Å; Y825-I877 HydrophobicContact CE1-CD1 4.2Å; Y825-I877 HydrophobicContact CG-CD1 4.42Å; Y825-P878 VanDerWaalsContact CE1-O 3.3Å; Y825-P878 WeakPolarHBondContact CE1-O 3.42Å; Y825-L880 HydrophobicContact CD1-CD1 3.79Å; Y825-L880 HydrophobicContact CD1-CG 4.15Å; Y825-L880 HydrophobicContact CD2-CD1 4.42Å; Y825-L880 HydrophobicContact CE1-CB 4.21Å; Y825-L880 HydrophobicContact CE1-CD1 3.63Å; Y825-L880 HydrophobicContact CE1-CG 3.53Å; Y825-L880 HydrophobicContact CE2-CD1 4.3Å; Y825-L880 HydrophobicContact CG-CD1 4.18Å; Y825-L880 PolarHBondContact OH-N 2.74Å; Y825-I946 HydrophobicContact CE2-CD1 3.96Å
826	A	93.1	Very high	93.9	Very high	4 Å²	4	28.2 Å²	28.2	3%	0.033	14%	0.142	C	C	.	.	H	α-helix	trans	-63.8	-14.1	176.9	0	0	0	0	0	114.1	F740 L822 A823 S824 K833	F740-A826 HydrophobicContact CD1-CB 4.48Å; F740-A826 HydrophobicContact CE1-CB 3.65Å; F740-A826 HydrophobicContact CE2-CB 4.33Å; F740-A826 HydrophobicContact CZ-CB 3.57Å; L822-A826 WeakPolarHBondContact O-CB 3.48Å; L822-A826 PolarHBondContact O-N 3.04Å; A823-A826 PolarHBondContact O-N 3.32Å; S824-A826 VanDerWaalsContact C-N 3.32Å; S824-A826 PolarHBondContact O-N 3.04Å; A826-K833 HydrophobicContact CB-CG 4.04Å; A826-K833 WeakPolarHBondContact O-CE 3.44Å
827	A	93.3	Very high	93.9	Very high	65 Å²	65	27.2 Å²	27.2	54%	0.537	14%	0.137	S	C	.	.	H	α-helix	trans	-106.1	-3.6	179.9	0	0	0	0	0	114	A823 S824 Y825 L905	A823-A827 PolarHBondContact O-N 3.19Å; S824-A827 PolarHBondContact O-N 2.95Å; Y825-A827 PolarHBondContact O-N 2.96Å; Y825-A827 VanDerWaalsContact O-N 3.12Å; A827-L905 HydrophobicContact CB-CD1 3.53Å
828	I	93.5	Very high	93.8	Very high	15 Å²	15	25.4 Å²	25.4	8%	0.077	13%	0.129	C	C	.	.	H	α-helix	trans	-75.3	-47.7	175.3	-68.5	173.2	0	0	0	111.4	S824 Y825 I877 P878 L880 L905 L908 Y915	S824-I828 PolarHBondContact O-N 2.86Å; Y825-I828 HydrophobicContact CD1-CD1 4.04Å; Y825-I828 PolarHBondContact O-N 2.98Å; I828-I877 HydrophobicContact CB-CG2 4.36Å; I828-I877 HydrophobicContact CG2-CG2 4.07Å; I828-P878 HydrophobicContact CD1-CG 4.17Å; I828-L880 HydrophobicContact CD1-CD1 4.19Å; I828-L880 HydrophobicContact CD1-CD2 4.1Å; I828-L880 HydrophobicContact CD1-CG 4.36Å; I828-L905 HydrophobicContact CD1-CD2 4.27Å; I828-L905 HydrophobicContact CG1-CD1 4.45Å; I828-L905 HydrophobicContact CG1-CD2 3.85Å; I828-L908 HydrophobicContact CD1-CD2 3.84Å; I828-L908 HydrophobicContact CG1-CD2 3.89Å; I828-L908 HydrophobicContact CG2-CD2 4.35Å; I828-Y915 HydrophobicContact CG2-CE2 4.19Å
829	D	92.8	Very high	93.9	Very high	37 Å²	37	25 Å²	25	20%	0.198	13%	0.126	C	C	.	.			trans	-147.9	137.5	-175.9	-172.6	-37.9	0	0	0	110.5	R831 V832	D829-R831 PolarHBondContact O-N 2.7Å; D829-R831 VanDerWaalsContact OD1-CB 3.32Å; D829-R831 WeakPolarHBondContact OD1-CB 3.37Å; D829-R831 VanDerWaalsContact OD1-CG 3.27Å; D829-R831 WeakPolarHBondContact OD1-CG 3.42Å; D829-R831 PolarHBondContact OD1-N 3.46Å; D829-R831 IonicContact OD1-NE 2.74Å; D829-R831 PolarHBondContact OD1-NE 3.14Å; D829-R831 IonicContact OD2-CZ 3.87Å; D829-R831 VanDerWaalsContact OD2-CZ 3.22Å; D829-R831 IonicContact OD2-NE 3.2Å; D829-R831 PolarHBondContact OD2-NE 2.76Å; D829-R831 IonicContact OD2-NH2 2.68Å; D829-R831 PolarHBondContact OD2-NH2 3.11Å; D829-V832 HydrophobicContact CB-CG2 4.22Å; D829-V832 WeakPolarHBondContact O-CB 3.33Å; D829-V832 PolarHBondContact O-N 3.34Å
830	R	91.6	Very high	93.8	Very high	109 Å²	109	25.4 Å²	25.4	41%	0.411	13%	0.127	S	C	.	.	H	α-helix	trans	-56	-33.9	176.6	-179.9	-179.9	176.3	-118.9	1.3	112.4	E693 Y697 V832 K833 I834	E693-R830 VanDerWaalsContact CD-NH1 3.31Å; E693-R830 VanDerWaalsContact CD-NH2 3.28Å; E693-R830 IonicContact OE1-CZ 2.83Å; E693-R830 IonicContact OE1-NH1 2.74Å; E693-R830 PolarHBondContact OE1-NH1 3.15Å; E693-R830 IonicContact OE1-NH2 3.43Å; E693-R830 IonicContact OE2-CZ 3.15Å; E693-R830 IonicContact OE2-NH1 2.95Å; E693-R830 PolarHBondContact OE2-NH1 3.27Å; E693-R830 IonicContact OE2-NH2 2.69Å; E693-R830 PolarHBondContact OE2-NH2 3.43Å; Y697-R830 PolarHBondContact OH-NH2 2.76Å; R830-V832 VanDerWaalsContact C-N 3.26Å; R830-V832 PolarHBondContact O-N 3.29Å; R830-K833 PolarHBondContact O-N 2.9Å; R830-I834 HydrophobicContact CG-CD1 3.89Å; R830-I834 HydrophobicContact CG-CG1 4.42Å; R830-I834 PolarHBondContact O-N 2.95Å
831	R	94.5	Very high	93.6	Very high	33 Å²	33	19.8 Å²	19.8	13%	0.125	11%	0.106	C	C	.	.	H	α-helix	trans	-59.7	-35.4	-179.2	-63.1	-179.6	-71.2	172.1	-2.2	112	D829 K833 I834 L835 N918 E920 V922 L925	D829-R831 PolarHBondContact O-N 2.7Å; D829-R831 VanDerWaalsContact OD1-CB 3.32Å; D829-R831 WeakPolarHBondContact OD1-CB 3.37Å; D829-R831 VanDerWaalsContact OD1-CG 3.27Å; D829-R831 WeakPolarHBondContact OD1-CG 3.42Å; D829-R831 PolarHBondContact OD1-N 3.46Å; D829-R831 IonicContact OD1-NE 2.74Å; D829-R831 PolarHBondContact OD1-NE 3.14Å; D829-R831 IonicContact OD2-CZ 3.87Å; D829-R831 VanDerWaalsContact OD2-CZ 3.22Å; D829-R831 IonicContact OD2-NE 3.2Å; D829-R831 PolarHBondContact OD2-NE 2.76Å; D829-R831 IonicContact OD2-NH2 2.68Å; D829-R831 PolarHBondContact OD2-NH2 3.11Å; R831-K833 PolarHBondContact O-N 2.75Å; R831-I834 PolarHBondContact O-N 3.15Å; R831-L835 WeakPolarHBondContact O-CB 3.25Å; R831-L835 WeakPolarHBondContact O-CG 3.4Å; R831-L835 PolarHBondContact O-N 3.46Å; R831-N918 PolarHBondContact NH1-O 3.33Å; R831-N918 VanDerWaalsContact NH1-O 3.14Å; R831-N918 PolarHBondContact NH1-OD1 3.38Å; R831-N918 PolarHBondContact NH2-O 3.05Å; R831-E920 WeakPolarHBondContact CD-O 3.4Å; R831-E920 PolarHBondContact NH1-O 3.06Å; R831-V922 HydrophobicContact CG-CG2 4.01Å; R831-L925 HydrophobicContact CB-CD1 4.38Å
832	V	94.8	Very high	93.5	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-58.8	-48.1	176.3	-175.6	0	0	0	0	110.8	F740 D829 R830 C836 L866 L869 I877	F740-V832 HydrophobicContact CE1-CG1 4.3Å; F740-V832 HydrophobicContact CZ-CG1 4.09Å; D829-V832 HydrophobicContact CB-CG2 4.22Å; D829-V832 WeakPolarHBondContact O-CB 3.33Å; D829-V832 PolarHBondContact O-N 3.34Å; R830-V832 VanDerWaalsContact C-N 3.26Å; R830-V832 PolarHBondContact O-N 3.29Å; V832-C836 WeakPolarHBondContact O-CB 3.13Å; V832-C836 PolarHBondContact O-N 3.46Å; V832-C836 PolarHBondContact O-SG 3.41Å; V832-L866 HydrophobicContact CG1-CD2 3.73Å; V832-L869 HydrophobicContact CG1-CD1 4.5Å; V832-L869 HydrophobicContact CG2-CD1 4.16Å; V832-I877 HydrophobicContact CG2-CG2 3.52Å
833	K	91.5	Very high	93.4	Very high	67 Å²	67	19.8 Å²	19.8	29%	0.291	11%	0.106	S	C	.	.	H	α-helix	trans	-59.9	-50.6	177	-77.8	179.1	169.7	171.6	0	111.4	Y696 F740 A826 R830 R831 L835 C836 Y837	Y696-K833 HydrophobicContact CE2-CB 4.24Å; F740-K833 HydrophobicContact CE1-CG 4.16Å; A826-K833 HydrophobicContact CB-CG 4.04Å; A826-K833 WeakPolarHBondContact O-CE 3.44Å; R830-K833 PolarHBondContact O-N 2.9Å; R831-K833 PolarHBondContact O-N 2.75Å; K833-L835 PolarHBondContact O-N 3.24Å; K833-C836 PolarHBondContact O-N 3.03Å; K833-Y837 WeakPolarHBondContact O-CD2 3.49Å; K833-Y837 PolarHBondContact O-N 3.32Å
834	I	92.3	Very high	93.3	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-61.4	-45.9	-175.5	-58.5	166.2	0	0	0	110.5	C692 E693 Y696 R830 R831 Y837 I838 V922	C692-I834 HydrophobicContact CB-CG2 4.45Å; C692-I834 VanDerWaalsContact O-CG2 3.24Å; C692-I834 WeakPolarHBondContact O-CG2 3.23Å; E693-I834 HydrophobicContact CG-CD1 4.38Å; Y696-I834 HydrophobicContact CD1-CG1 4.32Å; Y696-I834 HydrophobicContact CD2-CG1 4.3Å; Y696-I834 HydrophobicContact CG-CG1 3.98Å; R830-I834 HydrophobicContact CG-CD1 3.89Å; R830-I834 HydrophobicContact CG-CG1 4.42Å; R830-I834 PolarHBondContact O-N 2.95Å; R831-I834 PolarHBondContact O-N 3.15Å; I834-Y837 PolarHBondContact O-N 3.28Å; I834-I838 HydrophobicContact CG2-CD1 3.69Å; I834-I838 HydrophobicContact CG2-CG1 4.37Å; I834-I838 WeakPolarHBondContact O-CD1 3.34Å; I834-I838 VanDerWaalsContact O-CG1 3.28Å; I834-I838 WeakPolarHBondContact O-CG1 3.19Å; I834-I838 PolarHBondContact O-N 3.4Å; I834-V922 HydrophobicContact CB-CG1 4.13Å; I834-V922 HydrophobicContact CD1-CG2 4.04Å; I834-V922 HydrophobicContact CG2-CG1 3.65Å
835	L	95.1	Very high	93.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-65	-40.2	178.9	-67.5	166.9	0	0	0	113.2	R831 K833 Y837 I838 M839 V865 L869 V922 L925 W926	R831-L835 WeakPolarHBondContact O-CB 3.25Å; R831-L835 WeakPolarHBondContact O-CG 3.4Å; R831-L835 PolarHBondContact O-N 3.46Å; K833-L835 PolarHBondContact O-N 3.24Å; L835-Y837 VanDerWaalsContact C-N 3.33Å; L835-Y837 PolarHBondContact O-N 3.04Å; L835-I838 PolarHBondContact O-N 2.99Å; L835-M839 WeakPolarHBondContact O-CB 3.49Å; L835-M839 PolarHBondContact O-N 3.18Å; L835-V865 HydrophobicContact CB-CG1 3.78Å; L835-L869 HydrophobicContact CD1-CD1 4.01Å; L835-L869 HydrophobicContact CD1-CD2 3.76Å; L835-L869 HydrophobicContact CD1-CG 4.36Å; L835-V922 HydrophobicContact CD2-CG1 3.92Å; L835-V922 HydrophobicContact CG-CG1 4.14Å; L835-L925 HydrophobicContact CD1-CB 3.75Å; L835-L925 HydrophobicContact CD1-CD1 4.11Å; L835-L925 HydrophobicContact CD2-CB 4.25Å; L835-W926 HydrophobicContact CD2-CB 3.79Å; L835-W926 HydrophobicContact CD2-CE3 4.44Å
836	C	93.6	Very high	93	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.02	14%	0.135	C	C	.	.	H	α-helix	trans	-64.6	-34.7	174.6	-71.2	0	0	0	0	112.8	F740 V832 K833 K840	F740-C836 HydrophobicContact CD1-CB 3.46Å; F740-C836 VanDerWaalsContact CD1-CB 3.46Å; F740-C836 HydrophobicContact CE1-CB 3.59Å; F740-C836 HydrophobicContact CG-CB 4.01Å; F740-C836 HydrophobicContact CZ-CB 4.22Å; V832-C836 WeakPolarHBondContact O-CB 3.13Å; V832-C836 PolarHBondContact O-N 3.46Å; V832-C836 PolarHBondContact O-SG 3.41Å; K833-C836 PolarHBondContact O-N 3.03Å; C836-K840 WeakPolarHBondContact O-CB 3.35Å; C836-K840 PolarHBondContact O-N 3.12Å; C836-K840 VanDerWaalsContact O-N 3.12Å
837	Y	91.1	Very high	93	Very high	8 Å²	8	30.5 Å²	30.5	3%	0.031	15%	0.149	C	C	.	.	H	α-helix	trans	-70.2	-47.3	174.4	-83.7	-121.5	0	0	0	111.1	Y696 A701 G739 F740 G741 F742 K833 I834 L835 M839 K840 V841	Y696-Y837 AromaticContact CD2-CD1 3.94Å; Y696-Y837 HydrophobicContact CD2-CD1 3.94Å; Y696-Y837 HydrophobicContact CD2-CD2 4.07Å; Y696-Y837 HydrophobicContact CD2-CE1 4.23Å; Y696-Y837 HydrophobicContact CD2-CE2 4.29Å; Y696-Y837 AromaticContact CD2-CG 3.85Å; Y696-Y837 HydrophobicContact CD2-CG 3.85Å; Y696-Y837 HydrophobicContact CE2-CD1 4.38Å; Y696-Y837 HydrophobicContact CE2-CD2 4.22Å; Y696-Y837 HydrophobicContact CE2-CE1 4.23Å; Y696-Y837 AromaticContact CE2-CE2 3.99Å; Y696-Y837 HydrophobicContact CE2-CE2 3.99Å; Y696-Y837 HydrophobicContact CE2-CG 4.38Å; A701-Y837 HydrophobicContact CB-CE1 3.8Å; A701-Y837 WeakPolarHBondContact CB-OH 3.45Å; G739-Y837 WeakPolarHBondContact O-CE2 3.5Å; G739-Y837 PolarHBondContact O-OH 2.92Å; F740-Y837 HydrophobicContact CB-CE2 4.5Å; F740-Y837 HydrophobicContact CD1-CE2 4.38Å; G741-Y837 PolarHBondContact O-OH 3.48Å; F742-Y837 AromaticContact CD1-CD1 3.92Å; F742-Y837 HydrophobicContact CD1-CD1 3.92Å; F742-Y837 AromaticContact CD1-CE1 3.98Å; F742-Y837 HydrophobicContact CD1-CE1 3.98Å; F742-Y837 AromaticContact CE1-CD1 3.64Å; F742-Y837 HydrophobicContact CE1-CD1 3.64Å; F742-Y837 HydrophobicContact CE1-CE1 4.18Å; F742-Y837 HydrophobicContact CE1-CG 4.12Å; K833-Y837 WeakPolarHBondContact O-CD2 3.49Å; K833-Y837 PolarHBondContact O-N 3.32Å; I834-Y837 PolarHBondContact O-N 3.28Å; L835-Y837 VanDerWaalsContact C-N 3.33Å; L835-Y837 PolarHBondContact O-N 3.04Å; Y837-M839 VanDerWaalsContact C-N 3.35Å; Y837-M839 PolarHBondContact O-N 3.44Å; Y837-K840 PolarHBondContact O-N 3.14Å; Y837-K840 VanDerWaalsContact O-N 3.12Å; Y837-V841 WeakPolarHBondContact O-CG2 3.37Å; Y837-V841 PolarHBondContact O-N 2.86Å
838	I	93.1	Very high	93.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-57.2	-48.2	177.2	-66.6	158.1	0	0	0	110.8	C692 C695 I834 L835 K840 V841 F842 V922 W926 F1018	C692-I838 HydrophobicContact CB-CD1 3.53Å; C695-I838 HydrophobicContact CB-CG1 3.92Å; I834-I838 HydrophobicContact CG2-CD1 3.69Å; I834-I838 HydrophobicContact CG2-CG1 4.37Å; I834-I838 WeakPolarHBondContact O-CD1 3.34Å; I834-I838 VanDerWaalsContact O-CG1 3.28Å; I834-I838 WeakPolarHBondContact O-CG1 3.19Å; I834-I838 PolarHBondContact O-N 3.4Å; L835-I838 PolarHBondContact O-N 2.99Å; I838-K840 VanDerWaalsContact C-N 3.3Å; I838-K840 PolarHBondContact O-N 3.14Å; I838-V841 PolarHBondContact O-N 3.41Å; I838-V841 VanDerWaalsContact O-N 3.15Å; I838-F842 WeakPolarHBondContact O-CB 3.31Å; I838-F842 PolarHBondContact O-N 3.3Å; I838-V922 HydrophobicContact CD1-CG1 4.17Å; I838-W926 HydrophobicContact CB-CE3 4.37Å; I838-W926 HydrophobicContact CG2-CD2 3.54Å; I838-W926 HydrophobicContact CG2-CE3 3.63Å; I838-W926 HydrophobicContact CG2-CG 4.24Å; I838-W926 HydrophobicContact CG2-CH2 3.78Å; I838-W926 HydrophobicContact CG2-CZ2 3.66Å; I838-W926 HydrophobicContact CG2-CZ3 3.74Å; I838-F1018 HydrophobicContact CG2-CE1 4.36Å; I838-F1018 HydrophobicContact CG2-CZ 4.07Å
839	M	95.1	Very high	93	Very high	2 Å²	2	27.9 Å²	27.9	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-60	-40	177	176.3	55	77	0	0	111.9	L835 Y837 F842 A843 Y861 V865 W926 L929 F992	L835-M839 WeakPolarHBondContact O-CB 3.49Å; L835-M839 PolarHBondContact O-N 3.18Å; Y837-M839 VanDerWaalsContact C-N 3.35Å; Y837-M839 PolarHBondContact O-N 3.44Å; M839-F842 HydrophobicContact SD-CD1 4.18Å; M839-A843 VanDerWaalsContact O-CB 3.28Å; M839-A843 WeakPolarHBondContact O-CB 3.4Å; M839-A843 PolarHBondContact O-N 3.12Å; M839-Y861 HydrophobicContact CG-CD1 4.45Å; M839-Y861 HydrophobicContact CG-CG 4.35Å; M839-Y861 HydrophobicContact SD-CD1 3.87Å; M839-Y861 HydrophobicContact SD-CG 4.29Å; M839-V865 HydrophobicContact CB-CG2 3.61Å; M839-V865 HydrophobicContact CE-CG2 4.41Å; M839-V865 HydrophobicContact CG-CG2 3.75Å; M839-W926 HydrophobicContact CB-CZ3 4.21Å; M839-W926 HydrophobicContact CE-CH2 4.22Å; M839-W926 HydrophobicContact CE-CZ3 3.92Å; M839-L929 HydrophobicContact CE-CD1 4.37Å; M839-L929 HydrophobicContact CE-CD2 3.35Å; M839-F992 HydrophobicContact CE-CE1 3.76Å; M839-F992 HydrophobicContact CE-CZ 3.59Å; M839-F992 HydrophobicContact SD-CZ 4Å
840	K	91.4	Very high	92.9	Very high	20 Å²	20	28.2 Å²	28.2	9%	0.087	13%	0.134	C	C	.	.	H	α-helix	trans	-68.5	-34.8	176.1	-175.6	-180	-77.8	-175.1	0	112.6	F740 F742 C836 Y837 I838 K844	F740-K840 PolarHBondContact O-NZ 2.85Å; F742-K840 HydrophobicContact CD1-CD 4.13Å; F742-K840 HydrophobicContact CD2-CD 4.02Å; F742-K840 HydrophobicContact CD2-CG 4.5Å; F742-K840 HydrophobicContact CE1-CB 4.26Å; F742-K840 HydrophobicContact CE1-CD 3.7Å; F742-K840 HydrophobicContact CE1-CG 4.15Å; F742-K840 HydrophobicContact CE2-CB 4.37Å; F742-K840 HydrophobicContact CE2-CD 3.59Å; F742-K840 HydrophobicContact CE2-CG 3.63Å; F742-K840 HydrophobicContact CG-CD 4.28Å; F742-K840 HydrophobicContact CZ-CB 3.68Å; F742-K840 HydrophobicContact CZ-CD 3.43Å; F742-K840 VanDerWaalsContact CZ-CD 3.43Å; F742-K840 HydrophobicContact CZ-CG 3.42Å; F742-K840 VanDerWaalsContact CZ-CG 3.42Å; C836-K840 WeakPolarHBondContact O-CB 3.35Å; C836-K840 PolarHBondContact O-N 3.12Å; C836-K840 VanDerWaalsContact O-N 3.12Å; Y837-K840 PolarHBondContact O-N 3.14Å; Y837-K840 VanDerWaalsContact O-N 3.12Å; I838-K840 VanDerWaalsContact C-N 3.3Å; I838-K840 PolarHBondContact O-N 3.14Å; K840-K844 WeakPolarHBondContact O-CB 3.43Å; K840-K844 PolarHBondContact O-N 2.9Å; K840-K844 VanDerWaalsContact O-N 3.11Å
841	V	91.3	Very high	92.8	Very high	2 Å²	2	25.1 Å²	25.1	1%	0.012	13%	0.131	C	C	.	.	H	α-helix	trans	-66.7	-51.9	172.7	171.7	0	0	0	0	110.1	F699 F742 Y837 I838 A843 K844 M845 F1018	F699-V841 HydrophobicContact CB-CG2 4.08Å; F699-V841 HydrophobicContact CD1-CG2 4.21Å; F699-V841 HydrophobicContact CD2-CB 4.44Å; F699-V841 HydrophobicContact CD2-CG1 4.09Å; F699-V841 HydrophobicContact CD2-CG2 3.49Å; F699-V841 VanDerWaalsContact CD2-CG2 3.49Å; F699-V841 HydrophobicContact CE2-CB 4.42Å; F699-V841 HydrophobicContact CE2-CG1 3.59Å; F699-V841 HydrophobicContact CE2-CG2 3.9Å; F699-V841 HydrophobicContact CG-CG2 3.64Å; F699-V841 HydrophobicContact CZ-CG1 3.85Å; F699-V841 HydrophobicContact CZ-CG2 4.43Å; F742-V841 HydrophobicContact CE1-CG2 4.48Å; F742-V841 HydrophobicContact CE2-CG2 4.33Å; F742-V841 HydrophobicContact CZ-CG2 3.69Å; Y837-V841 WeakPolarHBondContact O-CG2 3.37Å; Y837-V841 PolarHBondContact O-N 2.86Å; I838-V841 PolarHBondContact O-N 3.41Å; I838-V841 VanDerWaalsContact O-N 3.15Å; V841-A843 PolarHBondContact O-N 3.44Å; V841-K844 CarbonylContact O-C 3.42Å; V841-K844 WeakPolarHBondContact O-CA 3.46Å; V841-K844 WeakPolarHBondContact O-CB 3.44Å; V841-K844 PolarHBondContact O-N 3.25Å; V841-M845 HydrophobicContact CG1-CG 4.08Å; V841-M845 WeakPolarHBondContact O-CG 3.48Å; V841-M845 PolarHBondContact O-N 3.01Å; V841-F1018 HydrophobicContact CG1-CD1 3.96Å; V841-F1018 HydrophobicContact CG1-CE1 4.01Å; V841-F1018 HydrophobicContact CG1-CG 4.41Å
842	F	94.3	Very high	92.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-51.8	-52.1	175.8	179.8	-101	0	0	0	112	I838 M839 K844 M845 C846 W926 L930 A991 F992 F999 F1018 L1023	I838-F842 WeakPolarHBondContact O-CB 3.31Å; I838-F842 PolarHBondContact O-N 3.3Å; M839-F842 HydrophobicContact SD-CD1 4.18Å; F842-K844 PolarHBondContact O-N 3.22Å; F842-M845 PolarHBondContact O-N 3.29Å; F842-C846 PolarHBondContact O-N 3.38Å; F842-C846 PolarHBondContact O-SG 3.37Å; F842-W926 HydrophobicContact CB-CH2 3.95Å; F842-W926 HydrophobicContact CB-CZ2 4.26Å; F842-W926 HydrophobicContact CD1-CH2 4.26Å; F842-W926 HydrophobicContact CD2-CH2 4.35Å; F842-W926 HydrophobicContact CD2-CZ2 4.09Å; F842-W926 AromaticContact CG-CH2 3.95Å; F842-W926 HydrophobicContact CG-CH2 3.95Å; F842-W926 HydrophobicContact CG-CZ2 4.15Å; F842-L930 HydrophobicContact CZ-CD2 4.29Å; F842-A991 WeakPolarHBondContact CZ-O 3.37Å; F842-F992 AromaticContact CE1-CD2 3.89Å; F842-F992 HydrophobicContact CE1-CD2 3.89Å; F842-F992 AromaticContact CE1-CE2 3.88Å; F842-F992 HydrophobicContact CE1-CE2 3.88Å; F842-F992 HydrophobicContact CE1-CG 4.36Å; F842-F992 HydrophobicContact CE1-CZ 4.35Å; F842-F999 HydrophobicContact CD2-CE2 4.49Å; F842-F1018 HydrophobicContact CB-CE1 4.23Å; F842-L1023 HydrophobicContact CD2-CD1 4.18Å; F842-L1023 HydrophobicContact CE2-CD1 4.06Å; F842-L1023 HydrophobicContact CE2-CD2 4.08Å
843	A	94.4	Very high	92.1	Very high	2 Å²	2	29.1 Å²	29.1	2%	0.017	15%	0.154	C	C	.	.	H	α-helix	trans	-64.9	-24.1	177.9	0	0	0	0	0	114	M839 V841 I848 G849 Y861	M839-A843 VanDerWaalsContact O-CB 3.28Å; M839-A843 WeakPolarHBondContact O-CB 3.4Å; M839-A843 PolarHBondContact O-N 3.12Å; V841-A843 PolarHBondContact O-N 3.44Å; A843-I848 HydrophobicContact CB-CG1 4.04Å; A843-I848 CarbonylContact O-C 3.59Å; A843-I848 WeakPolarHBondContact O-CG1 3.23Å; A843-I848 PolarHBondContact O-N 2.88Å; A843-G849 PolarHBondContact O-N 3.2Å; A843-G849 VanDerWaalsContact O-N 3.08Å; A843-Y861 HydrophobicContact CB-CD2 3.88Å; A843-Y861 HydrophobicContact CB-CE2 3.74Å; A843-Y861 HydrophobicContact CB-CG 4.34Å
844	K	91.1	Very high	91.9	Very high	148 Å²	148	26.4 Å²	26.4	64%	0.643	15%	0.145	S	C	*	.	H	α-helix	trans	-79.2	-44.4	173	-174.1	-174.4	176.1	-169.8	0	111.7	K840 V841 F842 C846 D847	K840-K844 WeakPolarHBondContact O-CB 3.43Å; K840-K844 PolarHBondContact O-N 2.9Å; K840-K844 VanDerWaalsContact O-N 3.11Å; V841-K844 CarbonylContact O-C 3.42Å; V841-K844 WeakPolarHBondContact O-CA 3.46Å; V841-K844 WeakPolarHBondContact O-CB 3.44Å; V841-K844 PolarHBondContact O-N 3.25Å; F842-K844 PolarHBondContact O-N 3.22Å; K844-C846 VanDerWaalsContact C-N 3.33Å; K844-C846 PolarHBondContact O-N 3.11Å; K844-D847 PolarHBondContact O-N 3.11Å; K844-D847 VanDerWaalsContact O-N 3.09Å
845	M	91.6	Very high	91.9	Very high	70 Å²	70	26.7 Å²	26.7	35%	0.345	15%	0.147	S	C	.	.	H	α-helix	trans	-66.5	-35.6	-178.4	-64.4	-62.3	-71.7	0	0	111.8	V841 F842 D847 F1018 P1020	V841-M845 HydrophobicContact CG1-CG 4.08Å; V841-M845 WeakPolarHBondContact O-CG 3.48Å; V841-M845 PolarHBondContact O-N 3.01Å; F842-M845 PolarHBondContact O-N 3.29Å; M845-D847 VanDerWaalsContact C-N 3.3Å; M845-D847 PolarHBondContact O-N 2.95Å; M845-F1018 HydrophobicContact CE-CB 4.41Å; M845-F1018 VanDerWaalsContact CE-O 3.27Å; M845-F1018 WeakPolarHBondContact CE-O 3.49Å; M845-F1018 HydrophobicContact CG-CB 4.25Å; M845-P1020 HydrophobicContact CE-CG 4Å
846	C	93.8	Very high	91.9	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.007	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	2.3	172.6	-56.7	0	0	0	0	114.2	F842 K844 I848 F987 A991 T1024	F842-C846 PolarHBondContact O-N 3.38Å; F842-C846 PolarHBondContact O-SG 3.37Å; K844-C846 VanDerWaalsContact C-N 3.33Å; K844-C846 PolarHBondContact O-N 3.11Å; C846-I848 VanDerWaalsContact C-N 3.27Å; C846-I848 HydrophobicContact CB-CD1 4.05Å; C846-I848 HydrophobicContact CB-CG1 4.02Å; C846-I848 HydrophobicContact CB-CG2 4.42Å; C846-I848 WeakPolarHBondContact O-CG2 3.3Å; C846-I848 PolarHBondContact O-N 3.47Å; C846-F987 WeakPolarHBondContact O-CE1 3.43Å; C846-A991 HydrophobicContact CB-CB 4.17Å; C846-T1024 HydrophobicContact CB-CG2 3.98Å
847	D	93.7	Very high	91.9	Very high	58 Å²	58	28.1 Å²	28.1	31%	0.31	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	30.9	-178.6	-159.4	32.1	0	0	0	115.7	K844 M845 R853 A1029	K844-D847 PolarHBondContact O-N 3.11Å; K844-D847 VanDerWaalsContact O-N 3.09Å; M845-D847 VanDerWaalsContact C-N 3.3Å; M845-D847 PolarHBondContact O-N 2.95Å; D847-R853 IonicContact OD1-CZ 3.38Å; D847-R853 IonicContact OD1-NH1 3.29Å; D847-R853 PolarHBondContact OD1-NH1 3.06Å; D847-R853 IonicContact OD1-NH2 3.67Å; D847-R853 IonicContact OD2-CZ 3.49Å; D847-R853 IonicContact OD2-NH1 3.51Å; D847-R853 PolarHBondContact OD2-NH1 3.38Å; D847-R853 IonicContact OD2-NH2 2.69Å; D847-R853 PolarHBondContact OD2-NH2 2.97Å; D847-A1029 HydrophobicContact CB-CB 4.1Å; D847-A1029 WeakPolarHBondContact O-CB 3.41Å
848	I	94.6	Very high	91.9	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.171	C	C	.	.			trans	-107.8	10.4	-177.7	60.2	179	0	0	0	114.2	A843 C846 S855 L856 Y861 F987 I988 A991 F992	A843-I848 HydrophobicContact CB-CG1 4.04Å; A843-I848 CarbonylContact O-C 3.59Å; A843-I848 WeakPolarHBondContact O-CG1 3.23Å; A843-I848 PolarHBondContact O-N 2.88Å; C846-I848 VanDerWaalsContact C-N 3.27Å; C846-I848 HydrophobicContact CB-CD1 4.05Å; C846-I848 HydrophobicContact CB-CG1 4.02Å; C846-I848 HydrophobicContact CB-CG2 4.42Å; C846-I848 WeakPolarHBondContact O-CG2 3.3Å; C846-I848 PolarHBondContact O-N 3.47Å; I848-S855 WeakPolarHBondContact O-CB 3.4Å; I848-S855 PolarHBondContact O-OG 2.98Å; I848-S855 VanDerWaalsContact O-OG 3.13Å; I848-L856 PolarHBondContact O-N 3.5Å; I848-Y861 WeakPolarHBondContact CB-OH 3.36Å; I848-Y861 WeakPolarHBondContact CD1-OH 3.32Å; I848-Y861 WeakPolarHBondContact CG1-OH 3.41Å; I848-Y861 WeakPolarHBondContact O-CE2 3.48Å; I848-Y861 PolarHBondContact O-OH 3.25Å; I848-F987 HydrophobicContact CG2-CD1 3.55Å; I848-F987 HydrophobicContact CG2-CE1 3.58Å; I848-I988 HydrophobicContact CB-CG1 3.96Å; I848-I988 HydrophobicContact CD1-CG1 4.29Å; I848-I988 HydrophobicContact CD1-CG2 4.46Å; I848-I988 HydrophobicContact CG2-CG1 3.83Å; I848-A991 HydrophobicContact CD1-CB 4.26Å; I848-F992 HydrophobicContact CD1-CE2 4.5Å
849	G	92.2	Very high	91.9	Very high	26 Å²	26	32.3 Å²	32.3	27%	0.268	18%	0.18	S	C	.	.			trans	-100.9	6.5	-171.8	0	0	0	0	0	117.3	A843 L856	A843-G849 PolarHBondContact O-N 3.2Å; A843-G849 VanDerWaalsContact O-N 3.08Å; G849-L856 CarbonylContact C-O 3.59Å; G849-L856 WeakPolarHBondContact CA-O 3.35Å
850	D	89.8	Confident	92	Very high	44 Å²	44	32.2 Å²	32.2	24%	0.235	18%	0.18	C	C	.	.			trans	-119.4	102.8	-177.3	-175.2	-1.3	0	0	0	112.7	S852 R853 S855 L856 K1040	D850-S852 VanDerWaalsContact CG-OG 3.3Å; D850-S852 PolarHBondContact O-N 2.89Å; D850-S852 WeakPolarHBondContact OD1-CA 3.4Å; D850-S852 WeakPolarHBondContact OD1-CB 3.3Å; D850-S852 PolarHBondContact OD1-N 2.96Å; D850-S852 PolarHBondContact OD1-OG 2.82Å; D850-S852 PolarHBondContact OD2-OG 2.65Å; D850-R853 HydrophobicContact CB-CB 4.3Å; D850-R853 HydrophobicContact CB-CG 4.29Å; D850-R853 PolarHBondContact O-N 2.88Å; D850-R853 VanDerWaalsContact OD2-CD 3.24Å; D850-R853 WeakPolarHBondContact OD2-CD 3.25Å; D850-R853 VanDerWaalsContact OD2-CG 3.23Å; D850-R853 WeakPolarHBondContact OD2-CG 3.34Å; D850-S855 PolarHBondContact N-OG 3.38Å; D850-S855 PolarHBondContact O-N 3.38Å; D850-S855 PolarHBondContact O-OG 2.94Å; D850-L856 PolarHBondContact N-O 2.85Å; D850-K1040 IonicContact OD1-NZ 3.06Å; D850-K1040 IonicContact OD2-NZ 2.98Å; D850-K1040 PolarHBondContact OD2-NZ 3.26Å
851	A	89.5	Confident	92.3	Very high	43 Å²	43	31.4 Å²	31.4	36%	0.355	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-63.4	-26.2	175.9	0	0	0	0	0	113.8	R853 G854 S855 L856 I1041	A851-R853 PolarHBondContact O-N 2.92Å; A851-G854 PolarHBondContact O-N 3.49Å; A851-S855 WeakPolarHBondContact CA-O 3.4Å; A851-L856 PolarHBondContact N-O 2.9Å; A851-I1041 WeakPolarHBondContact O-CD1 3.44Å
852	S	85.7	Confident	92.5	Very high	49 Å²	49	31.5 Å²	31.5	34%	0.343	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-74.5	-7.1	175.4	71.6	0	0	0	0	113.4	D850 K1040 I1041	D850-S852 VanDerWaalsContact CG-OG 3.3Å; D850-S852 PolarHBondContact O-N 2.89Å; D850-S852 WeakPolarHBondContact OD1-CA 3.4Å; D850-S852 WeakPolarHBondContact OD1-CB 3.3Å; D850-S852 PolarHBondContact OD1-N 2.96Å; D850-S852 PolarHBondContact OD1-OG 2.82Å; D850-S852 PolarHBondContact OD2-OG 2.65Å; S852-K1040 CarbonylContact O-C 3.59Å; S852-K1040 VanDerWaalsContact O-CA 3.3Å; S852-K1040 WeakPolarHBondContact O-CA 3.28Å; S852-K1040 VanDerWaalsContact OG-CD 3.32Å; S852-K1040 WeakPolarHBondContact OG-CD 3.46Å; S852-K1040 PolarHBondContact OG-NZ 2.81Å; S852-I1041 PolarHBondContact O-N 2.56Å
853	R	88.6	Confident	92.7	Very high	69 Å²	69	31.5 Å²	31.5	26%	0.26	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-106.5	10	167.8	-64	178	62	-157.5	-12.9	113	D847 D850 A851 C1034 G1039 K1040	D847-R853 IonicContact OD1-CZ 3.38Å; D847-R853 IonicContact OD1-NH1 3.29Å; D847-R853 PolarHBondContact OD1-NH1 3.06Å; D847-R853 IonicContact OD1-NH2 3.67Å; D847-R853 IonicContact OD2-CZ 3.49Å; D847-R853 IonicContact OD2-NH1 3.51Å; D847-R853 PolarHBondContact OD2-NH1 3.38Å; D847-R853 IonicContact OD2-NH2 2.69Å; D847-R853 PolarHBondContact OD2-NH2 2.97Å; D850-R853 HydrophobicContact CB-CB 4.3Å; D850-R853 HydrophobicContact CB-CG 4.29Å; D850-R853 PolarHBondContact O-N 2.88Å; D850-R853 VanDerWaalsContact OD2-CD 3.24Å; D850-R853 WeakPolarHBondContact OD2-CD 3.25Å; D850-R853 VanDerWaalsContact OD2-CG 3.23Å; D850-R853 WeakPolarHBondContact OD2-CG 3.34Å; A851-R853 PolarHBondContact O-N 2.92Å; R853-C1034 PolarHBondContact O-SG 2.98Å; R853-C1034 VanDerWaalsContact O-SG 3.39Å; R853-G1039 WeakPolarHBondContact CG-O 3.46Å; R853-K1040 HydrophobicContact CG-CD 3.99Å
854	G	87.2	Confident	92.9	Very high	9 Å²	9	31.6 Å²	31.6	9%	0.093	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.6	7.6	177	0	0	0	0	0	116	A851	A851-G854 PolarHBondContact O-N 3.49Å
855	S	93.5	Very high	93.2	Very high	6 Å²	6	24.5 Å²	24.5	4%	0.042	15%	0.146	C	C	.	.	S	Bend	trans	-91.1	-161	170.8	70.6	0	0	0	0	111.5	I848 D850 A851	I848-S855 WeakPolarHBondContact O-CB 3.4Å; I848-S855 PolarHBondContact O-OG 2.98Å; I848-S855 VanDerWaalsContact O-OG 3.13Å; D850-S855 PolarHBondContact N-OG 3.38Å; D850-S855 PolarHBondContact O-N 3.38Å; D850-S855 PolarHBondContact O-OG 2.94Å; A851-S855 WeakPolarHBondContact CA-O 3.4Å
856	L	94.4	Very high	93.5	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.005	13%	0.13	C	C	.	.			trans	-88.2	156.2	175.7	-77.3	177.5	0	0	0	111.2	I848 G849 D850 A851 A860 Y861 M864 I964 I966 L980 I988	I848-L856 PolarHBondContact O-N 3.5Å; G849-L856 CarbonylContact C-O 3.59Å; G849-L856 WeakPolarHBondContact CA-O 3.35Å; D850-L856 PolarHBondContact N-O 2.85Å; A851-L856 PolarHBondContact N-O 2.9Å; L856-A860 HydrophobicContact CB-CB 4.4Å; L856-A860 HydrophobicContact CD2-CB 4.15Å; L856-Y861 HydrophobicContact CB-CD2 4.12Å; L856-Y861 HydrophobicContact CB-CE1 4.42Å; L856-Y861 HydrophobicContact CB-CE2 3.45Å; L856-Y861 VanDerWaalsContact CB-CE2 3.45Å; L856-Y861 HydrophobicContact CD1-CD1 4.39Å; L856-Y861 HydrophobicContact CD1-CE1 3.81Å; L856-Y861 HydrophobicContact CD1-CE2 4.34Å; L856-M864 HydrophobicContact CD1-SD 4.36Å; L856-I964 HydrophobicContact CD1-CG2 4.24Å; L856-I966 HydrophobicContact CD1-CD1 4.15Å; L856-I966 HydrophobicContact CD2-CD1 4.3Å; L856-L980 HydrophobicContact CD2-CD1 3.92Å; L856-L980 HydrophobicContact CD2-CD2 4.31Å; L856-L980 HydrophobicContact CD2-CG 4.19Å; L856-L980 HydrophobicContact CG-CD1 4.1Å; L856-L980 HydrophobicContact CG-CD2 4.15Å; L856-L980 HydrophobicContact CG-CG 4.47Å; L856-I988 HydrophobicContact CD1-CD1 4.42Å; L856-I988 HydrophobicContact CG-CD1 4.26Å
857	S	93.1	Very high	93.7	Very high	33 Å²	33	21.3 Å²	21.3	23%	0.231	13%	0.13	C	C	.	.			trans	-78.9	150.3	170.5	69	0	0	0	0	111	Y859 A860 Y861	S857-Y859 PolarHBondContact O-N 3.24Å; S857-Y859 VanDerWaalsContact O-N 3.11Å; S857-A860 WeakPolarHBondContact O-CB 3.23Å; S857-A860 PolarHBondContact O-N 3.4Å; S857-A860 PolarHBondContact OG-N 3.04Å; S857-Y861 WeakPolarHBondContact O-CD2 3.44Å; S857-Y861 PolarHBondContact O-N 3.19Å
858	S	91.7	Very high	93.9	Very high	46 Å²	46	18.6 Å²	18.6	32%	0.322	12%	0.115	S	C	.	.	H	α-helix	trans	-60.3	-21	173.3	70.6	0	0	0	0	113.9	T862	S858-T862 PolarHBondContact O-N 2.9Å; S858-T862 VanDerWaalsContact O-N 3.14Å; S858-T862 PolarHBondContact O-OG1 3.18Å
859	Y	94.3	Very high	94	Very high	50 Å²	50	18.6 Å²	18.6	20%	0.196	12%	0.115	C	C	.	.	H	α-helix	trans	-67.4	-45.2	168.7	173.4	-120.1	0	0	0	112.3	N818 L822 S857 Y861 T862 L863 D968 P969 L976	N818-Y859 PolarHBondContact ND2-OH 2.6Å; N818-Y859 VanDerWaalsContact ND2-OH 3.12Å; N818-Y859 PolarHBondContact OD1-OH 2.72Å; L822-Y859 HydrophobicContact CD1-CE2 4.11Å; L822-Y859 HydrophobicContact CD2-CD2 3.74Å; L822-Y859 HydrophobicContact CD2-CE2 3.68Å; S857-Y859 PolarHBondContact O-N 3.24Å; S857-Y859 VanDerWaalsContact O-N 3.11Å; Y859-Y861 VanDerWaalsContact C-N 3.35Å; Y859-Y861 PolarHBondContact O-N 2.9Å; Y859-T862 WeakPolarHBondContact O-CA 3.48Å; Y859-T862 VanDerWaalsContact O-CB 3.26Å; Y859-T862 WeakPolarHBondContact O-CB 3.35Å; Y859-T862 PolarHBondContact O-N 3.42Å; Y859-L863 HydrophobicContact CE1-CD1 4.06Å; Y859-L863 HydrophobicContact CE2-CD1 4.42Å; Y859-L863 HydrophobicContact CE2-CD2 3.85Å; Y859-L863 HydrophobicContact CE2-CG 4.13Å; Y859-L863 PolarHBondContact O-N 3.26Å; Y859-D968 VanDerWaalsContact CE1-OD2 3.25Å; Y859-D968 WeakPolarHBondContact CE1-OD2 3.35Å; Y859-D968 PolarHBondContact OH-OD2 3.46Å; Y859-P969 WeakPolarHBondContact OH-CD 3.46Å; Y859-L976 HydrophobicContact CD1-CD1 3.8Å; Y859-L976 HydrophobicContact CD1-CD2 4.36Å; Y859-L976 HydrophobicContact CE1-CD1 3.78Å; Y859-L976 HydrophobicContact CE1-CD2 4.42Å
860	A	96.4	Very high	94.2	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-59.6	-43.5	177.4	0	0	0	0	0	112.1	L856 S857 T862 L863 M864 I966 L976	L856-A860 HydrophobicContact CB-CB 4.4Å; L856-A860 HydrophobicContact CD2-CB 4.15Å; S857-A860 WeakPolarHBondContact O-CB 3.23Å; S857-A860 PolarHBondContact O-N 3.4Å; S857-A860 PolarHBondContact OG-N 3.04Å; A860-T862 VanDerWaalsContact C-N 3.29Å; A860-T862 PolarHBondContact O-N 3.05Å; A860-L863 WeakPolarHBondContact O-CB 3.48Å; A860-L863 PolarHBondContact O-N 3.01Å; A860-M864 PolarHBondContact O-N 2.84Å; A860-I966 HydrophobicContact CB-CD1 3.97Å; A860-L976 HydrophobicContact CB-CB 3.98Å; A860-L976 HydrophobicContact CB-CD1 3.87Å
861	Y	97.3	Very high	94.5	Very high	2 Å²	2	17.1 Å²	17.1	1%	0.008	10%	0.1	C	C	.	.	H	α-helix	trans	-64	-32.1	172.5	-67.7	-69.5	0	0	0	113.3	M839 A843 I848 L856 S857 Y859 M864 V865 F992	M839-Y861 HydrophobicContact CG-CD1 4.45Å; M839-Y861 HydrophobicContact CG-CG 4.35Å; M839-Y861 HydrophobicContact SD-CD1 3.87Å; M839-Y861 HydrophobicContact SD-CG 4.29Å; A843-Y861 HydrophobicContact CB-CD2 3.88Å; A843-Y861 HydrophobicContact CB-CE2 3.74Å; A843-Y861 HydrophobicContact CB-CG 4.34Å; I848-Y861 WeakPolarHBondContact CB-OH 3.36Å; I848-Y861 WeakPolarHBondContact CD1-OH 3.32Å; I848-Y861 WeakPolarHBondContact CG1-OH 3.41Å; I848-Y861 WeakPolarHBondContact O-CE2 3.48Å; I848-Y861 PolarHBondContact O-OH 3.25Å; L856-Y861 HydrophobicContact CB-CD2 4.12Å; L856-Y861 HydrophobicContact CB-CE1 4.42Å; L856-Y861 HydrophobicContact CB-CE2 3.45Å; L856-Y861 VanDerWaalsContact CB-CE2 3.45Å; L856-Y861 HydrophobicContact CD1-CD1 4.39Å; L856-Y861 HydrophobicContact CD1-CE1 3.81Å; L856-Y861 HydrophobicContact CD1-CE2 4.34Å; S857-Y861 WeakPolarHBondContact O-CD2 3.44Å; S857-Y861 PolarHBondContact O-N 3.19Å; Y859-Y861 VanDerWaalsContact C-N 3.35Å; Y859-Y861 PolarHBondContact O-N 2.9Å; Y861-M864 HydrophobicContact CD1-SD 3.98Å; Y861-M864 HydrophobicContact CE1-SD 4.45Å; Y861-M864 WeakPolarHBondContact O-CB 3.32Å; Y861-M864 PolarHBondContact O-N 2.73Å; Y861-V865 WeakPolarHBondContact O-CG2 3.44Å; Y861-V865 PolarHBondContact O-N 3.33Å; Y861-F992 HydrophobicContact CD1-CZ 4.41Å; Y861-F992 HydrophobicContact CE1-CE2 4.05Å; Y861-F992 HydrophobicContact CE1-CZ 4.26Å
862	T	96.6	Very high	94.7	Very high	5 Å²	5	18.3 Å²	18.3	3%	0.031	10%	0.096	C	C	.	.	H	α-helix	trans	-64.3	-41.7	173.3	-55	0	0	0	0	110.6	F740 L822 S858 Y859 A860 M864 V865 L866	F740-T862 HydrophobicContact CD2-CG2 3.66Å; F740-T862 HydrophobicContact CE2-CG2 3.58Å; F740-T862 HydrophobicContact CZ-CG2 4.39Å; L822-T862 HydrophobicContact CD2-CG2 3.72Å; L822-T862 HydrophobicContact CG-CG2 4.2Å; S858-T862 PolarHBondContact O-N 2.9Å; S858-T862 VanDerWaalsContact O-N 3.14Å; S858-T862 PolarHBondContact O-OG1 3.18Å; Y859-T862 WeakPolarHBondContact O-CA 3.48Å; Y859-T862 VanDerWaalsContact O-CB 3.26Å; Y859-T862 WeakPolarHBondContact O-CB 3.35Å; Y859-T862 PolarHBondContact O-N 3.42Å; A860-T862 VanDerWaalsContact C-N 3.29Å; A860-T862 PolarHBondContact O-N 3.05Å; T862-M864 VanDerWaalsContact C-N 3.33Å; T862-M864 PolarHBondContact O-N 2.87Å; T862-V865 PolarHBondContact O-N 3.4Å; T862-L866 HydrophobicContact CG2-CD1 4.38Å; T862-L866 WeakPolarHBondContact O-CG 3.33Å; T862-L866 PolarHBondContact O-N 2.94Å
863	L	97.9	Very high	95	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-63.9	-36.7	173.8	-59.1	-174	0	0	0	112.2	L822 Y859 A860 L866 F867 I946 I966 P969 L976	L822-L863 HydrophobicContact CD1-CD2 4.12Å; Y859-L863 HydrophobicContact CE1-CD1 4.06Å; Y859-L863 HydrophobicContact CE2-CD1 4.42Å; Y859-L863 HydrophobicContact CE2-CD2 3.85Å; Y859-L863 HydrophobicContact CE2-CG 4.13Å; Y859-L863 PolarHBondContact O-N 3.26Å; A860-L863 WeakPolarHBondContact O-CB 3.48Å; A860-L863 PolarHBondContact O-N 3.01Å; L863-L866 PolarHBondContact O-N 2.85Å; L863-F867 WeakPolarHBondContact O-CB 3.27Å; L863-F867 PolarHBondContact O-N 3.37Å; L863-I946 HydrophobicContact CB-CG2 4.45Å; L863-I946 HydrophobicContact CD2-CD1 3.59Å; L863-I946 HydrophobicContact CD2-CG1 4.17Å; L863-I946 WeakPolarHBondContact O-CG2 3.27Å; L863-I966 HydrophobicContact CB-CG2 4.18Å; L863-I966 HydrophobicContact CD1-CG2 4.1Å; L863-P969 HydrophobicContact CD2-CG 4.46Å; L863-L976 HydrophobicContact CD1-CD1 3.61Å
864	M	98	Very high	95.3	Very high	3 Å²	3	21.8 Å²	21.8	2%	0.015	12%	0.118	C	C	.	.	H	α-helix	trans	-62.1	-44.2	173.7	-68.8	174.6	70.3	0	0	112.4	L856 A860 Y861 T862 F867 F868 Y933 F939 V944 I966 F992	L856-M864 HydrophobicContact CD1-SD 4.36Å; A860-M864 PolarHBondContact O-N 2.84Å; Y861-M864 HydrophobicContact CD1-SD 3.98Å; Y861-M864 HydrophobicContact CE1-SD 4.45Å; Y861-M864 WeakPolarHBondContact O-CB 3.32Å; Y861-M864 PolarHBondContact O-N 2.73Å; T862-M864 VanDerWaalsContact C-N 3.33Å; T862-M864 PolarHBondContact O-N 2.87Å; M864-F867 PolarHBondContact O-N 2.8Å; M864-F868 PolarHBondContact O-N 3.36Å; M864-Y933 VanDerWaalsContact CA-OH 3.31Å; M864-Y933 WeakPolarHBondContact CA-OH 3.5Å; M864-Y933 HydrophobicContact CB-CE2 3.88Å; M864-Y933 WeakPolarHBondContact CB-OH 3.29Å; M864-Y933 HydrophobicContact CE-CD1 3.93Å; M864-Y933 HydrophobicContact CE-CD2 3.99Å; M864-Y933 HydrophobicContact CE-CE1 3.84Å; M864-Y933 HydrophobicContact CE-CE2 3.9Å; M864-Y933 HydrophobicContact CE-CG 4Å; M864-Y933 PolarHBondContact O-OH 3.37Å; M864-Y933 VanDerWaalsContact O-OH 3.08Å; M864-F939 HydrophobicContact CE-CZ 4.15Å; M864-V944 HydrophobicContact CG-CG1 4.13Å; M864-I966 HydrophobicContact CG-CD1 3.92Å; M864-I966 HydrophobicContact SD-CD1 3.83Å; M864-F992 HydrophobicContact CE-CE1 4.44Å; M864-F992 HydrophobicContact CE-CZ 4.21Å
865	V	98.1	Very high	95.7	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61.1	-45.7	175	175.9	0	0	0	0	111	L835 M839 Y861 T862 F868 L869 L929	L835-V865 HydrophobicContact CB-CG1 3.78Å; M839-V865 HydrophobicContact CB-CG2 3.61Å; M839-V865 HydrophobicContact CE-CG2 4.41Å; M839-V865 HydrophobicContact CG-CG2 3.75Å; Y861-V865 WeakPolarHBondContact O-CG2 3.44Å; Y861-V865 PolarHBondContact O-N 3.33Å; T862-V865 PolarHBondContact O-N 3.4Å; V865-F868 PolarHBondContact O-N 2.8Å; V865-L869 HydrophobicContact CG1-CD1 3.89Å; V865-L869 VanDerWaalsContact O-CG 3.26Å; V865-L869 WeakPolarHBondContact O-CG 2.91Å; V865-L869 PolarHBondContact O-N 3.21Å; V865-L869 VanDerWaalsContact O-N 3.11Å; V865-L929 HydrophobicContact CB-CD1 4.16Å; V865-L929 HydrophobicContact CG1-CD1 4.3Å; V865-L929 HydrophobicContact CG2-CD1 3.75Å
866	L	97.9	Very high	95.8	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-63.1	-43.6	178.5	-67.1	173.7	0	0	0	111.9	L822 Y825 V832 T862 L863 L869 Q870 I877 I946	L822-L866 HydrophobicContact CD1-CD1 4.05Å; L822-L866 HydrophobicContact CG-CD1 4.06Å; Y825-L866 HydrophobicContact CD1-CD2 4.48Å; Y825-L866 HydrophobicContact CD2-CD1 3.83Å; Y825-L866 HydrophobicContact CD2-CD2 4.21Å; Y825-L866 HydrophobicContact CE2-CD1 4.41Å; Y825-L866 HydrophobicContact CG-CD1 4.36Å; Y825-L866 HydrophobicContact CG-CD2 3.9Å; V832-L866 HydrophobicContact CG1-CD2 3.73Å; T862-L866 HydrophobicContact CG2-CD1 4.38Å; T862-L866 WeakPolarHBondContact O-CG 3.33Å; T862-L866 PolarHBondContact O-N 2.94Å; L863-L866 PolarHBondContact O-N 2.85Å; L866-L869 PolarHBondContact O-N 3.47Å; L866-Q870 WeakPolarHBondContact O-CG 3.49Å; L866-Q870 PolarHBondContact O-N 3.15Å; L866-I877 HydrophobicContact CB-CD1 4.22Å; L866-I877 HydrophobicContact CD2-CD1 3.48Å; L866-I877 VanDerWaalsContact CD2-CD1 3.48Å; L866-I877 HydrophobicContact CG-CD1 4.46Å; L866-I946 HydrophobicContact CB-CD1 4.48Å; L866-I946 HydrophobicContact CB-CG2 4.07Å; L866-I946 HydrophobicContact CD1-CD1 3.95Å
867	F	97.9	Very high	95.9	Very high	4 Å²	4	22 Å²	22	2%	0.018	12%	0.117	C	C	.	.	H	α-helix	trans	-61.1	-46.3	178	-177.8	-104.5	0	0	0	112.5	L863 M864 L869 Q870 Q871 F932 F937 V944 C945 I946	L863-F867 WeakPolarHBondContact O-CB 3.27Å; L863-F867 PolarHBondContact O-N 3.37Å; M864-F867 PolarHBondContact O-N 2.8Å; F867-L869 VanDerWaalsContact C-N 3.3Å; F867-L869 PolarHBondContact O-N 3.03Å; F867-Q870 PolarHBondContact O-N 3.4Å; F867-Q871 HydrophobicContact CD1-CG 4.24Å; F867-Q871 HydrophobicContact CD2-CG 4.18Å; F867-Q871 HydrophobicContact CE1-CG 3.9Å; F867-Q871 HydrophobicContact CE2-CG 3.84Å; F867-Q871 HydrophobicContact CG-CG 4.39Å; F867-Q871 HydrophobicContact CZ-CG 3.7Å; F867-Q871 WeakPolarHBondContact O-CB 3.13Å; F867-Q871 WeakPolarHBondContact O-CG 3.41Å; F867-Q871 PolarHBondContact O-N 2.94Å; F867-F932 HydrophobicContact CD1-CE1 4.08Å; F867-F932 HydrophobicContact CD1-CZ 4.3Å; F867-F932 HydrophobicContact CE1-CE1 4.11Å; F867-F932 AromaticContact CE1-CZ 3.96Å; F867-F932 HydrophobicContact CE1-CZ 3.96Å; F867-F937 HydrophobicContact CD1-CE2 4.49Å; F867-F937 AromaticContact CE1-CD2 3.86Å; F867-F937 HydrophobicContact CE1-CD2 3.86Å; F867-F937 AromaticContact CE1-CE2 3.42Å; F867-F937 HydrophobicContact CE1-CE2 3.42Å; F867-F937 VanDerWaalsContact CE1-CE2 3.42Å; F867-F937 HydrophobicContact CE1-CZ 4.17Å; F867-F937 AromaticContact CZ-CE2 3.87Å; F867-F937 HydrophobicContact CZ-CE2 3.87Å; F867-V944 HydrophobicContact CB-CG1 3.66Å; F867-V944 HydrophobicContact CD1-CG1 4.05Å; F867-V944 HydrophobicContact CD1-CG2 4.44Å; F867-V944 HydrophobicContact CD2-CG1 4.41Å; F867-V944 HydrophobicContact CG-CG1 3.79Å; F867-C945 VanDerWaalsContact CD2-O 3.25Å; F867-C945 WeakPolarHBondContact CD2-O 3.34Å; F867-C945 WeakPolarHBondContact CE2-O 3.48Å; F867-I946 HydrophobicContact CB-CG2 3.82Å
868	F	97.8	Very high	96	Very high	1 Å²	1	20.7 Å²	20.7	0%	0.004	11%	0.108	C	C	.	.	H	α-helix	trans	-56.5	-44.4	173.8	164.9	-103.5	0	0	0	111.8	M864 V865 Q870 Q871 R872 L925 G928 L929 F932 Y933	M864-F868 PolarHBondContact O-N 3.36Å; V865-F868 PolarHBondContact O-N 2.8Å; F868-Q870 VanDerWaalsContact C-N 3.31Å; F868-Q870 PolarHBondContact O-N 3.25Å; F868-Q871 PolarHBondContact O-N 3.25Å; F868-R872 PolarHBondContact O-N 3.33Å; F868-L925 HydrophobicContact CE1-CB 4.36Å; F868-L925 HydrophobicContact CE1-CD2 4.19Å; F868-L925 VanDerWaalsContact CE1-O 3.22Å; F868-L925 WeakPolarHBondContact CE1-O 3.46Å; F868-L925 HydrophobicContact CZ-CD2 4.4Å; F868-L925 WeakPolarHBondContact CZ-O 3.4Å; F868-G928 VanDerWaalsContact CE2-C 3.44Å; F868-G928 WeakPolarHBondContact CE2-O 3.33Å; F868-G928 VanDerWaalsContact CZ-C 3.43Å; F868-L929 HydrophobicContact CB-CD1 4.2Å; F868-L929 HydrophobicContact CB-CG 4.25Å; F868-L929 HydrophobicContact CD1-CB 3.72Å; F868-L929 HydrophobicContact CD1-CD1 3.88Å; F868-L929 HydrophobicContact CD1-CG 4.02Å; F868-L929 HydrophobicContact CD2-CB 4.31Å; F868-L929 HydrophobicContact CE1-CB 3.8Å; F868-L929 HydrophobicContact CE2-CB 4.36Å; F868-L929 HydrophobicContact CG-CB 3.98Å; F868-L929 HydrophobicContact CG-CD1 4.18Å; F868-L929 HydrophobicContact CG-CG 4.02Å; F868-L929 HydrophobicContact CZ-CB 4.12Å; F868-L929 VanDerWaalsContact CZ-N 3.34Å; F868-F932 HydrophobicContact CB-CD1 4.26Å; F868-F932 HydrophobicContact CB-CE1 4.46Å; F868-F932 HydrophobicContact CD2-CB 3.63Å; F868-F932 AromaticContact CD2-CD1 3.81Å; F868-F932 HydrophobicContact CD2-CD1 3.81Å; F868-F932 HydrophobicContact CD2-CD2 4.27Å; F868-F932 AromaticContact CD2-CG 3.66Å; F868-F932 HydrophobicContact CD2-CG 3.66Å; F868-F932 HydrophobicContact CE2-CB 3.81Å; F868-F932 HydrophobicContact CE2-CG 4.23Å; F868-F932 HydrophobicContact CG-CD1 4.5Å; F868-Y933 HydrophobicContact CB-CE2 4.35Å
869	L	97.4	Very high	96.2	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-71.5	-22.2	-179	-67.4	174.2	0	0	0	113.9	V832 L835 V865 L866 F867 V876 I877 L925	V832-L869 HydrophobicContact CG1-CD1 4.5Å; V832-L869 HydrophobicContact CG2-CD1 4.16Å; L835-L869 HydrophobicContact CD1-CD1 4.01Å; L835-L869 HydrophobicContact CD1-CD2 3.76Å; L835-L869 HydrophobicContact CD1-CG 4.36Å; V865-L869 HydrophobicContact CG1-CD1 3.89Å; V865-L869 VanDerWaalsContact O-CG 3.26Å; V865-L869 WeakPolarHBondContact O-CG 2.91Å; V865-L869 PolarHBondContact O-N 3.21Å; V865-L869 VanDerWaalsContact O-N 3.11Å; L866-L869 PolarHBondContact O-N 3.47Å; F867-L869 VanDerWaalsContact C-N 3.3Å; F867-L869 PolarHBondContact O-N 3.03Å; L869-V876 HydrophobicContact CB-CB 4.17Å; L869-V876 HydrophobicContact CD2-CB 3.88Å; L869-V876 HydrophobicContact CD2-CG1 4.1Å; L869-V876 HydrophobicContact CD2-CG2 3.88Å; L869-V876 PolarHBondContact O-N 3.03Å; L869-I877 HydrophobicContact CB-CD1 3.93Å; L869-I877 HydrophobicContact CB-CG1 3.81Å; L869-I877 PolarHBondContact O-N 3.27Å; L869-L925 HydrophobicContact CD2-CD1 4.22Å; L869-L925 HydrophobicContact CD2-CD2 4.23Å
870	Q	96.3	Very high	96.2	Very high	2 Å²	2	16.6 Å²	16.6	1%	0.009	9%	0.086	C	C	.	.	H	α-helix	trans	-80.4	-39.6	170.2	-70.9	172.2	-32.7	0	0	112.5	Y825 L866 F867 F868 R872 I877 P878 V879 I946	Y825-Q870 PolarHBondContact OH-NE2 3.01Å; Y825-Q870 VanDerWaalsContact OH-NE2 3.15Å; L866-Q870 WeakPolarHBondContact O-CG 3.49Å; L866-Q870 PolarHBondContact O-N 3.15Å; F867-Q870 PolarHBondContact O-N 3.4Å; F868-Q870 VanDerWaalsContact C-N 3.31Å; F868-Q870 PolarHBondContact O-N 3.25Å; Q870-R872 VanDerWaalsContact C-N 3.33Å; Q870-I877 HydrophobicContact CG-CD1 4.12Å; Q870-I877 HydrophobicContact CG-CG1 3.78Å; Q870-P878 PolarHBondContact NE2-O 2.98Å; Q870-V879 HydrophobicContact CG-CG2 4.39Å; Q870-I946 PolarHBondContact NE2-O 3.02Å; Q870-I946 VanDerWaalsContact OE1-CA 3.23Å; Q870-I946 PolarHBondContact OE1-O 2.88Å
871	Q	94.6	Very high	96.1	Very high	37 Å²	37	16.7 Å²	16.7	17%	0.173	9%	0.086	C	C	.	.	H	α-helix	trans	-84.3	-4.3	-179	-64.2	-71.6	-54.1	0	0	113.3	F867 F868 F932 H949	F867-Q871 HydrophobicContact CD1-CG 4.24Å; F867-Q871 HydrophobicContact CD2-CG 4.18Å; F867-Q871 HydrophobicContact CE1-CG 3.9Å; F867-Q871 HydrophobicContact CE2-CG 3.84Å; F867-Q871 HydrophobicContact CG-CG 4.39Å; F867-Q871 HydrophobicContact CZ-CG 3.7Å; F867-Q871 WeakPolarHBondContact O-CB 3.13Å; F867-Q871 WeakPolarHBondContact O-CG 3.41Å; F867-Q871 PolarHBondContact O-N 2.94Å; F868-Q871 PolarHBondContact O-N 3.25Å; Q871-F932 HydrophobicContact CB-CZ 4.35Å; Q871-H949 PolarHBondContact NE2-O 3.19Å
872	R	94.8	Very high	95.9	Very high	68 Å²	68	20.5 Å²	20.5	26%	0.257	10%	0.104	S	C	.	.	S	Bend	trans	-64.7	149.3	174.5	-161.2	65	179.2	167.1	-1.6	110.6	F868 Q870 P874 P875 E920 L925	F868-R872 PolarHBondContact O-N 3.33Å; Q870-R872 VanDerWaalsContact C-N 3.33Å; R872-P874 CarbonylContact C-O 3.54Å; R872-P874 CarbonylContact O-C 3.54Å; R872-P875 WeakPolarHBondContact O-CA 3.46Å; R872-P875 WeakPolarHBondContact O-CD 3.26Å; R872-E920 VanDerWaalsContact CG-OE1 3.3Å; R872-E920 WeakPolarHBondContact CG-OE1 3.38Å; R872-E920 IonicContact CZ-OE1 2.73Å; R872-E920 IonicContact CZ-OE2 2.6Å; R872-E920 IonicContact NE-OE1 3.33Å; R872-E920 PolarHBondContact NE-OE1 3.38Å; R872-E920 IonicContact NE-OE2 3.22Å; R872-E920 PolarHBondContact NE-OE2 2.85Å; R872-E920 IonicContact NH2-OE1 2.87Å; R872-E920 IonicContact NH2-OE2 2.72Å; R872-E920 PolarHBondContact NH2-OE2 3.42Å; R872-L925 HydrophobicContact CG-CD2 4.29Å
873	N	91.5	Very high	95.6	Very high	148 Å²	148	21.1 Å²	21.1	79%	0.791	11%	0.107	S	C	*	.	S	Bend	trans	-123.4	110.2	178.1	-175.2	15.1	0	0	0	110.8
874	P	94.1	Very high	95.2	Very high	43 Å²	43	24.9 Å²	24.9	28%	0.279	12%	0.122	S	C	.	.	S	Bend	cis	-68.2	156	-6.5	29.5	-35.8	0	0	0	112.4	R872 Q917 N918	R872-P874 CarbonylContact C-O 3.54Å; R872-P874 CarbonylContact O-C 3.54Å; P874-Q917 HydrophobicContact CB-CB 4.28Å; P874-N918 HydrophobicContact CG-CB 3.95Å; P874-N918 PolarHBondContact O-ND2 2.89Å
875	P	95.4	Very high	94	Very high	14 Å²	14	28.4 Å²	28.4	9%	0.091	16%	0.159	C	C	.	.			trans	-70.5	147.5	-178.2	25.7	-34.2	0	0	0	112.8	R872 W912 L914	R872-P875 WeakPolarHBondContact O-CA 3.46Å; R872-P875 WeakPolarHBondContact O-CD 3.26Å; P875-W912 HydrophobicContact CB-CZ2 4.21Å; P875-W912 HydrophobicContact CG-CZ2 3.96Å; P875-L914 HydrophobicContact CG-CB 4.22Å; P875-L914 HydrophobicContact CG-CD1 3.61Å
876	V	96.2	Very high	92.9	Very high	5 Å²	5	30.7 Å²	30.7	3%	0.03	18%	0.183	C	C	.	.	S	Bend	trans	-89.4	-31.6	176.8	176	0	0	0	0	111.2	L869 N918 L925	L869-V876 HydrophobicContact CB-CB 4.17Å; L869-V876 HydrophobicContact CD2-CB 3.88Å; L869-V876 HydrophobicContact CD2-CG1 4.1Å; L869-V876 HydrophobicContact CD2-CG2 3.88Å; L869-V876 PolarHBondContact O-N 3.03Å; V876-N918 HydrophobicContact CG2-CB 3.84Å; V876-N918 VanDerWaalsContact CG2-CG 3.42Å; V876-L925 HydrophobicContact CG2-CD1 4.02Å; V876-L925 HydrophobicContact CG2-CD2 3.99Å
877	I	96.1	Very high	91.8	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.227	C	C	.	.	S	Bend	trans	-137	154.5	175.9	58.1	177.8	0	0	0	110.8	Y825 I828 V832 L866 L869 Q870	Y825-I877 HydrophobicContact CD1-CB 4.33Å; Y825-I877 HydrophobicContact CD1-CD1 3.82Å; Y825-I877 HydrophobicContact CE1-CD1 4.2Å; Y825-I877 HydrophobicContact CG-CD1 4.42Å; I828-I877 HydrophobicContact CB-CG2 4.36Å; I828-I877 HydrophobicContact CG2-CG2 4.07Å; V832-I877 HydrophobicContact CG2-CG2 3.52Å; L866-I877 HydrophobicContact CB-CD1 4.22Å; L866-I877 HydrophobicContact CD2-CD1 3.48Å; L866-I877 VanDerWaalsContact CD2-CD1 3.48Å; L866-I877 HydrophobicContact CG-CD1 4.46Å; L869-I877 HydrophobicContact CB-CD1 3.93Å; L869-I877 HydrophobicContact CB-CG1 3.81Å; L869-I877 PolarHBondContact O-N 3.27Å; Q870-I877 HydrophobicContact CG-CD1 4.12Å; Q870-I877 HydrophobicContact CG-CG1 3.78Å
878	P	95.6	Very high	91	Very high	7 Å²	7	45.3 Å²	45.3	5%	0.045	26%	0.259	C	S	.	.			trans	-82.5	-178.8	176.9	34.9	-35	0	0	0	112	Y825 I828 Q870 L880 I883 L908 W912	Y825-P878 VanDerWaalsContact CE1-O 3.3Å; Y825-P878 WeakPolarHBondContact CE1-O 3.42Å; I828-P878 HydrophobicContact CD1-CG 4.17Å; Q870-P878 PolarHBondContact NE2-O 2.98Å; P878-L880 HydrophobicContact CG-CD2 3.85Å; P878-L880 HydrophobicContact CG-CG 4.34Å; P878-I883 HydrophobicContact CB-CD1 3.67Å; P878-I883 HydrophobicContact CG-CD1 3.99Å; P878-L908 HydrophobicContact CG-CD1 4.23Å; P878-L908 HydrophobicContact CG-CD2 4.41Å; P878-W912 HydrophobicContact CB-CD2 3.73Å; P878-W912 HydrophobicContact CB-CE3 4.1Å; P878-W912 HydrophobicContact CB-CG 4.04Å; P878-W912 HydrophobicContact CB-CZ2 4.15Å; P878-W912 HydrophobicContact CG-CD2 4.15Å; P878-W912 HydrophobicContact CG-CE3 4Å; P878-W912 HydrophobicContact CG-CZ3 4.28Å
879	V	96.1	Very high	90.5	Very high	9 Å²	9	48.5 Å²	48.5	6%	0.055	27%	0.273	C	S	.	.			trans	-92.1	99.2	159.1	179	0	0	0	0	108.5	Q870 Q881 E882 R947 H949	Q870-V879 HydrophobicContact CG-CG2 4.39Å; V879-Q881 HydrophobicContact CG1-CB 4.33Å; V879-Q881 PolarHBondContact O-N 3.28Å; V879-Q881 VanDerWaalsContact O-N 3.1Å; V879-E882 HydrophobicContact CB-CB 4.25Å; V879-E882 HydrophobicContact CB-CG 4.36Å; V879-E882 WeakPolarHBondContact CB-OE2 3.23Å; V879-E882 HydrophobicContact CG1-CB 4Å; V879-E882 HydrophobicContact CG1-CG 3.73Å; V879-E882 WeakPolarHBondContact CG1-OE2 3.46Å; V879-E882 PolarHBondContact O-N 3.02Å; V879-R947 WeakPolarHBondContact CG1-O 3.28Å; V879-H949 HydrophobicContact CG2-CB 4.07Å
880	L	94.6	Very high	90.1	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.5	-178.1	-68.2	176	0	0	0	113.2	L821 Y825 I828 P878 E882 F901 F902 L908	L821-L880 HydrophobicContact CD1-CB 4.25Å; L821-L880 HydrophobicContact CD1-CD1 4.34Å; Y825-L880 HydrophobicContact CD1-CD1 3.79Å; Y825-L880 HydrophobicContact CD1-CG 4.15Å; Y825-L880 HydrophobicContact CD2-CD1 4.42Å; Y825-L880 HydrophobicContact CE1-CB 4.21Å; Y825-L880 HydrophobicContact CE1-CD1 3.63Å; Y825-L880 HydrophobicContact CE1-CG 3.53Å; Y825-L880 HydrophobicContact CE2-CD1 4.3Å; Y825-L880 HydrophobicContact CG-CD1 4.18Å; Y825-L880 PolarHBondContact OH-N 2.74Å; I828-L880 HydrophobicContact CD1-CD1 4.19Å; I828-L880 HydrophobicContact CD1-CD2 4.1Å; I828-L880 HydrophobicContact CD1-CG 4.36Å; P878-L880 HydrophobicContact CG-CD2 3.85Å; P878-L880 HydrophobicContact CG-CG 4.34Å; L880-E882 VanDerWaalsContact C-N 3.33Å; L880-F901 HydrophobicContact CB-CB 4.28Å; L880-F901 HydrophobicContact CD1-CD2 4.5Å; L880-F901 WeakPolarHBondContact O-CA 3.41Å; L880-F902 HydrophobicContact CD2-CB 4.32Å; L880-F902 HydrophobicContact CD2-CD1 4.33Å; L880-F902 PolarHBondContact O-N 2.98Å; L880-L908 HydrophobicContact CD2-CD1 4.31Å
881	Q	94.3	Very high	89.7	Confident	2 Å²	2	58.2 Å²	58.2	1%	0.009	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-4.7	176.7	-69.4	172.5	-90.9	0	0	113.6	V879 K889 F901 R947 P969 F970	V879-Q881 HydrophobicContact CG1-CB 4.33Å; V879-Q881 PolarHBondContact O-N 3.28Å; V879-Q881 VanDerWaalsContact O-N 3.1Å; Q881-K889 WeakPolarHBondContact O-CE 3.35Å; Q881-K889 PolarHBondContact O-NZ 2.83Å; Q881-F901 HydrophobicContact CG-CB 3.76Å; Q881-R947 HydrophobicContact CB-CB 4.35Å; Q881-R947 VanDerWaalsContact CD-CB 3.49Å; Q881-P969 PolarHBondContact NE2-O 2.91Å; Q881-F970 HydrophobicContact CG-CE1 4.41Å
882	E	92.4	Very high	89.4	Confident	82 Å²	82	59.8 Å²	59.8	38%	0.383	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-6	174.8	-71.4	178.2	143.8	0	0	112.7	V879 L880 Y884 Q948 H949	V879-E882 HydrophobicContact CB-CB 4.25Å; V879-E882 HydrophobicContact CB-CG 4.36Å; V879-E882 WeakPolarHBondContact CB-OE2 3.23Å; V879-E882 HydrophobicContact CG1-CB 4Å; V879-E882 HydrophobicContact CG1-CG 3.73Å; V879-E882 WeakPolarHBondContact CG1-OE2 3.46Å; V879-E882 PolarHBondContact O-N 3.02Å; L880-E882 VanDerWaalsContact C-N 3.33Å; E882-Y884 WeakPolarHBondContact O-CD1 3.1Å; E882-Y884 WeakPolarHBondContact O-CE1 3.22Å; E882-Q948 VanDerWaalsContact CD-CA 3.49Å; E882-Q948 VanDerWaalsContact OE1-CA 3.27Å; E882-Q948 WeakPolarHBondContact OE1-CA 3.46Å; E882-Q948 WeakPolarHBondContact OE1-CB 3.1Å; E882-H949 PolarHBondContact OE1-N 3.29Å; E882-H949 WeakPolarHBondContact OE2-CB 3.2Å; E882-H949 PolarHBondContact OE2-N 2.89Å
883	I	91.1	Very high	89.2	Confident	19 Å²	19	62 Å²	62	10%	0.097	35%	0.351	C	S	.	.			trans	-89	118.7	175.4	-63.3	-179.9	0	0	0	109.8	P878 Y900 F902 L908 H911 W912	P878-I883 HydrophobicContact CB-CD1 3.67Å; P878-I883 HydrophobicContact CG-CD1 3.99Å; I883-Y900 PolarHBondContact O-OH 3.15Å; I883-F902 HydrophobicContact CB-CB 3.98Å; I883-F902 HydrophobicContact CB-CD2 4.43Å; I883-F902 HydrophobicContact CB-CG 4.18Å; I883-F902 HydrophobicContact CG2-CB 4.05Å; I883-F902 HydrophobicContact CG2-CD1 4.18Å; I883-F902 HydrophobicContact CG2-CD2 3.6Å; I883-F902 HydrophobicContact CG2-CE2 4.03Å; I883-F902 HydrophobicContact CG2-CG 3.68Å; I883-F902 HydrophobicContact CG2-CZ 4.48Å; I883-L908 HydrophobicContact CD1-CD1 3.55Å; I883-H911 HydrophobicContact CG2-CB 3.89Å; I883-W912 HydrophobicContact CD1-CB 4.11Å; I883-W912 HydrophobicContact CD1-CG 4.48Å
884	Y	89	Confident	88.8	Confident	78 Å²	78	56.4 Å²	56.4	31%	0.306	32%	0.322	S	S	.	.			trans	-155.5	159.6	171	45.7	-89.3	0	0	0	110.3	E882 G886 T888 K889 Y900	E882-Y884 WeakPolarHBondContact O-CD1 3.1Å; E882-Y884 WeakPolarHBondContact O-CE1 3.22Å; Y884-G886 VanDerWaalsContact CD2-O 3.24Å; Y884-G886 WeakPolarHBondContact CD2-O 3.43Å; Y884-G886 VanDerWaalsContact CE2-O 3.31Å; Y884-G886 WeakPolarHBondContact CE2-O 3.41Å; Y884-T888 VanDerWaalsContact CD2-O 3.32Å; Y884-T888 WeakPolarHBondContact CD2-O 3.2Å; Y884-T888 WeakPolarHBondContact CE2-O 3.27Å; Y884-K889 HydrophobicContact CD1-CB 4.07Å; Y884-K889 HydrophobicContact CD1-CG 4.13Å; Y884-K889 HydrophobicContact CE1-CB 3.6Å; Y884-K889 HydrophobicContact CE1-CD 4.36Å; Y884-K889 HydrophobicContact CE1-CG 3.98Å; Y884-K889 HydrophobicContact CE2-CB 4.38Å; Y884-Y900 HydrophobicContact CD1-CE1 4.49Å
885	G	73.2	Confident	88.1	Confident	77 Å²	77	58.4 Å²	58.4	79%	0.794	33%	0.331	S	S	*	.	S	Bend	trans	-93.8	9.4	-172.9	0	0	0	0	0	116.3
886	G	74.4	Confident	87.6	Confident	48 Å²	48	60.7 Å²	60.7	50%	0.495	36%	0.357	S	S	.	.	S	Bend	trans	-126.5	178.1	-178	0	0	0	0	0	112.6	Y884 T888	Y884-G886 VanDerWaalsContact CD2-O 3.24Å; Y884-G886 WeakPolarHBondContact CD2-O 3.43Å; Y884-G886 VanDerWaalsContact CE2-O 3.31Å; Y884-G886 WeakPolarHBondContact CE2-O 3.41Å; G886-T888 VanDerWaalsContact C-N 3.32Å
887	E	74.3	Confident	87.3	Confident	197 Å²	197	63.2 Å²	63.2	92%	0.921	37%	0.366	S	S	*	.	S	Bend	trans	-71.2	-27.1	179	-63.1	-179.5	163.6	0	0	112.8
888	T	81.8	Confident	87.1	Confident	115 Å²	115	65 Å²	65	71%	0.706	38%	0.376	S	S	*	.	S	Bend	trans	-117	146.2	179.2	54.1	0	0	0	0	111.9	Y884 G886	Y884-T888 VanDerWaalsContact CD2-O 3.32Å; Y884-T888 WeakPolarHBondContact CD2-O 3.2Å; Y884-T888 WeakPolarHBondContact CE2-O 3.27Å; G886-T888 VanDerWaalsContact C-N 3.32Å
889	K	86.3	Confident	87	Confident	68 Å²	68	64.9 Å²	64.9	30%	0.296	38%	0.375	S	S	.	.			trans	-65.4	129	174.4	178.8	168	172.7	165.3	0	109.9	Q881 Y884 Y900	Q881-K889 WeakPolarHBondContact O-CE 3.35Å; Q881-K889 PolarHBondContact O-NZ 2.83Å; Y884-K889 HydrophobicContact CD1-CB 4.07Å; Y884-K889 HydrophobicContact CD1-CG 4.13Å; Y884-K889 HydrophobicContact CE1-CB 3.6Å; Y884-K889 HydrophobicContact CE1-CD 4.36Å; Y884-K889 HydrophobicContact CE1-CG 3.98Å; Y884-K889 HydrophobicContact CE2-CB 4.38Å; K889-Y900 HydrophobicContact CG-CD1 4.3Å
890	P	90.1	Very high	86.9	Confident	50 Å²	50	66.6 Å²	66.6	33%	0.325	38%	0.38	S	S	.	.			trans	-61.2	142.7	173.7	-24.3	34.5	0	0	0	112.1	N898 Y900	P890-N898 PolarHBondContact O-ND2 3.02Å; P890-N898 PolarHBondContact O-OD1 2.69Å; P890-Y900 HydrophobicContact CB-CD1 4.24Å; P890-Y900 HydrophobicContact CB-CD2 3.77Å; P890-Y900 HydrophobicContact CB-CE1 4.41Å; P890-Y900 HydrophobicContact CB-CE2 3.95Å; P890-Y900 HydrophobicContact CB-CG 3.92Å; P890-Y900 HydrophobicContact CG-CD1 4.26Å; P890-Y900 HydrophobicContact CG-CD2 4.19Å; P890-Y900 HydrophobicContact CG-CE1 3.96Å; P890-Y900 HydrophobicContact CG-CE2 3.88Å; P890-Y900 HydrophobicContact CG-CG 4.37Å; P890-Y900 WeakPolarHBondContact O-CB 3.15Å
891	E	87.9	Confident	86.9	Confident	155 Å²	155	67.1 Å²	67.1	72%	0.724	38%	0.383	S	S	*	.			trans	-108.7	116.3	177	-63.3	-170.7	153.9	0	0	110.7
892	V	89.3	Confident	86.8	Confident	71 Å²	71	68 Å²	68	43%	0.43	39%	0.387	S	S	.	.			trans	-122.2	97.1	171.2	-178.8	0	0	0	0	106.3	N898 V899 Y900	V892-N898 PolarHBondContact N-OD1 3.47Å; V892-N898 CarbonylContact O-C 3.52Å; V892-N898 WeakPolarHBondContact O-CA 3.45Å; V892-N898 PolarHBondContact O-OD1 2.72Å; V892-V899 HydrophobicContact CB-CG2 4.34Å; V892-V899 HydrophobicContact CG1-CG2 3.96Å; V892-V899 VanDerWaalsContact O-CG2 3.3Å; V892-V899 WeakPolarHBondContact O-CG2 3.24Å; V892-V899 PolarHBondContact O-N 3.5Å; V892-Y900 HydrophobicContact CG2-CD2 4.48Å
893	L	88.8	Confident	86.7	Confident	114 Å²	114	68 Å²	68	60%	0.597	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.1	126.7	-174.5	-61.6	179.9	0	0	0	111.5	W897 N898	L893-W897 WeakPolarHBondContact CA-O 3.3Å; L893-N898 HydrophobicContact CD2-CB 4.11Å
894	V	84.6	Confident	86.6	Confident	31 Å²	31	70.2 Å²	70.2	19%	0.188	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	128.4	171.8	174.1	0	0	0	0	107.5	T813 L814 G896 W897 V899	T813-V894 HydrophobicContact CG2-CG1 4.47Å; T813-V894 WeakPolarHBondContact OG1-CG1 3.3Å; L814-V894 HydrophobicContact CD2-CB 4.42Å; L814-V894 HydrophobicContact CD2-CG1 4.13Å; V894-G896 PolarHBondContact O-N 2.72Å; V894-W897 PolarHBondContact N-O 3.14Å; V894-W897 PolarHBondContact O-N 3Å; V894-V899 HydrophobicContact CB-CG1 4.04Å; V894-V899 HydrophobicContact CB-CG2 3.9Å; V894-V899 HydrophobicContact CG2-CG2 3.55Å
895	D	79.1	Confident	86.6	Confident	84 Å²	84	68.7 Å²	68.7	45%	0.449	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.3	34.1	-177	-56.7	-18.3	0	0	0	114	T813 L814	T813-D895 PolarHBondContact OG1-OD2 2.76Å; L814-D895 HydrophobicContact CD1-CB 4.35Å; L814-D895 HydrophobicContact CD2-CB 4.44Å; L814-D895 HydrophobicContact CG-CB 4.38Å
896	G	83.6	Confident	87.3	Confident	63 Å²	63	74 Å²	74	65%	0.649	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.3	-9	-178.4	0	0	0	0	0	115.8	V894	V894-G896 PolarHBondContact O-N 2.72Å
897	W	90.4	Very high	88	Confident	57 Å²	57	74.1 Å²	74.1	22%	0.216	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	143.4	-172.7	-60.3	110.6	0	0	0	113.1	L814 L893 V894 V899 F970 L972 N973	L814-W897 HydrophobicContact CD2-CB 4.42Å; L893-W897 WeakPolarHBondContact CA-O 3.3Å; V894-W897 PolarHBondContact N-O 3.14Å; V894-W897 PolarHBondContact O-N 3Å; W897-V899 PolarHBondContact O-N 3.29Å; W897-F970 WeakPolarHBondContact CB-O 3.25Å; W897-L972 HydrophobicContact CE3-CB 4.18Å; W897-L972 HydrophobicContact CE3-CD1 4.31Å; W897-L972 HydrophobicContact CE3-CG 3.78Å; W897-L972 HydrophobicContact CH2-CB 3.74Å; W897-L972 HydrophobicContact CH2-CG 4.28Å; W897-L972 HydrophobicContact CZ3-CB 3.5Å; W897-L972 VanDerWaalsContact CZ3-CB 3.5Å; W897-L972 HydrophobicContact CZ3-CD1 4.01Å; W897-L972 HydrophobicContact CZ3-CG 3.57Å; W897-N973 HydrophobicContact CH2-CB 4.28Å; W897-N973 HydrophobicContact CZ2-CB 4.07Å
898	N	92.8	Very high	88.8	Confident	39 Å²	39	64.8 Å²	64.8	21%	0.209	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	101.1	174.9	-175.8	4.4	0	0	0	111	P890 V892 L893 Y900	P890-N898 PolarHBondContact O-ND2 3.02Å; P890-N898 PolarHBondContact O-OD1 2.69Å; V892-N898 PolarHBondContact N-OD1 3.47Å; V892-N898 CarbonylContact O-C 3.52Å; V892-N898 WeakPolarHBondContact O-CA 3.45Å; V892-N898 PolarHBondContact O-OD1 2.72Å; L893-N898 HydrophobicContact CD2-CB 4.11Å; N898-Y900 VanDerWaalsContact C-N 3.28Å; N898-Y900 PolarHBondContact O-N 3.5Å; N898-Y900 VanDerWaalsContact OD1-CB 3.22Å; N898-Y900 WeakPolarHBondContact OD1-CB 3.3Å; N898-Y900 PolarHBondContact OD1-N 2.72Å; N898-Y900 VanDerWaalsContact OD1-N 3.07Å
899	V	92.9	Very high	89.1	Confident	4 Å²	4	62.3 Å²	62.3	2%	0.024	33%	0.333	C	S	.	.			trans	-87.7	17.2	-179.8	-61.4	0	0	0	0	114	L814 H817 V892 V894 W897 F970	L814-V899 HydrophobicContact CD2-CG1 3.75Å; H817-V899 HydrophobicContact CB-CB 4.12Å; H817-V899 HydrophobicContact CB-CG1 4.2Å; H817-V899 VanDerWaalsContact CE1-CG2 3.43Å; H817-V899 WeakPolarHBondContact CE1-CG2 3.27Å; H817-V899 WeakPolarHBondContact ND1-CB 3.41Å; H817-V899 VanDerWaalsContact ND1-CG2 3.33Å; H817-V899 WeakPolarHBondContact ND1-CG2 3.41Å; V892-V899 HydrophobicContact CB-CG2 4.34Å; V892-V899 HydrophobicContact CG1-CG2 3.96Å; V892-V899 VanDerWaalsContact O-CG2 3.3Å; V892-V899 WeakPolarHBondContact O-CG2 3.24Å; V892-V899 PolarHBondContact O-N 3.5Å; V894-V899 HydrophobicContact CB-CG1 4.04Å; V894-V899 HydrophobicContact CB-CG2 3.9Å; V894-V899 HydrophobicContact CG2-CG2 3.55Å; W897-V899 PolarHBondContact O-N 3.29Å; V899-F970 HydrophobicContact CB-CD1 4.21Å; V899-F970 HydrophobicContact CB-CD2 4.47Å; V899-F970 HydrophobicContact CB-CE1 4.22Å; V899-F970 HydrophobicContact CB-CG 4.35Å; V899-F970 HydrophobicContact CB-CZ 4.4Å; V899-F970 HydrophobicContact CG1-CB 4.13Å; V899-F970 HydrophobicContact CG1-CD1 4.1Å; V899-F970 HydrophobicContact CG1-CD2 4.09Å; V899-F970 HydrophobicContact CG1-CG 3.85Å
900	Y	94.2	Very high	89.2	Confident	44 Å²	44	64.3 Å²	64.3	17%	0.173	35%	0.354	C	S	.	.			trans	-70.3	132.4	174.1	178.5	-97.4	0	0	0	112.7	I883 Y884 K889 P890 V892 N898	I883-Y900 PolarHBondContact O-OH 3.15Å; Y884-Y900 HydrophobicContact CD1-CE1 4.49Å; K889-Y900 HydrophobicContact CG-CD1 4.3Å; P890-Y900 HydrophobicContact CB-CD1 4.24Å; P890-Y900 HydrophobicContact CB-CD2 3.77Å; P890-Y900 HydrophobicContact CB-CE1 4.41Å; P890-Y900 HydrophobicContact CB-CE2 3.95Å; P890-Y900 HydrophobicContact CB-CG 3.92Å; P890-Y900 HydrophobicContact CG-CD1 4.26Å; P890-Y900 HydrophobicContact CG-CD2 4.19Å; P890-Y900 HydrophobicContact CG-CE1 3.96Å; P890-Y900 HydrophobicContact CG-CE2 3.88Å; P890-Y900 HydrophobicContact CG-CG 4.37Å; P890-Y900 WeakPolarHBondContact O-CB 3.15Å; V892-Y900 HydrophobicContact CG2-CD2 4.48Å; N898-Y900 VanDerWaalsContact C-N 3.28Å; N898-Y900 PolarHBondContact O-N 3.5Å; N898-Y900 VanDerWaalsContact OD1-CB 3.22Å; N898-Y900 WeakPolarHBondContact OD1-CB 3.3Å; N898-Y900 PolarHBondContact OD1-N 2.72Å; N898-Y900 VanDerWaalsContact OD1-N 3.07Å
901	F	94.1	Very high	89	Confident	11 Å²	11	66.2 Å²	66.2	5%	0.048	36%	0.359	C	S	.	.			trans	-150.7	160.6	164.3	67.4	-82.3	0	0	0	109.3	R820 L821 L880 Q881 D903 F970	R820-F901 HydrophobicContact CB-CE1 4.33Å; R820-F901 HydrophobicContact CB-CZ 3.75Å; L821-F901 HydrophobicContact CB-CD1 4.37Å; L821-F901 HydrophobicContact CB-CE1 4.27Å; L821-F901 HydrophobicContact CB-CE2 4.45Å; L821-F901 HydrophobicContact CB-CZ 4.33Å; L821-F901 HydrophobicContact CD1-CB 3.82Å; L821-F901 HydrophobicContact CD1-CD1 4.23Å; L821-F901 HydrophobicContact CD1-CD2 3.67Å; L821-F901 HydrophobicContact CD1-CE2 4.31Å; L821-F901 HydrophobicContact CD1-CG 3.64Å; L880-F901 HydrophobicContact CB-CB 4.28Å; L880-F901 HydrophobicContact CD1-CD2 4.5Å; L880-F901 WeakPolarHBondContact O-CA 3.41Å; Q881-F901 HydrophobicContact CG-CB 3.76Å; F901-D903 HydrophobicContact CD2-CB 4.28Å; F901-D903 HydrophobicContact CE2-CB 3.68Å; F901-D903 HydrophobicContact CZ-CB 4.31Å; F901-F970 AromaticContact CD1-CZ 3.88Å; F901-F970 HydrophobicContact CD1-CZ 3.88Å; F901-F970 HydrophobicContact CE1-CZ 4.45Å
902	F	92.7	Very high	89.1	Confident	20 Å²	20	60.1 Å²	60.1	9%	0.088	33%	0.329	C	S	.	.			trans	-77.3	118.7	177.7	-171.9	-92.5	0	0	0	111.5	L880 I883 D904 T907 L908 H911	L880-F902 HydrophobicContact CD2-CB 4.32Å; L880-F902 HydrophobicContact CD2-CD1 4.33Å; L880-F902 PolarHBondContact O-N 2.98Å; I883-F902 HydrophobicContact CB-CB 3.98Å; I883-F902 HydrophobicContact CB-CD2 4.43Å; I883-F902 HydrophobicContact CB-CG 4.18Å; I883-F902 HydrophobicContact CG2-CB 4.05Å; I883-F902 HydrophobicContact CG2-CD1 4.18Å; I883-F902 HydrophobicContact CG2-CD2 3.6Å; I883-F902 HydrophobicContact CG2-CE2 4.03Å; I883-F902 HydrophobicContact CG2-CG 3.68Å; I883-F902 HydrophobicContact CG2-CZ 4.48Å; F902-D904 WeakPolarHBondContact CE1-O 3.4Å; F902-D904 HydrophobicContact CZ-CB 4.38Å; F902-T907 WeakPolarHBondContact CZ-OG1 3.47Å; F902-L908 HydrophobicContact CD1-CD1 4.08Å; F902-L908 HydrophobicContact CE1-CB 3.96Å; F902-L908 HydrophobicContact CE1-CD1 4.01Å; F902-H911 AromaticContact CZ-CD2 3.8Å
903	D	89.3	Confident	88.9	Confident	82 Å²	82	62 Å²	62	44%	0.439	34%	0.343	S	S	.	.			trans	-117.3	-3.9	-179	69.3	-10.7	0	0	0	116	R820 F901 L905	R820-D903 IonicContact CZ-OD2 3.65Å; R820-D903 IonicContact NH2-OD2 3.89Å; R820-D903 PolarHBondContact NH2-OD2 3.16Å; F901-D903 HydrophobicContact CD2-CB 4.28Å; F901-D903 HydrophobicContact CE2-CB 3.68Å; F901-D903 HydrophobicContact CZ-CB 4.31Å; D903-L905 VanDerWaalsContact C-N 3.31Å; D903-L905 PolarHBondContact O-N 3.4Å
904	D	89.6	Confident	88.9	Confident	67 Å²	67	59.8 Å²	59.8	36%	0.358	33%	0.331	S	S	.	.			trans	-80.6	74.7	171	-176	26.5	0	0	0	112.6	F902 K906 T907 L908	F902-D904 WeakPolarHBondContact CE1-O 3.4Å; F902-D904 HydrophobicContact CZ-CB 4.38Å; D904-K906 PolarHBondContact O-N 3.49Å; D904-K906 WeakPolarHBondContact OD1-CB 3.37Å; D904-K906 PolarHBondContact OD1-N 2.96Å; D904-T907 PolarHBondContact O-N 2.98Å; D904-T907 PolarHBondContact O-OG1 2.8Å; D904-T907 WeakPolarHBondContact OD2-CB 3.47Å; D904-T907 WeakPolarHBondContact OD2-CG2 3.28Å; D904-T907 PolarHBondContact OD2-OG1 3.06Å; D904-L908 PolarHBondContact O-N 2.89Å
905	L	89.1	Confident	89.1	Confident	46 Å²	46	63.3 Å²	63.3	24%	0.241	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-13.7	179.6	-55.9	-176.5	0	0	0	114.5	S824 A827 I828 D903 L908	S824-L905 WeakPolarHBondContact O-CD1 3.15Å; A827-L905 HydrophobicContact CB-CD1 3.53Å; I828-L905 HydrophobicContact CD1-CD2 4.27Å; I828-L905 HydrophobicContact CG1-CD1 4.45Å; I828-L905 HydrophobicContact CG1-CD2 3.85Å; D903-L905 VanDerWaalsContact C-N 3.31Å; D903-L905 PolarHBondContact O-N 3.4Å; L905-L908 HydrophobicContact CD2-CD2 4.25Å
906	K	88.6	Confident	89.6	Confident	188 Å²	188	61.8 Å²	61.8	82%	0.817	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-32	177	-60.8	173.5	-177	169	0	112.7	D904	D904-K906 PolarHBondContact O-N 3.49Å; D904-K906 WeakPolarHBondContact OD1-CB 3.37Å; D904-K906 PolarHBondContact OD1-N 2.96Å
907	T	89.4	Confident	90	Very high	50 Å²	50	63.8 Å²	63.8	31%	0.307	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-6	177.6	54.3	0	0	0	0	112.7	F902 D904 P909 C910 H911	F902-T907 WeakPolarHBondContact CZ-OG1 3.47Å; D904-T907 PolarHBondContact O-N 2.98Å; D904-T907 PolarHBondContact O-OG1 2.8Å; D904-T907 WeakPolarHBondContact OD2-CB 3.47Å; D904-T907 WeakPolarHBondContact OD2-CG2 3.28Å; D904-T907 PolarHBondContact OD2-OG1 3.06Å; T907-P909 VanDerWaalsContact C-CD 3.42Å; T907-P909 VanDerWaalsContact C-N 3.33Å; T907-C910 WeakPolarHBondContact O-CA 3.45Å; T907-C910 VanDerWaalsContact O-CB 3.28Å; T907-C910 WeakPolarHBondContact O-CB 3.48Å; T907-C910 PolarHBondContact O-N 2.69Å; T907-H911 PolarHBondContact O-CD2 3.04Å; T907-H911 PolarHBondContact O-N 3.05Å
908	L	89.8	Confident	90.3	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-47	-43.2	176.6	-176.7	62.9	0	0	0	114.6	I828 P878 L880 I883 F902 D904 L905 C910 H911 W912 Y915	I828-L908 HydrophobicContact CD1-CD2 3.84Å; I828-L908 HydrophobicContact CG1-CD2 3.89Å; I828-L908 HydrophobicContact CG2-CD2 4.35Å; P878-L908 HydrophobicContact CG-CD1 4.23Å; P878-L908 HydrophobicContact CG-CD2 4.41Å; L880-L908 HydrophobicContact CD2-CD1 4.31Å; I883-L908 HydrophobicContact CD1-CD1 3.55Å; F902-L908 HydrophobicContact CD1-CD1 4.08Å; F902-L908 HydrophobicContact CE1-CB 3.96Å; F902-L908 HydrophobicContact CE1-CD1 4.01Å; D904-L908 PolarHBondContact O-N 2.89Å; L905-L908 HydrophobicContact CD2-CD2 4.25Å; L908-C910 PolarHBondContact O-N 3.02Å; L908-H911 PolarHBondContact O-N 3.04Å; L908-W912 HydrophobicContact CD1-CB 4.11Å; L908-W912 PolarHBondContact O-N 3.02Å; L908-Y915 HydrophobicContact CD2-CD2 4.21Å; L908-Y915 HydrophobicContact CD2-CE2 4.3Å; L908-Y915 HydrophobicContact CG-CD2 4.36Å
909	P	89.2	Confident	90.3	Very high	64 Å²	64	65.7 Å²	65.7	42%	0.416	36%	0.358	S	S	.	.	H	α-helix	trans	-64.4	-20.7	178.1	-22.1	35.1	0	0	0	114.4	T907 Y915	T907-P909 VanDerWaalsContact C-CD 3.42Å; T907-P909 VanDerWaalsContact C-N 3.33Å; P909-Y915 HydrophobicContact CB-CD1 4.07Å; P909-Y915 HydrophobicContact CB-CG 4.25Å; P909-Y915 HydrophobicContact CG-CD1 3.94Å; P909-Y915 HydrophobicContact CG-CD2 4.37Å; P909-Y915 HydrophobicContact CG-CE1 3.99Å; P909-Y915 HydrophobicContact CG-CE2 4.43Å; P909-Y915 HydrophobicContact CG-CG 4.15Å
910	C	87.6	Confident	90.4	Very high	109 Å²	109	67.3 Å²	67.3	74%	0.736	37%	0.365	S	S	*	.	H	α-helix	trans	-80.9	-23.5	174	-57.4	0	0	0	0	112.6	T907 L908	T907-C910 WeakPolarHBondContact O-CA 3.45Å; T907-C910 VanDerWaalsContact O-CB 3.28Å; T907-C910 WeakPolarHBondContact O-CB 3.48Å; T907-C910 PolarHBondContact O-N 2.69Å; L908-C910 PolarHBondContact O-N 3.02Å
911	H	86.1	Confident	90.5	Very high	91 Å²	91	66.8 Å²	66.8	42%	0.421	37%	0.368	S	S	.	.	H	α-helix	trans	-102.7	-17.8	-176.8	-70.4	-73.3	0	0	0	113.8	I883 F902 T907 L908	I883-H911 HydrophobicContact CG2-CB 3.89Å; F902-H911 AromaticContact CZ-CD2 3.8Å; T907-H911 PolarHBondContact O-CD2 3.04Å; T907-H911 PolarHBondContact O-N 3.05Å; L908-H911 PolarHBondContact O-N 3.04Å
912	W	90.1	Very high	90.5	Very high	27 Å²	27	66.6 Å²	66.6	10%	0.102	37%	0.368	C	S	.	.			trans	-128.1	95.4	-178.5	-177.2	49.1	0	0	0	111.8	P875 P878 I883 L908 L914 Y915	P875-W912 HydrophobicContact CB-CZ2 4.21Å; P875-W912 HydrophobicContact CG-CZ2 3.96Å; P878-W912 HydrophobicContact CB-CD2 3.73Å; P878-W912 HydrophobicContact CB-CE3 4.1Å; P878-W912 HydrophobicContact CB-CG 4.04Å; P878-W912 HydrophobicContact CB-CZ2 4.15Å; P878-W912 HydrophobicContact CG-CD2 4.15Å; P878-W912 HydrophobicContact CG-CE3 4Å; P878-W912 HydrophobicContact CG-CZ3 4.28Å; I883-W912 HydrophobicContact CD1-CB 4.11Å; I883-W912 HydrophobicContact CD1-CG 4.48Å; L908-W912 HydrophobicContact CD1-CB 4.11Å; L908-W912 PolarHBondContact O-N 3.02Å; W912-L914 HydrophobicContact CZ2-CB 4.02Å; W912-L914 PolarHBondContact O-N 3.1Å; W912-Y915 AromaticContact CE3-CD2 3.74Å; W912-Y915 HydrophobicContact CE3-CD2 3.74Å; W912-Y915 HydrophobicContact CE3-CG 4.17Å; W912-Y915 AromaticContact CZ3-CD2 3.77Å; W912-Y915 HydrophobicContact CZ3-CD2 3.77Å; W912-Y915 HydrophobicContact CZ3-CG 4.31Å; W912-Y915 VanDerWaalsContact O-CB 3.3Å; W912-Y915 WeakPolarHBondContact O-CB 3.48Å; W912-Y915 PolarHBondContact O-N 3.35Å
913	P	86.1	Confident	90.5	Very high	110 Å²	110	65.7 Å²	65.7	71%	0.714	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-12.7	-175.9	-26.1	35.9	0	0	0	116.2	Q917	P913-Q917 PolarHBondContact O-NE2 3.28Å
914	L	88.3	Confident	90.8	Very high	67 Å²	67	65.1 Å²	65.1	35%	0.351	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-1.5	176.6	-51.2	178.4	0	0	0	113	P875 W912 G916 Q917	P875-L914 HydrophobicContact CG-CB 4.22Å; P875-L914 HydrophobicContact CG-CD1 3.61Å; W912-L914 HydrophobicContact CZ2-CB 4.02Å; W912-L914 PolarHBondContact O-N 3.1Å; L914-G916 PolarHBondContact O-N 3.22Å; L914-Q917 WeakPolarHBondContact O-CB 3.42Å; L914-Q917 WeakPolarHBondContact O-CG 3.45Å; L914-Q917 PolarHBondContact O-N 3.06Å
915	Y	89.3	Confident	91.1	Very high	105 Å²	105	62 Å²	62	41%	0.412	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	120.2	179.7	-176.2	-89	0	0	0	111.8	I828 L908 P909 W912 Q917	I828-Y915 HydrophobicContact CG2-CE2 4.19Å; L908-Y915 HydrophobicContact CD2-CD2 4.21Å; L908-Y915 HydrophobicContact CD2-CE2 4.3Å; L908-Y915 HydrophobicContact CG-CD2 4.36Å; P909-Y915 HydrophobicContact CB-CD1 4.07Å; P909-Y915 HydrophobicContact CB-CG 4.25Å; P909-Y915 HydrophobicContact CG-CD1 3.94Å; P909-Y915 HydrophobicContact CG-CD2 4.37Å; P909-Y915 HydrophobicContact CG-CE1 3.99Å; P909-Y915 HydrophobicContact CG-CE2 4.43Å; P909-Y915 HydrophobicContact CG-CG 4.15Å; W912-Y915 AromaticContact CE3-CD2 3.74Å; W912-Y915 HydrophobicContact CE3-CD2 3.74Å; W912-Y915 HydrophobicContact CE3-CG 4.17Å; W912-Y915 AromaticContact CZ3-CD2 3.77Å; W912-Y915 HydrophobicContact CZ3-CD2 3.77Å; W912-Y915 HydrophobicContact CZ3-CG 4.31Å; W912-Y915 VanDerWaalsContact O-CB 3.3Å; W912-Y915 WeakPolarHBondContact O-CB 3.48Å; W912-Y915 PolarHBondContact O-N 3.35Å; Y915-Q917 VanDerWaalsContact C-N 3.31Å; Y915-Q917 PolarHBondContact O-N 3.12Å
916	G	87.8	Confident	91.5	Very high	53 Å²	53	59.8 Å²	59.8	55%	0.546	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.7	7.1	178.7	0	0	0	0	0	115.9	L914	L914-G916 PolarHBondContact O-N 3.22Å
917	Q	92.9	Very high	91.8	Very high	104 Å²	104	51 Å²	51	49%	0.486	29%	0.292	S	S	.	.			trans	-73	-32.3	177.6	-67.1	-168.3	18.1	0	0	113.3	P874 P913 L914 Y915 T919	P874-Q917 HydrophobicContact CB-CB 4.28Å; P913-Q917 PolarHBondContact O-NE2 3.28Å; L914-Q917 WeakPolarHBondContact O-CB 3.42Å; L914-Q917 WeakPolarHBondContact O-CG 3.45Å; L914-Q917 PolarHBondContact O-N 3.06Å; Y915-Q917 VanDerWaalsContact C-N 3.31Å; Y915-Q917 PolarHBondContact O-N 3.12Å; Q917-T919 PolarHBondContact O-N 3.44Å
918	N	96.1	Very high	92.1	Very high	6 Å²	6	49 Å²	49	3%	0.032	28%	0.282	C	S	.	.			trans	-74.8	120.2	174.7	-173	-63.4	0	0	0	111	R831 P874 V876 E920	R831-N918 PolarHBondContact NH1-O 3.33Å; R831-N918 VanDerWaalsContact NH1-O 3.14Å; R831-N918 PolarHBondContact NH1-OD1 3.38Å; R831-N918 PolarHBondContact NH2-O 3.05Å; P874-N918 HydrophobicContact CG-CB 3.95Å; P874-N918 PolarHBondContact O-ND2 2.89Å; V876-N918 HydrophobicContact CG2-CB 3.84Å; V876-N918 VanDerWaalsContact CG2-CG 3.42Å; N918-E920 PolarHBondContact ND2-OE1 3.21Å; N918-E920 WeakPolarHBondContact OD1-CB 3.48Å; N918-E920 PolarHBondContact OD1-N 3.31Å
919	T	94.3	Very high	92.5	Very high	131 Å²	131	49 Å²	49	80%	0.804	28%	0.282	S	S	*	.			trans	-111.1	8.9	-179.2	45.6	0	0	0	0	113.9	Q917	Q917-T919 PolarHBondContact O-N 3.44Å
920	E	94.6	Very high	92.8	Very high	37 Å²	37	46 Å²	46	17%	0.173	26%	0.262	C	S	.	.			trans	-61.7	139	178.7	-62.2	-179.1	-97	0	0	111.8	R831 R872 N918 E924 L925	R831-E920 WeakPolarHBondContact CD-O 3.4Å; R831-E920 PolarHBondContact NH1-O 3.06Å; R872-E920 VanDerWaalsContact CG-OE1 3.3Å; R872-E920 WeakPolarHBondContact CG-OE1 3.38Å; R872-E920 IonicContact CZ-OE1 2.73Å; R872-E920 IonicContact CZ-OE2 2.6Å; R872-E920 IonicContact NE-OE1 3.33Å; R872-E920 PolarHBondContact NE-OE1 3.38Å; R872-E920 IonicContact NE-OE2 3.22Å; R872-E920 PolarHBondContact NE-OE2 2.85Å; R872-E920 IonicContact NH2-OE1 2.87Å; R872-E920 IonicContact NH2-OE2 2.72Å; R872-E920 PolarHBondContact NH2-OE2 3.42Å; N918-E920 PolarHBondContact ND2-OE1 3.21Å; N918-E920 WeakPolarHBondContact OD1-CB 3.48Å; N918-E920 PolarHBondContact OD1-N 3.31Å; E920-E924 HydrophobicContact CB-CB 4.38Å; E920-L925 HydrophobicContact CB-CD1 4.37Å; E920-L925 HydrophobicContact CB-CD2 3.89Å; E920-L925 HydrophobicContact CB-CG 3.82Å; E920-L925 HydrophobicContact CG-CD2 4.43Å
921	S	94.8	Very high	93.1	Very high	33 Å²	33	45.7 Å²	45.7	23%	0.231	25%	0.245	C	C	.	.			trans	-73.5	165.8	176	71.5	0	0	0	0	111.9	N689 G923 E924 L925	N689-S921 WeakPolarHBondContact ND2-CB 3.25Å; N689-S921 PolarHBondContact ND2-OG 2.99Å; N689-S921 VanDerWaalsContact OD1-CB 3.24Å; N689-S921 WeakPolarHBondContact OD1-CB 3.28Å; N689-S921 PolarHBondContact OD1-OG 3.39Å; S921-G923 VanDerWaalsContact C-N 3.32Å; S921-G923 PolarHBondContact O-N 2.95Å; S921-E924 WeakPolarHBondContact CB-OE2 3.24Å; S921-E924 PolarHBondContact N-OE2 3.49Å; S921-E924 PolarHBondContact O-N 2.99Å; S921-E924 VanDerWaalsContact OG-CD 3.32Å; S921-E924 WeakPolarHBondContact OG-CG 3.41Å; S921-E924 PolarHBondContact OG-OE2 3.12Å; S921-L925 WeakPolarHBondContact O-CG 2.94Å; S921-L925 PolarHBondContact O-N 3.37Å
922	V	94.8	Very high	93.6	Very high	8 Å²	8	42 Å²	42	5%	0.048	23%	0.228	C	C	.	.	H	α-helix	trans	-64.9	-37.9	-175.9	-173.3	0	0	0	0	111.5	N689 C692 R831 I834 L835 I838 L925 W926	N689-V922 PolarHBondContact OD1-N 3.02Å; C692-V922 HydrophobicContact CB-CB 4.12Å; C692-V922 HydrophobicContact CB-CG1 3.64Å; R831-V922 HydrophobicContact CG-CG2 4.01Å; I834-V922 HydrophobicContact CB-CG1 4.13Å; I834-V922 HydrophobicContact CD1-CG2 4.04Å; I834-V922 HydrophobicContact CG2-CG1 3.65Å; L835-V922 HydrophobicContact CD2-CG1 3.92Å; L835-V922 HydrophobicContact CG-CG1 4.14Å; I838-V922 HydrophobicContact CD1-CG1 4.17Å; V922-L925 PolarHBondContact O-N 2.73Å; V922-W926 WeakPolarHBondContact O-CB 3.32Å; V922-W926 PolarHBondContact O-N 2.93Å
923	G	93.5	Very high	93.8	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.2	-39.4	176.5	0	0	0	0	0	113	N689 S921 W926 L927	N689-G923 PolarHBondContact OD1-N 3.06Å; S921-G923 VanDerWaalsContact C-N 3.32Å; S921-G923 PolarHBondContact O-N 2.95Å; G923-W926 PolarHBondContact O-N 2.82Å; G923-L927 PolarHBondContact O-N 2.97Å
924	E	94.3	Very high	94.1	Very high	71 Å²	71	36.1 Å²	36.1	33%	0.332	19%	0.193	S	C	.	.	H	α-helix	trans	-66.2	-42.3	174.9	-69.1	167	120.6	0	0	111.4	L685 E920 S921 G928	L685-E924 HydrophobicContact CD1-CG 4.31Å; L685-E924 HydrophobicContact CD2-CG 3.73Å; E920-E924 HydrophobicContact CB-CB 4.38Å; S921-E924 WeakPolarHBondContact CB-OE2 3.24Å; S921-E924 PolarHBondContact N-OE2 3.49Å; S921-E924 PolarHBondContact O-N 2.99Å; S921-E924 VanDerWaalsContact OG-CD 3.32Å; S921-E924 WeakPolarHBondContact OG-CG 3.41Å; S921-E924 PolarHBondContact OG-OE2 3.12Å; E924-G928 WeakPolarHBondContact O-CA 3.27Å; E924-G928 PolarHBondContact O-N 3.24Å
925	L	96.7	Very high	94.2	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-69.9	-33.8	176.1	-68.5	172.7	0	0	0	112.9	R831 L835 F868 L869 R872 V876 E920 S921 V922 L929	R831-L925 HydrophobicContact CB-CD1 4.38Å; L835-L925 HydrophobicContact CD1-CB 3.75Å; L835-L925 HydrophobicContact CD1-CD1 4.11Å; L835-L925 HydrophobicContact CD2-CB 4.25Å; F868-L925 HydrophobicContact CE1-CB 4.36Å; F868-L925 HydrophobicContact CE1-CD2 4.19Å; F868-L925 VanDerWaalsContact CE1-O 3.22Å; F868-L925 WeakPolarHBondContact CE1-O 3.46Å; F868-L925 HydrophobicContact CZ-CD2 4.4Å; F868-L925 WeakPolarHBondContact CZ-O 3.4Å; L869-L925 HydrophobicContact CD2-CD1 4.22Å; L869-L925 HydrophobicContact CD2-CD2 4.23Å; R872-L925 HydrophobicContact CG-CD2 4.29Å; V876-L925 HydrophobicContact CG2-CD1 4.02Å; V876-L925 HydrophobicContact CG2-CD2 3.99Å; E920-L925 HydrophobicContact CB-CD1 4.37Å; E920-L925 HydrophobicContact CB-CD2 3.89Å; E920-L925 HydrophobicContact CB-CG 3.82Å; E920-L925 HydrophobicContact CG-CD2 4.43Å; S921-L925 WeakPolarHBondContact O-CG 2.94Å; S921-L925 PolarHBondContact O-N 3.37Å; V922-L925 PolarHBondContact O-N 2.73Å; L925-L929 WeakPolarHBondContact O-CB 3.47Å; L925-L929 PolarHBondContact O-N 2.94Å
926	W	96.8	Very high	94.2	Very high	1 Å²	1	34.3 Å²	34.3	0%	0.004	19%	0.189	C	C	.	.	H	α-helix	trans	-68.3	-51.3	176.8	173.6	-120.5	0	0	0	111.7	L835 I838 M839 F842 V922 G923 G928 L929 L930 F999	L835-W926 HydrophobicContact CD2-CB 3.79Å; L835-W926 HydrophobicContact CD2-CE3 4.44Å; I838-W926 HydrophobicContact CB-CE3 4.37Å; I838-W926 HydrophobicContact CG2-CD2 3.54Å; I838-W926 HydrophobicContact CG2-CE3 3.63Å; I838-W926 HydrophobicContact CG2-CG 4.24Å; I838-W926 HydrophobicContact CG2-CH2 3.78Å; I838-W926 HydrophobicContact CG2-CZ2 3.66Å; I838-W926 HydrophobicContact CG2-CZ3 3.74Å; M839-W926 HydrophobicContact CB-CZ3 4.21Å; M839-W926 HydrophobicContact CE-CH2 4.22Å; M839-W926 HydrophobicContact CE-CZ3 3.92Å; F842-W926 HydrophobicContact CB-CH2 3.95Å; F842-W926 HydrophobicContact CB-CZ2 4.26Å; F842-W926 HydrophobicContact CD1-CH2 4.26Å; F842-W926 HydrophobicContact CD2-CH2 4.35Å; F842-W926 HydrophobicContact CD2-CZ2 4.09Å; F842-W926 AromaticContact CG-CH2 3.95Å; F842-W926 HydrophobicContact CG-CH2 3.95Å; F842-W926 HydrophobicContact CG-CZ2 4.15Å; V922-W926 WeakPolarHBondContact O-CB 3.32Å; V922-W926 PolarHBondContact O-N 2.93Å; G923-W926 PolarHBondContact O-N 2.82Å; W926-G928 VanDerWaalsContact C-N 3.28Å; W926-G928 PolarHBondContact O-N 2.91Å; W926-L929 HydrophobicContact CZ3-CD2 4.34Å; W926-L929 WeakPolarHBondContact O-CB 3.11Å; W926-L929 PolarHBondContact O-N 3.13Å; W926-L930 HydrophobicContact CD2-CD1 4.36Å; W926-L930 HydrophobicContact CH2-CD2 4.23Å; W926-L930 HydrophobicContact CH2-CG 4.44Å; W926-L930 HydrophobicContact CZ2-CD1 3.88Å; W926-L930 HydrophobicContact CZ2-CD2 4.14Å; W926-L930 HydrophobicContact CZ2-CG 4.14Å; W926-L930 PolarHBondContact O-N 2.9Å; W926-L930 VanDerWaalsContact O-N 3.1Å; W926-F999 AromaticContact CD1-CD1 3.63Å; W926-F999 AromaticContact CD1-CE1 3.91Å; W926-F999 AromaticContact CD1-CG 3.93Å; W926-F999 HydrophobicContact CZ2-CD2 4.39Å; W926-F999 HydrophobicContact CZ2-CE2 4.05Å; W926-F999 HydrophobicContact CZ2-CZ 4.37Å; W926-F999 AromaticContact NE1-CD1 3.26Å; W926-F999 VanDerWaalsContact NE1-CD1 3.26Å; W926-F999 AromaticContact NE1-CD2 3.47Å; W926-F999 AromaticContact NE1-CE1 3.3Å; W926-F999 VanDerWaalsContact NE1-CE1 3.3Å; W926-F999 AromaticContact NE1-CE2 3.53Å; W926-F999 AromaticContact NE1-CG 3.35Å; W926-F999 AromaticContact NE1-CZ 3.44Å
927	L	95.4	Very high	94.4	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.021	17%	0.165	C	C	.	.	H	α-helix	trans	-65.1	-36.3	174.2	-179.6	58.6	0	0	0	111.1	L677 L680 L688 G923 L929 L930 R931 F999	L677-L927 HydrophobicContact CD1-CD1 4.13Å; L680-L927 HydrophobicContact CD1-CD2 3.84Å; L680-L927 HydrophobicContact CD2-CD2 3.6Å; L680-L927 HydrophobicContact CG-CD2 4.3Å; L688-L927 HydrophobicContact CD1-CD2 4.44Å; G923-L927 PolarHBondContact O-N 2.97Å; L927-L929 VanDerWaalsContact C-N 3.3Å; L927-L929 PolarHBondContact O-N 3.11Å; L927-L930 PolarHBondContact O-N 3.43Å; L927-R931 HydrophobicContact CD1-CG 4.26Å; L927-R931 HydrophobicContact CG-CG 4.43Å; L927-R931 WeakPolarHBondContact O-CB 3.06Å; L927-R931 WeakPolarHBondContact O-CG 3.38Å; L927-R931 PolarHBondContact O-N 3.34Å; L927-F999 HydrophobicContact CD1-CB 4.35Å
928	G	95.5	Very high	94.2	Very high	8 Å²	8	30.1 Å²	30.1	8%	0.082	16%	0.157	C	C	.	.	H	α-helix	trans	-58.6	-38.3	172.7	0	0	0	0	0	113	F868 E924 W926 F932	F868-G928 VanDerWaalsContact CE2-C 3.44Å; F868-G928 WeakPolarHBondContact CE2-O 3.33Å; F868-G928 VanDerWaalsContact CZ-C 3.43Å; E924-G928 WeakPolarHBondContact O-CA 3.27Å; E924-G928 PolarHBondContact O-N 3.24Å; W926-G928 VanDerWaalsContact C-N 3.28Å; W926-G928 PolarHBondContact O-N 2.91Å; G928-F932 WeakPolarHBondContact O-CB 3.45Å; G928-F932 PolarHBondContact O-N 2.86Å
929	L	97.6	Very high	93.9	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-68.8	-45.7	175.4	-175.7	155.5	0	0	0	111.6	M839 V865 F868 L925 W926 L927 F932 Y933 F992	M839-L929 HydrophobicContact CE-CD1 4.37Å; M839-L929 HydrophobicContact CE-CD2 3.35Å; V865-L929 HydrophobicContact CB-CD1 4.16Å; V865-L929 HydrophobicContact CG1-CD1 4.3Å; V865-L929 HydrophobicContact CG2-CD1 3.75Å; F868-L929 HydrophobicContact CB-CD1 4.2Å; F868-L929 HydrophobicContact CB-CG 4.25Å; F868-L929 HydrophobicContact CD1-CB 3.72Å; F868-L929 HydrophobicContact CD1-CD1 3.88Å; F868-L929 HydrophobicContact CD1-CG 4.02Å; F868-L929 HydrophobicContact CD2-CB 4.31Å; F868-L929 HydrophobicContact CE1-CB 3.8Å; F868-L929 HydrophobicContact CE2-CB 4.36Å; F868-L929 HydrophobicContact CG-CB 3.98Å; F868-L929 HydrophobicContact CG-CD1 4.18Å; F868-L929 HydrophobicContact CG-CG 4.02Å; F868-L929 HydrophobicContact CZ-CB 4.12Å; F868-L929 VanDerWaalsContact CZ-N 3.34Å; L925-L929 WeakPolarHBondContact O-CB 3.47Å; L925-L929 PolarHBondContact O-N 2.94Å; W926-L929 HydrophobicContact CZ3-CD2 4.34Å; W926-L929 WeakPolarHBondContact O-CB 3.11Å; W926-L929 PolarHBondContact O-N 3.13Å; L927-L929 VanDerWaalsContact C-N 3.3Å; L927-L929 PolarHBondContact O-N 3.11Å; L929-F932 PolarHBondContact O-N 2.88Å; L929-Y933 HydrophobicContact CD2-CD2 3.89Å; L929-Y933 HydrophobicContact CD2-CE2 4.36Å; L929-Y933 HydrophobicContact CG-CD2 4.11Å; L929-Y933 HydrophobicContact CG-CE2 4.29Å; L929-Y933 PolarHBondContact O-N 3.35Å; L929-F992 HydrophobicContact CD2-CE1 4.18Å
930	L	96.3	Very high	93.4	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-59.9	-46.5	177.1	-71.8	169	0	0	0	110.9	F842 W926 L927 T934 F992 R996 F999	F842-L930 HydrophobicContact CZ-CD2 4.29Å; W926-L930 HydrophobicContact CD2-CD1 4.36Å; W926-L930 HydrophobicContact CH2-CD2 4.23Å; W926-L930 HydrophobicContact CH2-CG 4.44Å; W926-L930 HydrophobicContact CZ2-CD1 3.88Å; W926-L930 HydrophobicContact CZ2-CD2 4.14Å; W926-L930 HydrophobicContact CZ2-CG 4.14Å; W926-L930 PolarHBondContact O-N 2.9Å; W926-L930 VanDerWaalsContact O-N 3.1Å; L927-L930 PolarHBondContact O-N 3.43Å; L930-T934 WeakPolarHBondContact O-CB 3.44Å; L930-T934 WeakPolarHBondContact O-CG2 3.47Å; L930-T934 PolarHBondContact O-N 3.36Å; L930-T934 PolarHBondContact O-OG1 2.76Å; L930-F992 HydrophobicContact CD2-CD1 4.1Å; L930-R996 HydrophobicContact CB-CB 4.31Å; L930-F999 HydrophobicContact CD1-CB 3.84Å; L930-F999 HydrophobicContact CD1-CD2 3.67Å; L930-F999 HydrophobicContact CD1-CG 3.98Å
931	R	94.5	Very high	92.8	Very high	103 Å²	103	29.3 Å²	29.3	39%	0.389	14%	0.14	S	C	.	.	H	α-helix	trans	-62.3	-46.3	173.6	-69.8	-172.9	70.5	-157.1	-12	111.9	L677 L927 Y933 T934 E935 R996	L677-R931 HydrophobicContact CD1-CG 3.98Å; L927-R931 HydrophobicContact CD1-CG 4.26Å; L927-R931 HydrophobicContact CG-CG 4.43Å; L927-R931 WeakPolarHBondContact O-CB 3.06Å; L927-R931 WeakPolarHBondContact O-CG 3.38Å; L927-R931 PolarHBondContact O-N 3.34Å; R931-Y933 VanDerWaalsContact C-N 3.32Å; R931-Y933 PolarHBondContact O-N 3.5Å; R931-T934 WeakPolarHBondContact CA-OG1 3.36Å; R931-T934 PolarHBondContact O-N 2.87Å; R931-T934 PolarHBondContact O-OG1 3.15Å; R931-E935 WeakPolarHBondContact CG-OE1 3.31Å; R931-E935 IonicContact CZ-OE1 3.6Å; R931-E935 IonicContact CZ-OE2 2.93Å; R931-E935 VanDerWaalsContact CZ-OE2 3.29Å; R931-E935 IonicContact NE-OE1 3.96Å; R931-E935 PolarHBondContact NE-OE1 3.27Å; R931-E935 IonicContact NE-OE2 2.78Å; R931-E935 PolarHBondContact NE-OE2 3.24Å; R931-E935 VanDerWaalsContact NE-OE2 3.09Å; R931-E935 IonicContact NH2-OE1 3.27Å; R931-E935 IonicContact NH2-OE2 2.74Å; R931-E935 PolarHBondContact NH2-OE2 2.75Å; R931-E935 WeakPolarHBondContact O-CB 3.39Å; R931-E935 PolarHBondContact O-N 2.78Å; R931-R996 HydrophobicContact CG-CG 4.29Å
932	F	95.3	Very high	92.6	Very high	13 Å²	13	29.4 Å²	29.4	6%	0.057	14%	0.137	C	C	.	.	I	π-helix	trans	-55.2	-46	179.5	176.1	-102	0	0	0	112.2	F867 F868 Q871 G928 L929 T934 D936 F937	F867-F932 HydrophobicContact CD1-CE1 4.08Å; F867-F932 HydrophobicContact CD1-CZ 4.3Å; F867-F932 HydrophobicContact CE1-CE1 4.11Å; F867-F932 AromaticContact CE1-CZ 3.96Å; F867-F932 HydrophobicContact CE1-CZ 3.96Å; F868-F932 HydrophobicContact CB-CD1 4.26Å; F868-F932 HydrophobicContact CB-CE1 4.46Å; F868-F932 HydrophobicContact CD2-CB 3.63Å; F868-F932 AromaticContact CD2-CD1 3.81Å; F868-F932 HydrophobicContact CD2-CD1 3.81Å; F868-F932 HydrophobicContact CD2-CD2 4.27Å; F868-F932 AromaticContact CD2-CG 3.66Å; F868-F932 HydrophobicContact CD2-CG 3.66Å; F868-F932 HydrophobicContact CE2-CB 3.81Å; F868-F932 HydrophobicContact CE2-CG 4.23Å; F868-F932 HydrophobicContact CG-CD1 4.5Å; Q871-F932 HydrophobicContact CB-CZ 4.35Å; G928-F932 WeakPolarHBondContact O-CB 3.45Å; G928-F932 PolarHBondContact O-N 2.86Å; L929-F932 PolarHBondContact O-N 2.88Å; F932-T934 VanDerWaalsContact C-N 3.3Å; F932-T934 PolarHBondContact O-N 2.79Å; F932-D936 HydrophobicContact CD2-CB 3.86Å; F932-D936 HydrophobicContact CE2-CB 4.45Å; F932-D936 PolarHBondContact O-N 3Å; F932-F937 HydrophobicContact CD1-CB 4.12Å; F932-F937 HydrophobicContact CE1-CB 3.86Å; F932-F937 AromaticContact CE1-CD2 3.93Å; F932-F937 HydrophobicContact CE1-CD2 3.93Å; F932-F937 HydrophobicContact CE1-CG 4.05Å; F932-F937 HydrophobicContact CE2-CB 4.39Å; F932-F937 HydrophobicContact CZ-CB 4.02Å; F932-F937 AromaticContact CZ-CD2 3.73Å; F932-F937 HydrophobicContact CZ-CD2 3.73Å; F932-F937 HydrophobicContact CZ-CG 4.2Å; F932-F937 VanDerWaalsContact O-CB 3.28Å; F932-F937 WeakPolarHBondContact O-CB 3.3Å; F932-F937 PolarHBondContact O-N 2.83Å
933	Y	95.5	Very high	92.6	Very high	2 Å²	2	29 Å²	29	1%	0.008	14%	0.135	C	C	.	.	I	π-helix	trans	-80.7	-0.4	179.3	-77.1	-61.2	0	0	0	115.4	M864 F868 L929 R931 F937 F939 V944 F992	M864-Y933 VanDerWaalsContact CA-OH 3.31Å; M864-Y933 WeakPolarHBondContact CA-OH 3.5Å; M864-Y933 HydrophobicContact CB-CE2 3.88Å; M864-Y933 WeakPolarHBondContact CB-OH 3.29Å; M864-Y933 HydrophobicContact CE-CD1 3.93Å; M864-Y933 HydrophobicContact CE-CD2 3.99Å; M864-Y933 HydrophobicContact CE-CE1 3.84Å; M864-Y933 HydrophobicContact CE-CE2 3.9Å; M864-Y933 HydrophobicContact CE-CG 4Å; M864-Y933 PolarHBondContact O-OH 3.37Å; M864-Y933 VanDerWaalsContact O-OH 3.08Å; F868-Y933 HydrophobicContact CB-CE2 4.35Å; L929-Y933 HydrophobicContact CD2-CD2 3.89Å; L929-Y933 HydrophobicContact CD2-CE2 4.36Å; L929-Y933 HydrophobicContact CG-CD2 4.11Å; L929-Y933 HydrophobicContact CG-CE2 4.29Å; L929-Y933 PolarHBondContact O-N 3.35Å; R931-Y933 VanDerWaalsContact C-N 3.32Å; R931-Y933 PolarHBondContact O-N 3.5Å; Y933-F937 HydrophobicContact CD1-CB 4.1Å; Y933-F937 AromaticContact CD1-CD1 3.85Å; Y933-F937 HydrophobicContact CD1-CD1 3.85Å; Y933-F937 HydrophobicContact CD1-CG 4.11Å; Y933-F937 HydrophobicContact CE1-CB 4.43Å; Y933-F937 AromaticContact CE1-CD1 3.8Å; Y933-F937 HydrophobicContact CE1-CD1 3.8Å; Y933-F937 HydrophobicContact CE1-CE1 4.24Å; Y933-F937 HydrophobicContact CE1-CG 4.04Å; Y933-F939 HydrophobicContact CD1-CE1 4.18Å; Y933-F939 AromaticContact CD1-CE2 3.85Å; Y933-F939 HydrophobicContact CD1-CE2 3.85Å; Y933-F939 AromaticContact CD1-CZ 3.4Å; Y933-F939 HydrophobicContact CD1-CZ 3.4Å; Y933-F939 HydrophobicContact CE1-CE1 4.33Å; Y933-F939 AromaticContact CE1-CZ 3.96Å; Y933-F939 HydrophobicContact CE1-CZ 3.96Å; Y933-F939 HydrophobicContact CG-CZ 4.26Å; Y933-F939 WeakPolarHBondContact O-CE2 3.31Å; Y933-V944 HydrophobicContact CE1-CG2 4.06Å; Y933-F992 HydrophobicContact CD2-CE1 4.4Å
934	T	92.6	Very high	92.8	Very high	12 Å²	12	29 Å²	29	7%	0.074	14%	0.135	C	C	.	.	I	π-helix	trans	-118.4	-28.1	177.5	53.2	0	0	0	0	113.6	L930 R931 F932 F992 I993 R996	L930-T934 WeakPolarHBondContact O-CB 3.44Å; L930-T934 WeakPolarHBondContact O-CG2 3.47Å; L930-T934 PolarHBondContact O-N 3.36Å; L930-T934 PolarHBondContact O-OG1 2.76Å; R931-T934 WeakPolarHBondContact CA-OG1 3.36Å; R931-T934 PolarHBondContact O-N 2.87Å; R931-T934 PolarHBondContact O-OG1 3.15Å; F932-T934 VanDerWaalsContact C-N 3.3Å; F932-T934 PolarHBondContact O-N 2.79Å; T934-F992 HydrophobicContact CG2-CB 3.99Å; T934-I993 HydrophobicContact CG2-CG1 3.85Å; T934-R996 WeakPolarHBondContact OG1-CD 3.21Å
935	E	90.2	Very high	92.9	Very high	43 Å²	43	25.8 Å²	25.8	20%	0.201	12%	0.12	C	C	.	.	I	π-helix	trans	-111.9	-53.2	-175.8	-60.3	173.3	-151.6	0	0	111.8	K671 L674 R931 R996	K671-E935 WeakPolarHBondContact CE-O 3.34Å; K671-E935 PolarHBondContact NZ-O 2.84Å; L674-E935 HydrophobicContact CD1-CG 4.42Å; R931-E935 WeakPolarHBondContact CG-OE1 3.31Å; R931-E935 IonicContact CZ-OE1 3.6Å; R931-E935 IonicContact CZ-OE2 2.93Å; R931-E935 VanDerWaalsContact CZ-OE2 3.29Å; R931-E935 IonicContact NE-OE1 3.96Å; R931-E935 PolarHBondContact NE-OE1 3.27Å; R931-E935 IonicContact NE-OE2 2.78Å; R931-E935 PolarHBondContact NE-OE2 3.24Å; R931-E935 VanDerWaalsContact NE-OE2 3.09Å; R931-E935 IonicContact NH2-OE1 3.27Å; R931-E935 IonicContact NH2-OE2 2.74Å; R931-E935 PolarHBondContact NH2-OE2 2.75Å; R931-E935 WeakPolarHBondContact O-CB 3.39Å; R931-E935 PolarHBondContact O-N 2.78Å; E935-R996 IonicContact OE1-CZ 3.49Å; E935-R996 IonicContact OE1-NE 2.68Å; E935-R996 PolarHBondContact OE1-NE 3.05Å; E935-R996 IonicContact OE1-NH2 3.64Å; E935-R996 PolarHBondContact OE1-NH2 2.97Å
936	D	89.9	Confident	92.9	Very high	92 Å²	92	25.9 Å²	25.9	49%	0.492	12%	0.12	S	C	.	.	I	π-helix	trans	-92.8	-38.9	-164.5	-57.9	-44.1	0	0	0	114.6	F932 D938	F932-D936 HydrophobicContact CD2-CB 3.86Å; F932-D936 HydrophobicContact CE2-CB 4.45Å; F932-D936 PolarHBondContact O-N 3Å; D936-D938 PolarHBondContact O-N 2.78Å
937	F	91.9	Very high	92.8	Very high	9 Å²	9	27.8 Å²	27.8	4%	0.039	13%	0.128	C	C	.	.			trans	-87	112.5	-171	-173.4	-102.1	0	0	0	111.5	F867 F932 Y933 F939 H942 V944	F867-F937 HydrophobicContact CD1-CE2 4.49Å; F867-F937 AromaticContact CE1-CD2 3.86Å; F867-F937 HydrophobicContact CE1-CD2 3.86Å; F867-F937 AromaticContact CE1-CE2 3.42Å; F867-F937 HydrophobicContact CE1-CE2 3.42Å; F867-F937 VanDerWaalsContact CE1-CE2 3.42Å; F867-F937 HydrophobicContact CE1-CZ 4.17Å; F867-F937 AromaticContact CZ-CE2 3.87Å; F867-F937 HydrophobicContact CZ-CE2 3.87Å; F932-F937 HydrophobicContact CD1-CB 4.12Å; F932-F937 HydrophobicContact CE1-CB 3.86Å; F932-F937 AromaticContact CE1-CD2 3.93Å; F932-F937 HydrophobicContact CE1-CD2 3.93Å; F932-F937 HydrophobicContact CE1-CG 4.05Å; F932-F937 HydrophobicContact CE2-CB 4.39Å; F932-F937 HydrophobicContact CZ-CB 4.02Å; F932-F937 AromaticContact CZ-CD2 3.73Å; F932-F937 HydrophobicContact CZ-CD2 3.73Å; F932-F937 HydrophobicContact CZ-CG 4.2Å; F932-F937 VanDerWaalsContact O-CB 3.28Å; F932-F937 WeakPolarHBondContact O-CB 3.3Å; F932-F937 PolarHBondContact O-N 2.83Å; Y933-F937 HydrophobicContact CD1-CB 4.1Å; Y933-F937 AromaticContact CD1-CD1 3.85Å; Y933-F937 HydrophobicContact CD1-CD1 3.85Å; Y933-F937 HydrophobicContact CD1-CG 4.11Å; Y933-F937 HydrophobicContact CE1-CB 4.43Å; Y933-F937 AromaticContact CE1-CD1 3.8Å; Y933-F937 HydrophobicContact CE1-CD1 3.8Å; Y933-F937 HydrophobicContact CE1-CE1 4.24Å; Y933-F937 HydrophobicContact CE1-CG 4.04Å; F937-F939 AromaticContact CD1-CD1 3.8Å; F937-F939 HydrophobicContact CD1-CD1 3.8Å; F937-F939 HydrophobicContact CD1-CD2 4Å; F937-F939 AromaticContact CD1-CE1 3.89Å; F937-F939 HydrophobicContact CD1-CE1 3.89Å; F937-F939 HydrophobicContact CD1-CE2 4.11Å; F937-F939 AromaticContact CD1-CG 3.86Å; F937-F939 HydrophobicContact CD1-CG 3.86Å; F937-F939 HydrophobicContact CD1-CZ 4.06Å; F937-F939 AromaticContact CE1-CD1 3.54Å; F937-F939 HydrophobicContact CE1-CD1 3.54Å; F937-F939 AromaticContact CE1-CE1 3.77Å; F937-F939 HydrophobicContact CE1-CE1 3.77Å; F937-F939 AromaticContact CE1-CG 3.96Å; F937-F939 HydrophobicContact CE1-CG 3.96Å; F937-F939 HydrophobicContact CE1-CZ 4.4Å; F937-F939 PolarHBondContact O-N 2.84Å; F937-H942 HydrophobicContact CE2-CB 3.66Å; F937-H942 HydrophobicContact CZ-CB 3.67Å; F937-H942 WeakPolarHBondContact CZ-O 3.44Å; F937-V944 HydrophobicContact CE1-CG2 3.81Å; F937-V944 HydrophobicContact CZ-CG2 3.73Å
938	D	88.6	Confident	92.7	Very high	60 Å²	60	29.4 Å²	29.4	32%	0.321	14%	0.135	S	C	.	.			trans	-80.1	100.8	172.8	-163.3	-43.7	0	0	0	111	D936 R940 E941 H942	D936-D938 PolarHBondContact O-N 2.78Å; D938-R940 VanDerWaalsContact C-N 3.33Å; D938-R940 WeakPolarHBondContact OD1-CA 3.35Å; D938-R940 WeakPolarHBondContact OD1-CB 3.44Å; D938-R940 PolarHBondContact OD1-N 3.07Å; D938-E941 HydrophobicContact CB-CB 4.2Å; D938-E941 PolarHBondContact O-N 3.27Å; D938-E941 PolarHBondContact OD1-N 2.94Å; D938-H942 WeakPolarHBondContact O-CB 3.47Å; D938-H942 PolarHBondContact O-N 3.41Å; D938-H942 PolarHBondContact O-ND1 2.95Å
939	F	88.9	Confident	92.3	Very high	3 Å²	3	33.7 Å²	33.7	1%	0.013	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-27.3	174.6	-85.1	-67.9	0	0	0	114.4	M864 Y933 F937 Y963 I964 M989	M864-F939 HydrophobicContact CE-CZ 4.15Å; Y933-F939 HydrophobicContact CD1-CE1 4.18Å; Y933-F939 AromaticContact CD1-CE2 3.85Å; Y933-F939 HydrophobicContact CD1-CE2 3.85Å; Y933-F939 AromaticContact CD1-CZ 3.4Å; Y933-F939 HydrophobicContact CD1-CZ 3.4Å; Y933-F939 HydrophobicContact CE1-CE1 4.33Å; Y933-F939 AromaticContact CE1-CZ 3.96Å; Y933-F939 HydrophobicContact CE1-CZ 3.96Å; Y933-F939 HydrophobicContact CG-CZ 4.26Å; Y933-F939 WeakPolarHBondContact O-CE2 3.31Å; F937-F939 AromaticContact CD1-CD1 3.8Å; F937-F939 HydrophobicContact CD1-CD1 3.8Å; F937-F939 HydrophobicContact CD1-CD2 4Å; F937-F939 AromaticContact CD1-CE1 3.89Å; F937-F939 HydrophobicContact CD1-CE1 3.89Å; F937-F939 HydrophobicContact CD1-CE2 4.11Å; F937-F939 AromaticContact CD1-CG 3.86Å; F937-F939 HydrophobicContact CD1-CG 3.86Å; F937-F939 HydrophobicContact CD1-CZ 4.06Å; F937-F939 AromaticContact CE1-CD1 3.54Å; F937-F939 HydrophobicContact CE1-CD1 3.54Å; F937-F939 AromaticContact CE1-CE1 3.77Å; F937-F939 HydrophobicContact CE1-CE1 3.77Å; F937-F939 AromaticContact CE1-CG 3.96Å; F937-F939 HydrophobicContact CE1-CG 3.96Å; F937-F939 HydrophobicContact CE1-CZ 4.4Å; F937-F939 PolarHBondContact O-N 2.84Å; F939-Y963 CarbonylContact C-O 3.59Å; F939-Y963 HydrophobicContact CB-CD1 3.81Å; F939-Y963 HydrophobicContact CB-CD2 4.33Å; F939-Y963 HydrophobicContact CB-CE1 3.49Å; F939-Y963 VanDerWaalsContact CB-CE1 3.49Å; F939-Y963 HydrophobicContact CB-CE2 4.06Å; F939-Y963 HydrophobicContact CB-CG 4.21Å; F939-Y963 WeakPolarHBondContact CB-O 3.46Å; F939-Y963 HydrophobicContact CD2-CD1 4.47Å; F939-Y963 AromaticContact CD2-CE1 3.75Å; F939-Y963 HydrophobicContact CD2-CE1 3.75Å; F939-Y963 HydrophobicContact CG-CD1 4.16Å; F939-Y963 AromaticContact CG-CE1 3.8Å; F939-Y963 HydrophobicContact CG-CE1 3.8Å; F939-I964 HydrophobicContact CD1-CB 4.38Å; F939-I964 HydrophobicContact CD1-CG1 4.07Å; F939-I964 HydrophobicContact CE1-CB 4.27Å; F939-I964 HydrophobicContact CE1-CG1 3.9Å; F939-I964 HydrophobicContact CE1-CG2 4.03Å; F939-I964 HydrophobicContact CZ-CG1 4.3Å; F939-M989 HydrophobicContact CD2-CE 4.12Å; F939-M989 HydrophobicContact CD2-SD 4.16Å; F939-M989 HydrophobicContact CE2-CE 3.9Å; F939-M989 HydrophobicContact CE2-SD 3.77Å; F939-M989 HydrophobicContact CZ-SD 4.42Å
940	R	82.9	Confident	91.9	Very high	94 Å²	94	38.6 Å²	38.6	36%	0.355	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-44.3	176	-60.8	-170.4	-178.4	-137.3	-5.7	109.8	H220 D668 F669 D938 T954 Y963	H220-R940 PolarHBondContact CE1-O 2.84Å; D668-R940 IonicContact OD1-CZ 2.67Å; D668-R940 IonicContact OD1-NH1 3.39Å; D668-R940 IonicContact OD1-NH2 2.63Å; D668-R940 PolarHBondContact OD1-NH2 3.37Å; D668-R940 IonicContact OD2-NH1 3.37Å; D668-R940 IonicContact OD2-NH2 3.16Å; F669-R940 PolarHBondContact O-NH2 3.24Å; D938-R940 VanDerWaalsContact C-N 3.33Å; D938-R940 WeakPolarHBondContact OD1-CA 3.35Å; D938-R940 WeakPolarHBondContact OD1-CB 3.44Å; D938-R940 PolarHBondContact OD1-N 3.07Å; R940-T954 WeakPolarHBondContact O-CB 3.42Å; R940-T954 VanDerWaalsContact O-CG2 3.25Å; R940-T954 WeakPolarHBondContact O-CG2 3.42Å; R940-T954 PolarHBondContact O-OG1 2.91Å; R940-Y963 HydrophobicContact CG-CD2 3.79Å; R940-Y963 HydrophobicContact CG-CE2 3.62Å
941	E	83.1	Confident	91.5	Very high	59 Å²	59	44.7 Å²	44.7	28%	0.276	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-33.6	-175.6	-67	-56.9	108.5	0	0	114.3	H220 D938 T953 T954	H220-E941 IonicContact CD2-OE1 2.69Å; H220-E941 IonicContact CE1-OE1 3.75Å; H220-E941 IonicContact NE2-OE1 3.18Å; H220-E941 PolarHBondContact NE2-OE1 3.09Å; D938-E941 HydrophobicContact CB-CB 4.2Å; D938-E941 PolarHBondContact O-N 3.27Å; D938-E941 PolarHBondContact OD1-N 2.94Å; E941-T953 CarbonylContact O-C 3.49Å; E941-T953 WeakPolarHBondContact O-CA 3.19Å; E941-T953 WeakPolarHBondContact O-CB 3.48Å; E941-T954 PolarHBondContact O-N 2.88Å; E941-T954 PolarHBondContact O-OG1 3.28Å
942	H	91.2	Very high	91.3	Very high	35 Å²	35	40.7 Å²	40.7	16%	0.162	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	146.4	-166	-58.1	93.4	0	0	0	115.4	F937 D938 L952	F937-H942 HydrophobicContact CE2-CB 3.66Å; F937-H942 HydrophobicContact CZ-CB 3.67Å; F937-H942 WeakPolarHBondContact CZ-O 3.44Å; D938-H942 WeakPolarHBondContact O-CB 3.47Å; D938-H942 PolarHBondContact O-N 3.41Å; D938-H942 PolarHBondContact O-ND1 2.95Å; H942-L952 WeakPolarHBondContact CA-O 3.3Å
943	V	94.9	Very high	90.9	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	131.9	173.1	-178.7	0	0	0	0	110.1	C945 L952 T954 K957 W959 V965 E967	V943-C945 HydrophobicContact CG1-CB 4.34Å; V943-C945 PolarHBondContact O-N 3.23Å; V943-L952 HydrophobicContact CB-CB 4.3Å; V943-L952 HydrophobicContact CB-CD2 4.2Å; V943-L952 HydrophobicContact CB-CG 4.21Å; V943-L952 HydrophobicContact CG1-CD2 4.28Å; V943-L952 HydrophobicContact CG2-CG 4.34Å; V943-L952 PolarHBondContact N-O 2.98Å; V943-T954 HydrophobicContact CG2-CG2 4Å; V943-K957 HydrophobicContact CG2-CB 4.29Å; V943-K957 HydrophobicContact CG2-CG 4.27Å; V943-W959 HydrophobicContact CG1-CE3 4.36Å; V943-W959 HydrophobicContact CG1-CZ3 4.3Å; V943-W959 HydrophobicContact CG2-CE3 4.5Å; V943-V965 HydrophobicContact CB-CG1 4.39Å; V943-V965 HydrophobicContact CG1-CG1 4.09Å; V943-V965 HydrophobicContact CG2-CB 4.49Å; V943-V965 HydrophobicContact CG2-CG1 3.83Å; V943-E967 HydrophobicContact CG1-CB 3.9Å
944	V	96.9	Very high	90.5	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.006	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-69	110.6	166.8	178.5	0	0	0	0	108	M864 F867 Y933 F937 V965 I966 E967	M864-V944 HydrophobicContact CG-CG1 4.13Å; F867-V944 HydrophobicContact CB-CG1 3.66Å; F867-V944 HydrophobicContact CD1-CG1 4.05Å; F867-V944 HydrophobicContact CD1-CG2 4.44Å; F867-V944 HydrophobicContact CD2-CG1 4.41Å; F867-V944 HydrophobicContact CG-CG1 3.79Å; Y933-V944 HydrophobicContact CE1-CG2 4.06Å; F937-V944 HydrophobicContact CE1-CG2 3.81Å; F937-V944 HydrophobicContact CZ-CG2 3.73Å; V944-V965 PolarHBondContact N-O 3.03Å; V944-I966 HydrophobicContact CB-CB 4.28Å; V944-I966 HydrophobicContact CB-CG1 4Å; V944-I966 HydrophobicContact CB-CG2 4.16Å; V944-I966 HydrophobicContact CG1-CG1 4.5Å; V944-I966 HydrophobicContact CG1-CG2 4.11Å; V944-I966 HydrophobicContact CG2-CG1 4.27Å; V944-E967 PolarHBondContact O-N 2.88Å
945	C	96.2	Very high	90	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.014	20%	0.195	C	C	.	.			trans	-143.1	108	-166.5	174.9	0	0	0	0	110.2	F867 V943 L952 E967	F867-C945 VanDerWaalsContact CD2-O 3.25Å; F867-C945 WeakPolarHBondContact CD2-O 3.34Å; F867-C945 WeakPolarHBondContact CE2-O 3.48Å; V943-C945 HydrophobicContact CG1-CB 4.34Å; V943-C945 PolarHBondContact O-N 3.23Å; C945-L952 HydrophobicContact CB-CB 4.28Å; C945-L952 HydrophobicContact CB-CD2 4.17Å; C945-E967 PolarHBondContact SG-OE2 3.39Å
946	I	96.7	Very high	89.7	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.01	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	1.9	-172.4	71	157.7	0	0	0	115.2	L821 Y825 L863 L866 F867 Q870 P969	L821-I946 HydrophobicContact CD2-CD1 4.35Å; Y825-I946 HydrophobicContact CE2-CD1 3.96Å; L863-I946 HydrophobicContact CB-CG2 4.45Å; L863-I946 HydrophobicContact CD2-CD1 3.59Å; L863-I946 HydrophobicContact CD2-CG1 4.17Å; L863-I946 WeakPolarHBondContact O-CG2 3.27Å; L866-I946 HydrophobicContact CB-CD1 4.48Å; L866-I946 HydrophobicContact CB-CG2 4.07Å; L866-I946 HydrophobicContact CD1-CD1 3.95Å; F867-I946 HydrophobicContact CB-CG2 3.82Å; Q870-I946 PolarHBondContact NE2-O 3.02Å; Q870-I946 VanDerWaalsContact OE1-CA 3.23Å; Q870-I946 PolarHBondContact OE1-O 2.88Å; I946-P969 HydrophobicContact CD1-CB 4.3Å; I946-P969 HydrophobicContact CD1-CG 4.2Å; I946-P969 HydrophobicContact CG1-CB 3.87Å; I946-P969 HydrophobicContact CG1-CG 4.18Å
947	R	95	Very high	89.4	Confident	42 Å²	42	39.4 Å²	39.4	16%	0.158	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-7.1	-172.9	65.1	159	-179.4	75.2	14.4	114.9	V879 Q881 E967 P969	V879-R947 WeakPolarHBondContact CG1-O 3.28Å; Q881-R947 HydrophobicContact CB-CB 4.35Å; Q881-R947 VanDerWaalsContact CD-CB 3.49Å; R947-E967 WeakPolarHBondContact CD-OE2 3.34Å; R947-E967 IonicContact CZ-OE1 2.79Å; R947-E967 IonicContact CZ-OE2 2.75Å; R947-E967 VanDerWaalsContact NE-CD 3.29Å; R947-E967 IonicContact NE-OE1 3.28Å; R947-E967 PolarHBondContact NE-OE1 2.75Å; R947-E967 VanDerWaalsContact NE-OE1 3.15Å; R947-E967 IonicContact NE-OE2 2.88Å; R947-E967 PolarHBondContact NE-OE2 3.39Å; R947-E967 IonicContact NH2-OE1 3.76Å; R947-E967 PolarHBondContact NH2-OE1 2.83Å; R947-E967 IonicContact NH2-OE2 3.7Å; R947-E967 PolarHBondContact NH2-OE2 2.96Å; R947-P969 HydrophobicContact CB-CB 4.32Å
948	Q	92.4	Very high	89	Confident	38 Å²	38	44.9 Å²	44.9	18%	0.178	21%	0.211	C	C	.	.			trans	-145.9	143.8	175.9	54.9	174.4	73.4	0	0	110.2	E882 T950	E882-Q948 VanDerWaalsContact CD-CA 3.49Å; E882-Q948 VanDerWaalsContact OE1-CA 3.27Å; E882-Q948 WeakPolarHBondContact OE1-CA 3.46Å; E882-Q948 WeakPolarHBondContact OE1-CB 3.1Å; Q948-T950 PolarHBondContact NE2-O 2.84Å
949	H	88.3	Confident	88.9	Confident	97 Å²	97	44 Å²	44	45%	0.449	20%	0.203	S	C	.	.	S	Bend	trans	-76.8	-33.3	178.1	-172.6	-74.3	0	0	0	112	Q871 V879 E882 R951	Q871-H949 PolarHBondContact NE2-O 3.19Å; V879-H949 HydrophobicContact CG2-CB 4.07Å; E882-H949 PolarHBondContact OE1-N 3.29Å; E882-H949 WeakPolarHBondContact OE2-CB 3.2Å; E882-H949 PolarHBondContact OE2-N 2.89Å; H949-R951 PolarHBondContact O-N 2.96Å
950	T	88.3	Confident	88.5	Confident	103 Å²	103	46.3 Å²	46.3	63%	0.632	22%	0.218	S	C	*	.	S	Bend	trans	-64.2	128.2	176.3	-57.5	0	0	0	0	110.2	Q948 L952	Q948-T950 PolarHBondContact NE2-O 2.84Å; T950-L952 PolarHBondContact O-N 2.94Å
951	R	87.8	Confident	88.3	Confident	129 Å²	129	46.8 Å²	46.8	49%	0.487	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-58.5	132.9	179.1	-67.4	-174.1	177.5	-172.9	-0.1	111	H949	H949-R951 PolarHBondContact O-N 2.96Å
952	L	90.1	Very high	88.4	Confident	19 Å²	19	47.2 Å²	47.2	10%	0.099	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	129.4	178.6	-179.2	61.9	0	0	0	109.2	H942 V943 C945 T950 K957	H942-L952 WeakPolarHBondContact CA-O 3.3Å; V943-L952 HydrophobicContact CB-CB 4.3Å; V943-L952 HydrophobicContact CB-CD2 4.2Å; V943-L952 HydrophobicContact CB-CG 4.21Å; V943-L952 HydrophobicContact CG1-CD2 4.28Å; V943-L952 HydrophobicContact CG2-CG 4.34Å; V943-L952 PolarHBondContact N-O 2.98Å; C945-L952 HydrophobicContact CB-CB 4.28Å; C945-L952 HydrophobicContact CB-CD2 4.17Å; T950-L952 PolarHBondContact O-N 2.94Å; L952-K957 HydrophobicContact CD1-CG 4.34Å; L952-K957 HydrophobicContact CD2-CD 4.47Å; L952-K957 HydrophobicContact CD2-CG 3.81Å; L952-K957 HydrophobicContact CG-CG 4.1Å
953	T	88.3	Confident	88.2	Confident	28 Å²	28	47.6 Å²	47.6	17%	0.172	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	148.7	178.5	60.2	0	0	0	0	112	E941 F955 N956 K957	E941-T953 CarbonylContact O-C 3.49Å; E941-T953 WeakPolarHBondContact O-CA 3.19Å; E941-T953 WeakPolarHBondContact O-CB 3.48Å; T953-F955 PolarHBondContact O-N 3.13Å; T953-N956 PolarHBondContact O-N 3.08Å; T953-N956 VanDerWaalsContact OG1-CB 3.32Å; T953-N956 WeakPolarHBondContact OG1-CB 3.43Å; T953-N956 PolarHBondContact OG1-N 3.08Å; T953-N956 VanDerWaalsContact OG1-N 3.11Å; T953-N956 PolarHBondContact OG1-OD1 3.34Å; T953-K957 PolarHBondContact O-N 2.81Å
954	T	86.4	Confident	88.1	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-34	171.4	56	0	0	0	0	110.8	R940 E941 V943 K957 Q958 W959 V965	R940-T954 WeakPolarHBondContact O-CB 3.42Å; R940-T954 VanDerWaalsContact O-CG2 3.25Å; R940-T954 WeakPolarHBondContact O-CG2 3.42Å; R940-T954 PolarHBondContact O-OG1 2.91Å; E941-T954 PolarHBondContact O-N 2.88Å; E941-T954 PolarHBondContact O-OG1 3.28Å; V943-T954 HydrophobicContact CG2-CG2 4Å; T954-K957 CarbonylContact O-C 3.51Å; T954-K957 PolarHBondContact O-N 3.12Å; T954-Q958 PolarHBondContact O-N 2.9Å; T954-W959 PolarHBondContact O-N 2.88Å; T954-V965 HydrophobicContact CG2-CB 4.19Å; T954-V965 HydrophobicContact CG2-CG1 4.47Å; T954-V965 HydrophobicContact CG2-CG2 3.95Å
955	F	81.8	Confident	88	Confident	7 Å²	7	47.6 Å²	47.6	3%	0.031	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-47.9	176.9	-178.6	-133.7	0	0	0	113.1	P196 L199 L200 F219 P224 T953 K957 Q958	P196-F955 HydrophobicContact CB-CD1 3.93Å; P196-F955 HydrophobicContact CB-CD2 4.26Å; P196-F955 HydrophobicContact CB-CE1 3.79Å; P196-F955 HydrophobicContact CB-CE2 4.1Å; P196-F955 HydrophobicContact CB-CG 4.18Å; P196-F955 HydrophobicContact CB-CZ 3.9Å; P196-F955 HydrophobicContact CG-CE2 4.33Å; P196-F955 HydrophobicContact CG-CZ 4.49Å; P196-F955 WeakPolarHBondContact CG-O 3.26Å; P196-F955 WeakPolarHBondContact O-CE1 3.37Å; L199-F955 HydrophobicContact CB-CE1 4.02Å; L199-F955 HydrophobicContact CB-CZ 3.91Å; L199-F955 HydrophobicContact CD1-CZ 4.02Å; L200-F955 HydrophobicContact CD2-CD1 4.28Å; L200-F955 HydrophobicContact CG-CD1 4.21Å; L200-F955 HydrophobicContact CG-CE1 4.36Å; F219-F955 HydrophobicContact CB-CB 4.08Å; F219-F955 HydrophobicContact CB-CD1 4.08Å; F219-F955 HydrophobicContact CB-CD2 3.67Å; F219-F955 HydrophobicContact CB-CE1 4.41Å; F219-F955 HydrophobicContact CB-CE2 4.07Å; F219-F955 HydrophobicContact CB-CG 3.68Å; F219-F955 HydrophobicContact CB-CZ 4.39Å; F219-F955 AromaticContact CD1-CD1 3.82Å; F219-F955 HydrophobicContact CD1-CD1 3.82Å; F219-F955 HydrophobicContact CD1-CD2 4.31Å; F219-F955 AromaticContact CD1-CE1 3.4Å; F219-F955 HydrophobicContact CD1-CE1 3.4Å; F219-F955 AromaticContact CD1-CE2 3.97Å; F219-F955 HydrophobicContact CD1-CE2 3.97Å; F219-F955 HydrophobicContact CD1-CG 4.25Å; F219-F955 AromaticContact CD1-CZ 3.46Å; F219-F955 HydrophobicContact CD1-CZ 3.46Å; F219-F955 VanDerWaalsContact CD1-CZ 3.46Å; F219-F955 HydrophobicContact CD2-CB 4.25Å; F219-F955 AromaticContact CD2-CD1 3.51Å; F219-F955 HydrophobicContact CD2-CD1 3.51Å; F219-F955 AromaticContact CD2-CE1 3.93Å; F219-F955 HydrophobicContact CD2-CE1 3.93Å; F219-F955 AromaticContact CD2-CG 3.9Å; F219-F955 HydrophobicContact CD2-CG 3.9Å; F219-F955 HydrophobicContact CE1-CD1 4.05Å; F219-F955 AromaticContact CE1-CE1 3.41Å; F219-F955 HydrophobicContact CE1-CE1 3.41Å; F219-F955 VanDerWaalsContact CE1-CE1 3.41Å; F219-F955 AromaticContact CE1-CZ 3.78Å; F219-F955 HydrophobicContact CE1-CZ 3.78Å; F219-F955 AromaticContact CE2-CD1 3.76Å; F219-F955 HydrophobicContact CE2-CD1 3.76Å; F219-F955 AromaticContact CE2-CE1 3.94Å; F219-F955 HydrophobicContact CE2-CE1 3.94Å; F219-F955 HydrophobicContact CG-CB 4.35Å; F219-F955 AromaticContact CG-CD1 3.54Å; F219-F955 HydrophobicContact CG-CD1 3.54Å; F219-F955 AromaticContact CG-CD2 4Å; F219-F955 HydrophobicContact CG-CD2 4Å; F219-F955 AromaticContact CG-CE1 3.66Å; F219-F955 HydrophobicContact CG-CE1 3.66Å; F219-F955 HydrophobicContact CG-CE2 4.13Å; F219-F955 AromaticContact CG-CG 3.7Å; F219-F955 HydrophobicContact CG-CG 3.7Å; F219-F955 AromaticContact CG-CZ 3.94Å; F219-F955 HydrophobicContact CG-CZ 3.94Å; F219-F955 HydrophobicContact CZ-CD1 4.01Å; F219-F955 AromaticContact CZ-CE1 3.68Å; F219-F955 HydrophobicContact CZ-CE1 3.68Å; F219-F955 HydrophobicContact CZ-CZ 4.49Å; P224-F955 HydrophobicContact CB-CE2 3.47Å; P224-F955 VanDerWaalsContact CB-CE2 3.47Å; P224-F955 HydrophobicContact CB-CZ 3.79Å; P224-F955 HydrophobicContact CG-CE2 3.69Å; P224-F955 HydrophobicContact CG-CZ 4.45Å; T953-F955 PolarHBondContact O-N 3.13Å; F955-K957 PolarHBondContact O-N 2.96Å; F955-Q958 PolarHBondContact O-N 3.03Å
956	N	83.5	Confident	88.1	Confident	58 Å²	58	47.5 Å²	47.5	31%	0.31	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-27.5	177.8	-68.1	18.6	0	0	0	111.9	L200 T953	L200-N956 WeakPolarHBondContact CD1-ND2 3.44Å; L200-N956 WeakPolarHBondContact CD1-OD1 3.5Å; T953-N956 PolarHBondContact O-N 3.08Å; T953-N956 VanDerWaalsContact OG1-CB 3.32Å; T953-N956 WeakPolarHBondContact OG1-CB 3.43Å; T953-N956 PolarHBondContact OG1-N 3.08Å; T953-N956 VanDerWaalsContact OG1-N 3.11Å; T953-N956 PolarHBondContact OG1-OD1 3.34Å
957	K	84.9	Confident	88.1	Confident	41 Å²	41	47.5 Å²	47.5	18%	0.178	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-8.2	170.7	-88.2	-71.4	-178.6	174.8	0	115	V943 L952 T953 T954 F955 W959 E967 L972	V943-K957 HydrophobicContact CG2-CB 4.29Å; V943-K957 HydrophobicContact CG2-CG 4.27Å; L952-K957 HydrophobicContact CD1-CG 4.34Å; L952-K957 HydrophobicContact CD2-CD 4.47Å; L952-K957 HydrophobicContact CD2-CG 3.81Å; L952-K957 HydrophobicContact CG-CG 4.1Å; T953-K957 PolarHBondContact O-N 2.81Å; T954-K957 CarbonylContact O-C 3.51Å; T954-K957 PolarHBondContact O-N 3.12Å; F955-K957 PolarHBondContact O-N 2.96Å; K957-W959 HydrophobicContact CB-CB 4.08Å; K957-W959 HydrophobicContact CB-CD2 3.81Å; K957-W959 HydrophobicContact CB-CE3 3.95Å; K957-W959 HydrophobicContact CB-CG 3.85Å; K957-W959 HydrophobicContact CD-CD2 4.18Å; K957-W959 HydrophobicContact CD-CE3 4.12Å; K957-W959 HydrophobicContact CD-CH2 4.18Å; K957-W959 HydrophobicContact CD-CZ2 4.17Å; K957-W959 HydrophobicContact CD-CZ3 4.14Å; K957-W959 HydrophobicContact CG-CD2 4.29Å; K957-W959 HydrophobicContact CG-CE3 4.06Å; K957-W959 HydrophobicContact CG-CZ3 4.4Å; K957-W959 PolarHBondContact O-N 2.93Å; K957-W959 PolarHBondContact O-NE1 3.02Å; K957-E967 WeakPolarHBondContact CE-OE1 3.41Å; K957-E967 IonicContact NZ-OE1 2.7Å; K957-E967 PolarHBondContact NZ-OE1 2.94Å; K957-L972 PolarHBondContact NZ-O 3.49Å
958	Q	83.2	Confident	88.1	Confident	124 Å²	124	45.8 Å²	45.8	58%	0.579	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.2	32.1	-171.2	-53.8	-175.8	-43.3	0	0	112.7	P196 T954 F955	P196-Q958 HydrophobicContact CG-CG 3.92Å; T954-Q958 PolarHBondContact O-N 2.9Å; F955-Q958 PolarHBondContact O-N 3.03Å
959	W	85.2	Confident	88.3	Confident	41 Å²	41	44 Å²	44	16%	0.155	22%	0.222	C	C	.	.			trans	-106.3	26.6	-174.6	-72.5	-4.5	0	0	0	113.2	V943 T954 K957 S961 V965 E967 L972 N975	V943-W959 HydrophobicContact CG1-CE3 4.36Å; V943-W959 HydrophobicContact CG1-CZ3 4.3Å; V943-W959 HydrophobicContact CG2-CE3 4.5Å; T954-W959 PolarHBondContact O-N 2.88Å; K957-W959 HydrophobicContact CB-CB 4.08Å; K957-W959 HydrophobicContact CB-CD2 3.81Å; K957-W959 HydrophobicContact CB-CE3 3.95Å; K957-W959 HydrophobicContact CB-CG 3.85Å; K957-W959 HydrophobicContact CD-CD2 4.18Å; K957-W959 HydrophobicContact CD-CE3 4.12Å; K957-W959 HydrophobicContact CD-CH2 4.18Å; K957-W959 HydrophobicContact CD-CZ2 4.17Å; K957-W959 HydrophobicContact CD-CZ3 4.14Å; K957-W959 HydrophobicContact CG-CD2 4.29Å; K957-W959 HydrophobicContact CG-CE3 4.06Å; K957-W959 HydrophobicContact CG-CZ3 4.4Å; K957-W959 PolarHBondContact O-N 2.93Å; K957-W959 PolarHBondContact O-NE1 3.02Å; W959-S961 PolarHBondContact O-N 3.19Å; W959-S961 VanDerWaalsContact O-N 3.12Å; W959-V965 HydrophobicContact CB-CG1 3.85Å; W959-V965 HydrophobicContact CD2-CG1 4.24Å; W959-V965 HydrophobicContact CE3-CG1 3.5Å; W959-V965 HydrophobicContact CG-CG1 4.44Å; W959-V965 HydrophobicContact CZ3-CG1 4.38Å; W959-E967 HydrophobicContact CH2-CB 4.34Å; W959-E967 HydrophobicContact CH2-CG 3.93Å; W959-E967 HydrophobicContact CZ3-CB 3.92Å; W959-E967 HydrophobicContact CZ3-CG 3.95Å; W959-L972 WeakPolarHBondContact CH2-O 3.48Å; W959-L972 WeakPolarHBondContact CZ2-O 3.38Å; W959-N975 HydrophobicContact CD2-CB 3.98Å; W959-N975 HydrophobicContact CE3-CB 3.9Å; W959-N975 HydrophobicContact CH2-CB 4Å; W959-N975 HydrophobicContact CZ2-CB 4.12Å; W959-N975 HydrophobicContact CZ3-CB 3.9Å
960	T	81.3	Confident	88.6	Confident	52 Å²	52	39.5 Å²	39.5	32%	0.319	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-3.7	-177	54.4	0	0	0	0	115	H220 K962	H220-T960 WeakPolarHBondContact ND1-CG2 3.19Å; T960-K962 VanDerWaalsContact C-N 3.34Å; T960-K962 PolarHBondContact O-N 3.46Å
961	S	77.8	Confident	88.7	Confident	105 Å²	105	35.8 Å²	35.8	73%	0.734	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-6	-178.5	63.2	0	0	0	0	115.1	W959	W959-S961 PolarHBondContact O-N 3.19Å; W959-S961 VanDerWaalsContact O-N 3.12Å
962	K	85.3	Confident	89	Confident	68 Å²	68	31.6 Å²	31.6	30%	0.296	17%	0.165	S	C	.	.			trans	-131.9	148.2	-179.9	-61.8	-66	179.6	175.1	0	109.9	T960 V965 A978 L980	T960-K962 VanDerWaalsContact C-N 3.34Å; T960-K962 PolarHBondContact O-N 3.46Å; K962-V965 HydrophobicContact CB-CG2 4.18Å; K962-V965 WeakPolarHBondContact O-CG2 3.41Å; K962-A978 WeakPolarHBondContact CE-O 3.48Å; K962-A978 PolarHBondContact NZ-O 3.21Å; K962-L980 PolarHBondContact NZ-O 3.45Å
963	Y	87.4	Confident	89	Confident	42 Å²	42	36.7 Å²	36.7	17%	0.165	19%	0.192	C	C	.	.	S	Bend	trans	-81.9	-54.5	177.4	-173	-97.4	0	0	0	111.2	F669 F939 R940 V965 T985 M989	F669-Y963 AromaticContact CD1-CE1 3.91Å; F669-Y963 HydrophobicContact CD1-CE1 3.91Å; F669-Y963 AromaticContact CD1-CE2 3.96Å; F669-Y963 HydrophobicContact CD1-CE2 3.96Å; F669-Y963 AromaticContact CD1-CZ 3.48Å; F669-Y963 VanDerWaalsContact CD1-CZ 3.48Å; F669-Y963 WeakPolarHBondContact CD1-OH 3.42Å; F669-Y963 HydrophobicContact CE1-CE1 4.16Å; F669-Y963 AromaticContact CE1-CZ 3.87Å; F669-Y963 WeakPolarHBondContact CE1-OH 3.47Å; F939-Y963 CarbonylContact C-O 3.59Å; F939-Y963 HydrophobicContact CB-CD1 3.81Å; F939-Y963 HydrophobicContact CB-CD2 4.33Å; F939-Y963 HydrophobicContact CB-CE1 3.49Å; F939-Y963 VanDerWaalsContact CB-CE1 3.49Å; F939-Y963 HydrophobicContact CB-CE2 4.06Å; F939-Y963 HydrophobicContact CB-CG 4.21Å; F939-Y963 WeakPolarHBondContact CB-O 3.46Å; F939-Y963 HydrophobicContact CD2-CD1 4.47Å; F939-Y963 AromaticContact CD2-CE1 3.75Å; F939-Y963 HydrophobicContact CD2-CE1 3.75Å; F939-Y963 HydrophobicContact CG-CD1 4.16Å; F939-Y963 AromaticContact CG-CE1 3.8Å; F939-Y963 HydrophobicContact CG-CE1 3.8Å; R940-Y963 HydrophobicContact CG-CD2 3.79Å; R940-Y963 HydrophobicContact CG-CE2 3.62Å; Y963-V965 PolarHBondContact O-N 2.89Å; Y963-T985 HydrophobicContact CD1-CG2 3.74Å; Y963-T985 HydrophobicContact CG-CG2 4.16Å; Y963-M989 HydrophobicContact CD1-CG 4.49Å; Y963-M989 HydrophobicContact CE1-CE 4.27Å; Y963-M989 HydrophobicContact CE1-CG 4.1Å; Y963-M989 HydrophobicContact CE1-SD 4.01Å
964	I	93.1	Very high	89.2	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.01	20%	0.197	C	C	.	.	S	Bend	trans	-82.7	114.2	171.4	-60.7	171.1	0	0	0	108.6	L856 F939 I966 L980 T985 I988 M989	L856-I964 HydrophobicContact CD1-CG2 4.24Å; F939-I964 HydrophobicContact CD1-CB 4.38Å; F939-I964 HydrophobicContact CD1-CG1 4.07Å; F939-I964 HydrophobicContact CE1-CB 4.27Å; F939-I964 HydrophobicContact CE1-CG1 3.9Å; F939-I964 HydrophobicContact CE1-CG2 4.03Å; F939-I964 HydrophobicContact CZ-CG1 4.3Å; I964-I966 HydrophobicContact CG2-CD1 3.8Å; I964-I966 HydrophobicContact CG2-CG1 3.97Å; I964-L980 HydrophobicContact CB-CD1 3.88Å; I964-L980 HydrophobicContact CD1-CD1 4.13Å; I964-L980 HydrophobicContact CG1-CD1 4.48Å; I964-L980 HydrophobicContact CG2-CD1 4.36Å; I964-T985 HydrophobicContact CD1-CG2 4.2Å; I964-T985 HydrophobicContact CG1-CG2 4.2Å; I964-I988 HydrophobicContact CD1-CB 4.36Å; I964-I988 HydrophobicContact CD1-CG2 3.83Å; I964-M989 HydrophobicContact CD1-SD 4.36Å
965	V	95.5	Very high	89.6	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.2	C	C	.	.			trans	-124.3	119.8	-177.7	-172.1	0	0	0	0	109.7	V943 V944 T954 W959 K962 Y963	V943-V965 HydrophobicContact CB-CG1 4.39Å; V943-V965 HydrophobicContact CG1-CG1 4.09Å; V943-V965 HydrophobicContact CG2-CB 4.49Å; V943-V965 HydrophobicContact CG2-CG1 3.83Å; V944-V965 PolarHBondContact N-O 3.03Å; T954-V965 HydrophobicContact CG2-CB 4.19Å; T954-V965 HydrophobicContact CG2-CG1 4.47Å; T954-V965 HydrophobicContact CG2-CG2 3.95Å; W959-V965 HydrophobicContact CB-CG1 3.85Å; W959-V965 HydrophobicContact CD2-CG1 4.24Å; W959-V965 HydrophobicContact CE3-CG1 3.5Å; W959-V965 HydrophobicContact CG-CG1 4.44Å; W959-V965 HydrophobicContact CZ3-CG1 4.38Å; K962-V965 HydrophobicContact CB-CG2 4.18Å; K962-V965 WeakPolarHBondContact O-CG2 3.41Å; Y963-V965 PolarHBondContact O-N 2.89Å
966	I	97.2	Very high	90.2	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-136.4	117.2	-172.9	-52.3	169.3	0	0	0	108.6	L856 A860 L863 M864 V944 I964 N975 L976	L856-I966 HydrophobicContact CD1-CD1 4.15Å; L856-I966 HydrophobicContact CD2-CD1 4.3Å; A860-I966 HydrophobicContact CB-CD1 3.97Å; L863-I966 HydrophobicContact CB-CG2 4.18Å; L863-I966 HydrophobicContact CD1-CG2 4.1Å; M864-I966 HydrophobicContact CG-CD1 3.92Å; M864-I966 HydrophobicContact SD-CD1 3.83Å; V944-I966 HydrophobicContact CB-CB 4.28Å; V944-I966 HydrophobicContact CB-CG1 4Å; V944-I966 HydrophobicContact CB-CG2 4.16Å; V944-I966 HydrophobicContact CG1-CG1 4.5Å; V944-I966 HydrophobicContact CG1-CG2 4.11Å; V944-I966 HydrophobicContact CG2-CG1 4.27Å; I964-I966 HydrophobicContact CG2-CD1 3.8Å; I964-I966 HydrophobicContact CG2-CG1 3.97Å; I966-N975 PolarHBondContact N-OD1 3.28Å; I966-N975 VanDerWaalsContact N-OD1 3.14Å; I966-N975 CarbonylContact O-C 3.58Å; I966-N975 VanDerWaalsContact O-CA 3.31Å; I966-N975 WeakPolarHBondContact O-CA 3.43Å; I966-N975 PolarHBondContact O-OD1 3.4Å; I966-L976 HydrophobicContact CB-CB 4.28Å; I966-L976 HydrophobicContact CG2-CD1 4.13Å; I966-L976 PolarHBondContact O-N 2.86Å
967	E	97.2	Very high	90.6	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-82.8	136	178.1	-162	-164.3	-139.7	0	0	110.7	V943 V944 C945 R947 K957 W959	V943-E967 HydrophobicContact CG1-CB 3.9Å; V944-E967 PolarHBondContact O-N 2.88Å; C945-E967 PolarHBondContact SG-OE2 3.39Å; R947-E967 WeakPolarHBondContact CD-OE2 3.34Å; R947-E967 IonicContact CZ-OE1 2.79Å; R947-E967 IonicContact CZ-OE2 2.75Å; R947-E967 VanDerWaalsContact NE-CD 3.29Å; R947-E967 IonicContact NE-OE1 3.28Å; R947-E967 PolarHBondContact NE-OE1 2.75Å; R947-E967 VanDerWaalsContact NE-OE1 3.15Å; R947-E967 IonicContact NE-OE2 2.88Å; R947-E967 PolarHBondContact NE-OE2 3.39Å; R947-E967 IonicContact NH2-OE1 3.76Å; R947-E967 PolarHBondContact NH2-OE1 2.83Å; R947-E967 IonicContact NH2-OE2 3.7Å; R947-E967 PolarHBondContact NH2-OE2 2.96Å; K957-E967 WeakPolarHBondContact CE-OE1 3.41Å; K957-E967 IonicContact NZ-OE1 2.7Å; K957-E967 PolarHBondContact NZ-OE1 2.94Å; W959-E967 HydrophobicContact CH2-CB 4.34Å; W959-E967 HydrophobicContact CH2-CG 3.93Å; W959-E967 HydrophobicContact CZ3-CB 3.92Å; W959-E967 HydrophobicContact CZ3-CG 3.95Å
968	D	96.1	Very high	90.9	Very high	7 Å²	7	37.6 Å²	37.6	4%	0.037	20%	0.203	C	C	.	.			trans	-68.9	134.9	162.8	-172.9	-87.5	0	0	0	110	N818 Y859 F970 D971 L972 H974	N818-D968 PolarHBondContact ND2-OD1 2.93Å; N818-D968 PolarHBondContact ND2-OD2 3.31Å; Y859-D968 VanDerWaalsContact CE1-OD2 3.25Å; Y859-D968 WeakPolarHBondContact CE1-OD2 3.35Å; Y859-D968 PolarHBondContact OH-OD2 3.46Å; D968-F970 PolarHBondContact O-N 2.82Å; D968-F970 VanDerWaalsContact O-N 3.11Å; D968-F970 PolarHBondContact OD1-N 3.08Å; D968-D971 HydrophobicContact CB-CB 4.28Å; D968-D971 PolarHBondContact OD1-N 3.13Å; D968-L972 WeakPolarHBondContact O-CD2 3.45Å; D968-H974 HydrophobicContact CB-CB 4.13Å; D968-H974 PolarHBondContact N-O 3.18Å; D968-H974 VanDerWaalsContact N-O 3.14Å
969	P	95.5	Very high	91.1	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.006	19%	0.193	C	C	.	.	S	Bend	trans	-66.5	-11.7	-175.6	25	-34.2	0	0	0	115	N818 L821 Y859 L863 Q881 I946 R947	N818-P969 WeakPolarHBondContact OD1-CG 3.41Å; L821-P969 HydrophobicContact CD2-CB 3.86Å; L821-P969 HydrophobicContact CD2-CG 3.75Å; Y859-P969 WeakPolarHBondContact OH-CD 3.46Å; L863-P969 HydrophobicContact CD2-CG 4.46Å; Q881-P969 PolarHBondContact NE2-O 2.91Å; I946-P969 HydrophobicContact CD1-CB 4.3Å; I946-P969 HydrophobicContact CD1-CG 4.2Å; I946-P969 HydrophobicContact CG1-CB 3.87Å; I946-P969 HydrophobicContact CG1-CG 4.18Å; R947-P969 HydrophobicContact CB-CB 4.32Å
970	F	94.1	Very high	91.3	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.009	19%	0.187	C	C	.	.	S	Bend	trans	-121.8	-49.1	173.1	-57.7	-48.1	0	0	0	113.6	L814 H817 N818 L821 Q881 W897 V899 F901 D968 L972	L814-F970 HydrophobicContact CD2-CB 4.47Å; H817-F970 HydrophobicContact CB-CD2 3.99Å; H817-F970 HydrophobicContact CB-CE2 3.71Å; N818-F970 WeakPolarHBondContact OD1-CD2 3.47Å; N818-F970 VanDerWaalsContact OD1-CE2 3.28Å; N818-F970 WeakPolarHBondContact OD1-CE2 3.32Å; L821-F970 HydrophobicContact CB-CE2 4.37Å; L821-F970 HydrophobicContact CB-CZ 4.35Å; L821-F970 HydrophobicContact CD2-CE2 4.13Å; L821-F970 HydrophobicContact CD2-CZ 3.88Å; Q881-F970 HydrophobicContact CG-CE1 4.41Å; W897-F970 WeakPolarHBondContact CB-O 3.25Å; V899-F970 HydrophobicContact CB-CD1 4.21Å; V899-F970 HydrophobicContact CB-CD2 4.47Å; V899-F970 HydrophobicContact CB-CE1 4.22Å; V899-F970 HydrophobicContact CB-CG 4.35Å; V899-F970 HydrophobicContact CB-CZ 4.4Å; V899-F970 HydrophobicContact CG1-CB 4.13Å; V899-F970 HydrophobicContact CG1-CD1 4.1Å; V899-F970 HydrophobicContact CG1-CD2 4.09Å; V899-F970 HydrophobicContact CG1-CG 3.85Å; F901-F970 AromaticContact CD1-CZ 3.88Å; F901-F970 HydrophobicContact CD1-CZ 3.88Å; F901-F970 HydrophobicContact CE1-CZ 4.45Å; D968-F970 PolarHBondContact O-N 2.82Å; D968-F970 VanDerWaalsContact O-N 3.11Å; D968-F970 PolarHBondContact OD1-N 3.08Å; F970-L972 VanDerWaalsContact C-N 3.3Å; F970-L972 WeakPolarHBondContact O-CD2 3.21Å; F970-L972 WeakPolarHBondContact O-CG 3.26Å; F970-L972 PolarHBondContact O-N 2.61Å
971	D	91.9	Very high	91.6	Very high	25 Å²	25	30.6 Å²	30.6	13%	0.134	18%	0.181	C	C	.	.			trans	-77.5	80.5	173.3	-177.2	-0.4	0	0	0	109.5	K791 L814 D968 N973 H974	K791-D971 IonicContact NZ-OD2 3.81Å; K791-D971 PolarHBondContact NZ-OD2 2.84Å; L814-D971 HydrophobicContact CD1-CB 4.28Å; D968-D971 HydrophobicContact CB-CB 4.28Å; D968-D971 PolarHBondContact OD1-N 3.13Å; D971-N973 PolarHBondContact O-N 2.87Å; D971-N973 PolarHBondContact OD1-N 3.18Å; D971-H974 HydrophobicContact CB-CB 3.98Å; D971-H974 WeakPolarHBondContact O-CB 3.37Å; D971-H974 PolarHBondContact O-N 2.86Å; D971-H974 WeakPolarHBondContact OD2-CB 3.24Å; D971-H974 IonicContact OD2-CD2 3.09Å
972	L	92.5	Very high	92	Very high	41 Å²	41	32.5 Å²	32.5	22%	0.215	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-6.6	-171.4	-45.6	-170.9	0	0	0	113.3	W897 K957 W959 D968 F970	W897-L972 HydrophobicContact CE3-CB 4.18Å; W897-L972 HydrophobicContact CE3-CD1 4.31Å; W897-L972 HydrophobicContact CE3-CG 3.78Å; W897-L972 HydrophobicContact CH2-CB 3.74Å; W897-L972 HydrophobicContact CH2-CG 4.28Å; W897-L972 HydrophobicContact CZ3-CB 3.5Å; W897-L972 VanDerWaalsContact CZ3-CB 3.5Å; W897-L972 HydrophobicContact CZ3-CD1 4.01Å; W897-L972 HydrophobicContact CZ3-CG 3.57Å; K957-L972 PolarHBondContact NZ-O 3.49Å; W959-L972 WeakPolarHBondContact CH2-O 3.48Å; W959-L972 WeakPolarHBondContact CZ2-O 3.38Å; D968-L972 WeakPolarHBondContact O-CD2 3.45Å; F970-L972 VanDerWaalsContact C-N 3.3Å; F970-L972 WeakPolarHBondContact O-CD2 3.21Å; F970-L972 WeakPolarHBondContact O-CG 3.26Å; F970-L972 PolarHBondContact O-N 2.61Å
973	N	91.6	Very high	92.1	Very high	126 Å²	126	36.2 Å²	36.2	67%	0.674	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-7.1	171.3	-68.7	-22.1	0	0	0	112.6	W897 D971 N975	W897-N973 HydrophobicContact CH2-CB 4.28Å; W897-N973 HydrophobicContact CZ2-CB 4.07Å; D971-N973 PolarHBondContact O-N 2.87Å; D971-N973 PolarHBondContact OD1-N 3.18Å; N973-N975 PolarHBondContact O-N 3.45Å
974	H	92.1	Very high	92.3	Very high	59 Å²	59	34.4 Å²	34.4	27%	0.273	18%	0.178	S	C	.	.			trans	-94.7	99	-178.8	-162.4	3.5	0	0	0	112.4	K791 D968 D971 L976	K791-H974 PolarHBondContact NZ-CD2 3.47Å; K791-H974 VanDerWaalsContact NZ-CD2 3.29Å; D968-H974 HydrophobicContact CB-CB 4.13Å; D968-H974 PolarHBondContact N-O 3.18Å; D968-H974 VanDerWaalsContact N-O 3.14Å; D971-H974 HydrophobicContact CB-CB 3.98Å; D971-H974 WeakPolarHBondContact O-CB 3.37Å; D971-H974 PolarHBondContact O-N 2.86Å; D971-H974 WeakPolarHBondContact OD2-CB 3.24Å; D971-H974 IonicContact OD2-CD2 3.09Å; H974-L976 PolarHBondContact O-N 2.99Å
975	N	94.4	Very high	92.2	Very high	14 Å²	14	34.7 Å²	34.7	8%	0.075	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-76.5	115.8	159	180	5.2	0	0	0	109.3	W959 I966 N973 G977 A978	W959-N975 HydrophobicContact CD2-CB 3.98Å; W959-N975 HydrophobicContact CE3-CB 3.9Å; W959-N975 HydrophobicContact CH2-CB 4Å; W959-N975 HydrophobicContact CZ2-CB 4.12Å; W959-N975 HydrophobicContact CZ3-CB 3.9Å; I966-N975 PolarHBondContact N-OD1 3.28Å; I966-N975 VanDerWaalsContact N-OD1 3.14Å; I966-N975 CarbonylContact O-C 3.58Å; I966-N975 VanDerWaalsContact O-CA 3.31Å; I966-N975 WeakPolarHBondContact O-CA 3.43Å; I966-N975 PolarHBondContact O-OD1 3.4Å; N973-N975 PolarHBondContact O-N 3.45Å; N975-G977 VanDerWaalsContact C-N 3.29Å; N975-G977 WeakPolarHBondContact OD1-CA 3.26Å; N975-G977 PolarHBondContact OD1-N 2.85Å; N975-A978 HydrophobicContact CB-CB 4.28Å; N975-A978 VanDerWaalsContact O-CB 3.3Å; N975-A978 WeakPolarHBondContact O-CB 3.33Å; N975-A978 PolarHBondContact O-N 2.92Å
976	L	93.7	Very high	92	Very high	29 Å²	29	36.8 Å²	36.8	15%	0.152	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-71.9	-23.7	177	-63.1	172.3	0	0	0	112.5	Y859 A860 L863 I966 H974 A978	Y859-L976 HydrophobicContact CD1-CD1 3.8Å; Y859-L976 HydrophobicContact CD1-CD2 4.36Å; Y859-L976 HydrophobicContact CE1-CD1 3.78Å; Y859-L976 HydrophobicContact CE1-CD2 4.42Å; A860-L976 HydrophobicContact CB-CB 3.98Å; A860-L976 HydrophobicContact CB-CD1 3.87Å; L863-L976 HydrophobicContact CD1-CD1 3.61Å; I966-L976 HydrophobicContact CB-CB 4.28Å; I966-L976 HydrophobicContact CG2-CD1 4.13Å; I966-L976 PolarHBondContact O-N 2.86Å; H974-L976 PolarHBondContact O-N 2.99Å; L976-A978 VanDerWaalsContact C-N 3.29Å; L976-A978 PolarHBondContact O-N 3.19Å
977	G	93.2	Very high	91.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-77.7	-6.8	174.6	0	0	0	0	0	114.5	N975 G979 L980	N975-G977 VanDerWaalsContact C-N 3.29Å; N975-G977 WeakPolarHBondContact OD1-CA 3.26Å; N975-G977 PolarHBondContact OD1-N 2.85Å; G977-G979 PolarHBondContact O-N 2.84Å; G977-G979 VanDerWaalsContact O-N 3.11Å; G977-L980 WeakPolarHBondContact O-CB 3.28Å; G977-L980 WeakPolarHBondContact O-CG 3.49Å; G977-L980 PolarHBondContact O-N 3.15Å; G977-L980 VanDerWaalsContact O-N 3.09Å
978	A	90.1	Very high	91.7	Very high	51 Å²	51	37.6 Å²	37.6	42%	0.421	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-58.2	-28.8	-176.4	0	0	0	0	0	114.1	K962 N975 L976 L980	K962-A978 WeakPolarHBondContact CE-O 3.48Å; K962-A978 PolarHBondContact NZ-O 3.21Å; N975-A978 HydrophobicContact CB-CB 4.28Å; N975-A978 VanDerWaalsContact O-CB 3.3Å; N975-A978 WeakPolarHBondContact O-CB 3.33Å; N975-A978 PolarHBondContact O-N 2.92Å; L976-A978 VanDerWaalsContact C-N 3.29Å; L976-A978 PolarHBondContact O-N 3.19Å; A978-L980 VanDerWaalsContact C-N 3.3Å; A978-L980 PolarHBondContact O-N 2.89Å
979	G	87.1	Confident	91.6	Very high	37 Å²	37	37.6 Å²	37.6	38%	0.381	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-69.8	-20.3	178.8	0	0	0	0	0	115.1	G977 R1033	G977-G979 PolarHBondContact O-N 2.84Å; G977-G979 VanDerWaalsContact O-N 3.11Å; G979-R1033 PolarHBondContact O-NH1 3.05Å; G979-R1033 VanDerWaalsContact O-NH1 3.08Å
980	L	90.5	Very high	91.4	Very high	3 Å²	3	42.1 Å²	42.1	2%	0.016	21%	0.214	C	C	.	.			trans	-69.6	141	-170.4	-64	176.4	0	0	0	113.2	L856 K962 I964 G977 A978 M984 I988	L856-L980 HydrophobicContact CD2-CD1 3.92Å; L856-L980 HydrophobicContact CD2-CD2 4.31Å; L856-L980 HydrophobicContact CD2-CG 4.19Å; L856-L980 HydrophobicContact CG-CD1 4.1Å; L856-L980 HydrophobicContact CG-CD2 4.15Å; L856-L980 HydrophobicContact CG-CG 4.47Å; K962-L980 PolarHBondContact NZ-O 3.45Å; I964-L980 HydrophobicContact CB-CD1 3.88Å; I964-L980 HydrophobicContact CD1-CD1 4.13Å; I964-L980 HydrophobicContact CG1-CD1 4.48Å; I964-L980 HydrophobicContact CG2-CD1 4.36Å; G977-L980 WeakPolarHBondContact O-CB 3.28Å; G977-L980 WeakPolarHBondContact O-CG 3.49Å; G977-L980 PolarHBondContact O-N 3.15Å; G977-L980 VanDerWaalsContact O-N 3.09Å; A978-L980 VanDerWaalsContact C-N 3.3Å; A978-L980 PolarHBondContact O-N 2.89Å; L980-M984 HydrophobicContact CD2-CB 4.43Å; L980-M984 HydrophobicContact CD2-CG 3.73Å; L980-I988 HydrophobicContact CD1-CD1 4.36Å; L980-I988 HydrophobicContact CD2-CD1 3.82Å
981	S	88.3	Confident	91.5	Very high	29 Å²	29	42 Å²	42	20%	0.203	21%	0.214	C	C	.	.			trans	-88.6	162.2	163.6	74.9	0	0	0	0	110.6	R983 M984 T985	S981-R983 VanDerWaalsContact C-N 3.32Å; S981-R983 PolarHBondContact O-N 2.91Å; S981-M984 PolarHBondContact O-N 3.11Å; S981-M984 WeakPolarHBondContact OG-CB 3.24Å; S981-M984 PolarHBondContact OG-N 2.91Å; S981-M984 VanDerWaalsContact OG-N 3.08Å; S981-T985 PolarHBondContact O-N 3.18Å; S981-T985 PolarHBondContact O-OG1 3.35Å
982	R	84.8	Confident	91.6	Very high	146 Å²	146	41 Å²	41	55%	0.551	21%	0.208	S	C	*	.	H	α-helix	trans	-59	-43.2	174.4	-67.2	-174.7	-176.4	165.8	2.4	111.8	M984 T985 N986	R982-M984 PolarHBondContact O-N 3.14Å; R982-T985 WeakPolarHBondContact O-CB 3.31Å; R982-T985 PolarHBondContact O-N 3.34Å; R982-N986 VanDerWaalsContact O-CG 3.28Å; R982-N986 PolarHBondContact O-N 3Å; R982-N986 PolarHBondContact O-OD1 3.26Å; R982-N986 VanDerWaalsContact O-OD1 3.13Å
983	R	87.8	Confident	91.7	Very high	146 Å²	146	40.6 Å²	40.6	55%	0.551	21%	0.205	S	C	*	.	H	α-helix	trans	-58.8	-46.8	176	-71.5	176.2	172.9	-169.9	-2.5	112.5	S981 N986 F987 P1030 D1032	S981-R983 VanDerWaalsContact C-N 3.32Å; S981-R983 PolarHBondContact O-N 2.91Å; R983-N986 PolarHBondContact O-N 3.25Å; R983-F987 WeakPolarHBondContact O-CB 3.49Å; R983-F987 PolarHBondContact O-N 2.91Å; R983-P1030 HydrophobicContact CB-CB 3.99Å; R983-P1030 HydrophobicContact CB-CG 4.15Å; R983-D1032 WeakPolarHBondContact CD-OD2 3.26Å; R983-D1032 IonicContact CZ-OD2 2.74Å; R983-D1032 IonicContact NE-OD2 3.2Å; R983-D1032 IonicContact NH1-OD1 2.86Å; R983-D1032 PolarHBondContact NH1-OD1 3.36Å; R983-D1032 IonicContact NH1-OD2 2.73Å; R983-D1032 PolarHBondContact NH1-OD2 2.77Å
984	M	91.7	Very high	91.8	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.015	17%	0.174	C	C	.	.	H	α-helix	trans	-65.9	-38.7	177.4	-176.4	60	67.8	0	0	111.9	L980 S981 R982 F987 I988 A1029 P1030	L980-M984 HydrophobicContact CD2-CB 4.43Å; L980-M984 HydrophobicContact CD2-CG 3.73Å; S981-M984 PolarHBondContact O-N 3.11Å; S981-M984 WeakPolarHBondContact OG-CB 3.24Å; S981-M984 PolarHBondContact OG-N 2.91Å; S981-M984 VanDerWaalsContact OG-N 3.08Å; R982-M984 PolarHBondContact O-N 3.14Å; M984-F987 PolarHBondContact O-N 2.87Å; M984-F987 HydrophobicContact SD-CD1 4.41Å; M984-I988 HydrophobicContact CG-CD1 3.97Å; M984-I988 HydrophobicContact CG-CG1 4.49Å; M984-I988 VanDerWaalsContact O-CG1 3.28Å; M984-I988 WeakPolarHBondContact O-CG1 3.44Å; M984-I988 PolarHBondContact O-N 3.16Å; M984-I988 HydrophobicContact SD-CD1 4.35Å; M984-I988 HydrophobicContact SD-CG1 4.36Å; M984-A1029 HydrophobicContact CE-CB 4.31Å; M984-P1030 HydrophobicContact CE-CB 4.44Å; M984-P1030 VanDerWaalsContact CE-O 3.24Å; M984-P1030 WeakPolarHBondContact CE-O 3.43Å
985	T	92.1	Very high	91.9	Very high	9 Å²	9	31.9 Å²	31.9	6%	0.055	16%	0.161	C	C	.	.	H	α-helix	trans	-59	-49.8	173.6	-54.4	0	0	0	0	110.8	Y963 I964 S981 R982 F987 I988 M989	Y963-T985 HydrophobicContact CD1-CG2 3.74Å; Y963-T985 HydrophobicContact CG-CG2 4.16Å; I964-T985 HydrophobicContact CD1-CG2 4.2Å; I964-T985 HydrophobicContact CG1-CG2 4.2Å; S981-T985 PolarHBondContact O-N 3.18Å; S981-T985 PolarHBondContact O-OG1 3.35Å; R982-T985 WeakPolarHBondContact O-CB 3.31Å; R982-T985 PolarHBondContact O-N 3.34Å; T985-F987 VanDerWaalsContact C-N 3.3Å; T985-F987 PolarHBondContact O-N 3.07Å; T985-I988 PolarHBondContact O-N 3.19Å; T985-M989 HydrophobicContact CG2-CG 4.5Å; T985-M989 WeakPolarHBondContact O-CG 3.14Å; T985-M989 PolarHBondContact O-N 2.91Å
986	N	90.3	Very high	91.9	Very high	43 Å²	43	31.9 Å²	31.9	23%	0.23	16%	0.16	C	C	.	.	H	α-helix	trans	-63.6	-36.6	-179.8	-65.7	9.9	0	0	0	111.6	R982 R983 M989 K990	R982-N986 VanDerWaalsContact O-CG 3.28Å; R982-N986 PolarHBondContact O-N 3Å; R982-N986 PolarHBondContact O-OD1 3.26Å; R982-N986 VanDerWaalsContact O-OD1 3.13Å; R983-N986 PolarHBondContact O-N 3.25Å; N986-M989 PolarHBondContact O-N 3.44Å; N986-K990 WeakPolarHBondContact O-CB 3.32Å; N986-K990 PolarHBondContact O-N 3.42Å
987	F	93.1	Very high	91.8	Very high	17 Å²	17	36 Å²	36	8%	0.075	17%	0.174	C	C	.	.	H	α-helix	trans	-66.5	-44.2	174.9	-173.3	-98	0	0	0	112.4	C846 I848 R983 M984 T985 K990 A991 T1024 E1027 A1029 P1030	C846-F987 WeakPolarHBondContact O-CE1 3.43Å; I848-F987 HydrophobicContact CG2-CD1 3.55Å; I848-F987 HydrophobicContact CG2-CE1 3.58Å; R983-F987 WeakPolarHBondContact O-CB 3.49Å; R983-F987 PolarHBondContact O-N 2.91Å; M984-F987 PolarHBondContact O-N 2.87Å; M984-F987 HydrophobicContact SD-CD1 4.41Å; T985-F987 VanDerWaalsContact C-N 3.3Å; T985-F987 PolarHBondContact O-N 3.07Å; F987-K990 PolarHBondContact O-N 3.47Å; F987-A991 PolarHBondContact O-N 3.44Å; F987-T1024 HydrophobicContact CE1-CG2 4.35Å; F987-T1024 HydrophobicContact CE2-CG2 4.39Å; F987-T1024 HydrophobicContact CZ-CG2 3.71Å; F987-E1027 HydrophobicContact CE2-CB 3.95Å; F987-A1029 HydrophobicContact CD1-CB 4.35Å; F987-A1029 HydrophobicContact CE1-CB 3.75Å; F987-A1029 HydrophobicContact CZ-CB 4.2Å; F987-P1030 HydrophobicContact CB-CG 4.06Å; F987-P1030 HydrophobicContact CD2-CG 4.48Å; F987-P1030 HydrophobicContact CG-CG 4.28Å
988	I	94.8	Very high	91.8	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-59.5	-48.8	172.4	-69.7	165.5	0	0	0	110.5	I848 L856 I964 L980 M984 T985 K990 A991 F992	I848-I988 HydrophobicContact CB-CG1 3.96Å; I848-I988 HydrophobicContact CD1-CG1 4.29Å; I848-I988 HydrophobicContact CD1-CG2 4.46Å; I848-I988 HydrophobicContact CG2-CG1 3.83Å; L856-I988 HydrophobicContact CD1-CD1 4.42Å; L856-I988 HydrophobicContact CG-CD1 4.26Å; I964-I988 HydrophobicContact CD1-CB 4.36Å; I964-I988 HydrophobicContact CD1-CG2 3.83Å; L980-I988 HydrophobicContact CD1-CD1 4.36Å; L980-I988 HydrophobicContact CD2-CD1 3.82Å; M984-I988 HydrophobicContact CG-CD1 3.97Å; M984-I988 HydrophobicContact CG-CG1 4.49Å; M984-I988 VanDerWaalsContact O-CG1 3.28Å; M984-I988 WeakPolarHBondContact O-CG1 3.44Å; M984-I988 PolarHBondContact O-N 3.16Å; M984-I988 HydrophobicContact SD-CD1 4.35Å; M984-I988 HydrophobicContact SD-CG1 4.36Å; T985-I988 PolarHBondContact O-N 3.19Å; I988-K990 PolarHBondContact O-N 2.86Å; I988-A991 WeakPolarHBondContact O-CB 3.49Å; I988-A991 PolarHBondContact O-N 3.35Å; I988-F992 HydrophobicContact CG2-CD2 4.06Å; I988-F992 HydrophobicContact CG2-CE2 4.07Å; I988-F992 WeakPolarHBondContact O-CD2 3.22Å; I988-F992 PolarHBondContact O-N 2.93Å
989	M	93.8	Very high	91.9	Very high	7 Å²	7	34.1 Å²	34.1	3%	0.034	16%	0.157	C	C	.	.	H	α-helix	trans	-64	-39.6	-179.8	-67.5	-55.4	-59.2	0	0	112.3	F669 F939 Y963 I964 T985 N986 F992 I993	F669-M989 HydrophobicContact CD2-CB 4.32Å; F669-M989 HydrophobicContact CE1-CB 4.41Å; F669-M989 HydrophobicContact CE1-CE 4.16Å; F669-M989 HydrophobicContact CE1-CG 4.3Å; F669-M989 HydrophobicContact CE2-CB 3.5Å; F669-M989 HydrophobicContact CE2-CG 4.07Å; F669-M989 HydrophobicContact CZ-CB 3.57Å; F669-M989 HydrophobicContact CZ-CE 4.09Å; F669-M989 HydrophobicContact CZ-CG 3.93Å; F939-M989 HydrophobicContact CD2-CE 4.12Å; F939-M989 HydrophobicContact CD2-SD 4.16Å; F939-M989 HydrophobicContact CE2-CE 3.9Å; F939-M989 HydrophobicContact CE2-SD 3.77Å; F939-M989 HydrophobicContact CZ-SD 4.42Å; Y963-M989 HydrophobicContact CD1-CG 4.49Å; Y963-M989 HydrophobicContact CE1-CE 4.27Å; Y963-M989 HydrophobicContact CE1-CG 4.1Å; Y963-M989 HydrophobicContact CE1-SD 4.01Å; I964-M989 HydrophobicContact CD1-SD 4.36Å; T985-M989 HydrophobicContact CG2-CG 4.5Å; T985-M989 WeakPolarHBondContact O-CG 3.14Å; T985-M989 PolarHBondContact O-N 2.91Å; N986-M989 PolarHBondContact O-N 3.44Å; M989-F992 PolarHBondContact O-N 3.28Å; M989-I993 VanDerWaalsContact O-CG1 3.29Å; M989-I993 WeakPolarHBondContact O-CG1 3.41Å; M989-I993 PolarHBondContact O-N 3.44Å
990	K	92.4	Very high	92.1	Very high	95 Å²	95	32.4 Å²	32.4	41%	0.413	14%	0.138	S	C	.	.	H	α-helix	trans	-56.6	-49.7	170.3	-90.4	-164.1	168.2	-159.1	0	111.7	N986 F987 I988 F992 I993 N994 E1025	N986-K990 WeakPolarHBondContact O-CB 3.32Å; N986-K990 PolarHBondContact O-N 3.42Å; F987-K990 PolarHBondContact O-N 3.47Å; I988-K990 PolarHBondContact O-N 2.86Å; K990-F992 VanDerWaalsContact C-N 3.32Å; K990-F992 PolarHBondContact O-N 2.81Å; K990-I993 PolarHBondContact O-N 3.43Å; K990-I993 VanDerWaalsContact O-N 3.11Å; K990-N994 PolarHBondContact O-N 2.94Å; K990-E1025 IonicContact NZ-OE1 3.88Å; K990-E1025 IonicContact NZ-OE2 3.37Å; K990-E1025 PolarHBondContact NZ-OE2 3Å
991	A	95	Very high	92	Very high	1 Å²	1	35 Å²	35	1%	0.008	16%	0.155	C	C	.	.	H	α-helix	trans	-57.7	-44	178.8	0	0	0	0	0	111.6	F842 C846 I848 F987 I988 N994 G995	F842-A991 WeakPolarHBondContact CZ-O 3.37Å; C846-A991 HydrophobicContact CB-CB 4.17Å; I848-A991 HydrophobicContact CD1-CB 4.26Å; F987-A991 PolarHBondContact O-N 3.44Å; I988-A991 WeakPolarHBondContact O-CB 3.49Å; I988-A991 PolarHBondContact O-N 3.35Å; A991-N994 PolarHBondContact O-N 3.45Å; A991-G995 PolarHBondContact O-N 3.39Å
992	F	95.1	Very high	91.8	Very high	3 Å²	3	35.5 Å²	35.5	1%	0.013	16%	0.157	C	C	.	.	H	α-helix	trans	-63.3	-39.4	174.8	-87.9	-107.6	0	0	0	113.1	M839 F842 I848 Y861 M864 L929 L930 Y933 T934 I988 M989 K990 G995 R996	M839-F992 HydrophobicContact CE-CE1 3.76Å; M839-F992 HydrophobicContact CE-CZ 3.59Å; M839-F992 HydrophobicContact SD-CZ 4Å; F842-F992 AromaticContact CE1-CD2 3.89Å; F842-F992 HydrophobicContact CE1-CD2 3.89Å; F842-F992 AromaticContact CE1-CE2 3.88Å; F842-F992 HydrophobicContact CE1-CE2 3.88Å; F842-F992 HydrophobicContact CE1-CG 4.36Å; F842-F992 HydrophobicContact CE1-CZ 4.35Å; I848-F992 HydrophobicContact CD1-CE2 4.5Å; Y861-F992 HydrophobicContact CD1-CZ 4.41Å; Y861-F992 HydrophobicContact CE1-CE2 4.05Å; Y861-F992 HydrophobicContact CE1-CZ 4.26Å; M864-F992 HydrophobicContact CE-CE1 4.44Å; M864-F992 HydrophobicContact CE-CZ 4.21Å; L929-F992 HydrophobicContact CD2-CE1 4.18Å; L930-F992 HydrophobicContact CD2-CD1 4.1Å; Y933-F992 HydrophobicContact CD2-CE1 4.4Å; T934-F992 HydrophobicContact CG2-CB 3.99Å; I988-F992 HydrophobicContact CG2-CD2 4.06Å; I988-F992 HydrophobicContact CG2-CE2 4.07Å; I988-F992 WeakPolarHBondContact O-CD2 3.22Å; I988-F992 PolarHBondContact O-N 2.93Å; M989-F992 PolarHBondContact O-N 3.28Å; K990-F992 VanDerWaalsContact C-N 3.32Å; K990-F992 PolarHBondContact O-N 2.81Å; F992-G995 PolarHBondContact O-N 3.27Å; F992-R996 WeakPolarHBondContact O-CB 3.49Å; F992-R996 PolarHBondContact O-N 3.27Å
993	I	93.6	Very high	91.4	Very high	32 Å²	32	30.2 Å²	30.2	16%	0.164	14%	0.139	C	C	.	.	H	α-helix	trans	-66.8	-43	176.2	-70.5	164.2	0	0	0	111.4	F669 L674 T934 M989 K990 R996 R997	F669-I993 HydrophobicContact CZ-CD1 4.29Å; L674-I993 HydrophobicContact CD1-CG1 4.34Å; L674-I993 HydrophobicContact CD2-CD1 4.12Å; L674-I993 HydrophobicContact CD2-CG1 4.1Å; L674-I993 HydrophobicContact CD2-CG2 3.82Å; T934-I993 HydrophobicContact CG2-CG1 3.85Å; M989-I993 VanDerWaalsContact O-CG1 3.29Å; M989-I993 WeakPolarHBondContact O-CG1 3.41Å; M989-I993 PolarHBondContact O-N 3.44Å; K990-I993 PolarHBondContact O-N 3.43Å; K990-I993 VanDerWaalsContact O-N 3.11Å; I993-R996 WeakPolarHBondContact O-CB 3.35Å; I993-R996 PolarHBondContact O-N 2.87Å; I993-R997 PolarHBondContact O-N 3.4Å
994	N	93.5	Very high	90.5	Very high	2 Å²	2	34 Å²	34	1%	0.011	16%	0.16	C	C	.	.	H	α-helix	trans	-68.9	-38.5	176.4	-70.5	-26	0	0	0	111.4	K990 A991 R997 V998 L1023 E1025	K990-N994 PolarHBondContact O-N 2.94Å; A991-N994 PolarHBondContact O-N 3.45Å; N994-R997 WeakPolarHBondContact O-CB 3.34Å; N994-R997 PolarHBondContact O-N 3.07Å; N994-R997 VanDerWaalsContact O-N 3.17Å; N994-R997 PolarHBondContact OD1-NH1 2.92Å; N994-R997 PolarHBondContact OD1-NH2 3.36Å; N994-V998 WeakPolarHBondContact O-CG2 3.05Å; N994-V998 PolarHBondContact O-N 3.26Å; N994-L1023 WeakPolarHBondContact CB-O 3.3Å; N994-L1023 PolarHBondContact ND2-O 3.43Å; N994-E1025 PolarHBondContact ND2-OE1 2.81Å; N994-E1025 PolarHBondContact OD1-OE1 3.43Å
995	G	94.8	Very high	89.6	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-56.9	-50.8	169	0	0	0	0	0	111.8	A991 F992 R997 V998 F999	A991-G995 PolarHBondContact O-N 3.39Å; F992-G995 PolarHBondContact O-N 3.27Å; G995-R997 VanDerWaalsContact C-N 3.27Å; G995-R997 PolarHBondContact O-N 3.16Å; G995-V998 PolarHBondContact O-N 2.65Å; G995-F999 WeakPolarHBondContact O-CB 3.43Å; G995-F999 WeakPolarHBondContact O-CD2 3.33Å; G995-F999 PolarHBondContact O-N 2.98Å
996	R	94.6	Very high	88.9	Confident	15 Å²	15	38.8 Å²	38.8	6%	0.057	20%	0.195	C	C	.	.	H	α-helix	trans	-53.5	-43.3	173.2	177.7	-151.5	178.3	-108.5	7.5	111.6	D675 L677 L930 R931 T934 E935 F992 I993 G1000	D675-R996 VanDerWaalsContact O-CZ 3.3Å; D675-R996 PolarHBondContact O-NH1 3.07Å; D675-R996 PolarHBondContact O-NH2 3.41Å; L677-R996 HydrophobicContact CD1-CG 4.09Å; L930-R996 HydrophobicContact CB-CB 4.31Å; R931-R996 HydrophobicContact CG-CG 4.29Å; T934-R996 WeakPolarHBondContact OG1-CD 3.21Å; E935-R996 IonicContact OE1-CZ 3.49Å; E935-R996 IonicContact OE1-NE 2.68Å; E935-R996 PolarHBondContact OE1-NE 3.05Å; E935-R996 IonicContact OE1-NH2 3.64Å; E935-R996 PolarHBondContact OE1-NH2 2.97Å; F992-R996 WeakPolarHBondContact O-CB 3.49Å; F992-R996 PolarHBondContact O-N 3.27Å; I993-R996 WeakPolarHBondContact O-CB 3.35Å; I993-R996 PolarHBondContact O-N 2.87Å; R996-G1000 VanDerWaalsContact O-CA 3.26Å; R996-G1000 WeakPolarHBondContact O-CA 3.25Å; R996-G1000 PolarHBondContact O-N 2.91Å
997	R	92.5	Very high	88.4	Confident	116 Å²	116	38.4 Å²	38.4	44%	0.438	20%	0.195	S	C	.	.	H	α-helix	trans	-62.9	-49.3	177.3	-176.3	176.4	67	-143.1	-3.8	112	I993 N994 G995 T1001	I993-R997 PolarHBondContact O-N 3.4Å; N994-R997 WeakPolarHBondContact O-CB 3.34Å; N994-R997 PolarHBondContact O-N 3.07Å; N994-R997 VanDerWaalsContact O-N 3.17Å; N994-R997 PolarHBondContact OD1-NH1 2.92Å; N994-R997 PolarHBondContact OD1-NH2 3.36Å; G995-R997 VanDerWaalsContact C-N 3.27Å; G995-R997 PolarHBondContact O-N 3.16Å; R997-T1001 VanDerWaalsContact O-CB 3.25Å; R997-T1001 WeakPolarHBondContact O-CB 3.4Å; R997-T1001 PolarHBondContact O-N 3.36Å; R997-T1001 PolarHBondContact O-OG1 3.43Å
998	V	92.6	Very high	87.7	Confident	10 Å²	10	43.5 Å²	43.5	6%	0.061	23%	0.23	C	C	.	.	H	α-helix	trans	-70.5	-52.7	-177.1	178.8	0	0	0	0	111.5	N994 G995 G1000 Y1016 F1017 V1022 L1023	N994-V998 WeakPolarHBondContact O-CG2 3.05Å; N994-V998 PolarHBondContact O-N 3.26Å; G995-V998 PolarHBondContact O-N 2.65Å; V998-G1000 PolarHBondContact O-N 3.4Å; V998-Y1016 HydrophobicContact CG1-CE1 4.32Å; V998-F1017 HydrophobicContact CG1-CD1 3.89Å; V998-F1017 HydrophobicContact CG1-CE1 4.4Å; V998-V1022 HydrophobicContact CG2-CG1 3.58Å; V998-L1023 HydrophobicContact CG2-CD2 4.44Å
999	F	92.9	Very high	87.1	Confident	1 Å²	1	50.3 Å²	50.3	0%	0.004	26%	0.262	C	S	.	.	H	α-helix	trans	-70.5	-17.9	178.5	-70.8	-78.9	0	0	0	113.6	F684 L688 V691 F842 W926 L927 L930 G995 F1017 F1018	F684-F999 WeakPolarHBondContact CE1-O 3.45Å; F684-F999 WeakPolarHBondContact CZ-O 3.35Å; L688-F999 HydrophobicContact CD2-CB 4.44Å; L688-F999 HydrophobicContact CD2-CD1 3.94Å; V691-F999 HydrophobicContact CG1-CE1 4.47Å; F842-F999 HydrophobicContact CD2-CE2 4.49Å; W926-F999 AromaticContact CD1-CD1 3.63Å; W926-F999 AromaticContact CD1-CE1 3.91Å; W926-F999 AromaticContact CD1-CG 3.93Å; W926-F999 HydrophobicContact CZ2-CD2 4.39Å; W926-F999 HydrophobicContact CZ2-CE2 4.05Å; W926-F999 HydrophobicContact CZ2-CZ 4.37Å; W926-F999 AromaticContact NE1-CD1 3.26Å; W926-F999 VanDerWaalsContact NE1-CD1 3.26Å; W926-F999 AromaticContact NE1-CD2 3.47Å; W926-F999 AromaticContact NE1-CE1 3.3Å; W926-F999 VanDerWaalsContact NE1-CE1 3.3Å; W926-F999 AromaticContact NE1-CE2 3.53Å; W926-F999 AromaticContact NE1-CG 3.35Å; W926-F999 AromaticContact NE1-CZ 3.44Å; L927-F999 HydrophobicContact CD1-CB 4.35Å; L930-F999 HydrophobicContact CD1-CB 3.84Å; L930-F999 HydrophobicContact CD1-CD2 3.67Å; L930-F999 HydrophobicContact CD1-CG 3.98Å; G995-F999 WeakPolarHBondContact O-CB 3.43Å; G995-F999 WeakPolarHBondContact O-CD2 3.33Å; G995-F999 PolarHBondContact O-N 2.98Å; F999-F1017 HydrophobicContact CD1-CB 4.42Å; F999-F1017 AromaticContact CD1-CD1 3.45Å; F999-F1017 HydrophobicContact CD1-CD1 3.45Å; F999-F1017 VanDerWaalsContact CD1-CD1 3.45Å; F999-F1017 HydrophobicContact CD1-CE1 4.02Å; F999-F1017 HydrophobicContact CD1-CG 4.14Å; F999-F1017 HydrophobicContact CE1-CB 3.64Å; F999-F1017 AromaticContact CE1-CD1 3.56Å; F999-F1017 HydrophobicContact CE1-CD1 3.56Å; F999-F1017 HydrophobicContact CE1-CE1 4.49Å; F999-F1017 AromaticContact CE1-CG 3.78Å; F999-F1017 HydrophobicContact CE1-CG 3.78Å; F999-F1017 WeakPolarHBondContact CE2-O 3.28Å; F999-F1017 HydrophobicContact CG-CD1 4.08Å; F999-F1017 HydrophobicContact CZ-CB 3.78Å; F999-F1017 HydrophobicContact CZ-CD1 4.23Å; F999-F1017 HydrophobicContact CZ-CG 4.37Å; F999-F1017 VanDerWaalsContact CZ-O 3.28Å; F999-F1017 WeakPolarHBondContact CZ-O 3.41Å; F999-F1018 HydrophobicContact CE1-CE2 4.44Å; F999-F1018 HydrophobicContact CE1-CZ 4.31Å; F999-F1018 HydrophobicContact CZ-CD1 4.32Å; F999-F1018 HydrophobicContact CZ-CD2 4.48Å; F999-F1018 AromaticContact CZ-CE1 3.87Å; F999-F1018 HydrophobicContact CZ-CE1 3.87Å; F999-F1018 HydrophobicContact CZ-CE2 4.05Å; F999-F1018 AromaticContact CZ-CZ 3.72Å; F999-F1018 HydrophobicContact CZ-CZ 3.72Å
1000	G	91.1	Very high	86.7	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-95.8	-9.6	-179.9	0	0	0	0	0	115.7	R996 V998	R996-G1000 VanDerWaalsContact O-CA 3.26Å; R996-G1000 WeakPolarHBondContact O-CA 3.25Å; R996-G1000 PolarHBondContact O-N 2.91Å; V998-G1000 PolarHBondContact O-N 3.4Å
1001	T	88.4	Confident	86.2	Confident	58 Å²	58	52.9 Å²	52.9	36%	0.356	28%	0.282	S	S	.	.	S	Bend	trans	-109.1	115.5	-174.8	-55.9	0	0	0	0	111.5	F684 R997 M1003	F684-T1001 WeakPolarHBondContact CZ-O 3.33Å; R997-T1001 VanDerWaalsContact O-CB 3.25Å; R997-T1001 WeakPolarHBondContact O-CB 3.4Å; R997-T1001 PolarHBondContact O-N 3.36Å; R997-T1001 PolarHBondContact O-OG1 3.43Å; T1001-M1003 PolarHBondContact O-N 3.07Å
1002	P	82.4	Confident	85.8	Confident	39 Å²	39	54.5 Å²	54.5	25%	0.253	29%	0.294	S	S	.	.			trans	-61	107.9	177.6	-27.1	35.9	0	0	0	113.9	P678 F684 K1004	P678-P1002 HydrophobicContact CG-CG 4.37Å; F684-P1002 HydrophobicContact CB-CB 4.29Å; F684-P1002 HydrophobicContact CB-CG 4.38Å; F684-P1002 HydrophobicContact CD1-CB 4.28Å; F684-P1002 HydrophobicContact CD1-CG 3.8Å; F684-P1002 HydrophobicContact CD2-CB 4.16Å; F684-P1002 HydrophobicContact CE1-CG 4.16Å; F684-P1002 HydrophobicContact CG-CB 3.99Å; F684-P1002 HydrophobicContact CG-CG 4.01Å; P1002-K1004 PolarHBondContact O-N 2.7Å
1003	M	77.3	Confident	85.4	Confident	36 Å²	36	56.2 Å²	56.2	18%	0.177	30%	0.301	C	S	.	.			trans	-59.7	128.2	166.1	55	-171.3	-76.6	0	0	110.8	F684 V687 T1001 G1005 L1006 Y1016 F1017	F684-M1003 HydrophobicContact CD2-CG 4.45Å; F684-M1003 HydrophobicContact CE2-CG 4.22Å; V687-M1003 HydrophobicContact CG1-SD 4.37Å; T1001-M1003 PolarHBondContact O-N 3.07Å; M1003-G1005 PolarHBondContact O-N 2.85Å; M1003-L1006 HydrophobicContact CE-CB 3.98Å; M1003-L1006 HydrophobicContact CE-CD1 3.84Å; M1003-Y1016 HydrophobicContact CB-CE1 4.24Å; M1003-Y1016 HydrophobicContact SD-CD1 3.91Å; M1003-Y1016 HydrophobicContact SD-CE1 3.86Å; M1003-F1017 HydrophobicContact SD-CE2 3.75Å; M1003-F1017 HydrophobicContact SD-CZ 3.74Å
1004	K	68.1	Low	85	Confident	225 Å²	225	55.7 Å²	55.7	98%	0.978	30%	0.298	S	S	*	.	S	Bend	trans	-76.7	-6.3	177.3	-67.1	178.8	-179.2	172.4	0	113.5	P1002	P1002-K1004 PolarHBondContact O-N 2.7Å
1005	G	72.9	Confident	84.7	Confident	45 Å²	45	60.2 Å²	60.2	46%	0.464	32%	0.32	S	S	.	.	S	Bend	trans	167.5	161.2	-177.9	0	0	0	0	0	107.8	M1003	M1003-G1005 PolarHBondContact O-N 2.85Å
1006	L	78.3	Confident	84.5	Confident	67 Å²	67	62.5 Å²	62.5	35%	0.351	33%	0.329	S	S	.	.			trans	-69.8	128.8	171.2	-169.1	66.5	0	0	0	108.5	M1003 Y1010 E1013 Y1016	M1003-L1006 HydrophobicContact CE-CB 3.98Å; M1003-L1006 HydrophobicContact CE-CD1 3.84Å; L1006-Y1010 VanDerWaalsContact CD2-O 3.24Å; L1006-Y1010 WeakPolarHBondContact CD2-O 3.44Å; L1006-E1013 HydrophobicContact CD1-CG 4.49Å; L1006-Y1016 HydrophobicContact CD1-CG 4.23Å
1007	P	79.5	Confident	84.3	Confident	35 Å²	35	61.9 Å²	61.9	23%	0.227	33%	0.326	C	S	.	.			trans	-64.7	148.5	176.9	-16	29.4	0	0	0	110.8	E1009 Y1010 Y1016	P1007-E1009 WeakPolarHBondContact CB-OE2 3.48Å; P1007-E1009 PolarHBondContact O-N 3.19Å; P1007-E1009 VanDerWaalsContact O-N 3.1Å; P1007-Y1010 HydrophobicContact CB-CD2 3.95Å; P1007-Y1010 HydrophobicContact CB-CE2 4.41Å; P1007-Y1010 HydrophobicContact CG-CD2 3.9Å; P1007-Y1010 HydrophobicContact CG-CE2 4.24Å; P1007-Y1010 PolarHBondContact O-N 3.48Å; P1007-Y1016 HydrophobicContact CG-CD2 4.15Å; P1007-Y1016 HydrophobicContact CG-CE2 4.05Å
1008	P	79	Confident	84.2	Confident	124 Å²	124	56.6 Å²	56.6	81%	0.805	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-12.1	-175	30	-36.3	0	0	0	113.8
1009	E	82.3	Confident	84.2	Confident	145 Å²	145	57.3 Å²	57.3	68%	0.678	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-27	172.3	-58	75.5	-153.6	0	0	112.9	P1007	P1007-E1009 WeakPolarHBondContact CB-OE2 3.48Å; P1007-E1009 PolarHBondContact O-N 3.19Å; P1007-E1009 VanDerWaalsContact O-N 3.1Å
1010	Y	84	Confident	84.1	Confident	53 Å²	53	59.8 Å²	59.8	21%	0.208	33%	0.326	C	S	.	.			trans	-104.1	122.8	-173.5	-63.4	-85.3	0	0	0	111.7	L1006 P1007 E1015 Y1016 D1019	L1006-Y1010 VanDerWaalsContact CD2-O 3.24Å; L1006-Y1010 WeakPolarHBondContact CD2-O 3.44Å; P1007-Y1010 HydrophobicContact CB-CD2 3.95Å; P1007-Y1010 HydrophobicContact CB-CE2 4.41Å; P1007-Y1010 HydrophobicContact CG-CD2 3.9Å; P1007-Y1010 HydrophobicContact CG-CE2 4.24Å; P1007-Y1010 PolarHBondContact O-N 3.48Å; Y1010-E1015 HydrophobicContact CD1-CB 4.19Å; Y1010-Y1016 AromaticContact CD2-CD2 3.83Å; Y1010-Y1016 HydrophobicContact CD2-CD2 3.83Å; Y1010-Y1016 AromaticContact CE2-CD2 3.79Å; Y1010-Y1016 HydrophobicContact CE2-CD2 3.79Å; Y1010-Y1016 HydrophobicContact CE2-CE2 4.46Å; Y1010-Y1016 HydrophobicContact CG-CD2 4.26Å; Y1010-D1019 HydrophobicContact CE1-CB 4.22Å; Y1010-D1019 VanDerWaalsContact CE1-OD2 3.28Å; Y1010-D1019 WeakPolarHBondContact CE1-OD2 3.48Å; Y1010-D1019 PolarHBondContact OH-OD2 2.94Å
1011	P	82.1	Confident	84.1	Confident	104 Å²	104	66.8 Å²	66.8	68%	0.675	36%	0.359	S	S	*	.	S	Bend	trans	-81.8	-15.1	178	33.4	-34.6	0	0	0	113.1	E1015	P1011-E1015 WeakPolarHBondContact CD-OE2 3.5Å; P1011-E1015 WeakPolarHBondContact CG-OE2 3.49Å
1012	S	86.6	Confident	84.2	Confident	35 Å²	35	66.4 Å²	66.4	25%	0.245	36%	0.357	C	S	.	.	S	Bend	trans	-141.9	154.9	176.6	81.7	0	0	0	0	113.5	M1014 E1015 Y1016	S1012-M1014 PolarHBondContact O-N 3Å; S1012-M1014 PolarHBondContact OG-N 2.65Å; S1012-E1015 VanDerWaalsContact CB-OE1 3.28Å; S1012-E1015 WeakPolarHBondContact CB-OE1 3.44Å; S1012-E1015 PolarHBondContact O-N 3.46Å; S1012-E1015 PolarHBondContact OG-N 2.84Å; S1012-E1015 VanDerWaalsContact OG-N 3.13Å; S1012-E1015 PolarHBondContact OG-OE1 2.92Å; S1012-Y1016 PolarHBondContact O-N 2.89Å
1013	E	86.4	Confident	84.7	Confident	38 Å²	38	64.7 Å²	64.7	18%	0.178	35%	0.345	C	S	.	.	H	α-helix	trans	-62.5	-33.1	172.6	-58.9	-178.5	134.5	0	0	111.3	R690 V691 L1006 Y1016 F1017	R690-E1013 IonicContact CZ-OE1 3.6Å; R690-E1013 IonicContact CZ-OE2 2.71Å; R690-E1013 VanDerWaalsContact CZ-OE2 3.27Å; R690-E1013 IonicContact NE-OE1 3.53Å; R690-E1013 IonicContact NE-OE2 3.8Å; R690-E1013 PolarHBondContact NE-OE2 3Å; R690-E1013 IonicContact NH2-OE1 2.7Å; R690-E1013 PolarHBondContact NH2-OE1 2.65Å; R690-E1013 IonicContact NH2-OE2 3.62Å; R690-E1013 PolarHBondContact NH2-OE2 2.67Å; V691-E1013 HydrophobicContact CG2-CB 3.82Å; L1006-E1013 HydrophobicContact CD1-CG 4.49Å; E1013-Y1016 PolarHBondContact O-N 3.05Å; E1013-F1017 HydrophobicContact CB-CD2 4.4Å; E1013-F1017 WeakPolarHBondContact O-CD2 3.47Å; E1013-F1017 PolarHBondContact O-N 2.84Å
1014	M	85.9	Confident	85.3	Confident	21 Å²	21	63.6 Å²	63.6	10%	0.103	34%	0.341	C	S	.	.	H	α-helix	trans	-63.3	-42.1	177.7	-70.7	-64.4	-56	0	0	112.1	V691 Q694 C695 L698 F699 S1012 F1018	V691-M1014 HydrophobicContact CG1-SD 3.87Å; Q694-M1014 HydrophobicContact CB-SD 4.11Å; C695-M1014 HydrophobicContact CB-CE 3.86Å; C695-M1014 HydrophobicContact CB-SD 4.4Å; L698-M1014 HydrophobicContact CD1-CG 3.81Å; L698-M1014 HydrophobicContact CD1-SD 4.4Å; F699-M1014 HydrophobicContact CD2-CE 4.41Å; F699-M1014 HydrophobicContact CE2-CE 3.73Å; S1012-M1014 PolarHBondContact O-N 3Å; S1012-M1014 PolarHBondContact OG-N 2.65Å; M1014-F1018 HydrophobicContact CE-CD2 3.76Å; M1014-F1018 HydrophobicContact CE-CE2 3.63Å; M1014-F1018 WeakPolarHBondContact O-CB 3.32Å; M1014-F1018 WeakPolarHBondContact O-CD2 3.38Å; M1014-F1018 PolarHBondContact O-N 3.34Å; M1014-F1018 VanDerWaalsContact O-N 3.1Å; M1014-F1018 HydrophobicContact SD-CE2 4.24Å
1015	E	86.6	Confident	86.3	Confident	98 Å²	98	57.3 Å²	57.3	46%	0.458	32%	0.315	S	S	.	.	H	α-helix	trans	-67.9	-40	176.9	-75.6	152.3	-92.8	0	0	111.6	Y1010 P1011 S1012 D1019	Y1010-E1015 HydrophobicContact CD1-CB 4.19Å; P1011-E1015 WeakPolarHBondContact CD-OE2 3.5Å; P1011-E1015 WeakPolarHBondContact CG-OE2 3.49Å; S1012-E1015 VanDerWaalsContact CB-OE1 3.28Å; S1012-E1015 WeakPolarHBondContact CB-OE1 3.44Å; S1012-E1015 PolarHBondContact O-N 3.46Å; S1012-E1015 PolarHBondContact OG-N 2.84Å; S1012-E1015 VanDerWaalsContact OG-N 3.13Å; S1012-E1015 PolarHBondContact OG-OE1 2.92Å; E1015-D1019 WeakPolarHBondContact O-CA 3.31Å; E1015-D1019 WeakPolarHBondContact O-CB 3.41Å; E1015-D1019 PolarHBondContact O-N 3.03Å
1016	Y	90.4	Very high	86.9	Confident	48 Å²	48	57.7 Å²	57.7	19%	0.188	32%	0.319	C	S	.	.	H	α-helix	trans	-61.5	-44.6	175	176.2	-102.7	0	0	0	113.2	V998 M1003 L1006 P1007 Y1010 S1012 E1013	V998-Y1016 HydrophobicContact CG1-CE1 4.32Å; M1003-Y1016 HydrophobicContact CB-CE1 4.24Å; M1003-Y1016 HydrophobicContact SD-CD1 3.91Å; M1003-Y1016 HydrophobicContact SD-CE1 3.86Å; L1006-Y1016 HydrophobicContact CD1-CG 4.23Å; P1007-Y1016 HydrophobicContact CG-CD2 4.15Å; P1007-Y1016 HydrophobicContact CG-CE2 4.05Å; Y1010-Y1016 AromaticContact CD2-CD2 3.83Å; Y1010-Y1016 HydrophobicContact CD2-CD2 3.83Å; Y1010-Y1016 AromaticContact CE2-CD2 3.79Å; Y1010-Y1016 HydrophobicContact CE2-CD2 3.79Å; Y1010-Y1016 HydrophobicContact CE2-CE2 4.46Å; Y1010-Y1016 HydrophobicContact CG-CD2 4.26Å; S1012-Y1016 PolarHBondContact O-N 2.89Å; E1013-Y1016 PolarHBondContact O-N 3.05Å
1017	F	91	Very high	87.4	Confident	1 Å²	1	60.5 Å²	60.5	0%	0.004	33%	0.33	C	S	.	.	H	α-helix	trans	-79	-20.3	-176.7	-81.5	-66.9	0	0	0	114.6	F684 V687 L688 V691 V998 F999 M1003 E1013	F684-F1017 HydrophobicContact CE2-CE1 4.44Å; F684-F1017 AromaticContact CE2-CZ 3.98Å; F684-F1017 HydrophobicContact CE2-CZ 3.98Å; F684-F1017 HydrophobicContact CZ-CE1 4.47Å; F684-F1017 HydrophobicContact CZ-CZ 4.43Å; V687-F1017 HydrophobicContact CG1-CE2 3.85Å; V687-F1017 HydrophobicContact CG1-CZ 4.24Å; L688-F1017 HydrophobicContact CD2-CE1 3.94Å; L688-F1017 HydrophobicContact CD2-CZ 4.04Å; V691-F1017 HydrophobicContact CB-CD2 4.33Å; V691-F1017 HydrophobicContact CG1-CB 4.17Å; V691-F1017 HydrophobicContact CG1-CD2 3.92Å; V691-F1017 HydrophobicContact CG1-CG 4.21Å; V691-F1017 HydrophobicContact CG2-CD2 3.69Å; V691-F1017 HydrophobicContact CG2-CE2 3.89Å; V998-F1017 HydrophobicContact CG1-CD1 3.89Å; V998-F1017 HydrophobicContact CG1-CE1 4.4Å; F999-F1017 HydrophobicContact CD1-CB 4.42Å; F999-F1017 AromaticContact CD1-CD1 3.45Å; F999-F1017 HydrophobicContact CD1-CD1 3.45Å; F999-F1017 VanDerWaalsContact CD1-CD1 3.45Å; F999-F1017 HydrophobicContact CD1-CE1 4.02Å; F999-F1017 HydrophobicContact CD1-CG 4.14Å; F999-F1017 HydrophobicContact CE1-CB 3.64Å; F999-F1017 AromaticContact CE1-CD1 3.56Å; F999-F1017 HydrophobicContact CE1-CD1 3.56Å; F999-F1017 HydrophobicContact CE1-CE1 4.49Å; F999-F1017 AromaticContact CE1-CG 3.78Å; F999-F1017 HydrophobicContact CE1-CG 3.78Å; F999-F1017 WeakPolarHBondContact CE2-O 3.28Å; F999-F1017 HydrophobicContact CG-CD1 4.08Å; F999-F1017 HydrophobicContact CZ-CB 3.78Å; F999-F1017 HydrophobicContact CZ-CD1 4.23Å; F999-F1017 HydrophobicContact CZ-CG 4.37Å; F999-F1017 VanDerWaalsContact CZ-O 3.28Å; F999-F1017 WeakPolarHBondContact CZ-O 3.41Å; M1003-F1017 HydrophobicContact SD-CE2 3.75Å; M1003-F1017 HydrophobicContact SD-CZ 3.74Å; E1013-F1017 HydrophobicContact CB-CD2 4.4Å; E1013-F1017 WeakPolarHBondContact O-CD2 3.47Å; E1013-F1017 PolarHBondContact O-N 2.84Å
1018	F	91.6	Very high	87.9	Confident	6 Å²	6	63.8 Å²	63.8	3%	0.026	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.1	19	-177.4	-66	-83.2	0	0	0	113.9	V691 I838 V841 F842 M845 F999 M1014 P1020	V691-F1018 HydrophobicContact CG1-CE2 4.03Å; I838-F1018 HydrophobicContact CG2-CE1 4.36Å; I838-F1018 HydrophobicContact CG2-CZ 4.07Å; V841-F1018 HydrophobicContact CG1-CD1 3.96Å; V841-F1018 HydrophobicContact CG1-CE1 4.01Å; V841-F1018 HydrophobicContact CG1-CG 4.41Å; F842-F1018 HydrophobicContact CB-CE1 4.23Å; M845-F1018 HydrophobicContact CE-CB 4.41Å; M845-F1018 VanDerWaalsContact CE-O 3.27Å; M845-F1018 WeakPolarHBondContact CE-O 3.49Å; M845-F1018 HydrophobicContact CG-CB 4.25Å; F999-F1018 HydrophobicContact CE1-CE2 4.44Å; F999-F1018 HydrophobicContact CE1-CZ 4.31Å; F999-F1018 HydrophobicContact CZ-CD1 4.32Å; F999-F1018 HydrophobicContact CZ-CD2 4.48Å; F999-F1018 AromaticContact CZ-CE1 3.87Å; F999-F1018 HydrophobicContact CZ-CE1 3.87Å; F999-F1018 HydrophobicContact CZ-CE2 4.05Å; F999-F1018 AromaticContact CZ-CZ 3.72Å; F999-F1018 HydrophobicContact CZ-CZ 3.72Å; M1014-F1018 HydrophobicContact CE-CD2 3.76Å; M1014-F1018 HydrophobicContact CE-CE2 3.63Å; M1014-F1018 WeakPolarHBondContact O-CB 3.32Å; M1014-F1018 WeakPolarHBondContact O-CD2 3.38Å; M1014-F1018 PolarHBondContact O-N 3.34Å; M1014-F1018 VanDerWaalsContact O-N 3.1Å; M1014-F1018 HydrophobicContact SD-CE2 4.24Å; F1018-P1020 VanDerWaalsContact O-CD 3.28Å; F1018-P1020 WeakPolarHBondContact O-CD 3.36Å
1019	D	91.9	Very high	88.4	Confident	24 Å²	24	58.1 Å²	58.1	13%	0.128	31%	0.313	C	S	.	.			trans	-58.5	115.2	176.8	-171.8	-20.6	0	0	0	111.7	Y1010 E1015 E1021 V1022 L1023	Y1010-D1019 HydrophobicContact CE1-CB 4.22Å; Y1010-D1019 VanDerWaalsContact CE1-OD2 3.28Å; Y1010-D1019 WeakPolarHBondContact CE1-OD2 3.48Å; Y1010-D1019 PolarHBondContact OH-OD2 2.94Å; E1015-D1019 WeakPolarHBondContact O-CA 3.31Å; E1015-D1019 WeakPolarHBondContact O-CB 3.41Å; E1015-D1019 PolarHBondContact O-N 3.03Å; D1019-E1021 VanDerWaalsContact C-N 3.31Å; D1019-E1021 PolarHBondContact O-N 3.42Å; D1019-E1021 WeakPolarHBondContact OD1-CB 3.31Å; D1019-E1021 PolarHBondContact OD1-N 3.41Å; D1019-V1022 HydrophobicContact CB-CB 4.15Å; D1019-V1022 HydrophobicContact CB-CG2 4.07Å; D1019-V1022 PolarHBondContact O-N 3.4Å; D1019-V1022 WeakPolarHBondContact OD2-CG2 3.42Å; D1019-L1023 WeakPolarHBondContact O-CB 3.46Å; D1019-L1023 VanDerWaalsContact O-CG 3.25Å; D1019-L1023 WeakPolarHBondContact O-CG 3.41Å; D1019-L1023 PolarHBondContact O-N 3.48Å
1020	P	91.2	Very high	88.9	Confident	53 Å²	53	52.8 Å²	52.8	34%	0.344	29%	0.29	S	S	.	.	H	α-helix	trans	-60.2	-37.1	176.8	-23	35.2	0	0	0	113.2	M845 F1018 V1022 L1023 T1024	M845-P1020 HydrophobicContact CE-CG 4Å; F1018-P1020 VanDerWaalsContact O-CD 3.28Å; F1018-P1020 WeakPolarHBondContact O-CD 3.36Å; P1020-V1022 VanDerWaalsContact C-N 3.32Å; P1020-V1022 PolarHBondContact O-N 3.45Å; P1020-L1023 PolarHBondContact O-N 2.81Å; P1020-T1024 PolarHBondContact O-N 3.18Å; P1020-T1024 PolarHBondContact O-OG1 3.33Å; P1020-T1024 VanDerWaalsContact O-OG1 3.07Å
1021	E	90.1	Very high	89.1	Confident	148 Å²	148	54.8 Å²	54.8	69%	0.692	31%	0.305	S	S	*	.	H	α-helix	trans	-66.6	-36.6	-176.9	-61.2	-169.1	-176.9	0	0	111	D1019 E1025 G1026	D1019-E1021 VanDerWaalsContact C-N 3.31Å; D1019-E1021 PolarHBondContact O-N 3.42Å; D1019-E1021 WeakPolarHBondContact OD1-CB 3.31Å; D1019-E1021 PolarHBondContact OD1-N 3.41Å; E1021-E1025 CarbonylContact O-C 3.55Å; E1021-E1025 WeakPolarHBondContact O-CA 3.32Å; E1021-E1025 PolarHBondContact O-N 3.09Å; E1021-G1026 PolarHBondContact O-N 2.94Å; E1021-G1026 VanDerWaalsContact O-N 3.09Å
1022	V	91	Very high	89.2	Confident	50 Å²	50	54.4 Å²	54.4	30%	0.303	30%	0.297	S	S	.	.	H	α-helix	trans	-78.6	-34.6	176.1	-177.9	0	0	0	0	112.3	V998 D1019 P1020	V998-V1022 HydrophobicContact CG2-CG1 3.58Å; D1019-V1022 HydrophobicContact CB-CB 4.15Å; D1019-V1022 HydrophobicContact CB-CG2 4.07Å; D1019-V1022 PolarHBondContact O-N 3.4Å; D1019-V1022 WeakPolarHBondContact OD2-CG2 3.42Å; P1020-V1022 VanDerWaalsContact C-N 3.32Å; P1020-V1022 PolarHBondContact O-N 3.45Å
1023	L	92.2	Very high	89.1	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.01	31%	0.307	C	S	.	.	H	α-helix	trans	-78.3	-38.6	-178.4	-69.2	176.9	0	0	0	113	F842 N994 V998 D1019 P1020	F842-L1023 HydrophobicContact CD2-CD1 4.18Å; F842-L1023 HydrophobicContact CE2-CD1 4.06Å; F842-L1023 HydrophobicContact CE2-CD2 4.08Å; N994-L1023 WeakPolarHBondContact CB-O 3.3Å; N994-L1023 PolarHBondContact ND2-O 3.43Å; V998-L1023 HydrophobicContact CG2-CD2 4.44Å; D1019-L1023 WeakPolarHBondContact O-CB 3.46Å; D1019-L1023 VanDerWaalsContact O-CG 3.25Å; D1019-L1023 WeakPolarHBondContact O-CG 3.41Å; D1019-L1023 PolarHBondContact O-N 3.48Å; P1020-L1023 PolarHBondContact O-N 2.81Å
1024	T	91.3	Very high	89.2	Confident	14 Å²	14	57.4 Å²	57.4	9%	0.086	30%	0.304	C	S	.	.	H	α-helix	trans	-104.2	3.5	179.5	76.9	0	0	0	0	114.1	C846 F987 P1020 G1026 E1027	C846-T1024 HydrophobicContact CB-CG2 3.98Å; F987-T1024 HydrophobicContact CE1-CG2 4.35Å; F987-T1024 HydrophobicContact CE2-CG2 4.39Å; F987-T1024 HydrophobicContact CZ-CG2 3.71Å; P1020-T1024 PolarHBondContact O-N 3.18Å; P1020-T1024 PolarHBondContact O-OG1 3.33Å; P1020-T1024 VanDerWaalsContact O-OG1 3.07Å; T1024-G1026 PolarHBondContact O-N 3.31Å; T1024-E1027 WeakPolarHBondContact CB-O 3.48Å; T1024-E1027 WeakPolarHBondContact O-CB 3.19Å; T1024-E1027 PolarHBondContact O-N 2.99Å; T1024-E1027 VanDerWaalsContact O-N 3.1Å; T1024-E1027 PolarHBondContact OG1-O 2.87Å
1025	E	89.1	Confident	89.3	Confident	93 Å²	93	57 Å²	57	44%	0.435	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.5	27.6	-174.7	-63	154.6	-152.3	0	0	112.9	K990 N994 E1021 E1027	K990-E1025 IonicContact NZ-OE1 3.88Å; K990-E1025 IonicContact NZ-OE2 3.37Å; K990-E1025 PolarHBondContact NZ-OE2 3Å; N994-E1025 PolarHBondContact ND2-OE1 2.81Å; N994-E1025 PolarHBondContact OD1-OE1 3.43Å; E1021-E1025 CarbonylContact O-C 3.55Å; E1021-E1025 WeakPolarHBondContact O-CA 3.32Å; E1021-E1025 PolarHBondContact O-N 3.09Å; E1025-E1027 PolarHBondContact O-N 3.18Å
1026	G	85.5	Confident	89.3	Confident	53 Å²	53	64.5 Å²	64.5	55%	0.546	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	75	-3.4	-173.4	0	0	0	0	0	114.7	E1021 T1024	E1021-G1026 PolarHBondContact O-N 2.94Å; E1021-G1026 VanDerWaalsContact O-N 3.09Å; T1024-G1026 PolarHBondContact O-N 3.31Å
1027	E	88.1	Confident	89.2	Confident	126 Å²	126	64.5 Å²	64.5	59%	0.589	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-75.2	147.9	178.1	-70.5	-75.6	-174.1	0	0	112	F987 T1024 E1025	F987-E1027 HydrophobicContact CE2-CB 3.95Å; T1024-E1027 WeakPolarHBondContact CB-O 3.48Å; T1024-E1027 WeakPolarHBondContact O-CB 3.19Å; T1024-E1027 PolarHBondContact O-N 2.99Å; T1024-E1027 VanDerWaalsContact O-N 3.1Å; T1024-E1027 PolarHBondContact OG1-O 2.87Å; E1025-E1027 PolarHBondContact O-N 3.18Å
1028	V	89.8	Confident	89	Confident	104 Å²	104	66.2 Å²	66.2	63%	0.63	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-97.6	142	-179.5	-179.8	0	0	0	0	110.7
1029	A	90.1	Very high	88.8	Confident	5 Å²	5	67.3 Å²	67.3	4%	0.041	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-51	122.3	-179.1	0	0	0	0	0	112.9	D847 M984 F987 N1031	D847-A1029 HydrophobicContact CB-CB 4.1Å; D847-A1029 WeakPolarHBondContact O-CB 3.41Å; M984-A1029 HydrophobicContact CE-CB 4.31Å; F987-A1029 HydrophobicContact CD1-CB 4.35Å; F987-A1029 HydrophobicContact CE1-CB 3.75Å; F987-A1029 HydrophobicContact CZ-CB 4.2Å; A1029-N1031 PolarHBondContact O-N 3.02Å; A1029-N1031 VanDerWaalsContact O-N 3.14Å
1030	P	91	Very high	88.5	Confident	32 Å²	32	70 Å²	70	21%	0.208	37%	0.367	C	S	.	.			trans	-58	114.9	-171.5	-30.2	36	0	0	0	114.6	R983 M984 F987	R983-P1030 HydrophobicContact CB-CB 3.99Å; R983-P1030 HydrophobicContact CB-CG 4.15Å; M984-P1030 HydrophobicContact CE-CB 4.44Å; M984-P1030 VanDerWaalsContact CE-O 3.24Å; M984-P1030 WeakPolarHBondContact CE-O 3.43Å; F987-P1030 HydrophobicContact CB-CG 4.06Å; F987-P1030 HydrophobicContact CD2-CG 4.48Å; F987-P1030 HydrophobicContact CG-CG 4.28Å
1031	N	88.6	Confident	88.3	Confident	96 Å²	96	70.2 Å²	70.2	51%	0.513	37%	0.365	S	S	.	.			trans	-105	14.2	-171.9	67.5	21.1	0	0	0	114.7	A1029 R1033 C1034	A1029-N1031 PolarHBondContact O-N 3.02Å; A1029-N1031 VanDerWaalsContact O-N 3.14Å; N1031-R1033 PolarHBondContact O-N 2.98Å; N1031-C1034 HydrophobicContact CB-CB 4.36Å; N1031-C1034 WeakPolarHBondContact O-CB 3.45Å; N1031-C1034 PolarHBondContact O-N 2.96Å
1032	D	83.9	Confident	87.9	Confident	95 Å²	95	66.2 Å²	66.2	51%	0.508	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-36.9	-173.2	-61.8	-61.6	0	0	0	114.7	R983 C1034	R983-D1032 WeakPolarHBondContact CD-OD2 3.26Å; R983-D1032 IonicContact CZ-OD2 2.74Å; R983-D1032 IonicContact NE-OD2 3.2Å; R983-D1032 IonicContact NH1-OD1 2.86Å; R983-D1032 PolarHBondContact NH1-OD1 3.36Å; R983-D1032 IonicContact NH1-OD2 2.73Å; R983-D1032 PolarHBondContact NH1-OD2 2.77Å; D1032-C1034 VanDerWaalsContact C-N 3.31Å; D1032-C1034 PolarHBondContact O-N 3.23Å
1033	R	85.3	Confident	87.4	Confident	121 Å²	121	66 Å²	66	46%	0.457	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	2	-177.7	-51.6	-173.8	83.2	-154.5	4.3	113.8	D569 G979 N1031 I1041	D569-R1033 IonicContact OD2-CZ 2.7Å; D569-R1033 IonicContact OD2-NE 3.46Å; D569-R1033 IonicContact OD2-NH2 2.76Å; D569-R1033 PolarHBondContact OD2-NH2 3.02Å; G979-R1033 PolarHBondContact O-NH1 3.05Å; G979-R1033 VanDerWaalsContact O-NH1 3.08Å; N1031-R1033 PolarHBondContact O-N 2.98Å; R1033-I1041 HydrophobicContact CB-CG2 4.45Å
1034	C	88.2	Confident	87.1	Confident	16 Å²	16	69.8 Å²	69.8	11%	0.108	38%	0.375	C	S	.	.	S	Bend	trans	-97.9	148.1	-171.5	-61.6	0	0	0	0	112.7	R853 N1031 D1032 R1036 G1039	R853-C1034 PolarHBondContact O-SG 2.98Å; R853-C1034 VanDerWaalsContact O-SG 3.39Å; N1031-C1034 HydrophobicContact CB-CB 4.36Å; N1031-C1034 WeakPolarHBondContact O-CB 3.45Å; N1031-C1034 PolarHBondContact O-N 2.96Å; D1032-C1034 VanDerWaalsContact C-N 3.31Å; D1032-C1034 PolarHBondContact O-N 3.23Å; C1034-R1036 PolarHBondContact O-N 3.2Å; C1034-R1036 VanDerWaalsContact O-N 3.17Å; C1034-G1039 WeakPolarHBondContact CB-O 3.17Å; C1034-G1039 PolarHBondContact SG-O 2.82Å
1035	C	88.6	Confident	86.7	Confident	13 Å²	13	74 Å²	74	9%	0.088	40%	0.396	C	S	.	.			trans	-63.9	116.2	172.9	175.4	0	0	0	0	110.7	V1037 C1038 G1039 K1040 H1043 C1048	C1035-V1037 PolarHBondContact O-N 2.83Å; C1035-C1038 PolarHBondContact O-N 2.99Å; C1035-G1039 PolarHBondContact O-N 3.04Å; C1035-K1040 VanDerWaalsContact CB-O 3.27Å; C1035-K1040 WeakPolarHBondContact CB-O 3.42Å; C1035-K1040 PolarHBondContact N-O 2.7Å; C1035-H1043 VanDerWaalsContact CB-CE1 3.45Å; C1035-H1043 WeakPolarHBondContact CB-CE1 3.42Å; C1035-H1043 WeakPolarHBondContact CB-NE2 3.4Å; C1035-H1043 PolarHBondContact SG-NE2 2.75Å; C1035-H1043 VanDerWaalsContact SG-NE2 3.35Å; C1035-C1048 VanDerWaalsContact SG-SG 3.65Å
1036	R	87.3	Confident	86.4	Confident	254 Å²	254	75.2 Å²	75.2	96%	0.958	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-5.5	-175	-59.3	-176.5	-175	174.1	2.9	116.1	C1034	C1034-R1036 PolarHBondContact O-N 3.2Å; C1034-R1036 VanDerWaalsContact O-N 3.17Å
1037	V	88.4	Confident	86.1	Confident	48 Å²	48	76.9 Å²	76.9	29%	0.291	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	-20	179.3	173.3	0	0	0	0	113.6	C1035 L1045 M1050	C1035-V1037 PolarHBondContact O-N 2.83Å; V1037-L1045 HydrophobicContact CB-CD1 4.19Å; V1037-L1045 HydrophobicContact CG2-CD1 3.44Å; V1037-L1045 VanDerWaalsContact CG2-CD1 3.44Å; V1037-M1050 HydrophobicContact CG1-CB 4Å
1038	C	85.6	Confident	85.8	Confident	38 Å²	38	71.2 Å²	71.2	26%	0.257	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.7	-2.9	-177.7	67.9	0	0	0	0	115	C1035 K1040 H1043 M1050	C1035-C1038 PolarHBondContact O-N 2.99Å; C1038-K1040 PolarHBondContact O-N 2.86Å; C1038-H1043 PolarHBondContact SG-CE1 3.29Å; C1038-H1043 PolarHBondContact SG-NE2 2.75Å; C1038-H1043 VanDerWaalsContact SG-NE2 3.39Å; C1038-M1050 HydrophobicContact CB-CB 4.08Å; C1038-M1050 HydrophobicContact CB-CG 3.73Å
1039	G	86.9	Confident	85.2	Confident	28 Å²	28	69.8 Å²	69.8	29%	0.289	36%	0.364	S	S	.	.	S	Bend	trans	71.9	5.2	179	0	0	0	0	0	115.3	R853 C1034 C1035	R853-G1039 WeakPolarHBondContact CG-O 3.46Å; C1034-G1039 WeakPolarHBondContact CB-O 3.17Å; C1034-G1039 PolarHBondContact SG-O 2.82Å; C1035-G1039 PolarHBondContact O-N 3.04Å
1040	K	86.7	Confident	84.6	Confident	80 Å²	80	71 Å²	71	35%	0.348	37%	0.369	S	S	.	.			trans	-106.4	150.4	-177.3	-57.9	-66.8	-174.9	164.6	0	112.9	D850 S852 R853 C1035 C1038 H1043	D850-K1040 IonicContact OD1-NZ 3.06Å; D850-K1040 IonicContact OD2-NZ 2.98Å; D850-K1040 PolarHBondContact OD2-NZ 3.26Å; S852-K1040 CarbonylContact O-C 3.59Å; S852-K1040 VanDerWaalsContact O-CA 3.3Å; S852-K1040 WeakPolarHBondContact O-CA 3.28Å; S852-K1040 VanDerWaalsContact OG-CD 3.32Å; S852-K1040 WeakPolarHBondContact OG-CD 3.46Å; S852-K1040 PolarHBondContact OG-NZ 2.81Å; R853-K1040 HydrophobicContact CG-CD 3.99Å; C1035-K1040 VanDerWaalsContact CB-O 3.27Å; C1035-K1040 WeakPolarHBondContact CB-O 3.42Å; C1035-K1040 PolarHBondContact N-O 2.7Å; C1038-K1040 PolarHBondContact O-N 2.86Å; K1040-H1043 PolarHBondContact O-CE1 2.9Å
1041	I	87	Confident	84	Confident	59 Å²	59	75.9 Å²	75.9	30%	0.303	38%	0.383	S	S	.	.	S	Bend	trans	-82.2	-178.6	178.5	71	179.2	0	0	0	112.7	A851 S852 R1033 H1043	A851-I1041 WeakPolarHBondContact O-CD1 3.44Å; S852-I1041 PolarHBondContact O-N 2.56Å; R1033-I1041 HydrophobicContact CB-CG2 4.45Å; I1041-H1043 PolarHBondContact O-N 3.09Å; I1041-H1043 PolarHBondContact O-ND1 3.14Å
1042	G	81.8	Confident	82.7	Confident	64 Å²	64	78.2 Å²	78.2	66%	0.66	40%	0.396	S	S	*	.	S	Bend	trans	77.4	15	161	0	0	0	0	0	117.5
1043	H	80.9	Confident	81.6	Confident	44 Å²	44	76.2 Å²	76.2	20%	0.204	38%	0.383	C	S	.	.	S	Bend	trans	-157.9	160.2	176.8	67.5	-74.3	0	0	0	111.2	C1035 C1038 K1040 I1041	C1035-H1043 VanDerWaalsContact CB-CE1 3.45Å; C1035-H1043 WeakPolarHBondContact CB-CE1 3.42Å; C1035-H1043 WeakPolarHBondContact CB-NE2 3.4Å; C1035-H1043 PolarHBondContact SG-NE2 2.75Å; C1035-H1043 VanDerWaalsContact SG-NE2 3.35Å; C1038-H1043 PolarHBondContact SG-CE1 3.29Å; C1038-H1043 PolarHBondContact SG-NE2 2.75Å; C1038-H1043 VanDerWaalsContact SG-NE2 3.39Å; K1040-H1043 PolarHBondContact O-CE1 2.9Å; I1041-H1043 PolarHBondContact O-N 3.09Å; I1041-H1043 PolarHBondContact O-ND1 3.14Å
1044	F	84	Confident	79.8	Confident	83 Å²	83	74.8 Å²	74.8	36%	0.364	39%	0.389	S	S	.	.			trans	-92.4	160.2	179.6	-51.8	-62.6	0	0	0	112.1	T566 K1046 D1047 C1048	T566-F1044 HydrophobicContact CG2-CD1 3.92Å; T566-F1044 HydrophobicContact CG2-CD2 4.14Å; T566-F1044 HydrophobicContact CG2-CE1 3.44Å; T566-F1044 VanDerWaalsContact CG2-CE1 3.44Å; T566-F1044 HydrophobicContact CG2-CE2 3.65Å; T566-F1044 HydrophobicContact CG2-CG 4.27Å; T566-F1044 HydrophobicContact CG2-CZ 3.3Å; T566-F1044 WeakPolarHBondContact OG1-CE1 3.31Å; T566-F1044 WeakPolarHBondContact OG1-CZ 3.45Å; F1044-K1046 HydrophobicContact CB-CG 3.83Å; F1044-K1046 PolarHBondContact O-N 2.81Å; F1044-K1046 VanDerWaalsContact O-N 3.11Å; F1044-D1047 WeakPolarHBondContact CD2-OD2 3.4Å; F1044-D1047 PolarHBondContact O-N 2.91Å; F1044-C1048 PolarHBondContact O-N 2.94Å
1045	L	83.4	Confident	77.8	Confident	101 Å²	101	82.1 Å²	82.1	53%	0.529	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-52.8	-36.1	178.2	-177.5	63.1	0	0	0	112.7	V1037 D1047 C1048	V1037-L1045 HydrophobicContact CB-CD1 4.19Å; V1037-L1045 HydrophobicContact CG2-CD1 3.44Å; V1037-L1045 VanDerWaalsContact CG2-CD1 3.44Å; L1045-D1047 VanDerWaalsContact C-N 3.29Å; L1045-D1047 PolarHBondContact O-N 3.38Å; L1045-C1048 WeakPolarHBondContact O-CB 3.49Å; L1045-C1048 PolarHBondContact O-N 2.68Å
1046	K	82.4	Confident	75.5	Confident	120 Å²	120	89.6 Å²	89.6	52%	0.522	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-60.7	-34.6	176.1	54.5	163.5	-165.2	-171.9	0	113.3	F1044 R1051	F1044-K1046 HydrophobicContact CB-CG 3.83Å; F1044-K1046 PolarHBondContact O-N 2.81Å; F1044-K1046 VanDerWaalsContact O-N 3.11Å; K1046-R1051 PolarHBondContact O-NH1 2.73Å
1047	D	80.1	Confident	73.5	Confident	88 Å²	88	85.5 Å²	85.5	47%	0.471	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-99.7	0.8	-172.9	-46.4	-53.1	0	0	0	112.4	F1044 L1045 P1049	F1044-D1047 WeakPolarHBondContact CD2-OD2 3.4Å; F1044-D1047 PolarHBondContact O-N 2.91Å; L1045-D1047 VanDerWaalsContact C-N 3.29Å; L1045-D1047 PolarHBondContact O-N 3.38Å; D1047-P1049 WeakPolarHBondContact O-CD 3.45Å
1048	C	82.9	Confident	71.3	Confident	7 Å²	7	86.7 Å²	86.7	5%	0.047	44%	0.436	C	S	.	.			trans	-65.7	121.1	-174.2	-177.6	0	0	0	0	112.2	C1035 F1044 L1045 M1050 R1051	C1035-C1048 VanDerWaalsContact SG-SG 3.65Å; F1044-C1048 PolarHBondContact O-N 2.94Å; L1045-C1048 WeakPolarHBondContact O-CB 3.49Å; L1045-C1048 PolarHBondContact O-N 2.68Å; C1048-M1050 PolarHBondContact O-N 3.44Å; C1048-R1051 HydrophobicContact CB-CB 4.34Å; C1048-R1051 VanDerWaalsContact O-CB 3.23Å; C1048-R1051 WeakPolarHBondContact O-CB 3.2Å; C1048-R1051 PolarHBondContact O-N 3.4Å
1049	P	76.6	Confident	69.1	Low	73 Å²	73	91.4 Å²	91.4	47%	0.474	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-23.7	-179	-26.1	34.9	0	0	0	114.7	L785 D1047	L785-P1049 HydrophobicContact CD1-CB 4.3Å; L785-P1049 HydrophobicContact CD1-CG 3.99Å; L785-P1049 HydrophobicContact CD2-CB 4.32Å; L785-P1049 HydrophobicContact CD2-CG 3.93Å; D1047-P1049 WeakPolarHBondContact O-CD 3.45Å
1050	M	76.6	Confident	66.6	Low	32 Å²	32	94.2 Å²	94.2	16%	0.158	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-11.4	-179	-65	-65.2	-82.9	0	0	113.5	V1037 C1038 C1048 N1052 K1053 R1058 E1061	V1037-M1050 HydrophobicContact CG1-CB 4Å; C1038-M1050 HydrophobicContact CB-CB 4.08Å; C1038-M1050 HydrophobicContact CB-CG 3.73Å; C1048-M1050 PolarHBondContact O-N 3.44Å; M1050-N1052 VanDerWaalsContact C-N 3.26Å; M1050-N1052 PolarHBondContact O-N 2.85Å; M1050-N1052 VanDerWaalsContact O-N 3.15Å; M1050-K1053 HydrophobicContact CE-CD 3.95Å; M1050-K1053 PolarHBondContact O-N 3.38Å; M1050-K1053 HydrophobicContact SD-CD 3.61Å; M1050-K1053 WeakPolarHBondContact SD-CE 3.41Å; M1050-K1053 HydrophobicContact SD-CG 4.36Å; M1050-K1053 PolarHBondContact SD-NZ 2.96Å; M1050-K1053 VanDerWaalsContact SD-NZ 3.4Å; M1050-R1058 PolarHBondContact O-NH2 3.37Å; M1050-E1061 VanDerWaalsContact CE-OE2 3.25Å; M1050-E1061 WeakPolarHBondContact CE-OE2 3.42Å
1051	R	77.9	Confident	64.6	Low	134 Å²	134	94.8 Å²	94.8	51%	0.506	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-42	-174.2	-173.6	-176.5	176.8	-167.1	-4.2	113	K1046 C1048 R1058	K1046-R1051 PolarHBondContact O-NH1 2.73Å; C1048-R1051 HydrophobicContact CB-CB 4.34Å; C1048-R1051 VanDerWaalsContact O-CB 3.23Å; C1048-R1051 WeakPolarHBondContact O-CB 3.2Å; C1048-R1051 PolarHBondContact O-N 3.4Å; R1051-R1058 PolarHBondContact O-NH2 2.8Å
1052	N	63.3	Low	62	Low	145 Å²	145	98.1 Å²	98.1	78%	0.775	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	3.7	-172.8	-63	11.8	0	0	0	114	M1050	M1050-N1052 VanDerWaalsContact C-N 3.26Å; M1050-N1052 PolarHBondContact O-N 2.85Å; M1050-N1052 VanDerWaalsContact O-N 3.15Å
1053	K	60.3	Low	59.4	Low	53 Å²	53	105.4 Å²	105.4	23%	0.23	50%	0.5	C	S	.	.	S	Bend	trans	-72.7	133.6	169.7	-71.5	-165.3	-171	176.8	0	109.4	M1050 R1058 E1061	M1050-K1053 HydrophobicContact CE-CD 3.95Å; M1050-K1053 PolarHBondContact O-N 3.38Å; M1050-K1053 HydrophobicContact SD-CD 3.61Å; M1050-K1053 WeakPolarHBondContact SD-CE 3.41Å; M1050-K1053 HydrophobicContact SD-CG 4.36Å; M1050-K1053 PolarHBondContact SD-NZ 2.96Å; M1050-K1053 VanDerWaalsContact SD-NZ 3.4Å; K1053-R1058 VanDerWaalsContact O-CZ 3.25Å; K1053-R1058 PolarHBondContact O-NE 3.28Å; K1053-R1058 PolarHBondContact O-NH2 3.14Å; K1053-E1061 IonicContact NZ-OE1 2.69Å; K1053-E1061 PolarHBondContact NZ-OE1 2.86Å; K1053-E1061 IonicContact NZ-OE2 2.89Å; K1053-E1061 PolarHBondContact NZ-OE2 2.96Å
1054	P	47.7	Very low	57	Low	91 Å²	91	108.1 Å²	108.1	59%	0.591	52%	0.521	S	S	*	.			trans	-64.3	146.2	176.4	26.2	-34.1	0	0	0	111.8	H1056 R1057	P1054-H1056 VanDerWaalsContact C-N 3.27Å; P1054-H1056 PolarHBondContact O-N 3.46Å; P1054-H1056 VanDerWaalsContact O-N 3.12Å; P1054-R1057 PolarHBondContact O-N 2.95Å
1055	K	45.1	Very low	54.4	Low	170 Å²	170	113 Å²	113	74%	0.739	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-45.7	-47.2	-174.4	-83.6	-177.2	175.5	175.1	0	113.2	R1057 R1058	K1055-R1057 PolarHBondContact O-N 2.89Å; K1055-R1058 WeakPolarHBondContact O-CB 3.17Å; K1055-R1058 PolarHBondContact O-N 3.33Å
1056	H	41.7	Very low	51.7	Low	169 Å²	169	115.9 Å²	115.9	78%	0.782	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-62.1	-10	-175.8	-145.6	-40.1	0	0	0	115.3	P1054	P1054-H1056 VanDerWaalsContact C-N 3.27Å; P1054-H1056 PolarHBondContact O-N 3.46Å; P1054-H1056 VanDerWaalsContact O-N 3.12Å
1057	R	45	Very low	49.2	Very low	168 Å²	168	119.6 Å²	119.6	63%	0.634	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-105.2	-5	172.7	-108.6	-175.3	179.3	169.6	1	114.4	P1054 K1055 S1060	P1054-R1057 PolarHBondContact O-N 2.95Å; K1055-R1057 PolarHBondContact O-N 2.89Å; R1057-S1060 PolarHBondContact O-OG 3.36Å; R1057-S1060 VanDerWaalsContact O-OG 3.07Å
1058	R	41.9	Very low	46.7	Very low	74 Å²	74	123.8 Å²	123.8	28%	0.279	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.3	-40	178.1	-56.6	-175.8	-171.8	-166.1	-0.4	110.9	M1050 R1051 K1053 K1055 S1060 E1061 N1062	M1050-R1058 PolarHBondContact O-NH2 3.37Å; R1051-R1058 PolarHBondContact O-NH2 2.8Å; K1053-R1058 VanDerWaalsContact O-CZ 3.25Å; K1053-R1058 PolarHBondContact O-NE 3.28Å; K1053-R1058 PolarHBondContact O-NH2 3.14Å; K1055-R1058 WeakPolarHBondContact O-CB 3.17Å; K1055-R1058 PolarHBondContact O-N 3.33Å; R1058-S1060 VanDerWaalsContact C-N 3.33Å; R1058-S1060 PolarHBondContact O-N 2.77Å; R1058-E1061 PolarHBondContact O-N 3.23Å; R1058-N1062 WeakPolarHBondContact O-CB 3.46Å; R1058-N1062 PolarHBondContact O-N 3.13Å
1059	E	38.1	Very low	44.5	Very low	136 Å²	136	129.8 Å²	129.8	64%	0.636	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-67.5	-31.4	179.3	-70	158.8	-162	0	0	112.7	E1061 N1062	E1059-E1061 VanDerWaalsContact C-N 3.3Å; E1059-E1061 PolarHBondContact O-N 2.79Å; E1059-N1062 PolarHBondContact O-N 3.26Å
1060	S	36.4	Very low	42.1	Very low	87 Å²	87	131.7 Å²	131.7	61%	0.608	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-72.7	-16.8	177.1	54.6	0	0	0	0	114.8	R1057 R1058	R1057-S1060 PolarHBondContact O-OG 3.36Å; R1057-S1060 VanDerWaalsContact O-OG 3.07Å; R1058-S1060 VanDerWaalsContact C-N 3.33Å; R1058-S1060 PolarHBondContact O-N 2.77Å
1061	E	43.2	Very low	40	Very low	92 Å²	92	135.9 Å²	135.9	43%	0.43	66%	0.662	S	S	.	*	G	3₁₀ helix	trans	-101.9	-4.9	177	-67.1	174.9	170.8	0	0	112.1	M1050 K1053 R1058 E1059	M1050-E1061 VanDerWaalsContact CE-OE2 3.25Å; M1050-E1061 WeakPolarHBondContact CE-OE2 3.42Å; K1053-E1061 IonicContact NZ-OE1 2.69Å; K1053-E1061 PolarHBondContact NZ-OE1 2.86Å; K1053-E1061 IonicContact NZ-OE2 2.89Å; K1053-E1061 PolarHBondContact NZ-OE2 2.96Å; R1058-E1061 PolarHBondContact O-N 3.23Å; E1059-E1061 VanDerWaalsContact C-N 3.3Å; E1059-E1061 PolarHBondContact O-N 2.79Å
1062	N	33.7	Very low	37.8	Very low	129 Å²	129	138.5 Å²	138.5	69%	0.69	68%	0.681	S	S	*	*	S	Bend	trans	-114.2	1.9	-171.1	-95.5	20.7	0	0	0	115	R1058 E1059	R1058-N1062 WeakPolarHBondContact O-CB 3.46Å; R1058-N1062 PolarHBondContact O-N 3.13Å; E1059-N1062 PolarHBondContact O-N 3.26Å
1063	R	26.5	Very low	36.3	Very low	218 Å²	218	144.9 Å²	144.9	82%	0.823	71%	0.706	S	S	*	*			trans	-78.2	126.8	170.7	-89.1	-171.2	169.3	-163.3	-4.6	109.9	E1065	R1063-E1065 PolarHBondContact O-N 2.79Å
1064	P	29.5	Very low	35.1	Very low	100 Å²	100	149.5 Å²	149.5	65%	0.649	73%	0.729	S	S	*	*			trans	-65.6	125.5	158.6	28.9	-31.4	0	0	0	108.2	H1066	P1064-H1066 VanDerWaalsContact C-N 3.34Å; P1064-H1066 PolarHBondContact O-N 2.83Å
1065	E	29.6	Very low	34.4	Very low	187 Å²	187	152.6 Å²	152.6	87%	0.874	74%	0.737	S	S	*	*			trans	-72.9	91.6	170.1	-68.1	-173.1	150.8	0	0	108.7	R1063 F1067	R1063-E1065 PolarHBondContact O-N 2.79Å; E1065-F1067 PolarHBondContact O-N 3.45Å
1066	H	27.5	Very low	33.8	Very low	161 Å²	161	151.6 Å²	151.6	75%	0.745	74%	0.737	S	S	*	*			trans	-58.4	134.3	160.9	-82.5	-96.9	0	0	0	108.6	P1064 H1068	P1064-H1066 VanDerWaalsContact C-N 3.34Å; P1064-H1066 PolarHBondContact O-N 2.83Å; H1066-H1068 PolarHBondContact O-N 3.25Å
1067	F	30.8	Very low	33.4	Very low	198 Å²	198	150.6 Å²	150.6	87%	0.868	73%	0.734	S	S	*	*			trans	-59.3	110.9	174.8	-78.6	-98.7	0	0	0	109.6	E1065	E1065-F1067 PolarHBondContact O-N 3.45Å
1068	H	27.6	Very low	32.7	Very low	175 Å²	175	149.5 Å²	149.5	81%	0.81	74%	0.74	S	S	*	*			trans	-112.7	126.3	161.2	-112	-59.5	0	0	0	109.1	H1066	H1066-H1068 PolarHBondContact O-N 3.25Å
1069	D	34.9	Very low	32	Very low	133 Å²	133	154.5 Å²	154.5	71%	0.711	77%	0.771	S	S	*	*			trans	-59.2	146.6	177.2	-155.5	-29.8	0	0	0	110.9	T1071	D1069-T1071 PolarHBondContact OD1-N 3.12Å; D1069-T1071 PolarHBondContact OD1-OG1 3.39Å; D1069-T1071 VanDerWaalsContact OD1-OG1 3.05Å
1070	S	26.6	Very low	31.6	Very low	114 Å²	114	155.9 Å²	155.9	80%	0.797	78%	0.781	S	S	*	*			trans	-147.5	45.7	179.8	37.8	0	0	0	0	111.7	E1072	S1070-E1072 PolarHBondContact O-N 3.32Å
1071	T	32.7	Very low	31.2	Very low	119 Å²	119	161.2 Å²	161.2	73%	0.73	79%	0.794	S	S	*	*			trans	-79.3	78.7	159.8	40.6	0	0	0	0	111.7	D1069	D1069-T1071 PolarHBondContact OD1-N 3.12Å; D1069-T1071 PolarHBondContact OD1-OG1 3.39Å; D1069-T1071 VanDerWaalsContact OD1-OG1 3.05Å
1072	E	32.1	Very low	30.2	Very low	190 Å²	190	166.9 Å²	166.9	89%	0.888	82%	0.824	S	S	*	*			trans	-168.3	88.7	157.7	-114.7	171.9	-158.8	0	0	113.4	S1070	S1070-E1072 PolarHBondContact O-N 3.32Å
1073	E	31.3	Very low	29.9	Very low	279 Å²	279	170.4 Å²	170.4	100%	1.304	84%	0.836	S	S	*	*				171.2	0	128.5	-89.7	-158.4	149.9	0	0	111.9

Retrieved 1,073 of 1,073 residues in 362 ms (Link to these results)

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