A0A087YKW5_POEFO Loading...

Actinin, alpha 2b

AlphaFold DB , UniProt , Accession A0A087YKW5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 894 aa.

						>A0A087YKW5_POEFO|A0A087YKW5
MMTQIETTVHYDNGYEDEYMLQEEEWDRDMLLDPAWEQQQRKTFTAWCNSHLRKAGTQIENIEEDFRNGLKLMLLLEVISGERLPKPDRGKMRFHKIANVNKALDFITSKGVKLVSIGAEEIVDGNVKMTLGMIWTIILRFAIQDISVEETSAKEGLLLWCQRKTAPYRNVNVQNFHVSWKDGLAFCALIHRHRPDLLDFSKLNKDDPLGNLNLAFDIAEKHLDIPKMLDAEDIINTPKPDERAIMTYVSCFYHAFAGAEQAETAANRICKVLGVNQENEKLMEEYERLASELLEWIRRTTPWLENRTPEKTMAEMQRKLEDFRDYRRQHKPPKVQEKCQLEINFNTLQTKLRISNRPAFMPSEGKMVSDITSAWQGLEQAEKGFEEWLLTEIRRLERLDHLAEKFRQKATNHENWASGKELILIQKDYETATLTEVRALLRKHEAFESDLAAHQDRVEQIAAIAQELNELDYHDIASVNLRCQSICDLWDKLGTLTQKRREALERAEKLLETIDQLFLEFAKRSAPFNNWMEGAMEDLQDMFIVHTIEEVQSLIAAHEQFKATMPEADAERQAILGIHNEVQKISQSYGIKANIINPYSTITTEELLNKWEKVKKLVPQRDGSLQEEMARQHAHERLRRQFAAQANLIGPWIQARMEEIGRCSLEIGGTLEDQMTQLKQMEHVIIAYKPNIDKLEGDHQLIQESLVFDNKHTNYTMEHIRVGWELLLTTIARTINEIETQILTRDAKGISQQQMNEFRSSFNHFDRKKNGAMETDDFRACLISMGYDLGEVEFARIMMLVDPNATGIVSFQSFIDFMTRETADTDTADQVVASFRILAADKPYILVDELRRELPPEQAEYCIMRMPPYKGPGAPPGALDYTAFSTALYGESDL
					

Structure Viewer

Loading PAE data...

(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	33.3	Very low	31.7	Very low	239 Å²	239	167 Å²	167	100%	1.177	85%	0.847	S	S	*	*				0	129.2	0	-93.6	-176.9	172.8	0	0	107.8
2	M	32.7	Very low	31.5	Very low	175 Å²	175	165.2 Å²	165.2	86%	0.862	84%	0.841	S	S	*	*			trans	68.6	97.6	166.5	-66.7	175.5	173.4	0	0	117.2
3	T	31.7	Very low	31.5	Very low	124 Å²	124	164.8 Å²	164.8	76%	0.761	84%	0.843	S	S	*	*				84.7	113.1	67.2	52.3	0	0	0	0	115.2
4	Q	34.3	Very low	31.8	Very low	183 Å²	183	156.6 Å²	156.6	86%	0.855	82%	0.819	S	S	*	*			trans	44.6	127.6	142.6	-72.4	179.5	-20.4	0	0	120.2
5	I	32.6	Very low	31.9	Very low	150 Å²	150	162.4 Å²	162.4	77%	0.769	83%	0.828	S	S	*	*				-163.8	121.5	104.7	-84.9	146.7	0	0	0	107.6	T7	I5-T7 HydrophobicContact CG2-CG2 4.48Å
6	E	33.3	Very low	32	Very low	193 Å²	193	163.4 Å²	163.4	90%	0.902	83%	0.829	S	S	*	*			trans	-80.5	125.8	163	-77.6	173.9	150	0	0	108.4
7	T	31.9	Very low	32.4	Very low	122 Å²	122	162.6 Å²	162.6	75%	0.748	83%	0.827	S	S	*	*			trans	-117.9	97.7	165.3	13.8	0	0	0	0	108.6	I5	I5-T7 HydrophobicContact CG2-CG2 4.48Å
8	T	29.7	Very low	32.5	Very low	143 Å²	143	163.9 Å²	163.9	88%	0.877	83%	0.829	S	S	*	*			trans	-70	115.9	159.6	28	0	0	0	0	108.8
9	V	31.5	Very low	32.6	Very low	117 Å²	117	167.4 Å²	167.4	71%	0.709	83%	0.833	S	S	*	*			trans	-100.4	107.4	166.8	-178.4	0	0	0	0	107.7
10	H	28	Very low	32.6	Very low	180 Å²	180	167.8 Å²	167.8	83%	0.833	84%	0.835	S	S	*	*			trans	-62.3	122.3	160.8	-109.4	-58.1	0	0	0	108.6
11	Y	29.6	Very low	32.8	Very low	211 Å²	211	167.9 Å²	167.9	83%	0.827	84%	0.837	S	S	*	*			trans	-87.1	101.5	155.5	-95.4	-88	0	0	0	107.4
12	D	29	Very low	33	Very low	145 Å²	145	165.5 Å²	165.5	78%	0.775	82%	0.823	S	S	*	*			trans	-79.4	116.1	167.5	-163	13.2	0	0	0	107.3	G14	D12-G14 PolarHBondContact O-N 2.77Å
13	N	31.3	Very low	33.2	Very low	161 Å²	161	166.1 Å²	166.1	86%	0.861	82%	0.824	S	S	*	*			trans	-77.3	75.3	172.1	-93	-11.6	0	0	0	108.3
14	G	35.5	Very low	33.5	Very low	49 Å²	49	169 Å²	169	51%	0.505	83%	0.828	S	S	.	*			trans	-100.1	82.4	171.4	0	0	0	0	0	111	D12	D12-G14 PolarHBondContact O-N 2.77Å
15	Y	33.3	Very low	33.4	Very low	244 Å²	244	169.2 Å²	169.2	96%	0.957	83%	0.83	S	S	*	*			trans	-151.5	57.2	157.5	-79.6	-71	0	0	0	109.1
16	E	34.9	Very low	33.8	Very low	179 Å²	179	173.7 Å²	173.7	84%	0.836	84%	0.837	S	S	*	*			trans	-96.1	147.7	147.8	-77.7	-176.8	157.3	0	0	107.1
17	D	38.7	Very low	34.1	Very low	150 Å²	150	172.2 Å²	172.2	80%	0.802	84%	0.835	S	S	*	*	S	Bend	trans	84	67.8	174.6	-58.1	-26.5	0	0	0	119
18	E	33.8	Very low	34.3	Very low	185 Å²	185	177.2 Å²	177.2	86%	0.864	84%	0.84	S	S	*	*	S	Bend	trans	-154.4	22	149.4	-124.1	175.1	-160.8	0	0	117.5
19	Y	34.3	Very low	34.7	Very low	231 Å²	231	177.1 Å²	177.1	91%	0.906	84%	0.835	S	S	*	*	S	Bend	trans	-132.2	20	173.8	-78.8	-81.6	0	0	0	114.8
20	M	33.3	Very low	34.9	Very low	175 Å²	175	180.3 Å²	180.3	86%	0.862	84%	0.844	S	S	*	*	S	Bend	trans	-111.7	26.5	178.2	-68.2	-66.7	-86.2	0	0	113.5
21	L	36.9	Very low	35.4	Very low	169 Å²	169	179.8 Å²	179.8	89%	0.885	85%	0.847	S	S	*	*	S	Bend	trans	-138.1	52.2	179.5	-76.3	169.4	0	0	0	112.4
22	Q	37	Very low	36.2	Very low	190 Å²	190	176 Å²	176	89%	0.888	84%	0.84	S	S	*	*	S	Bend	trans	-158.8	39.5	160	-139.5	168.6	31.6	0	0	115.6
23	E	36.3	Very low	37.2	Very low	187 Å²	187	174.1 Å²	174.1	87%	0.874	83%	0.83	S	S	*	*	S	Bend	trans	-130.3	0.1	167	-77	-165.8	157	0	0	114.6
24	E	37.8	Very low	38.8	Very low	184 Å²	184	169.9 Å²	169.9	86%	0.86	81%	0.811	S	S	*	*	S	Bend	trans	-94.1	6.9	-177.6	-73.4	-166.2	156.1	0	0	115.8
25	E	32.6	Very low	40.4	Very low	188 Å²	188	168.9 Å²	168.9	88%	0.879	80%	0.798	S	S	*	*	S	Bend	trans	-107.4	2.5	-177.2	-84.3	-169.1	155.8	0	0	116.5
26	W	40.3	Very low	42.4	Very low	244 Å²	244	162 Å²	162	92%	0.924	77%	0.77	S	S	*	*	S	Bend	trans	-110.3	-6.8	176.5	-70.3	-16.5	0	0	0	115.8	R28	W26-R28 VanDerWaalsContact C-N 3.3Å; W26-R28 PolarHBondContact O-N 2.72Å
27	D	39.6	Very low	44.5	Very low	162 Å²	162	155.2 Å²	155.2	87%	0.866	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	10.9	-177.7	-91.5	-10.2	0	0	0	114.6
28	R	36.6	Very low	46.5	Very low	227 Å²	227	153.6 Å²	153.6	86%	0.857	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.4	6.5	-175.5	-139.3	-174.8	-79.5	-163.9	-1.2	116.6	W26	W26-R28 VanDerWaalsContact C-N 3.3Å; W26-R28 PolarHBondContact O-N 2.72Å
29	D	38.6	Very low	48.8	Very low	142 Å²	142	145.1 Å²	145.1	76%	0.759	69%	0.687	S	S	*	*	S	Bend	trans	-153.5	93.7	172.5	-102.3	-25.4	0	0	0	111.2
30	M	36.1	Very low	51.2	Low	184 Å²	184	134.4 Å²	134.4	91%	0.906	65%	0.645	S	S	*	*			trans	-173.7	124.7	140.1	-91.8	-48.5	133.1	0	0	109.1
31	L	38	Very low	53.7	Low	169 Å²	169	130.1 Å²	130.1	89%	0.885	62%	0.619	S	S	*	*			trans	-48.7	140.5	168.5	-107.4	72.2	0	0	0	111.5	D33	L31-D33 PolarHBondContact O-N 3.44Å
32	L	46	Very low	56	Low	132 Å²	132	126.5 Å²	126.5	69%	0.691	60%	0.596	S	S	*	*			trans	-41	117	176.1	-76.5	82.7	0	0	0	113.6
33	D	51.1	Low	58.4	Low	104 Å²	104	117.5 Å²	117.5	56%	0.556	55%	0.554	S	S	*	*			trans	-89.1	119.6	162.3	-165	-13.2	0	0	0	109.7	L31 A35 W36	L31-D33 PolarHBondContact O-N 3.44Å; D33-A35 PolarHBondContact O-N 2.73Å; D33-A35 PolarHBondContact OD1-N 2.72Å; D33-W36 PolarHBondContact O-NE1 2.74Å
34	P	63.4	Low	61	Low	72 Å²	72	108.6 Å²	108.6	47%	0.468	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-6.2	179	-19.1	31.7	0	0	0	115.5	W36 E37 Q38	P34-W36 PolarHBondContact O-N 2.68Å; P34-E37 PolarHBondContact O-N 3.01Å; P34-Q38 PolarHBondContact O-N 3.03Å
35	A	68.9	Low	63.5	Low	28 Å²	28	101 Å²	101	23%	0.231	48%	0.479	C	S	.	.	H	α-helix	trans	-62.8	-39.6	-170.9	0	0	0	0	0	114.3	D33 E37 Q38 Q39	D33-A35 PolarHBondContact O-N 2.73Å; D33-A35 PolarHBondContact OD1-N 2.72Å; A35-E37 PolarHBondContact O-N 2.86Å; A35-Q38 PolarHBondContact O-N 3.19Å; A35-Q39 PolarHBondContact O-N 3.19Å
36	W	76.8	Confident	66.1	Low	99 Å²	99	93 Å²	93	38%	0.375	45%	0.445	S	S	.	.	H	α-helix	trans	-68.8	-34.1	-179	70.1	-90	0	0	0	112.5	D33 P34 Q38 Q39 Q40	D33-W36 PolarHBondContact O-NE1 2.74Å; P34-W36 PolarHBondContact O-N 2.68Å; W36-Q38 VanDerWaalsContact C-N 3.32Å; W36-Q38 PolarHBondContact O-N 3.42Å; W36-Q39 PolarHBondContact O-N 3.34Å; W36-Q40 PolarHBondContact O-N 3.45Å; W36-Q40 VanDerWaalsContact O-N 3.08Å
37	E	79.4	Confident	68.4	Low	38 Å²	38	81.5 Å²	81.5	18%	0.178	40%	0.402	C	S	.	.	H	α-helix	trans	-65.1	-39.1	176.2	-66.1	-177.4	-165.8	0	0	110.7	P34 A35 R41 K128	P34-E37 PolarHBondContact O-N 3.01Å; A35-E37 PolarHBondContact O-N 2.86Å; E37-R41 WeakPolarHBondContact O-CB 3.49Å; E37-R41 WeakPolarHBondContact O-CG 3.34Å; E37-R41 PolarHBondContact O-N 3.42Å; E37-K128 WeakPolarHBondContact OE1-CE 3.35Å; E37-K128 IonicContact OE1-NZ 3.81Å; E37-K128 PolarHBondContact OE1-NZ 2.86Å
38	Q	79.6	Confident	70.8	Confident	116 Å²	116	73.8 Å²	73.8	54%	0.542	36%	0.36	S	S	.	.	H	α-helix	trans	-66.5	-41.2	177.8	-65.6	179.1	11.6	0	0	112	P34 A35 W36 R41 K42	P34-Q38 PolarHBondContact O-N 3.03Å; A35-Q38 PolarHBondContact O-N 3.19Å; W36-Q38 VanDerWaalsContact C-N 3.32Å; W36-Q38 PolarHBondContact O-N 3.42Å; Q38-R41 PolarHBondContact O-N 2.93Å; Q38-K42 PolarHBondContact O-N 3.04Å
39	Q	81.5	Confident	73.4	Confident	7 Å²	7	64.6 Å²	64.6	3%	0.033	33%	0.328	C	S	.	.	H	α-helix	trans	-66.4	-43.7	178.5	-167	175.1	14.9	0	0	112.1	A35 W36 K42 T43 D241 A244	A35-Q39 PolarHBondContact O-N 3.19Å; W36-Q39 PolarHBondContact O-N 3.34Å; Q39-K42 PolarHBondContact O-N 3.09Å; Q39-T43 PolarHBondContact O-N 2.88Å; Q39-T43 VanDerWaalsContact O-N 3.13Å; Q39-T43 PolarHBondContact O-OG1 3.21Å; Q39-D241 HydrophobicContact CB-CB 4.5Å; Q39-D241 HydrophobicContact CG-CB 4.41Å; Q39-A244 HydrophobicContact CG-CB 4.23Å
40	Q	84.9	Confident	75.6	Confident	5 Å²	5	58.5 Å²	58.5	2%	0.023	30%	0.297	C	S	.	.	H	α-helix	trans	-64	-40.4	175	-74.8	-175.6	12.2	0	0	111.9	W36 K42 T43 F44 L131 D241	W36-Q40 PolarHBondContact O-N 3.45Å; W36-Q40 VanDerWaalsContact O-N 3.08Å; Q40-K42 PolarHBondContact O-N 3.13Å; Q40-T43 PolarHBondContact O-N 3.37Å; Q40-F44 HydrophobicContact CB-CD2 4.35Å; Q40-F44 HydrophobicContact CB-CE2 4.13Å; Q40-F44 HydrophobicContact CB-CZ 4.38Å; Q40-F44 HydrophobicContact CG-CE2 4.35Å; Q40-F44 HydrophobicContact CG-CZ 4.21Å; Q40-F44 VanDerWaalsContact O-CB 3.24Å; Q40-F44 WeakPolarHBondContact O-CB 3.45Å; Q40-F44 VanDerWaalsContact O-CG 3.3Å; Q40-F44 WeakPolarHBondContact O-CG 3.48Å; Q40-F44 PolarHBondContact O-N 3.39Å; Q40-L131 HydrophobicContact CB-CD1 4.37Å; Q40-L131 HydrophobicContact CB-CD2 4.45Å; Q40-D241 WeakPolarHBondContact CG-OD2 3.36Å; Q40-D241 VanDerWaalsContact NE2-CG 3.3Å; Q40-D241 PolarHBondContact NE2-OD1 3.38Å; Q40-D241 PolarHBondContact NE2-OD2 3.38Å
41	R	86.5	Confident	78.1	Confident	85 Å²	85	51.6 Å²	51.6	32%	0.321	26%	0.262	S	S	.	.	H	α-helix	trans	-57.2	-48.9	176.5	-78	173.5	66.8	175.6	11.7	112.2	E37 Q38 T45 I62 E63 L131	E37-R41 WeakPolarHBondContact O-CB 3.49Å; E37-R41 WeakPolarHBondContact O-CG 3.34Å; E37-R41 PolarHBondContact O-N 3.42Å; Q38-R41 PolarHBondContact O-N 2.93Å; R41-T45 WeakPolarHBondContact O-CB 3.39Å; R41-T45 PolarHBondContact O-N 2.84Å; R41-T45 PolarHBondContact O-OG1 3.27Å; R41-I62 HydrophobicContact CG-CG2 4.19Å; R41-E63 WeakPolarHBondContact CD-OE1 3.44Å; R41-E63 IonicContact CZ-OE1 2.72Å; R41-E63 IonicContact NE-OE1 3.3Å; R41-E63 PolarHBondContact NE-OE1 3.37Å; R41-E63 VanDerWaalsContact NE-OE1 3.09Å; R41-E63 IonicContact NH1-OE1 2.99Å; R41-E63 PolarHBondContact NH1-OE1 3.33Å; R41-E63 IonicContact NH2-OE1 3.41Å; R41-E63 PolarHBondContact NH2-OE1 3.46Å; R41-E63 VanDerWaalsContact NH2-OE1 3.13Å; R41-E63 IonicContact NH2-OE2 3.77Å; R41-L131 HydrophobicContact CG-CD1 3.95Å; R41-L131 HydrophobicContact CG-CD2 3.9Å; R41-L131 HydrophobicContact CG-CG 4.42Å
42	K	85.4	Confident	80.4	Confident	94 Å²	94	43.5 Å²	43.5	41%	0.409	22%	0.22	S	C	.	.	H	α-helix	trans	-60.4	-51.4	178.2	-72.5	-178.1	179.1	177.2	0	110.9	Q38 Q39 Q40 T45 A46 D230 D233	Q38-K42 PolarHBondContact O-N 3.04Å; Q39-K42 PolarHBondContact O-N 3.09Å; Q40-K42 PolarHBondContact O-N 3.13Å; K42-T45 PolarHBondContact O-N 2.76Å; K42-A46 WeakPolarHBondContact O-CB 3.25Å; K42-A46 PolarHBondContact O-N 2.91Å; K42-D230 HydrophobicContact CD-CB 4.47Å; K42-D230 IonicContact NZ-OD2 3.09Å; K42-D230 PolarHBondContact NZ-OD2 2.7Å; K42-D233 WeakPolarHBondContact CD-OD2 3.42Å; K42-D233 WeakPolarHBondContact CE-OD2 3.39Å; K42-D233 IonicContact NZ-OD1 3.96Å; K42-D233 PolarHBondContact NZ-OD1 2.9Å; K42-D233 IonicContact NZ-OD2 3.05Å; K42-D233 PolarHBondContact NZ-OD2 3.31Å
43	T	86.4	Confident	82.3	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.006	21%	0.207	C	C	.	.	H	α-helix	trans	-65.7	-48.1	-174.4	-45.3	0	0	0	0	112.5	Q39 Q40 T45 A46 W47 M228 L229 A244 T247	Q39-T43 PolarHBondContact O-N 2.88Å; Q39-T43 VanDerWaalsContact O-N 3.13Å; Q39-T43 PolarHBondContact O-OG1 3.21Å; Q40-T43 PolarHBondContact O-N 3.37Å; T43-T45 VanDerWaalsContact C-N 3.34Å; T43-T45 PolarHBondContact O-N 2.66Å; T43-A46 PolarHBondContact O-N 3.07Å; T43-W47 WeakPolarHBondContact O-CB 3.44Å; T43-W47 PolarHBondContact O-N 2.73Å; T43-M228 VanDerWaalsContact CA-O 3.27Å; T43-M228 WeakPolarHBondContact CA-O 3.3Å; T43-M228 HydrophobicContact CG2-CB 3.84Å; T43-M228 PolarHBondContact OG1-O 3.11Å; T43-L229 HydrophobicContact CG2-CD2 3.9Å; T43-L229 WeakPolarHBondContact OG1-CD2 3.4Å; T43-A244 HydrophobicContact CG2-CB 4.08Å; T43-A244 WeakPolarHBondContact OG1-CB 3.4Å; T43-T247 HydrophobicContact CG2-CG2 4.43Å
44	F	91.5	Very high	83.7	Confident	0 Å²	0	45 Å²	45	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-68.4	-35.1	-179.5	-67.4	-4.2	0	0	0	111.6	Q40 W47 C48 I62 L131 I134 W135 I138 R243	Q40-F44 HydrophobicContact CB-CD2 4.35Å; Q40-F44 HydrophobicContact CB-CE2 4.13Å; Q40-F44 HydrophobicContact CB-CZ 4.38Å; Q40-F44 HydrophobicContact CG-CE2 4.35Å; Q40-F44 HydrophobicContact CG-CZ 4.21Å; Q40-F44 VanDerWaalsContact O-CB 3.24Å; Q40-F44 WeakPolarHBondContact O-CB 3.45Å; Q40-F44 VanDerWaalsContact O-CG 3.3Å; Q40-F44 WeakPolarHBondContact O-CG 3.48Å; Q40-F44 PolarHBondContact O-N 3.39Å; F44-W47 PolarHBondContact O-N 2.83Å; F44-C48 WeakPolarHBondContact O-CB 3.48Å; F44-C48 PolarHBondContact O-N 3.17Å; F44-C48 PolarHBondContact O-SG 3.16Å; F44-I62 HydrophobicContact CB-CD1 3.83Å; F44-L131 HydrophobicContact CD2-CB 4.45Å; F44-L131 HydrophobicContact CD2-CD2 3.82Å; F44-L131 HydrophobicContact CE2-CB 4.44Å; F44-L131 WeakPolarHBondContact CE2-O 3.32Å; F44-I134 HydrophobicContact CB-CG2 3.84Å; F44-I134 HydrophobicContact CD2-CB 4.19Å; F44-I134 HydrophobicContact CD2-CG2 4.01Å; F44-I134 HydrophobicContact CG-CG2 4Å; F44-W135 HydrophobicContact CE1-CE3 4.15Å; F44-W135 HydrophobicContact CE2-CB 3.87Å; F44-W135 HydrophobicContact CZ-CB 3.88Å; F44-W135 HydrophobicContact CZ-CD2 4.41Å; F44-W135 AromaticContact CZ-CE3 3.83Å; F44-W135 HydrophobicContact CZ-CE3 3.83Å; F44-W135 HydrophobicContact CZ-CG 4.48Å; F44-I138 HydrophobicContact CD1-CD1 3.46Å; F44-I138 VanDerWaalsContact CD1-CD1 3.46Å; F44-I138 HydrophobicContact CE1-CD1 3.71Å; F44-I138 HydrophobicContact CG-CD1 3.99Å; F44-I138 HydrophobicContact CZ-CD1 4.42Å; F44-R243 HydrophobicContact CE1-CB 4.5Å; F44-R243 HydrophobicContact CZ-CB 4.1Å
45	T	89.7	Confident	84.5	Confident	23 Å²	23	43.7 Å²	43.7	14%	0.141	21%	0.208	C	C	.	.	H	α-helix	trans	-61.6	-48.5	172.7	-61.5	0	0	0	0	111.2	R41 K42 T43 W47 C48 N49 I59	R41-T45 WeakPolarHBondContact O-CB 3.39Å; R41-T45 PolarHBondContact O-N 2.84Å; R41-T45 PolarHBondContact O-OG1 3.27Å; K42-T45 PolarHBondContact O-N 2.76Å; T43-T45 VanDerWaalsContact C-N 3.34Å; T43-T45 PolarHBondContact O-N 2.66Å; T45-W47 PolarHBondContact O-N 3.15Å; T45-C48 PolarHBondContact O-N 3.47Å; T45-N49 WeakPolarHBondContact O-CB 3.09Å; T45-N49 PolarHBondContact O-N 2.78Å; T45-N49 PolarHBondContact O-ND2 3.34Å; T45-I59 HydrophobicContact CG2-CD1 4.38Å; T45-I59 HydrophobicContact CG2-CG1 3.88Å
46	A	87.3	Confident	85.1	Confident	22 Å²	22	45.8 Å²	45.8	18%	0.182	23%	0.233	C	C	.	.	H	α-helix	trans	-63.5	-40.8	178.1	0	0	0	0	0	112.1	K42 T43 N49 S50 M228	K42-A46 WeakPolarHBondContact O-CB 3.25Å; K42-A46 PolarHBondContact O-N 2.91Å; T43-A46 PolarHBondContact O-N 3.07Å; A46-N49 PolarHBondContact O-N 3.22Å; A46-S50 PolarHBondContact O-N 3.02Å; A46-M228 HydrophobicContact CB-CB 3.89Å; A46-M228 HydrophobicContact CB-CG 3.79Å
47	W	90.1	Very high	85.6	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.008	23%	0.229	C	C	.	.	H	α-helix	trans	-61.5	-50	174.8	-176.9	84.4	0	0	0	111.8	T43 F44 T45 N49 S50 H51 L75 I79 I137 I138 A142 M228 T247	T43-W47 WeakPolarHBondContact O-CB 3.44Å; T43-W47 PolarHBondContact O-N 2.73Å; F44-W47 PolarHBondContact O-N 2.83Å; T45-W47 PolarHBondContact O-N 3.15Å; W47-N49 VanDerWaalsContact C-N 3.28Å; W47-N49 PolarHBondContact O-N 3.33Å; W47-S50 WeakPolarHBondContact O-CB 3.43Å; W47-S50 PolarHBondContact O-N 3.11Å; W47-S50 VanDerWaalsContact O-N 3.11Å; W47-S50 PolarHBondContact O-OG 3.19Å; W47-H51 AromaticContact CD2-CD2 3.99Å; W47-H51 AromaticContact CE2-CD2 3.62Å; W47-H51 AromaticContact CE2-NE2 3.41Å; W47-H51 AromaticContact CZ2-CD2 3.73Å; W47-H51 AromaticContact CZ2-NE2 3.47Å; W47-H51 WeakPolarHBondContact CZ2-NE2 3.5Å; W47-H51 AromaticContact NE1-CD2 3.96Å; W47-H51 AromaticContact NE1-NE2 3.46Å; W47-H51 PolarHBondContact NE1-NE2 2.94Å; W47-H51 PolarHBondContact O-CD2 3.04Å; W47-H51 PolarHBondContact O-N 3.4Å; W47-L75 HydrophobicContact CZ3-CD1 4.49Å; W47-L75 HydrophobicContact CZ3-CD2 4.26Å; W47-I79 HydrophobicContact CH2-CD1 4.37Å; W47-I79 HydrophobicContact CH2-CG2 4.22Å; W47-I137 HydrophobicContact CH2-CG2 4.11Å; W47-I137 HydrophobicContact CZ3-CG2 4.35Å; W47-I138 HydrophobicContact CD2-CD1 3.9Å; W47-I138 HydrophobicContact CD2-CG1 3.57Å; W47-I138 HydrophobicContact CE3-CD1 3.78Å; W47-I138 HydrophobicContact CE3-CG1 3.44Å; W47-I138 VanDerWaalsContact CE3-CG1 3.44Å; W47-I138 HydrophobicContact CG-CD1 4.23Å; W47-I138 HydrophobicContact CG-CG1 4.31Å; W47-I138 HydrophobicContact CH2-CG1 3.72Å; W47-I138 HydrophobicContact CZ2-CG1 3.84Å; W47-I138 HydrophobicContact CZ3-CD1 4.29Å; W47-I138 HydrophobicContact CZ3-CG1 3.51Å; W47-A142 HydrophobicContact CZ2-CB 4.31Å; W47-M228 HydrophobicContact CB-CE 4.23Å; W47-M228 HydrophobicContact CB-SD 3.74Å; W47-M228 HydrophobicContact CG-CE 4.46Å; W47-M228 HydrophobicContact CG-SD 4.31Å; W47-T247 HydrophobicContact CB-CG2 3.96Å; W47-T247 HydrophobicContact CG-CG2 3.75Å
48	C	89.9	Confident	86.1	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-57.3	-43	175.5	-69.5	0	0	0	0	111.6	F44 T45 S50 H51 L52 I59 F66 L75	F44-C48 WeakPolarHBondContact O-CB 3.48Å; F44-C48 PolarHBondContact O-N 3.17Å; F44-C48 PolarHBondContact O-SG 3.16Å; T45-C48 PolarHBondContact O-N 3.47Å; C48-S50 VanDerWaalsContact C-N 3.33Å; C48-S50 PolarHBondContact O-N 3.37Å; C48-H51 PolarHBondContact O-N 3.35Å; C48-L52 WeakPolarHBondContact O-CB 3.05Å; C48-L52 VanDerWaalsContact O-CG 3.31Å; C48-L52 WeakPolarHBondContact O-CG 3.44Å; C48-L52 PolarHBondContact O-N 3.04Å; C48-I59 HydrophobicContact CB-CD1 3.8Å; C48-F66 HydrophobicContact CB-CZ 4.19Å; C48-L75 HydrophobicContact CB-CD2 4.2Å; C48-L75 VanDerWaalsContact SG-CD2 3.54Å
49	N	89.4	Confident	86.6	Confident	34 Å²	34	42 Å²	42	18%	0.182	22%	0.222	C	C	.	.	H	α-helix	trans	-66.5	-32.3	178	-74.6	-20.6	0	0	0	113.1	T45 A46 W47 H51 L52 R53 Q58 I59	T45-N49 WeakPolarHBondContact O-CB 3.09Å; T45-N49 PolarHBondContact O-N 2.78Å; T45-N49 PolarHBondContact O-ND2 3.34Å; A46-N49 PolarHBondContact O-N 3.22Å; W47-N49 VanDerWaalsContact C-N 3.28Å; W47-N49 PolarHBondContact O-N 3.33Å; N49-H51 PolarHBondContact O-N 3.13Å; N49-L52 PolarHBondContact O-N 3.33Å; N49-R53 WeakPolarHBondContact O-CB 3.47Å; N49-R53 WeakPolarHBondContact O-CG 3.41Å; N49-R53 PolarHBondContact O-N 3.23Å; N49-Q58 WeakPolarHBondContact OD1-CA 3.46Å; N49-I59 PolarHBondContact ND2-O 2.72Å; N49-I59 PolarHBondContact OD1-N 3.27Å
50	S	86.6	Confident	86.9	Confident	13 Å²	13	49.6 Å²	49.6	9%	0.091	26%	0.258	C	S	.	.	H	α-helix	trans	-61.4	-27.9	175.6	83.1	0	0	0	0	113.4	A46 W47 C48 R53	A46-S50 PolarHBondContact O-N 3.02Å; W47-S50 WeakPolarHBondContact O-CB 3.43Å; W47-S50 PolarHBondContact O-N 3.11Å; W47-S50 VanDerWaalsContact O-N 3.11Å; W47-S50 PolarHBondContact O-OG 3.19Å; C48-S50 VanDerWaalsContact C-N 3.33Å; C48-S50 PolarHBondContact O-N 3.37Å; S50-R53 VanDerWaalsContact O-CG 3.29Å; S50-R53 WeakPolarHBondContact O-CG 3.47Å; S50-R53 PolarHBondContact O-NE 3.26Å; S50-R53 VanDerWaalsContact O-NE 3.09Å
51	H	87.4	Confident	86.9	Confident	39 Å²	39	51.4 Å²	51.4	18%	0.181	27%	0.268	C	S	.	.	H	α-helix	trans	-92.1	-46.8	174.5	-68.6	-75.2	0	0	0	111.5	W47 C48 N49 R53 K54 L75 V78 I79	W47-H51 AromaticContact CD2-CD2 3.99Å; W47-H51 AromaticContact CE2-CD2 3.62Å; W47-H51 AromaticContact CE2-NE2 3.41Å; W47-H51 AromaticContact CZ2-CD2 3.73Å; W47-H51 AromaticContact CZ2-NE2 3.47Å; W47-H51 WeakPolarHBondContact CZ2-NE2 3.5Å; W47-H51 AromaticContact NE1-CD2 3.96Å; W47-H51 AromaticContact NE1-NE2 3.46Å; W47-H51 PolarHBondContact NE1-NE2 2.94Å; W47-H51 PolarHBondContact O-CD2 3.04Å; W47-H51 PolarHBondContact O-N 3.4Å; C48-H51 PolarHBondContact O-N 3.35Å; N49-H51 PolarHBondContact O-N 3.13Å; H51-R53 VanDerWaalsContact C-N 3.26Å; H51-R53 PolarHBondContact O-N 3.4Å; H51-K54 VanDerWaalsContact O-CB 3.3Å; H51-K54 WeakPolarHBondContact O-CB 3.26Å; H51-K54 PolarHBondContact O-N 3.32Å; H51-L75 HydrophobicContact CB-CD1 3.76Å; H51-V78 HydrophobicContact CB-CG1 4.16Å; H51-I79 HydrophobicContact CB-CG2 4.13Å
52	L	86.7	Confident	86.9	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64	-27	-178.5	-70.7	173	0	0	0	113.5	C48 N49 K54 A55 G56 T57 I59 L74 L75	C48-L52 WeakPolarHBondContact O-CB 3.05Å; C48-L52 VanDerWaalsContact O-CG 3.31Å; C48-L52 WeakPolarHBondContact O-CG 3.44Å; C48-L52 PolarHBondContact O-N 3.04Å; N49-L52 PolarHBondContact O-N 3.33Å; L52-K54 PolarHBondContact O-N 3.33Å; L52-A55 CarbonylContact O-C 3.49Å; L52-A55 WeakPolarHBondContact O-CA 3.33Å; L52-A55 PolarHBondContact O-N 3.35Å; L52-G56 PolarHBondContact O-N 2.96Å; L52-G56 VanDerWaalsContact O-N 3.12Å; L52-T57 CarbonylContact C-O 3.31Å; L52-T57 HydrophobicContact CB-CG2 3.92Å; L52-T57 VanDerWaalsContact CB-O 3.28Å; L52-T57 WeakPolarHBondContact CB-O 3.33Å; L52-T57 HydrophobicContact CD1-CG2 4.43Å; L52-T57 HydrophobicContact CD2-CG2 3.81Å; L52-T57 HydrophobicContact CG-CG2 4.27Å; L52-T57 PolarHBondContact O-N 3.11Å; L52-T57 VanDerWaalsContact O-N 3.16Å; L52-T57 VanDerWaalsContact O-O 3.09Å; L52-I59 HydrophobicContact CD1-CG2 3.69Å; L52-L74 HydrophobicContact CD2-CB 4.44Å; L52-L74 HydrophobicContact CD2-CD2 4.28Å; L52-L74 HydrophobicContact CD2-CG 4.19Å; L52-L75 HydrophobicContact CD2-CB 4.01Å; L52-L75 HydrophobicContact CD2-CD1 4.46Å; L52-L75 HydrophobicContact CG-CB 4.46Å; L52-L75 HydrophobicContact CG-CD1 4.19Å
53	R	85.7	Confident	86.7	Confident	110 Å²	110	44.8 Å²	44.8	42%	0.415	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-56.1	-33	171.9	69.2	-178	177.1	157.2	4.5	112.3	N49 S50 H51 A55 G56 T57 D224	N49-R53 WeakPolarHBondContact O-CB 3.47Å; N49-R53 WeakPolarHBondContact O-CG 3.41Å; N49-R53 PolarHBondContact O-N 3.23Å; S50-R53 VanDerWaalsContact O-CG 3.29Å; S50-R53 WeakPolarHBondContact O-CG 3.47Å; S50-R53 PolarHBondContact O-NE 3.26Å; S50-R53 VanDerWaalsContact O-NE 3.09Å; H51-R53 VanDerWaalsContact C-N 3.26Å; H51-R53 PolarHBondContact O-N 3.4Å; R53-A55 PolarHBondContact O-N 3.31Å; R53-G56 PolarHBondContact O-N 3.02Å; R53-G56 VanDerWaalsContact O-N 3.13Å; R53-T57 PolarHBondContact N-O 3.01Å; R53-D224 IonicContact CZ-OD1 2.69Å; R53-D224 IonicContact CZ-OD2 3Å; R53-D224 IonicContact NH1-OD1 2.71Å; R53-D224 PolarHBondContact NH1-OD1 3.3Å; R53-D224 VanDerWaalsContact NH2-CG 3.29Å; R53-D224 PolarHBondContact NH2-O 3.27Å; R53-D224 IonicContact NH2-OD1 2.62Å; R53-D224 PolarHBondContact NH2-OD1 2.9Å; R53-D224 IonicContact NH2-OD2 2.75Å; R53-D224 PolarHBondContact NH2-OD2 3.33Å; R53-D224 VanDerWaalsContact NH2-OD2 3.12Å
54	K	80.8	Confident	86.7	Confident	156 Å²	156	50.7 Å²	50.7	68%	0.678	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-67.6	-25	176.7	-57.3	-177.1	-179.3	-177.3	0	112.4	H51 L52 V78	H51-K54 VanDerWaalsContact O-CB 3.3Å; H51-K54 WeakPolarHBondContact O-CB 3.26Å; H51-K54 PolarHBondContact O-N 3.32Å; L52-K54 PolarHBondContact O-N 3.33Å; K54-V78 HydrophobicContact CB-CG1 4.49Å
55	A	79.6	Confident	86.5	Confident	45 Å²	45	52.3 Å²	52.3	37%	0.372	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-99.7	6.4	175.1	0	0	0	0	0	113.4	L52 R53 L74 V78	L52-A55 CarbonylContact O-C 3.49Å; L52-A55 WeakPolarHBondContact O-CA 3.33Å; L52-A55 PolarHBondContact O-N 3.35Å; R53-A55 PolarHBondContact O-N 3.31Å; A55-L74 HydrophobicContact CB-CD1 4.24Å; A55-L74 HydrophobicContact CB-CD2 4.1Å; A55-L74 HydrophobicContact CB-CG 4.24Å; A55-V78 HydrophobicContact CB-CG2 3.78Å
56	G	82.1	Confident	86.6	Confident	73 Å²	73	51.3 Å²	51.3	75%	0.753	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	26.1	176.9	0	0	0	0	0	115.2	L52 R53	L52-G56 PolarHBondContact O-N 2.96Å; L52-G56 VanDerWaalsContact O-N 3.12Å; R53-G56 PolarHBondContact O-N 3.02Å; R53-G56 VanDerWaalsContact O-N 3.13Å
57	T	87.7	Confident	86.7	Confident	47 Å²	47	54.2 Å²	54.2	29%	0.288	28%	0.278	S	S	.	.			trans	-136.7	168.5	176	-161.2	0	0	0	0	112.3	L52 R53 L74	L52-T57 CarbonylContact C-O 3.31Å; L52-T57 HydrophobicContact CB-CG2 3.92Å; L52-T57 VanDerWaalsContact CB-O 3.28Å; L52-T57 WeakPolarHBondContact CB-O 3.33Å; L52-T57 HydrophobicContact CD1-CG2 4.43Å; L52-T57 HydrophobicContact CD2-CG2 3.81Å; L52-T57 HydrophobicContact CG-CG2 4.27Å; L52-T57 PolarHBondContact O-N 3.11Å; L52-T57 VanDerWaalsContact O-N 3.16Å; L52-T57 VanDerWaalsContact O-O 3.09Å; R53-T57 PolarHBondContact N-O 3.01Å; T57-L74 HydrophobicContact CG2-CD2 3.67Å
58	Q	89.1	Confident	86.4	Confident	123 Å²	123	56.6 Å²	56.6	58%	0.575	29%	0.291	S	S	*	.			trans	-151.3	162.8	178.6	67.4	-175.2	8.5	0	0	111.8	N49 K71	N49-Q58 WeakPolarHBondContact OD1-CA 3.46Å; Q58-K71 VanDerWaalsContact O-CE 3.24Å; Q58-K71 WeakPolarHBondContact O-CE 3.4Å; Q58-K71 PolarHBondContact O-NZ 3.35Å
59	I	90.4	Very high	86.1	Confident	3 Å²	3	56.6 Å²	56.6	2%	0.015	29%	0.291	C	S	.	.			trans	-115.4	140.5	173.9	78.8	-174.6	0	0	0	110.3	T45 C48 N49 L52 I62 D65 F66 K71	T45-I59 HydrophobicContact CG2-CD1 4.38Å; T45-I59 HydrophobicContact CG2-CG1 3.88Å; C48-I59 HydrophobicContact CB-CD1 3.8Å; N49-I59 PolarHBondContact ND2-O 2.72Å; N49-I59 PolarHBondContact OD1-N 3.27Å; L52-I59 HydrophobicContact CD1-CG2 3.69Å; I59-I62 HydrophobicContact CD1-CB 4.37Å; I59-I62 HydrophobicContact CD1-CG1 4.13Å; I59-D65 WeakPolarHBondContact CA-OD2 3.16Å; I59-D65 HydrophobicContact CB-CB 3.91Å; I59-D65 WeakPolarHBondContact CB-OD2 3.27Å; I59-D65 HydrophobicContact CG2-CB 4.11Å; I59-F66 HydrophobicContact CD1-CD2 4.45Å; I59-F66 HydrophobicContact CD1-CE1 4.33Å; I59-F66 HydrophobicContact CD1-CE2 3.6Å; I59-F66 HydrophobicContact CD1-CZ 3.52Å; I59-F66 HydrophobicContact CG2-CE1 4.28Å; I59-F66 HydrophobicContact CG2-CZ 4.4Å; I59-K71 HydrophobicContact CG2-CB 4.39Å; I59-K71 HydrophobicContact CG2-CD 3.74Å; I59-K71 HydrophobicContact CG2-CG 4.44Å
60	E	87.1	Confident	86.1	Confident	166 Å²	166	58.5 Å²	58.5	78%	0.776	30%	0.301	S	S	*	.	S	Bend	trans	-103.1	-46.5	178	-67.4	-178	-176.6	0	0	110.7	D65	E60-D65 PolarHBondContact N-OD2 3.16Å
61	N	86	Confident	86.2	Confident	43 Å²	43	59.8 Å²	59.8	23%	0.23	31%	0.305	C	S	.	.			trans	-122.8	107.1	176.2	-172.5	-9.9	0	0	0	110.3	E63 E64 D65	N61-E63 PolarHBondContact O-N 2.69Å; N61-E63 VanDerWaalsContact O-N 3.1Å; N61-E63 WeakPolarHBondContact OD1-CB 3.34Å; N61-E63 PolarHBondContact OD1-N 3.41Å; N61-E63 VanDerWaalsContact OD1-N 3.14Å; N61-E64 HydrophobicContact CB-CB 4.35Å; N61-E64 PolarHBondContact O-N 2.65Å; N61-D65 PolarHBondContact N-OD2 2.79Å; N61-D65 VanDerWaalsContact O-CB 3.3Å; N61-D65 WeakPolarHBondContact O-CB 3.4Å; N61-D65 PolarHBondContact O-N 3.21Å
62	I	85.9	Confident	86.4	Confident	2 Å²	2	58 Å²	58	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-55	-29.7	-178.4	-161.2	166.5	0	0	0	113.5	R41 F44 I59 F66 L131 I134	R41-I62 HydrophobicContact CG-CG2 4.19Å; F44-I62 HydrophobicContact CB-CD1 3.83Å; I59-I62 HydrophobicContact CD1-CB 4.37Å; I59-I62 HydrophobicContact CD1-CG1 4.13Å; I62-F66 HydrophobicContact CD1-CE2 4.17Å; I62-F66 HydrophobicContact CG1-CD2 3.67Å; I62-F66 HydrophobicContact CG1-CE2 3.57Å; I62-F66 WeakPolarHBondContact O-CD2 3.07Å; I62-L131 HydrophobicContact CD1-CD2 4.22Å; I62-L131 HydrophobicContact CG2-CD2 4.43Å; I62-I134 HydrophobicContact CD1-CG1 4.27Å
63	E	81.6	Confident	86.5	Confident	38 Å²	38	58.3 Å²	58.3	18%	0.178	30%	0.298	C	S	.	.	H	α-helix	trans	-76.1	-28.7	-178.7	-57.9	171.9	-175.9	0	0	112.5	R41 N61 R67 V127	R41-E63 WeakPolarHBondContact CD-OE1 3.44Å; R41-E63 IonicContact CZ-OE1 2.72Å; R41-E63 IonicContact NE-OE1 3.3Å; R41-E63 PolarHBondContact NE-OE1 3.37Å; R41-E63 VanDerWaalsContact NE-OE1 3.09Å; R41-E63 IonicContact NH1-OE1 2.99Å; R41-E63 PolarHBondContact NH1-OE1 3.33Å; R41-E63 IonicContact NH2-OE1 3.41Å; R41-E63 PolarHBondContact NH2-OE1 3.46Å; R41-E63 VanDerWaalsContact NH2-OE1 3.13Å; R41-E63 IonicContact NH2-OE2 3.77Å; N61-E63 PolarHBondContact O-N 2.69Å; N61-E63 VanDerWaalsContact O-N 3.1Å; N61-E63 WeakPolarHBondContact OD1-CB 3.34Å; N61-E63 PolarHBondContact OD1-N 3.41Å; N61-E63 VanDerWaalsContact OD1-N 3.14Å; E63-R67 VanDerWaalsContact O-CD 3.24Å; E63-R67 WeakPolarHBondContact O-CD 3.23Å; E63-R67 WeakPolarHBondContact O-CG 3.3Å; E63-V127 HydrophobicContact CB-CG2 4.49Å; E63-V127 HydrophobicContact CG-CB 4.26Å; E63-V127 HydrophobicContact CG-CG1 3.98Å; E63-V127 HydrophobicContact CG-CG2 3.71Å; E63-V127 WeakPolarHBondContact OE1-CG1 3.29Å; E63-V127 VanDerWaalsContact OE1-CG2 3.27Å; E63-V127 WeakPolarHBondContact OE1-CG2 3.28Å
64	E	85.6	Confident	86.6	Confident	125 Å²	125	55.6 Å²	55.6	58%	0.584	29%	0.291	S	S	*	.	H	α-helix	trans	-102	-40	-175.4	-66.1	-168.5	157.7	0	0	112.3	N61 F66 R67	N61-E64 HydrophobicContact CB-CB 4.35Å; N61-E64 PolarHBondContact O-N 2.65Å; E64-F66 VanDerWaalsContact C-N 3.34Å; E64-F66 PolarHBondContact O-N 2.65Å; E64-R67 WeakPolarHBondContact O-CB 3.38Å; E64-R67 WeakPolarHBondContact O-CG 3.36Å; E64-R67 PolarHBondContact O-N 3.29Å
65	D	88.9	Confident	87.1	Confident	35 Å²	35	48.1 Å²	48.1	19%	0.187	26%	0.259	C	S	.	.	H	α-helix	trans	-72.1	-26.8	-171.5	-86.6	-37.6	0	0	0	113.6	I59 E60 N61 K71	I59-D65 WeakPolarHBondContact CA-OD2 3.16Å; I59-D65 HydrophobicContact CB-CB 3.91Å; I59-D65 WeakPolarHBondContact CB-OD2 3.27Å; I59-D65 HydrophobicContact CG2-CB 4.11Å; E60-D65 PolarHBondContact N-OD2 3.16Å; N61-D65 PolarHBondContact N-OD2 2.79Å; N61-D65 VanDerWaalsContact O-CB 3.3Å; N61-D65 WeakPolarHBondContact O-CB 3.4Å; N61-D65 PolarHBondContact O-N 3.21Å; D65-K71 HydrophobicContact CB-CD 3.87Å; D65-K71 IonicContact OD1-NZ 2.94Å; D65-K71 PolarHBondContact OD1-NZ 3.38Å; D65-K71 IonicContact OD2-NZ 2.74Å; D65-K71 PolarHBondContact OD2-NZ 2.89Å
66	F	90.6	Very high	87.5	Confident	1 Å²	1	46 Å²	46	0%	0.004	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-11.3	175.4	-70.6	-42.8	0	0	0	114	C48 I59 I62 E64 N68 G69 K71 L72 L75 T130 I134	C48-F66 HydrophobicContact CB-CZ 4.19Å; I59-F66 HydrophobicContact CD1-CD2 4.45Å; I59-F66 HydrophobicContact CD1-CE1 4.33Å; I59-F66 HydrophobicContact CD1-CE2 3.6Å; I59-F66 HydrophobicContact CD1-CZ 3.52Å; I59-F66 HydrophobicContact CG2-CE1 4.28Å; I59-F66 HydrophobicContact CG2-CZ 4.4Å; I62-F66 HydrophobicContact CD1-CE2 4.17Å; I62-F66 HydrophobicContact CG1-CD2 3.67Å; I62-F66 HydrophobicContact CG1-CE2 3.57Å; I62-F66 WeakPolarHBondContact O-CD2 3.07Å; E64-F66 VanDerWaalsContact C-N 3.34Å; E64-F66 PolarHBondContact O-N 2.65Å; F66-N68 PolarHBondContact O-N 3.4Å; F66-G69 PolarHBondContact O-N 3.28Å; F66-K71 HydrophobicContact CD1-CB 3.98Å; F66-K71 HydrophobicContact CE1-CB 4Å; F66-L72 HydrophobicContact CD1-CB 3.83Å; F66-L72 HydrophobicContact CE1-CB 4.31Å; F66-L75 HydrophobicContact CZ-CD2 4.16Å; F66-T130 HydrophobicContact CD2-CG2 4.31Å; F66-I134 HydrophobicContact CD2-CD1 4.01Å; F66-I134 HydrophobicContact CD2-CG1 4.35Å; F66-I134 HydrophobicContact CE2-CD1 3.48Å; F66-I134 VanDerWaalsContact CE2-CD1 3.48Å; F66-I134 HydrophobicContact CE2-CG1 3.99Å; F66-I134 HydrophobicContact CZ-CD1 3.98Å
67	R	89.1	Confident	87.8	Confident	83 Å²	83	44.2 Å²	44.2	31%	0.313	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-22.2	-177.2	-60.4	-180	65.2	169.4	8.1	114	E63 E64 K96 I122 V123 D124	E63-R67 VanDerWaalsContact O-CD 3.24Å; E63-R67 WeakPolarHBondContact O-CD 3.23Å; E63-R67 WeakPolarHBondContact O-CG 3.3Å; E64-R67 WeakPolarHBondContact O-CB 3.38Å; E64-R67 WeakPolarHBondContact O-CG 3.36Å; E64-R67 PolarHBondContact O-N 3.29Å; R67-K96 WeakPolarHBondContact O-CB 3.34Å; R67-I122 WeakPolarHBondContact CG-O 3.37Å; R67-V123 VanDerWaalsContact CZ-O 3.27Å; R67-V123 PolarHBondContact NE-O 3.46Å; R67-V123 PolarHBondContact NH2-O 3.2Å; R67-D124 PolarHBondContact NH2-O 3.36Å
68	N	84.2	Confident	87.8	Confident	52 Å²	52	44 Å²	44	28%	0.278	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-6.8	179.3	70.3	25	0	0	0	113.9	F66 L70 K96 N99	F66-N68 PolarHBondContact O-N 3.4Å; N68-L70 PolarHBondContact O-N 3.49Å; N68-L70 VanDerWaalsContact O-N 3.15Å; N68-L70 WeakPolarHBondContact OD1-CB 3.19Å; N68-L70 PolarHBondContact OD1-N 3.26Å; N68-K96 HydrophobicContact CB-CD 4.41Å; N68-K96 HydrophobicContact CB-CG 4.34Å; N68-N99 PolarHBondContact O-ND2 3.42Å
69	G	84.3	Confident	87.7	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.193	C	C	.	.	S	Bend	trans	74	-16	-179.3	0	0	0	0	0	116	F66 L72 M73	F66-G69 PolarHBondContact O-N 3.28Å; G69-L72 PolarHBondContact O-N 2.74Å; G69-M73 VanDerWaalsContact O-CG 3.24Å; G69-M73 WeakPolarHBondContact O-CG 3.29Å; G69-M73 PolarHBondContact O-N 3.45Å
70	L	88.6	Confident	87.4	Confident	75 Å²	75	41 Å²	41	39%	0.393	20%	0.202	S	C	.	.	H	α-helix	trans	-69.5	-48.4	-173	-60.5	179.4	0	0	0	112.6	N68 L72 M73 L74 P87	N68-L70 PolarHBondContact O-N 3.49Å; N68-L70 VanDerWaalsContact O-N 3.15Å; N68-L70 WeakPolarHBondContact OD1-CB 3.19Å; N68-L70 PolarHBondContact OD1-N 3.26Å; L70-L72 VanDerWaalsContact C-N 3.27Å; L70-L72 PolarHBondContact O-N 3.05Å; L70-M73 PolarHBondContact O-N 2.74Å; L70-L74 PolarHBondContact O-N 3.1Å; L70-P87 HydrophobicContact CD2-CB 3.31Å; L70-P87 HydrophobicContact CD2-CG 3.99Å
71	K	89.6	Confident	87.1	Confident	40 Å²	40	36.5 Å²	36.5	17%	0.174	20%	0.2	C	C	.	.	H	α-helix	trans	-65.6	-33.5	177.8	-76.8	170.7	157.4	-171.4	0	111.4	Q58 I59 D65 F66 L75	Q58-K71 VanDerWaalsContact O-CE 3.24Å; Q58-K71 WeakPolarHBondContact O-CE 3.4Å; Q58-K71 PolarHBondContact O-NZ 3.35Å; I59-K71 HydrophobicContact CG2-CB 4.39Å; I59-K71 HydrophobicContact CG2-CD 3.74Å; I59-K71 HydrophobicContact CG2-CG 4.44Å; D65-K71 HydrophobicContact CB-CD 3.87Å; D65-K71 IonicContact OD1-NZ 2.94Å; D65-K71 PolarHBondContact OD1-NZ 3.38Å; D65-K71 IonicContact OD2-NZ 2.74Å; D65-K71 PolarHBondContact OD2-NZ 2.89Å; F66-K71 HydrophobicContact CD1-CB 3.98Å; F66-K71 HydrophobicContact CE1-CB 4Å; K71-L75 WeakPolarHBondContact O-CB 3.48Å; K71-L75 PolarHBondContact O-N 2.74Å
72	L	90	Very high	87	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-67.7	-46.7	176	-179.9	63.3	0	0	0	111.5	F66 G69 L70 L74 L75 L76 A103 M133 I134 I137	F66-L72 HydrophobicContact CD1-CB 3.83Å; F66-L72 HydrophobicContact CE1-CB 4.31Å; G69-L72 PolarHBondContact O-N 2.74Å; L70-L72 VanDerWaalsContact C-N 3.27Å; L70-L72 PolarHBondContact O-N 3.05Å; L72-L74 VanDerWaalsContact C-N 3.34Å; L72-L74 PolarHBondContact O-N 3.46Å; L72-L75 WeakPolarHBondContact O-CB 3.41Å; L72-L75 PolarHBondContact O-N 3.4Å; L72-L76 WeakPolarHBondContact O-CG 3.48Å; L72-L76 PolarHBondContact O-N 3.2Å; L72-A103 HydrophobicContact CD2-CB 3.67Å; L72-A103 HydrophobicContact CG-CB 3.86Å; L72-M133 HydrophobicContact CD1-CE 3.59Å; L72-M133 HydrophobicContact CD1-SD 4.33Å; L72-M133 HydrophobicContact CD2-CE 3.64Å; L72-M133 HydrophobicContact CD2-SD 3.65Å; L72-M133 HydrophobicContact CG-CE 4.25Å; L72-I134 HydrophobicContact CD1-CD1 4.12Å; L72-I137 HydrophobicContact CD1-CD1 3.9Å
73	M	89.8	Confident	86.8	Confident	7 Å²	7	48.6 Å²	48.6	3%	0.034	25%	0.246	C	C	.	.	H	α-helix	trans	-60	-44.7	175.8	-71	176.9	77.1	0	0	111.5	G69 L70 L75 L76 E77 L84 P85 P87 N99 K102 A103	G69-M73 VanDerWaalsContact O-CG 3.24Å; G69-M73 WeakPolarHBondContact O-CG 3.29Å; G69-M73 PolarHBondContact O-N 3.45Å; L70-M73 PolarHBondContact O-N 2.74Å; M73-L75 PolarHBondContact O-N 2.95Å; M73-L76 PolarHBondContact O-N 3.35Å; M73-E77 WeakPolarHBondContact O-CG 3.45Å; M73-E77 PolarHBondContact O-N 3.39Å; M73-L84 HydrophobicContact CB-CD2 4.19Å; M73-L84 HydrophobicContact CE-CB 4.08Å; M73-L84 HydrophobicContact CE-CD2 4.3Å; M73-L84 HydrophobicContact CG-CD2 4.17Å; M73-P85 WeakPolarHBondContact CE-O 3.49Å; M73-P87 HydrophobicContact SD-CB 4.2Å; M73-N99 HydrophobicContact SD-CB 4.06Å; M73-K102 HydrophobicContact CE-CB 3.87Å; M73-K102 HydrophobicContact CE-CD 4.1Å; M73-K102 HydrophobicContact SD-CB 4.28Å; M73-A103 HydrophobicContact CG-CB 3.9Å
74	L	88.8	Confident	87	Confident	53 Å²	53	47.5 Å²	47.5	28%	0.277	24%	0.242	S	C	.	.	H	α-helix	trans	-64	-39.8	178.3	-176.6	62.6	0	0	0	112.4	L52 A55 T57 L70 L72 L76 E77 V78	L52-L74 HydrophobicContact CD2-CB 4.44Å; L52-L74 HydrophobicContact CD2-CD2 4.28Å; L52-L74 HydrophobicContact CD2-CG 4.19Å; A55-L74 HydrophobicContact CB-CD1 4.24Å; A55-L74 HydrophobicContact CB-CD2 4.1Å; A55-L74 HydrophobicContact CB-CG 4.24Å; T57-L74 HydrophobicContact CG2-CD2 3.67Å; L70-L74 PolarHBondContact O-N 3.1Å; L72-L74 VanDerWaalsContact C-N 3.34Å; L72-L74 PolarHBondContact O-N 3.46Å; L74-L76 VanDerWaalsContact C-N 3.31Å; L74-L76 PolarHBondContact O-N 3.09Å; L74-E77 PolarHBondContact O-N 3.23Å; L74-V78 WeakPolarHBondContact O-CG2 3.34Å; L74-V78 PolarHBondContact O-N 3.26Å
75	L	90.3	Very high	87	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-58.1	-46	174	177	65.3	0	0	0	110.9	W47 C48 H51 L52 F66 K71 L72 M73 E77 V78 I79 I134	W47-L75 HydrophobicContact CZ3-CD1 4.49Å; W47-L75 HydrophobicContact CZ3-CD2 4.26Å; C48-L75 HydrophobicContact CB-CD2 4.2Å; C48-L75 VanDerWaalsContact SG-CD2 3.54Å; H51-L75 HydrophobicContact CB-CD1 3.76Å; L52-L75 HydrophobicContact CD2-CB 4.01Å; L52-L75 HydrophobicContact CD2-CD1 4.46Å; L52-L75 HydrophobicContact CG-CB 4.46Å; L52-L75 HydrophobicContact CG-CD1 4.19Å; F66-L75 HydrophobicContact CZ-CD2 4.16Å; K71-L75 WeakPolarHBondContact O-CB 3.48Å; K71-L75 PolarHBondContact O-N 2.74Å; L72-L75 WeakPolarHBondContact O-CB 3.41Å; L72-L75 PolarHBondContact O-N 3.4Å; M73-L75 PolarHBondContact O-N 2.95Å; L75-E77 VanDerWaalsContact C-N 3.34Å; L75-E77 PolarHBondContact O-N 3.2Å; L75-V78 PolarHBondContact O-N 3.43Å; L75-I79 HydrophobicContact CD1-CG2 4.07Å; L75-I79 WeakPolarHBondContact O-CG1 3.28Å; L75-I79 WeakPolarHBondContact O-CG2 3.33Å; L75-I79 PolarHBondContact O-N 3.32Å; L75-I134 HydrophobicContact CD2-CD1 4.45Å
76	L	88.9	Confident	86.7	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61.9	-39.6	177.6	-68.5	171.4	0	0	0	112.3	L72 M73 L74 V78 I79 S80 L84 A103 F106 I107 I137 F141	L72-L76 WeakPolarHBondContact O-CG 3.48Å; L72-L76 PolarHBondContact O-N 3.2Å; M73-L76 PolarHBondContact O-N 3.35Å; L74-L76 VanDerWaalsContact C-N 3.31Å; L74-L76 PolarHBondContact O-N 3.09Å; L76-V78 VanDerWaalsContact C-N 3.34Å; L76-V78 PolarHBondContact O-N 3.14Å; L76-I79 HydrophobicContact CD2-CD1 3.99Å; L76-S80 VanDerWaalsContact O-CB 3.27Å; L76-S80 WeakPolarHBondContact O-CB 3.44Å; L76-S80 PolarHBondContact O-N 3.23Å; L76-S80 PolarHBondContact O-OG 3.29Å; L76-L84 HydrophobicContact CB-CD1 4.06Å; L76-L84 HydrophobicContact CB-CD2 4.2Å; L76-L84 HydrophobicContact CD1-CD2 4.13Å; L76-A103 HydrophobicContact CD1-CB 3.71Å; L76-F106 HydrophobicContact CB-CD1 3.99Å; L76-F106 HydrophobicContact CB-CE1 4.09Å; L76-F106 HydrophobicContact CD1-CD1 4.03Å; L76-F106 HydrophobicContact CD2-CD1 4.33Å; L76-F106 HydrophobicContact CG-CD1 4.34Å; L76-I107 HydrophobicContact CD1-CD1 3.93Å; L76-I107 HydrophobicContact CD1-CG1 3.8Å; L76-I107 HydrophobicContact CD2-CD1 4.14Å; L76-I107 HydrophobicContact CD2-CG1 3.7Å; L76-I107 HydrophobicContact CG-CG1 4.41Å; L76-I137 HydrophobicContact CD2-CD1 4.08Å; L76-I137 HydrophobicContact CD2-CG1 4.29Å; L76-I137 HydrophobicContact CD2-CG2 4.2Å; L76-F141 HydrophobicContact CD2-CE2 4.39Å
77	E	88.3	Confident	86.5	Confident	35 Å²	35	55.3 Å²	55.3	16%	0.164	29%	0.286	C	S	.	.	H	α-helix	trans	-61.8	-42.8	174.4	-65.9	-167	166	0	0	111.8	M73 L74 L75 G81 E82 R83 L84	M73-E77 WeakPolarHBondContact O-CG 3.45Å; M73-E77 PolarHBondContact O-N 3.39Å; L74-E77 PolarHBondContact O-N 3.23Å; L75-E77 VanDerWaalsContact C-N 3.34Å; L75-E77 PolarHBondContact O-N 3.2Å; E77-G81 WeakPolarHBondContact O-CA 3.42Å; E77-G81 PolarHBondContact O-N 3.07Å; E77-E82 VanDerWaalsContact CA-O 3.24Å; E77-E82 WeakPolarHBondContact CA-O 3.44Å; E77-E82 WeakPolarHBondContact CB-O 3.38Å; E77-E82 WeakPolarHBondContact CG-O 3.4Å; E77-R83 IonicContact OE2-CZ 2.67Å; E77-R83 IonicContact OE2-NH1 3.97Å; E77-R83 PolarHBondContact OE2-NH1 3.23Å; E77-L84 HydrophobicContact CB-CD1 4.43Å; E77-L84 HydrophobicContact CG-CB 4.09Å; E77-L84 HydrophobicContact CG-CD1 3.55Å; E77-L84 HydrophobicContact CG-CG 4.38Å; E77-L84 PolarHBondContact OE1-N 3.48Å
78	V	87.3	Confident	86.3	Confident	43 Å²	43	54.2 Å²	54.2	26%	0.261	29%	0.286	S	S	.	.	H	α-helix	trans	-70.1	-40.6	-177	173.9	0	0	0	0	112.1	H51 K54 A55 L74 L75 L76	H51-V78 HydrophobicContact CB-CG1 4.16Å; K54-V78 HydrophobicContact CB-CG1 4.49Å; A55-V78 HydrophobicContact CB-CG2 3.78Å; L74-V78 WeakPolarHBondContact O-CG2 3.34Å; L74-V78 PolarHBondContact O-N 3.26Å; L75-V78 PolarHBondContact O-N 3.43Å; L76-V78 VanDerWaalsContact C-N 3.34Å; L76-V78 PolarHBondContact O-N 3.14Å
79	I	86.7	Confident	85.8	Confident	33 Å²	33	63.6 Å²	63.6	17%	0.169	32%	0.317	C	S	.	.	H	α-helix	trans	-78.6	-29.6	-178.4	67.8	-176.6	0	0	0	112.8	W47 H51 L75 L76 I137 F141	W47-I79 HydrophobicContact CH2-CD1 4.37Å; W47-I79 HydrophobicContact CH2-CG2 4.22Å; H51-I79 HydrophobicContact CB-CG2 4.13Å; L75-I79 HydrophobicContact CD1-CG2 4.07Å; L75-I79 WeakPolarHBondContact O-CG1 3.28Å; L75-I79 WeakPolarHBondContact O-CG2 3.33Å; L75-I79 PolarHBondContact O-N 3.32Å; L76-I79 HydrophobicContact CD2-CD1 3.99Å; I79-I137 HydrophobicContact CD1-CG2 3.35Å; I79-F141 HydrophobicContact CD1-CB 4.06Å; I79-F141 HydrophobicContact CD1-CD1 4.36Å; I79-F141 HydrophobicContact CD1-CD2 3.68Å; I79-F141 HydrophobicContact CD1-CE2 4.15Å; I79-F141 HydrophobicContact CD1-CG 3.78Å; I79-F141 HydrophobicContact CG1-CB 4.46Å; I79-F141 HydrophobicContact CG1-CD1 4.25Å; I79-F141 HydrophobicContact CG1-CD2 4.41Å; I79-F141 HydrophobicContact CG1-CG 4.14Å
80	S	83.6	Confident	85.3	Confident	31 Å²	31	64.8 Å²	64.8	22%	0.217	33%	0.33	C	S	.	.	H	α-helix	trans	-92.5	-20.6	180	66.9	0	0	0	0	113.6	L76 E82 F106	L76-S80 VanDerWaalsContact O-CB 3.27Å; L76-S80 WeakPolarHBondContact O-CB 3.44Å; L76-S80 PolarHBondContact O-N 3.23Å; L76-S80 PolarHBondContact O-OG 3.29Å; S80-E82 PolarHBondContact O-N 3.29Å; S80-E82 PolarHBondContact OG-N 2.86Å; S80-F106 WeakPolarHBondContact OG-CZ 3.24Å
81	G	82.1	Confident	84.6	Confident	71 Å²	71	70.9 Å²	70.9	73%	0.732	35%	0.353	S	S	*	.			trans	73.7	1.5	-170.8	0	0	0	0	0	114.3	E77	E77-G81 WeakPolarHBondContact O-CA 3.42Å; E77-G81 PolarHBondContact O-N 3.07Å
82	E	83.8	Confident	84.3	Confident	88 Å²	88	74.8 Å²	74.8	41%	0.411	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-102.8	150.6	-177.3	-69	178.4	-166	0	0	112.3	E77 S80 F106 K110	E77-E82 VanDerWaalsContact CA-O 3.24Å; E77-E82 WeakPolarHBondContact CA-O 3.44Å; E77-E82 WeakPolarHBondContact CB-O 3.38Å; E77-E82 WeakPolarHBondContact CG-O 3.4Å; S80-E82 PolarHBondContact O-N 3.29Å; S80-E82 PolarHBondContact OG-N 2.86Å; E82-F106 HydrophobicContact CB-CE2 4.38Å; E82-F106 HydrophobicContact CB-CZ 4.26Å; E82-K110 IonicContact OE1-NZ 3.18Å; E82-K110 PolarHBondContact OE1-NZ 3.02Å; E82-K110 VanDerWaalsContact OE2-CE 3.26Å; E82-K110 WeakPolarHBondContact OE2-CE 3.47Å; E82-K110 IonicContact OE2-NZ 3.73Å; E82-K110 PolarHBondContact OE2-NZ 2.84Å
83	R	81.7	Confident	84.1	Confident	211 Å²	211	79.8 Å²	79.8	80%	0.796	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-87.6	129.1	177.5	-69.7	-64.9	-171.1	-174.3	-2.7	111.1	E77	E77-R83 IonicContact OE2-CZ 2.67Å; E77-R83 IonicContact OE2-NH1 3.97Å; E77-R83 PolarHBondContact OE2-NH1 3.23Å
84	L	85.4	Confident	83.9	Confident	15 Å²	15	85 Å²	85	8%	0.079	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-86.3	162.8	176.2	-88.4	78.6	0	0	0	111.1	M73 L76 E77 F106	M73-L84 HydrophobicContact CB-CD2 4.19Å; M73-L84 HydrophobicContact CE-CB 4.08Å; M73-L84 HydrophobicContact CE-CD2 4.3Å; M73-L84 HydrophobicContact CG-CD2 4.17Å; L76-L84 HydrophobicContact CB-CD1 4.06Å; L76-L84 HydrophobicContact CB-CD2 4.2Å; L76-L84 HydrophobicContact CD1-CD2 4.13Å; E77-L84 HydrophobicContact CB-CD1 4.43Å; E77-L84 HydrophobicContact CG-CB 4.09Å; E77-L84 HydrophobicContact CG-CD1 3.55Å; E77-L84 HydrophobicContact CG-CG 4.38Å; E77-L84 PolarHBondContact OE1-N 3.48Å; L84-F106 HydrophobicContact CD1-CD1 4.02Å; L84-F106 HydrophobicContact CD1-CD2 3.92Å; L84-F106 HydrophobicContact CD1-CE1 3.99Å; L84-F106 HydrophobicContact CD1-CE2 3.9Å; L84-F106 HydrophobicContact CD1-CG 3.96Å; L84-F106 HydrophobicContact CD1-CZ 3.92Å; L84-F106 HydrophobicContact CD2-CB 3.89Å; L84-F106 HydrophobicContact CD2-CD1 4.31Å; L84-F106 HydrophobicContact CD2-CD2 4.45Å; L84-F106 HydrophobicContact CD2-CG 3.97Å; L84-F106 HydrophobicContact CG-CB 4.27Å; L84-F106 HydrophobicContact CG-CD1 4.43Å; L84-F106 HydrophobicContact CG-CD2 3.94Å; L84-F106 HydrophobicContact CG-CE2 4.38Å; L84-F106 HydrophobicContact CG-CG 3.95Å
85	P	84.6	Confident	83.8	Confident	79 Å²	79	84.7 Å²	84.7	51%	0.513	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-56.2	147.9	174.2	-24.6	34.3	0	0	0	112.4	M73 K102	M73-P85 WeakPolarHBondContact CE-O 3.49Å; P85-K102 HydrophobicContact CB-CD 4.45Å
86	K	83.3	Confident	83.7	Confident	190 Å²	190	88 Å²	88	83%	0.826	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-56.9	133.6	-176.8	-70.7	-176.9	179.7	176.1	0	111.7	K102	K86-K102 PolarHBondContact O-NZ 3.49Å
87	P	86.3	Confident	83.7	Confident	56 Å²	56	89 Å²	89	36%	0.364	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-73.8	148.4	179.7	28.1	-33.9	0	0	0	112.2	L70 M73 N99	L70-P87 HydrophobicContact CD2-CB 3.31Å; L70-P87 HydrophobicContact CD2-CG 3.99Å; M73-P87 HydrophobicContact SD-CB 4.2Å; P87-N99 WeakPolarHBondContact CA-OD1 3.26Å
88	D	85.5	Confident	83.7	Confident	60 Å²	60	88.7 Å²	88.7	32%	0.321	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-81.2	123.7	175.4	-56.8	-40.2	0	0	0	109.8	G90 A98 N99 K102	D88-G90 VanDerWaalsContact C-N 3.32Å; D88-G90 PolarHBondContact O-N 2.96Å; D88-A98 WeakPolarHBondContact OD2-CB 3.36Å; D88-N99 PolarHBondContact N-OD1 2.83Å; D88-N99 PolarHBondContact O-ND2 2.9Å; D88-K102 IonicContact OD1-NZ 2.67Å; D88-K102 PolarHBondContact OD1-NZ 3.16Å; D88-K102 IonicContact OD2-NZ 2.88Å; D88-K102 PolarHBondContact OD2-NZ 3.47Å
89	R	73.6	Confident	83.8	Confident	248 Å²	248	86.9 Å²	86.9	94%	0.936	42%	0.424	S	S	*	.			trans	-89.2	27.9	-168.5	-64.5	-175.2	175.2	-176.4	-3.1	115
90	G	73	Confident	84	Confident	26 Å²	26	85.3 Å²	85.3	27%	0.268	42%	0.416	S	S	.	.			trans	-99.8	151.8	-176.3	0	0	0	0	0	114.7	D88 H95	D88-G90 VanDerWaalsContact C-N 3.32Å; D88-G90 PolarHBondContact O-N 2.96Å; G90-H95 WeakPolarHBondContact CA-ND1 3.16Å; G90-H95 WeakPolarHBondContact O-CB 3.29Å
91	K	75	Confident	84.3	Confident	202 Å²	202	87 Å²	87	88%	0.878	42%	0.423	S	S	*	.			trans	-86.8	-16.5	-179.7	-67	-174.2	179.3	-177.7	0	114.5
92	M	82.4	Confident	84.7	Confident	123 Å²	123	86 Å²	86	61%	0.606	40%	0.398	S	S	*	.	S	Bend	trans	-70.5	150.4	-177.9	-60.6	-178.4	66.1	0	0	112.1	F94 H95 K96	M92-F94 VanDerWaalsContact C-N 3.27Å; M92-F94 HydrophobicContact CB-CD1 3.73Å; M92-F94 HydrophobicContact CB-CE1 3.69Å; M92-F94 HydrophobicContact CE-CD1 4.26Å; M92-F94 HydrophobicContact CE-CE1 3.94Å; M92-F94 HydrophobicContact CG-CE1 4.27Å; M92-F94 PolarHBondContact O-N 3.1Å; M92-F94 VanDerWaalsContact O-N 3.16Å; M92-F94 HydrophobicContact SD-CD1 4.44Å; M92-F94 HydrophobicContact SD-CE1 3.69Å; M92-H95 WeakPolarHBondContact O-CB 3.36Å; M92-H95 PolarHBondContact O-N 3.19Å; M92-K96 PolarHBondContact O-N 3.3Å
93	R	85.9	Confident	85	Confident	105 Å²	105	81.8 Å²	81.8	40%	0.396	38%	0.379	S	S	.	.	H	α-helix	trans	-50	-42.1	-177.2	-173.8	178.3	178.9	-94.1	4.6	113.2	H95 K96 I97 E120 V123 D124	R93-H95 VanDerWaalsContact C-N 3.32Å; R93-H95 PolarHBondContact O-N 3.22Å; R93-K96 WeakPolarHBondContact O-CB 3.23Å; R93-K96 PolarHBondContact O-N 2.86Å; R93-K96 VanDerWaalsContact O-N 3.13Å; R93-I97 HydrophobicContact CG-CD1 4.02Å; R93-I97 VanDerWaalsContact NH1-CD1 3.32Å; R93-I97 WeakPolarHBondContact O-CG1 3.13Å; R93-I97 PolarHBondContact O-N 3.25Å; R93-E120 IonicContact CZ-OE2 3.5Å; R93-E120 VanDerWaalsContact CZ-OE2 3.3Å; R93-E120 IonicContact NH1-OE1 2.95Å; R93-E120 IonicContact NH1-OE2 3.67Å; R93-E120 PolarHBondContact NH1-OE2 2.94Å; R93-E120 IonicContact NH2-OE2 3.59Å; R93-E120 PolarHBondContact NH2-OE2 2.99Å; R93-V123 HydrophobicContact CG-CG1 3.98Å; R93-D124 IonicContact CZ-OD1 3.71Å; R93-D124 IonicContact CZ-OD2 2.67Å; R93-D124 IonicContact NE-OD1 2.7Å; R93-D124 PolarHBondContact NE-OD1 3.02Å; R93-D124 IonicContact NH2-OD1 3.7Å; R93-D124 PolarHBondContact NH2-OD1 3.22Å; R93-D124 IonicContact NH2-OD2 2.97Å; R93-D124 PolarHBondContact NH2-OD2 3.3Å
94	F	85.1	Confident	85.3	Confident	117 Å²	117	72.2 Å²	72.2	51%	0.513	34%	0.343	S	S	.	.	H	α-helix	trans	-64.9	-31	-179.2	79.7	-93.7	0	0	0	113.9	M92 I97 A98	M92-F94 VanDerWaalsContact C-N 3.27Å; M92-F94 HydrophobicContact CB-CD1 3.73Å; M92-F94 HydrophobicContact CB-CE1 3.69Å; M92-F94 HydrophobicContact CE-CD1 4.26Å; M92-F94 HydrophobicContact CE-CE1 3.94Å; M92-F94 HydrophobicContact CG-CE1 4.27Å; M92-F94 PolarHBondContact O-N 3.1Å; M92-F94 VanDerWaalsContact O-N 3.16Å; M92-F94 HydrophobicContact SD-CD1 4.44Å; M92-F94 HydrophobicContact SD-CE1 3.69Å; F94-I97 PolarHBondContact O-N 2.71Å; F94-A98 WeakPolarHBondContact O-CB 3.39Å; F94-A98 PolarHBondContact O-N 2.64Å
95	H	86.3	Confident	85.4	Confident	46 Å²	46	76.6 Å²	76.6	21%	0.213	37%	0.367	C	S	.	.	H	α-helix	trans	-68.5	-36.9	174.4	-60.7	111.4	0	0	0	111.5	G90 M92 R93 A98 N99	G90-H95 WeakPolarHBondContact CA-ND1 3.16Å; G90-H95 WeakPolarHBondContact O-CB 3.29Å; M92-H95 WeakPolarHBondContact O-CB 3.36Å; M92-H95 PolarHBondContact O-N 3.19Å; R93-H95 VanDerWaalsContact C-N 3.32Å; R93-H95 PolarHBondContact O-N 3.22Å; H95-A98 PolarHBondContact O-N 3.1Å; H95-N99 PolarHBondContact O-N 2.83Å; H95-N99 PolarHBondContact O-ND2 3.12Å
96	K	89.4	Confident	85.6	Confident	68 Å²	68	73.9 Å²	73.9	30%	0.296	35%	0.347	S	S	.	.	H	α-helix	trans	-64.7	-44.1	175	-60.3	-174.3	179.6	-175.9	0	110.8	R67 N68 M92 R93 A98 N99 V100 V123	R67-K96 WeakPolarHBondContact O-CB 3.34Å; N68-K96 HydrophobicContact CB-CD 4.41Å; N68-K96 HydrophobicContact CB-CG 4.34Å; M92-K96 PolarHBondContact O-N 3.3Å; R93-K96 WeakPolarHBondContact O-CB 3.23Å; R93-K96 PolarHBondContact O-N 2.86Å; R93-K96 VanDerWaalsContact O-N 3.13Å; K96-A98 VanDerWaalsContact C-N 3.35Å; K96-A98 PolarHBondContact O-N 2.76Å; K96-N99 PolarHBondContact O-N 2.72Å; K96-V100 WeakPolarHBondContact O-CG2 3.27Å; K96-V100 PolarHBondContact O-N 3.14Å; K96-V123 HydrophobicContact CB-CG1 3.87Å; K96-V123 HydrophobicContact CB-CG2 3.97Å; K96-V123 HydrophobicContact CD-CG1 4.26Å
97	I	87.9	Confident	85.8	Confident	22 Å²	22	64.9 Å²	64.9	11%	0.113	31%	0.308	C	S	.	.	H	α-helix	trans	-61.1	-43.9	175.7	-66.5	170	0	0	0	110.7	R93 F94 N99 V100 N101 A119 V123	R93-I97 HydrophobicContact CG-CD1 4.02Å; R93-I97 VanDerWaalsContact NH1-CD1 3.32Å; R93-I97 WeakPolarHBondContact O-CG1 3.13Å; R93-I97 PolarHBondContact O-N 3.25Å; F94-I97 PolarHBondContact O-N 2.71Å; I97-N99 PolarHBondContact O-N 3.44Å; I97-V100 PolarHBondContact O-N 2.83Å; I97-N101 WeakPolarHBondContact CG2-ND2 3.3Å; I97-N101 WeakPolarHBondContact O-CB 3.21Å; I97-N101 PolarHBondContact O-N 2.68Å; I97-N101 PolarHBondContact O-ND2 2.79Å; I97-A119 HydrophobicContact CG2-CB 4.18Å; I97-V123 HydrophobicContact CB-CG2 4.44Å; I97-V123 HydrophobicContact CG1-CB 4.07Å; I97-V123 HydrophobicContact CG1-CG1 4.13Å; I97-V123 HydrophobicContact CG1-CG2 3.75Å
98	A	88.4	Confident	85.8	Confident	29 Å²	29	65.8 Å²	65.8	24%	0.24	31%	0.312	C	S	.	.	H	α-helix	trans	-60.5	-42.4	176.9	0	0	0	0	0	112.8	D88 F94 H95 K96 N101 K102	D88-A98 WeakPolarHBondContact OD2-CB 3.36Å; F94-A98 WeakPolarHBondContact O-CB 3.39Å; F94-A98 PolarHBondContact O-N 2.64Å; H95-A98 PolarHBondContact O-N 3.1Å; K96-A98 VanDerWaalsContact C-N 3.35Å; K96-A98 PolarHBondContact O-N 2.76Å; A98-N101 PolarHBondContact O-N 3.42Å; A98-K102 WeakPolarHBondContact O-CG 3.47Å; A98-K102 PolarHBondContact O-N 3.4Å
99	N	90.3	Very high	85.8	Confident	4 Å²	4	67 Å²	67	2%	0.021	33%	0.326	C	S	.	.	H	α-helix	trans	-67.4	-41.5	176.5	-69.2	-25.5	0	0	0	112.6	N68 M73 P87 D88 H95 K96 I97 K102 A103	N68-N99 PolarHBondContact O-ND2 3.42Å; M73-N99 HydrophobicContact SD-CB 4.06Å; P87-N99 WeakPolarHBondContact CA-OD1 3.26Å; D88-N99 PolarHBondContact N-OD1 2.83Å; D88-N99 PolarHBondContact O-ND2 2.9Å; H95-N99 PolarHBondContact O-N 2.83Å; H95-N99 PolarHBondContact O-ND2 3.12Å; K96-N99 PolarHBondContact O-N 2.72Å; I97-N99 PolarHBondContact O-N 3.44Å; N99-K102 PolarHBondContact O-N 3.41Å; N99-A103 PolarHBondContact O-N 2.94Å
100	V	90.1	Very high	86.2	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-65.8	-41.5	175.4	174.4	0	0	0	0	110.7	K96 I97 K102 A103 L104 A119 I122 V123	K96-V100 WeakPolarHBondContact O-CG2 3.27Å; K96-V100 PolarHBondContact O-N 3.14Å; I97-V100 PolarHBondContact O-N 2.83Å; V100-K102 PolarHBondContact O-N 3.11Å; V100-A103 WeakPolarHBondContact O-CA 3.08Å; V100-A103 WeakPolarHBondContact O-CB 3.1Å; V100-A103 PolarHBondContact O-N 3.41Å; V100-L104 HydrophobicContact CG1-CD1 4.07Å; V100-L104 HydrophobicContact CG1-CG 4.09Å; V100-L104 WeakPolarHBondContact O-CG 3.02Å; V100-L104 PolarHBondContact O-N 2.99Å; V100-A119 HydrophobicContact CB-CB 4.04Å; V100-A119 HydrophobicContact CG1-CB 3.66Å; V100-I122 HydrophobicContact CG1-CB 3.95Å; V100-I122 HydrophobicContact CG1-CG1 4.19Å; V100-I122 HydrophobicContact CG1-CG2 4.16Å; V100-I122 HydrophobicContact CG2-CG2 4.26Å; V100-V123 HydrophobicContact CB-CG2 4.31Å; V100-V123 HydrophobicContact CG2-CG2 3.81Å
101	N	90.5	Very high	86.4	Confident	66 Å²	66	59.5 Å²	59.5	35%	0.353	31%	0.309	S	S	.	.	H	α-helix	trans	-58.3	-45.5	174.5	-81.4	-34.2	0	0	0	111.8	I97 A98 A103 L104 D105 A119	I97-N101 WeakPolarHBondContact CG2-ND2 3.3Å; I97-N101 WeakPolarHBondContact O-CB 3.21Å; I97-N101 PolarHBondContact O-N 2.68Å; I97-N101 PolarHBondContact O-ND2 2.79Å; A98-N101 PolarHBondContact O-N 3.42Å; N101-A103 PolarHBondContact O-N 2.92Å; N101-L104 PolarHBondContact O-N 3.45Å; N101-L104 VanDerWaalsContact O-N 3.11Å; N101-D105 WeakPolarHBondContact O-CB 3Å; N101-D105 PolarHBondContact O-N 3.18Å; N101-A119 WeakPolarHBondContact OD1-CB 3.5Å
102	K	90.3	Very high	86.7	Confident	50 Å²	50	50.5 Å²	50.5	22%	0.217	27%	0.271	C	S	.	.	H	α-helix	trans	-55.8	-37.8	174.4	-72.3	168.1	-179	168.1	0	112.4	M73 P85 K86 D88 A98 N99 V100 F106	M73-K102 HydrophobicContact CE-CB 3.87Å; M73-K102 HydrophobicContact CE-CD 4.1Å; M73-K102 HydrophobicContact SD-CB 4.28Å; P85-K102 HydrophobicContact CB-CD 4.45Å; K86-K102 PolarHBondContact O-NZ 3.49Å; D88-K102 IonicContact OD1-NZ 2.67Å; D88-K102 PolarHBondContact OD1-NZ 3.16Å; D88-K102 IonicContact OD2-NZ 2.88Å; D88-K102 PolarHBondContact OD2-NZ 3.47Å; A98-K102 WeakPolarHBondContact O-CG 3.47Å; A98-K102 PolarHBondContact O-N 3.4Å; N99-K102 PolarHBondContact O-N 3.41Å; V100-K102 PolarHBondContact O-N 3.11Å; K102-F106 PolarHBondContact O-N 3.32Å
103	A	89.6	Confident	86.4	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-71.4	-44.1	175.5	0	0	0	0	0	112.6	L72 M73 L76 N99 V100 N101 F106 I107	L72-A103 HydrophobicContact CD2-CB 3.67Å; L72-A103 HydrophobicContact CG-CB 3.86Å; M73-A103 HydrophobicContact CG-CB 3.9Å; L76-A103 HydrophobicContact CD1-CB 3.71Å; N99-A103 PolarHBondContact O-N 2.94Å; V100-A103 WeakPolarHBondContact O-CA 3.08Å; V100-A103 WeakPolarHBondContact O-CB 3.1Å; V100-A103 PolarHBondContact O-N 3.41Å; N101-A103 PolarHBondContact O-N 2.92Å; A103-F106 WeakPolarHBondContact O-CB 3.26Å; A103-F106 PolarHBondContact O-N 3.19Å; A103-I107 WeakPolarHBondContact O-CD1 3.33Å; A103-I107 VanDerWaalsContact O-CG1 3.29Å; A103-I107 WeakPolarHBondContact O-CG1 2.92Å; A103-I107 PolarHBondContact O-N 3.4Å
104	L	89.3	Confident	86.1	Confident	11 Å²	11	50.4 Å²	50.4	6%	0.058	27%	0.272	C	S	.	.	H	α-helix	trans	-66.2	-37.6	178.5	-64.3	-177	0	0	0	112.3	V100 N101 F106 I107 T108 L114 A119 M133	V100-L104 HydrophobicContact CG1-CD1 4.07Å; V100-L104 HydrophobicContact CG1-CG 4.09Å; V100-L104 WeakPolarHBondContact O-CG 3.02Å; V100-L104 PolarHBondContact O-N 2.99Å; N101-L104 PolarHBondContact O-N 3.45Å; N101-L104 VanDerWaalsContact O-N 3.11Å; L104-F106 VanDerWaalsContact C-N 3.34Å; L104-I107 HydrophobicContact CD2-CD1 4.27Å; L104-I107 PolarHBondContact O-N 3.34Å; L104-T108 WeakPolarHBondContact O-CB 3.26Å; L104-T108 PolarHBondContact O-N 3.36Å; L104-T108 PolarHBondContact O-OG1 3.35Å; L104-L114 HydrophobicContact CB-CD1 4.01Å; L104-L114 HydrophobicContact CD2-CD1 3.85Å; L104-L114 HydrophobicContact CG-CD1 4.39Å; L104-A119 HydrophobicContact CD1-CB 3.98Å; L104-M133 HydrophobicContact CD2-CG 4.11Å; L104-M133 HydrophobicContact CD2-SD 3.68Å
105	D	87.7	Confident	85.4	Confident	107 Å²	107	50.2 Å²	50.2	57%	0.572	28%	0.28	S	S	*	.	H	α-helix	trans	-62.2	-43.1	174.1	-70	-24.1	0	0	0	110.7	N101 T108 S109	N101-D105 WeakPolarHBondContact O-CB 3Å; N101-D105 PolarHBondContact O-N 3.18Å; D105-T108 PolarHBondContact O-N 3.37Å; D105-S109 WeakPolarHBondContact O-CB 3.46Å; D105-S109 PolarHBondContact O-N 3.25Å
106	F	88.6	Confident	84.8	Confident	22 Å²	22	53 Å²	53	10%	0.096	30%	0.304	C	S	.	.	H	α-helix	trans	-62.4	-46.1	174.9	-176.7	-97	0	0	0	111.7	L76 S80 E82 L84 K102 A103 L104 T108 S109 K110 F141	L76-F106 HydrophobicContact CB-CD1 3.99Å; L76-F106 HydrophobicContact CB-CE1 4.09Å; L76-F106 HydrophobicContact CD1-CD1 4.03Å; L76-F106 HydrophobicContact CD2-CD1 4.33Å; L76-F106 HydrophobicContact CG-CD1 4.34Å; S80-F106 WeakPolarHBondContact OG-CZ 3.24Å; E82-F106 HydrophobicContact CB-CE2 4.38Å; E82-F106 HydrophobicContact CB-CZ 4.26Å; L84-F106 HydrophobicContact CD1-CD1 4.02Å; L84-F106 HydrophobicContact CD1-CD2 3.92Å; L84-F106 HydrophobicContact CD1-CE1 3.99Å; L84-F106 HydrophobicContact CD1-CE2 3.9Å; L84-F106 HydrophobicContact CD1-CG 3.96Å; L84-F106 HydrophobicContact CD1-CZ 3.92Å; L84-F106 HydrophobicContact CD2-CB 3.89Å; L84-F106 HydrophobicContact CD2-CD1 4.31Å; L84-F106 HydrophobicContact CD2-CD2 4.45Å; L84-F106 HydrophobicContact CD2-CG 3.97Å; L84-F106 HydrophobicContact CG-CB 4.27Å; L84-F106 HydrophobicContact CG-CD1 4.43Å; L84-F106 HydrophobicContact CG-CD2 3.94Å; L84-F106 HydrophobicContact CG-CE2 4.38Å; L84-F106 HydrophobicContact CG-CG 3.95Å; K102-F106 PolarHBondContact O-N 3.32Å; A103-F106 WeakPolarHBondContact O-CB 3.26Å; A103-F106 PolarHBondContact O-N 3.19Å; L104-F106 VanDerWaalsContact C-N 3.34Å; F106-T108 VanDerWaalsContact C-N 3.31Å; F106-T108 PolarHBondContact O-N 3.42Å; F106-S109 PolarHBondContact O-N 3.48Å; F106-S109 PolarHBondContact O-OG 3.07Å; F106-K110 HydrophobicContact CD1-CG 4.42Å; F106-K110 HydrophobicContact CE1-CG 4.09Å; F106-K110 HydrophobicContact CZ-CD 4.46Å; F106-K110 VanDerWaalsContact CZ-CE 3.45Å; F106-K110 HydrophobicContact CZ-CG 4.22Å; F106-K110 WeakPolarHBondContact O-CG 3.44Å; F106-K110 PolarHBondContact O-N 3.04Å; F106-F141 HydrophobicContact CE1-CZ 4.36Å
107	I	87	Confident	84.5	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-58.9	-43.9	176.7	-69.5	161.9	0	0	0	111	L76 A103 L104 S109 K110 V112 L114 M133 I137	L76-I107 HydrophobicContact CD1-CD1 3.93Å; L76-I107 HydrophobicContact CD1-CG1 3.8Å; L76-I107 HydrophobicContact CD2-CD1 4.14Å; L76-I107 HydrophobicContact CD2-CG1 3.7Å; L76-I107 HydrophobicContact CG-CG1 4.41Å; A103-I107 WeakPolarHBondContact O-CD1 3.33Å; A103-I107 VanDerWaalsContact O-CG1 3.29Å; A103-I107 WeakPolarHBondContact O-CG1 2.92Å; A103-I107 PolarHBondContact O-N 3.4Å; L104-I107 HydrophobicContact CD2-CD1 4.27Å; L104-I107 PolarHBondContact O-N 3.34Å; I107-S109 PolarHBondContact O-N 3.45Å; I107-K110 PolarHBondContact O-N 3.38Å; I107-K110 VanDerWaalsContact O-N 3.15Å; I107-V112 HydrophobicContact CG2-CB 3.55Å; I107-V112 HydrophobicContact CG2-CG1 3.72Å; I107-V112 HydrophobicContact CG2-CG2 3.89Å; I107-V112 WeakPolarHBondContact O-CB 3.41Å; I107-V112 PolarHBondContact O-N 2.82Å; I107-L114 HydrophobicContact CG2-CD1 4.29Å; I107-L114 HydrophobicContact CG2-CD2 4.18Å; I107-L114 HydrophobicContact CG2-CG 4.37Å; I107-M133 HydrophobicContact CD1-CG 4.47Å; I107-I137 HydrophobicContact CD1-CD1 3.58Å; I107-I137 HydrophobicContact CD1-CG1 3.75Å; I107-I137 HydrophobicContact CG1-CD1 4.34Å; I107-I137 HydrophobicContact CG1-CG1 4.1Å
108	T	86	Confident	84.2	Confident	75 Å²	75	51.5 Å²	51.5	46%	0.46	31%	0.306	S	S	.	.	H	α-helix	trans	-64.2	-40.3	177.8	-52.9	0	0	0	0	111.3	L104 D105 F106 K110 G111	L104-T108 WeakPolarHBondContact O-CB 3.26Å; L104-T108 PolarHBondContact O-N 3.36Å; L104-T108 PolarHBondContact O-OG1 3.35Å; D105-T108 PolarHBondContact O-N 3.37Å; F106-T108 VanDerWaalsContact C-N 3.31Å; F106-T108 PolarHBondContact O-N 3.42Å; T108-K110 PolarHBondContact O-N 2.95Å; T108-G111 PolarHBondContact O-N 3.05Å; T108-G111 VanDerWaalsContact O-N 3.1Å
109	S	85.4	Confident	84.1	Confident	86 Å²	86	50.4 Å²	50.4	60%	0.601	30%	0.297	S	S	*	.	H	α-helix	trans	-62.6	-23.8	175.9	80.5	0	0	0	0	113.5	D105 F106 I107 G111	D105-S109 WeakPolarHBondContact O-CB 3.46Å; D105-S109 PolarHBondContact O-N 3.25Å; F106-S109 PolarHBondContact O-N 3.48Å; F106-S109 PolarHBondContact O-OG 3.07Å; I107-S109 PolarHBondContact O-N 3.45Å; S109-G111 VanDerWaalsContact C-N 3.27Å; S109-G111 PolarHBondContact O-N 3.08Å
110	K	82.1	Confident	83.9	Confident	58 Å²	58	54.9 Å²	54.9	25%	0.252	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	14.1	178.4	-63	-70.3	-178.6	-172.2	0	113.3	E82 F106 I107 T108 F141	E82-K110 IonicContact OE1-NZ 3.18Å; E82-K110 PolarHBondContact OE1-NZ 3.02Å; E82-K110 VanDerWaalsContact OE2-CE 3.26Å; E82-K110 WeakPolarHBondContact OE2-CE 3.47Å; E82-K110 IonicContact OE2-NZ 3.73Å; E82-K110 PolarHBondContact OE2-NZ 2.84Å; F106-K110 HydrophobicContact CD1-CG 4.42Å; F106-K110 HydrophobicContact CE1-CG 4.09Å; F106-K110 HydrophobicContact CZ-CD 4.46Å; F106-K110 VanDerWaalsContact CZ-CE 3.45Å; F106-K110 HydrophobicContact CZ-CG 4.22Å; F106-K110 WeakPolarHBondContact O-CG 3.44Å; F106-K110 PolarHBondContact O-N 3.04Å; I107-K110 PolarHBondContact O-N 3.38Å; I107-K110 VanDerWaalsContact O-N 3.15Å; T108-K110 PolarHBondContact O-N 2.95Å; K110-F141 HydrophobicContact CB-CZ 3.84Å; K110-F141 HydrophobicContact CG-CE1 4.41Å; K110-F141 HydrophobicContact CG-CZ 3.86Å
111	G	78.2	Confident	83.8	Confident	59 Å²	59	58.4 Å²	58.4	61%	0.608	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.7	12.9	170.9	0	0	0	0	0	114.9	T108 S109	T108-G111 PolarHBondContact O-N 3.05Å; T108-G111 VanDerWaalsContact O-N 3.1Å; S109-G111 VanDerWaalsContact C-N 3.27Å; S109-G111 PolarHBondContact O-N 3.08Å
112	V	81	Confident	83.7	Confident	12 Å²	12	55.3 Å²	55.3	7%	0.073	32%	0.318	C	S	.	.			trans	-88.7	126	179	-180	0	0	0	0	110.6	I107 L114 T136 R140	I107-V112 HydrophobicContact CG2-CB 3.55Å; I107-V112 HydrophobicContact CG2-CG1 3.72Å; I107-V112 HydrophobicContact CG2-CG2 3.89Å; I107-V112 WeakPolarHBondContact O-CB 3.41Å; I107-V112 PolarHBondContact O-N 2.82Å; V112-L114 HydrophobicContact CG1-CD2 4.16Å; V112-L114 HydrophobicContact CG1-CG 4.5Å; V112-L114 PolarHBondContact O-N 3.38Å; V112-T136 HydrophobicContact CG1-CG2 4.36Å; V112-R140 HydrophobicContact CG2-CB 3.67Å; V112-R140 HydrophobicContact CG2-CG 3.88Å
113	K	76.3	Confident	83.6	Confident	189 Å²	189	53.1 Å²	53.1	82%	0.822	31%	0.309	S	S	*	.			trans	-86.3	105.1	173.2	-68.5	-177.5	-179.1	177.4	0	110.4	V115	K113-V115 PolarHBondContact O-N 3.05Å
114	L	78.4	Confident	83.4	Confident	38 Å²	38	57 Å²	57	20%	0.199	33%	0.33	C	S	.	.			trans	-84.4	99.9	174.4	-62.9	171.6	0	0	0	109.7	L104 I107 V112 I117	L104-L114 HydrophobicContact CB-CD1 4.01Å; L104-L114 HydrophobicContact CD2-CD1 3.85Å; L104-L114 HydrophobicContact CG-CD1 4.39Å; I107-L114 HydrophobicContact CG2-CD1 4.29Å; I107-L114 HydrophobicContact CG2-CD2 4.18Å; I107-L114 HydrophobicContact CG2-CG 4.37Å; V112-L114 HydrophobicContact CG1-CD2 4.16Å; V112-L114 HydrophobicContact CG1-CG 4.5Å; V112-L114 PolarHBondContact O-N 3.38Å; L114-I117 HydrophobicContact CD2-CD1 4.45Å
115	V	70.6	Confident	83.1	Confident	113 Å²	113	57.5 Å²	57.5	69%	0.685	34%	0.337	S	S	*	.			trans	-97.7	125.3	177.6	-176.8	0	0	0	0	109.4	K113 I117	K113-V115 PolarHBondContact O-N 3.05Å; V115-I117 PolarHBondContact O-N 3.31Å; V115-I117 VanDerWaalsContact O-N 3.1Å
116	S	74.4	Confident	83.1	Confident	103 Å²	103	55 Å²	55	72%	0.72	32%	0.323	S	S	*	.	S	Bend	trans	61.1	9.1	179.3	-54.6	0	0	0	0	117	M129	S116-M129 WeakPolarHBondContact O-CE 3.36Å
117	I	81.4	Confident	82.9	Confident	30 Å²	30	55.3 Å²	55.3	15%	0.154	33%	0.327	C	S	.	.			trans	-99.8	129.3	172.7	-62.1	170.3	0	0	0	109	L114 V115 I122 M129 M133	L114-I117 HydrophobicContact CD2-CD1 4.45Å; V115-I117 PolarHBondContact O-N 3.31Å; V115-I117 VanDerWaalsContact O-N 3.1Å; I117-I122 HydrophobicContact CG2-CD1 4.3Å; I117-M129 HydrophobicContact CG1-SD 3.93Å; I117-M133 HydrophobicContact CD1-CB 4.28Å; I117-M133 HydrophobicContact CG2-CB 4.42Å
118	G	82.7	Confident	82.8	Confident	29 Å²	29	59.9 Å²	59.9	30%	0.299	35%	0.347	S	S	.	.			trans	-130	159.7	174.3	0	0	0	0	0	112.4	E120 E121	G118-E120 PolarHBondContact O-N 3.49Å; G118-E121 WeakPolarHBondContact O-CB 3.01Å; G118-E121 PolarHBondContact O-N 3.09Å; G118-E121 VanDerWaalsContact O-N 3.16Å
119	A	86.1	Confident	82.8	Confident	6 Å²	6	58.9 Å²	58.9	5%	0.05	34%	0.338	C	S	.	.	H	α-helix	trans	-62.4	-30.1	-179	0	0	0	0	0	113.7	I97 V100 N101 L104 E121 I122 V123	I97-A119 HydrophobicContact CG2-CB 4.18Å; V100-A119 HydrophobicContact CB-CB 4.04Å; V100-A119 HydrophobicContact CG1-CB 3.66Å; N101-A119 WeakPolarHBondContact OD1-CB 3.5Å; L104-A119 HydrophobicContact CD1-CB 3.98Å; A119-E121 VanDerWaalsContact C-N 3.33Å; A119-E121 PolarHBondContact O-N 3.19Å; A119-I122 PolarHBondContact O-N 3.03Å; A119-V123 VanDerWaalsContact O-CG2 3.29Å; A119-V123 WeakPolarHBondContact O-CG2 3.39Å; A119-V123 PolarHBondContact O-N 3.31Å; A119-V123 VanDerWaalsContact O-N 3.08Å
120	E	86.9	Confident	82.9	Confident	98 Å²	98	54.9 Å²	54.9	46%	0.458	31%	0.31	S	S	.	.	H	α-helix	trans	-58.7	-44.5	174.9	-60.3	-102.4	156.6	0	0	110.9	R93 G118 I122 V123 D124	R93-E120 IonicContact CZ-OE2 3.5Å; R93-E120 VanDerWaalsContact CZ-OE2 3.3Å; R93-E120 IonicContact NH1-OE1 2.95Å; R93-E120 IonicContact NH1-OE2 3.67Å; R93-E120 PolarHBondContact NH1-OE2 2.94Å; R93-E120 IonicContact NH2-OE2 3.59Å; R93-E120 PolarHBondContact NH2-OE2 2.99Å; G118-E120 PolarHBondContact O-N 3.49Å; E120-I122 VanDerWaalsContact C-N 3.35Å; E120-I122 PolarHBondContact O-N 3.07Å; E120-V123 PolarHBondContact O-N 2.82Å; E120-D124 WeakPolarHBondContact O-CB 3.34Å; E120-D124 VanDerWaalsContact O-CG 3.31Å; E120-D124 PolarHBondContact O-N 2.84Å
121	E	86.9	Confident	83	Confident	75 Å²	75	52.2 Å²	52.2	35%	0.35	30%	0.299	S	S	.	.	H	α-helix	trans	-62.6	-39.4	-178.5	-62.1	-62.7	145.3	0	0	112.6	G118 A119 G125 N126 M129	G118-E121 WeakPolarHBondContact O-CB 3.01Å; G118-E121 PolarHBondContact O-N 3.09Å; G118-E121 VanDerWaalsContact O-N 3.16Å; A119-E121 VanDerWaalsContact C-N 3.33Å; A119-E121 PolarHBondContact O-N 3.19Å; E121-G125 PolarHBondContact O-N 2.89Å; E121-N126 HydrophobicContact CB-CB 4.21Å; E121-N126 WeakPolarHBondContact O-CB 3.37Å; E121-N126 PolarHBondContact O-N 3.47Å; E121-N126 PolarHBondContact OE2-ND2 2.96Å; E121-M129 HydrophobicContact CB-CB 3.95Å; E121-M129 HydrophobicContact CB-CG 4Å; E121-M129 HydrophobicContact CG-CG 4.21Å
122	I	87.8	Confident	83.4	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-72.7	-40	178.7	-52.2	-59.2	0	0	0	110.6	R67 V100 I117 A119 E120 D124 G125 M129 M133	R67-I122 WeakPolarHBondContact CG-O 3.37Å; V100-I122 HydrophobicContact CG1-CB 3.95Å; V100-I122 HydrophobicContact CG1-CG1 4.19Å; V100-I122 HydrophobicContact CG1-CG2 4.16Å; V100-I122 HydrophobicContact CG2-CG2 4.26Å; I117-I122 HydrophobicContact CG2-CD1 4.3Å; A119-I122 PolarHBondContact O-N 3.03Å; E120-I122 VanDerWaalsContact C-N 3.35Å; E120-I122 PolarHBondContact O-N 3.07Å; I122-D124 VanDerWaalsContact C-N 3.35Å; I122-G125 PolarHBondContact O-N 2.86Å; I122-M129 HydrophobicContact CD1-CB 4.37Å; I122-M133 HydrophobicContact CD1-CB 4.27Å; I122-M133 HydrophobicContact CD1-CE 4.34Å; I122-M133 HydrophobicContact CD1-SD 3.96Å; I122-M133 HydrophobicContact CG1-SD 4.08Å; I122-M133 HydrophobicContact CG2-CE 4.5Å
123	V	88.3	Confident	83.7	Confident	4 Å²	4	49.6 Å²	49.6	2%	0.024	27%	0.274	C	S	.	.	H	α-helix	trans	-70.9	-33	178.6	175.1	0	0	0	0	111.6	R67 R93 K96 I97 V100 A119 E120 G125	R67-V123 VanDerWaalsContact CZ-O 3.27Å; R67-V123 PolarHBondContact NE-O 3.46Å; R67-V123 PolarHBondContact NH2-O 3.2Å; R93-V123 HydrophobicContact CG-CG1 3.98Å; K96-V123 HydrophobicContact CB-CG1 3.87Å; K96-V123 HydrophobicContact CB-CG2 3.97Å; K96-V123 HydrophobicContact CD-CG1 4.26Å; I97-V123 HydrophobicContact CB-CG2 4.44Å; I97-V123 HydrophobicContact CG1-CB 4.07Å; I97-V123 HydrophobicContact CG1-CG1 4.13Å; I97-V123 HydrophobicContact CG1-CG2 3.75Å; V100-V123 HydrophobicContact CB-CG2 4.31Å; V100-V123 HydrophobicContact CG2-CG2 3.81Å; A119-V123 VanDerWaalsContact O-CG2 3.29Å; A119-V123 WeakPolarHBondContact O-CG2 3.39Å; A119-V123 PolarHBondContact O-N 3.31Å; A119-V123 VanDerWaalsContact O-N 3.08Å; E120-V123 PolarHBondContact O-N 2.82Å; V123-G125 VanDerWaalsContact C-N 3.3Å
124	D	86	Confident	84.4	Confident	83 Å²	83	40.6 Å²	40.6	44%	0.444	24%	0.235	S	C	.	.	H	α-helix	trans	-81.2	-12	178.7	-68.4	-15.7	0	0	0	112.9	R67 R93 E120 I122	R67-D124 PolarHBondContact NH2-O 3.36Å; R93-D124 IonicContact CZ-OD1 3.71Å; R93-D124 IonicContact CZ-OD2 2.67Å; R93-D124 IonicContact NE-OD1 2.7Å; R93-D124 PolarHBondContact NE-OD1 3.02Å; R93-D124 IonicContact NH2-OD1 3.7Å; R93-D124 PolarHBondContact NH2-OD1 3.22Å; R93-D124 IonicContact NH2-OD2 2.97Å; R93-D124 PolarHBondContact NH2-OD2 3.3Å; E120-D124 WeakPolarHBondContact O-CB 3.34Å; E120-D124 VanDerWaalsContact O-CG 3.31Å; E120-D124 PolarHBondContact O-N 2.84Å; I122-D124 VanDerWaalsContact C-N 3.35Å
125	G	83.8	Confident	84.9	Confident	20 Å²	20	40 Å²	40	21%	0.206	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.3	32.3	172	0	0	0	0	0	113.4	E121 I122 V123 V127	E121-G125 PolarHBondContact O-N 2.89Å; I122-G125 PolarHBondContact O-N 2.86Å; V123-G125 VanDerWaalsContact C-N 3.3Å; G125-V127 PolarHBondContact O-N 2.78Å; G125-V127 VanDerWaalsContact O-N 3.11Å
126	N	87.5	Confident	85.6	Confident	54 Å²	54	36 Å²	36	29%	0.289	21%	0.206	S	C	.	.			trans	-69.5	106.9	173.8	-173.5	-28.1	0	0	0	109.9	E121 K128 M129 T130	E121-N126 HydrophobicContact CB-CB 4.21Å; E121-N126 WeakPolarHBondContact O-CB 3.37Å; E121-N126 PolarHBondContact O-N 3.47Å; E121-N126 PolarHBondContact OE2-ND2 2.96Å; N126-K128 PolarHBondContact O-N 2.77Å; N126-K128 PolarHBondContact OD1-N 3.03Å; N126-M129 HydrophobicContact CB-CB 4.11Å; N126-M129 HydrophobicContact CB-CG 4.17Å; N126-M129 WeakPolarHBondContact ND2-CG 3.45Å; N126-M129 PolarHBondContact O-N 3.04Å; N126-M129 PolarHBondContact OD1-N 3.2Å; N126-T130 WeakPolarHBondContact O-CB 3.41Å; N126-T130 PolarHBondContact O-N 3.43Å; N126-T130 PolarHBondContact O-OG1 2.85Å
127	V	84.3	Confident	86.2	Confident	30 Å²	30	31.1 Å²	31.1	18%	0.182	17%	0.172	C	C	.	.	H	α-helix	trans	-57.6	-46.9	-174.7	-175	0	0	0	0	111.7	E63 G125 M129 T130 L131	E63-V127 HydrophobicContact CB-CG2 4.49Å; E63-V127 HydrophobicContact CG-CB 4.26Å; E63-V127 HydrophobicContact CG-CG1 3.98Å; E63-V127 HydrophobicContact CG-CG2 3.71Å; E63-V127 WeakPolarHBondContact OE1-CG1 3.29Å; E63-V127 VanDerWaalsContact OE1-CG2 3.27Å; E63-V127 WeakPolarHBondContact OE1-CG2 3.28Å; G125-V127 PolarHBondContact O-N 2.78Å; G125-V127 VanDerWaalsContact O-N 3.11Å; V127-M129 PolarHBondContact O-N 2.79Å; V127-T130 PolarHBondContact O-N 3.36Å; V127-L131 HydrophobicContact CG1-CD1 3.95Å; V127-L131 HydrophobicContact CG1-CG 4.36Å; V127-L131 WeakPolarHBondContact O-CG 3.44Å; V127-L131 PolarHBondContact O-N 2.78Å
128	K	84.3	Confident	86.5	Confident	96 Å²	96	29.7 Å²	29.7	42%	0.417	16%	0.164	S	C	.	.	H	α-helix	trans	-63.3	-41.9	-178.4	-71.1	-177.8	172.5	-179.7	0	111.9	E37 N126 G132	E37-K128 WeakPolarHBondContact OE1-CE 3.35Å; E37-K128 IonicContact OE1-NZ 3.81Å; E37-K128 PolarHBondContact OE1-NZ 2.86Å; N126-K128 PolarHBondContact O-N 2.77Å; N126-K128 PolarHBondContact OD1-N 3.03Å; K128-G132 PolarHBondContact O-N 2.88Å
129	M	86.4	Confident	86.7	Confident	53 Å²	53	31 Å²	31	26%	0.261	16%	0.164	S	C	.	.	H	α-helix	trans	-70.9	-35.6	178	-63.3	-58	-173.2	0	0	111.9	S116 I117 E121 I122 N126 V127 G132 M133	S116-M129 WeakPolarHBondContact O-CE 3.36Å; I117-M129 HydrophobicContact CG1-SD 3.93Å; E121-M129 HydrophobicContact CB-CB 3.95Å; E121-M129 HydrophobicContact CB-CG 4Å; E121-M129 HydrophobicContact CG-CG 4.21Å; I122-M129 HydrophobicContact CD1-CB 4.37Å; N126-M129 HydrophobicContact CB-CB 4.11Å; N126-M129 HydrophobicContact CB-CG 4.17Å; N126-M129 WeakPolarHBondContact ND2-CG 3.45Å; N126-M129 PolarHBondContact O-N 3.04Å; N126-M129 PolarHBondContact OD1-N 3.2Å; V127-M129 PolarHBondContact O-N 2.79Å; M129-G132 PolarHBondContact O-N 2.72Å; M129-M133 WeakPolarHBondContact O-CB 3.47Å; M129-M133 PolarHBondContact O-N 2.69Å
130	T	86.4	Confident	86.6	Confident	2 Å²	2	33.1 Å²	33.1	1%	0.012	17%	0.171	C	C	.	.	H	α-helix	trans	-67.1	-46.4	176.7	-54.3	0	0	0	0	111.4	F66 N126 V127 M133 I134	F66-T130 HydrophobicContact CD2-CG2 4.31Å; N126-T130 WeakPolarHBondContact O-CB 3.41Å; N126-T130 PolarHBondContact O-N 3.43Å; N126-T130 PolarHBondContact O-OG1 2.85Å; V127-T130 PolarHBondContact O-N 3.36Å; T130-M133 PolarHBondContact O-N 3.09Å; T130-I134 WeakPolarHBondContact O-CG1 3.47Å; T130-I134 PolarHBondContact O-N 3.44Å
131	L	86.1	Confident	86.5	Confident	3 Å²	3	30.5 Å²	30.5	2%	0.016	16%	0.158	C	C	.	.	H	α-helix	trans	-64.5	-40.5	174.3	-66.2	174.5	0	0	0	111.8	Q40 R41 F44 I62 V127 M133 I134 W135	Q40-L131 HydrophobicContact CB-CD1 4.37Å; Q40-L131 HydrophobicContact CB-CD2 4.45Å; R41-L131 HydrophobicContact CG-CD1 3.95Å; R41-L131 HydrophobicContact CG-CD2 3.9Å; R41-L131 HydrophobicContact CG-CG 4.42Å; F44-L131 HydrophobicContact CD2-CB 4.45Å; F44-L131 HydrophobicContact CD2-CD2 3.82Å; F44-L131 HydrophobicContact CE2-CB 4.44Å; F44-L131 WeakPolarHBondContact CE2-O 3.32Å; I62-L131 HydrophobicContact CD1-CD2 4.22Å; I62-L131 HydrophobicContact CG2-CD2 4.43Å; V127-L131 HydrophobicContact CG1-CD1 3.95Å; V127-L131 HydrophobicContact CG1-CG 4.36Å; V127-L131 WeakPolarHBondContact O-CG 3.44Å; V127-L131 PolarHBondContact O-N 2.78Å; L131-M133 VanDerWaalsContact C-N 3.34Å; L131-M133 PolarHBondContact O-N 2.81Å; L131-I134 PolarHBondContact O-N 2.94Å; L131-W135 WeakPolarHBondContact O-CB 3.4Å; L131-W135 PolarHBondContact O-N 2.93Å
132	G	85.6	Confident	86.3	Confident	16 Å²	16	27.5 Å²	27.5	17%	0.165	15%	0.146	C	C	.	.	H	α-helix	trans	-58.9	-42.6	174.9	0	0	0	0	0	112.9	K128 M129 T136	K128-G132 PolarHBondContact O-N 2.88Å; M129-G132 PolarHBondContact O-N 2.72Å; G132-T136 WeakPolarHBondContact O-CG2 3.21Å; G132-T136 PolarHBondContact O-N 3.4Å; G132-T136 VanDerWaalsContact O-N 3.14Å
133	M	88.3	Confident	86.1	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-66.5	-45.4	175.9	179.8	-164	69	0	0	112.1	L72 L104 I107 I117 I122 M129 T130 L131 W135 T136 I137	L72-M133 HydrophobicContact CD1-CE 3.59Å; L72-M133 HydrophobicContact CD1-SD 4.33Å; L72-M133 HydrophobicContact CD2-CE 3.64Å; L72-M133 HydrophobicContact CD2-SD 3.65Å; L72-M133 HydrophobicContact CG-CE 4.25Å; L104-M133 HydrophobicContact CD2-CG 4.11Å; L104-M133 HydrophobicContact CD2-SD 3.68Å; I107-M133 HydrophobicContact CD1-CG 4.47Å; I117-M133 HydrophobicContact CD1-CB 4.28Å; I117-M133 HydrophobicContact CG2-CB 4.42Å; I122-M133 HydrophobicContact CD1-CB 4.27Å; I122-M133 HydrophobicContact CD1-CE 4.34Å; I122-M133 HydrophobicContact CD1-SD 3.96Å; I122-M133 HydrophobicContact CG1-SD 4.08Å; I122-M133 HydrophobicContact CG2-CE 4.5Å; M129-M133 WeakPolarHBondContact O-CB 3.47Å; M129-M133 PolarHBondContact O-N 2.69Å; T130-M133 PolarHBondContact O-N 3.09Å; L131-M133 VanDerWaalsContact C-N 3.34Å; L131-M133 PolarHBondContact O-N 2.81Å; M133-W135 VanDerWaalsContact C-N 3.29Å; M133-W135 PolarHBondContact O-N 3.29Å; M133-T136 PolarHBondContact O-N 2.94Å; M133-T136 PolarHBondContact O-OG1 3.45Å; M133-I137 HydrophobicContact CG-CD1 4.31Å; M133-I137 WeakPolarHBondContact O-CG1 3.41Å; M133-I137 PolarHBondContact O-N 2.66Å; M133-I137 VanDerWaalsContact O-N 3.15Å
134	I	89	Confident	85.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-65.5	-36.9	179.2	-62.9	-64.6	0	0	0	110.9	F44 I62 F66 L72 L75 T130 L131 T136 I137 I138	F44-I134 HydrophobicContact CB-CG2 3.84Å; F44-I134 HydrophobicContact CD2-CB 4.19Å; F44-I134 HydrophobicContact CD2-CG2 4.01Å; F44-I134 HydrophobicContact CG-CG2 4Å; I62-I134 HydrophobicContact CD1-CG1 4.27Å; F66-I134 HydrophobicContact CD2-CD1 4.01Å; F66-I134 HydrophobicContact CD2-CG1 4.35Å; F66-I134 HydrophobicContact CE2-CD1 3.48Å; F66-I134 VanDerWaalsContact CE2-CD1 3.48Å; F66-I134 HydrophobicContact CE2-CG1 3.99Å; F66-I134 HydrophobicContact CZ-CD1 3.98Å; L72-I134 HydrophobicContact CD1-CD1 4.12Å; L75-I134 HydrophobicContact CD2-CD1 4.45Å; T130-I134 WeakPolarHBondContact O-CG1 3.47Å; T130-I134 PolarHBondContact O-N 3.44Å; L131-I134 PolarHBondContact O-N 2.94Å; I134-T136 PolarHBondContact O-N 3.5Å; I134-I137 HydrophobicContact CD1-CD1 4.2Å; I134-I137 WeakPolarHBondContact O-CB 3.31Å; I134-I137 PolarHBondContact O-N 3.22Å; I134-I138 HydrophobicContact CG2-CD1 3.87Å; I134-I138 HydrophobicContact CG2-CG1 4.39Å; I134-I138 WeakPolarHBondContact O-CG1 3.21Å; I134-I138 PolarHBondContact O-N 3.45Å
135	W	89.1	Confident	85.1	Confident	24 Å²	24	33 Å²	33	9%	0.091	17%	0.172	C	C	.	.	H	α-helix	trans	-59.7	-45.8	172.9	171.2	-112.8	0	0	0	112.6	F44 L131 M133 I137 I138 L139 I143 R243 M246	F44-W135 HydrophobicContact CE1-CE3 4.15Å; F44-W135 HydrophobicContact CE2-CB 3.87Å; F44-W135 HydrophobicContact CZ-CB 3.88Å; F44-W135 HydrophobicContact CZ-CD2 4.41Å; F44-W135 AromaticContact CZ-CE3 3.83Å; F44-W135 HydrophobicContact CZ-CE3 3.83Å; F44-W135 HydrophobicContact CZ-CG 4.48Å; L131-W135 WeakPolarHBondContact O-CB 3.4Å; L131-W135 PolarHBondContact O-N 2.93Å; M133-W135 VanDerWaalsContact C-N 3.29Å; M133-W135 PolarHBondContact O-N 3.29Å; W135-I137 PolarHBondContact O-N 2.88Å; W135-I138 HydrophobicContact CZ3-CG2 4.47Å; W135-I138 PolarHBondContact O-N 3.18Å; W135-L139 HydrophobicContact CD2-CB 4.43Å; W135-L139 HydrophobicContact CH2-CD1 4.37Å; W135-L139 HydrophobicContact CZ2-CB 4.21Å; W135-L139 HydrophobicContact CZ2-CD1 3.99Å; W135-L139 HydrophobicContact CZ2-CD2 4.13Å; W135-L139 HydrophobicContact CZ2-CG 4.35Å; W135-L139 VanDerWaalsContact O-CB 3.23Å; W135-L139 WeakPolarHBondContact O-CB 3.42Å; W135-L139 PolarHBondContact O-N 3.36Å; W135-I143 HydrophobicContact CH2-CD1 4.38Å; W135-I143 HydrophobicContact CZ3-CD1 4.49Å; W135-R243 HydrophobicContact CD2-CB 4Å; W135-R243 VanDerWaalsContact CD2-CD 3.49Å; W135-R243 HydrophobicContact CD2-CG 3.77Å; W135-R243 HydrophobicContact CE3-CB 3.57Å; W135-R243 HydrophobicContact CE3-CG 3.86Å; W135-R243 HydrophobicContact CG-CG 4.47Å; W135-R243 HydrophobicContact CH2-CB 3.87Å; W135-R243 HydrophobicContact CH2-CG 3.78Å; W135-R243 HydrophobicContact CZ2-CB 4.3Å; W135-R243 HydrophobicContact CZ2-CG 3.71Å; W135-R243 HydrophobicContact CZ3-CB 3.5Å; W135-R243 VanDerWaalsContact CZ3-CB 3.5Å; W135-R243 HydrophobicContact CZ3-CG 3.87Å; W135-R243 WeakPolarHBondContact CZ3-O 3.44Å; W135-M246 HydrophobicContact CH2-CB 4.28Å; W135-M246 HydrophobicContact CH2-CE 4.2Å; W135-M246 HydrophobicContact CH2-SD 4.13Å
136	T	86.2	Confident	84.7	Confident	30 Å²	30	32.2 Å²	32.2	18%	0.184	16%	0.163	C	C	.	.	H	α-helix	trans	-65.4	-31.1	179.6	56.5	0	0	0	0	112.2	V112 G132 M133 I134 R140	V112-T136 HydrophobicContact CG1-CG2 4.36Å; G132-T136 WeakPolarHBondContact O-CG2 3.21Å; G132-T136 PolarHBondContact O-N 3.4Å; G132-T136 VanDerWaalsContact O-N 3.14Å; M133-T136 PolarHBondContact O-N 2.94Å; M133-T136 PolarHBondContact O-OG1 3.45Å; I134-T136 PolarHBondContact O-N 3.5Å; T136-R140 WeakPolarHBondContact O-CB 3.42Å; T136-R140 PolarHBondContact O-N 3.27Å
137	I	87.2	Confident	83.7	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-66.2	-49.5	171.6	-64.3	167.9	0	0	0	110.8	W47 L72 L76 I79 I107 M133 I134 W135 R140 F141	W47-I137 HydrophobicContact CH2-CG2 4.11Å; W47-I137 HydrophobicContact CZ3-CG2 4.35Å; L72-I137 HydrophobicContact CD1-CD1 3.9Å; L76-I137 HydrophobicContact CD2-CD1 4.08Å; L76-I137 HydrophobicContact CD2-CG1 4.29Å; L76-I137 HydrophobicContact CD2-CG2 4.2Å; I79-I137 HydrophobicContact CD1-CG2 3.35Å; I107-I137 HydrophobicContact CD1-CD1 3.58Å; I107-I137 HydrophobicContact CD1-CG1 3.75Å; I107-I137 HydrophobicContact CG1-CD1 4.34Å; I107-I137 HydrophobicContact CG1-CG1 4.1Å; M133-I137 HydrophobicContact CG-CD1 4.31Å; M133-I137 WeakPolarHBondContact O-CG1 3.41Å; M133-I137 PolarHBondContact O-N 2.66Å; M133-I137 VanDerWaalsContact O-N 3.15Å; I134-I137 HydrophobicContact CD1-CD1 4.2Å; I134-I137 WeakPolarHBondContact O-CB 3.31Å; I134-I137 PolarHBondContact O-N 3.22Å; W135-I137 PolarHBondContact O-N 2.88Å; I137-R140 PolarHBondContact O-N 3.1Å; I137-F141 HydrophobicContact CG2-CD2 3.91Å; I137-F141 HydrophobicContact CG2-CE2 4.42Å; I137-F141 WeakPolarHBondContact O-CD2 3.46Å; I137-F141 PolarHBondContact O-N 3.3Å
138	I	88	Confident	82.8	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.4	-50.9	178	-67.6	164.5	0	0	0	110.5	F44 W47 I134 W135 R140 F141 A142 I143 T247	F44-I138 HydrophobicContact CD1-CD1 3.46Å; F44-I138 VanDerWaalsContact CD1-CD1 3.46Å; F44-I138 HydrophobicContact CE1-CD1 3.71Å; F44-I138 HydrophobicContact CG-CD1 3.99Å; F44-I138 HydrophobicContact CZ-CD1 4.42Å; W47-I138 HydrophobicContact CD2-CD1 3.9Å; W47-I138 HydrophobicContact CD2-CG1 3.57Å; W47-I138 HydrophobicContact CE3-CD1 3.78Å; W47-I138 HydrophobicContact CE3-CG1 3.44Å; W47-I138 VanDerWaalsContact CE3-CG1 3.44Å; W47-I138 HydrophobicContact CG-CD1 4.23Å; W47-I138 HydrophobicContact CG-CG1 4.31Å; W47-I138 HydrophobicContact CH2-CG1 3.72Å; W47-I138 HydrophobicContact CZ2-CG1 3.84Å; W47-I138 HydrophobicContact CZ3-CD1 4.29Å; W47-I138 HydrophobicContact CZ3-CG1 3.51Å; I134-I138 HydrophobicContact CG2-CD1 3.87Å; I134-I138 HydrophobicContact CG2-CG1 4.39Å; I134-I138 WeakPolarHBondContact O-CG1 3.21Å; I134-I138 PolarHBondContact O-N 3.45Å; W135-I138 HydrophobicContact CZ3-CG2 4.47Å; W135-I138 PolarHBondContact O-N 3.18Å; I138-R140 VanDerWaalsContact C-N 3.27Å; I138-R140 PolarHBondContact O-N 3.47Å; I138-F141 PolarHBondContact O-N 2.96Å; I138-A142 HydrophobicContact CG2-CB 4.33Å; I138-A142 WeakPolarHBondContact O-CA 3.21Å; I138-A142 WeakPolarHBondContact O-CB 3.25Å; I138-A142 PolarHBondContact O-N 2.85Å; I138-I143 HydrophobicContact CG2-CD1 4.28Å; I138-I143 PolarHBondContact O-N 3.32Å; I138-T247 HydrophobicContact CD1-CG2 3.93Å; I138-T247 HydrophobicContact CG2-CG2 3.89Å
139	L	85.8	Confident	81.7	Confident	57 Å²	57	34.4 Å²	34.4	30%	0.298	18%	0.183	S	C	.	.	I	π-helix	trans	-56.2	-43.9	-178.5	-178.8	60.3	0	0	0	110.3	W135 I143 Q144	W135-L139 HydrophobicContact CD2-CB 4.43Å; W135-L139 HydrophobicContact CH2-CD1 4.37Å; W135-L139 HydrophobicContact CZ2-CB 4.21Å; W135-L139 HydrophobicContact CZ2-CD1 3.99Å; W135-L139 HydrophobicContact CZ2-CD2 4.13Å; W135-L139 HydrophobicContact CZ2-CG 4.35Å; W135-L139 VanDerWaalsContact O-CB 3.23Å; W135-L139 WeakPolarHBondContact O-CB 3.42Å; W135-L139 PolarHBondContact O-N 3.36Å; L139-I143 HydrophobicContact CD1-CB 4.32Å; L139-I143 HydrophobicContact CD1-CG2 4.36Å; L139-I143 PolarHBondContact O-N 3.11Å; L139-Q144 VanDerWaalsContact O-CB 3.3Å; L139-Q144 WeakPolarHBondContact O-CB 3.27Å; L139-Q144 PolarHBondContact O-N 3.49Å
140	R	85.6	Confident	80.3	Confident	51 Å²	51	41.5 Å²	41.5	19%	0.192	22%	0.215	C	C	.	.	I	π-helix	trans	-66.9	-68.4	172.6	177.2	59.9	-162.4	88.8	-17.9	112.1	V112 T136 I137 I138 A142 Q144 D145	V112-R140 HydrophobicContact CG2-CB 3.67Å; V112-R140 HydrophobicContact CG2-CG 3.88Å; T136-R140 WeakPolarHBondContact O-CB 3.42Å; T136-R140 PolarHBondContact O-N 3.27Å; I137-R140 PolarHBondContact O-N 3.1Å; I138-R140 VanDerWaalsContact C-N 3.27Å; I138-R140 PolarHBondContact O-N 3.47Å; R140-A142 PolarHBondContact O-N 3.18Å; R140-Q144 WeakPolarHBondContact O-CB 3.29Å; R140-Q144 PolarHBondContact O-N 3.27Å; R140-D145 IonicContact CZ-OD1 3.79Å; R140-D145 VanDerWaalsContact CZ-OD1 3.27Å; R140-D145 IonicContact CZ-OD2 2.7Å; R140-D145 IonicContact NH1-OD1 3.48Å; R140-D145 PolarHBondContact NH1-OD1 2.96Å; R140-D145 IonicContact NH1-OD2 2.97Å; R140-D145 PolarHBondContact NH1-OD2 3.11Å; R140-D145 IonicContact NH2-OD1 2.81Å; R140-D145 PolarHBondContact NH2-OD1 3.5Å; R140-D145 IonicContact NH2-OD2 2.87Å; R140-D145 PolarHBondContact NH2-OD2 3.07Å
141	F	83	Confident	79.6	Confident	43 Å²	43	43.8 Å²	43.8	19%	0.189	23%	0.229	C	C	.	.	I	π-helix	trans	-78.3	-18	-161.3	-71.5	-84.9	0	0	0	114.5	L76 I79 F106 K110 I137 I138	L76-F141 HydrophobicContact CD2-CE2 4.39Å; I79-F141 HydrophobicContact CD1-CB 4.06Å; I79-F141 HydrophobicContact CD1-CD1 4.36Å; I79-F141 HydrophobicContact CD1-CD2 3.68Å; I79-F141 HydrophobicContact CD1-CE2 4.15Å; I79-F141 HydrophobicContact CD1-CG 3.78Å; I79-F141 HydrophobicContact CG1-CB 4.46Å; I79-F141 HydrophobicContact CG1-CD1 4.25Å; I79-F141 HydrophobicContact CG1-CD2 4.41Å; I79-F141 HydrophobicContact CG1-CG 4.14Å; F106-F141 HydrophobicContact CE1-CZ 4.36Å; K110-F141 HydrophobicContact CB-CZ 3.84Å; K110-F141 HydrophobicContact CG-CE1 4.41Å; K110-F141 HydrophobicContact CG-CZ 3.86Å; I137-F141 HydrophobicContact CG2-CD2 3.91Å; I137-F141 HydrophobicContact CG2-CE2 4.42Å; I137-F141 WeakPolarHBondContact O-CD2 3.46Å; I137-F141 PolarHBondContact O-N 3.3Å; I138-F141 PolarHBondContact O-N 2.96Å
142	A	83.3	Confident	79.1	Confident	11 Å²	11	46.6 Å²	46.6	9%	0.091	25%	0.249	C	C	.	.	I	π-helix	trans	-113.6	-21.9	-179.3	0	0	0	0	0	113.5	W47 I138 R140 H254	W47-A142 HydrophobicContact CZ2-CB 4.31Å; I138-A142 HydrophobicContact CG2-CB 4.33Å; I138-A142 WeakPolarHBondContact O-CA 3.21Å; I138-A142 WeakPolarHBondContact O-CB 3.25Å; I138-A142 PolarHBondContact O-N 2.85Å; R140-A142 PolarHBondContact O-N 3.18Å; A142-H254 PolarHBondContact O-NE2 3.16Å
143	I	83.3	Confident	78.7	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.249	C	C	.	.	I	π-helix	trans	-118.8	-43.4	-172.4	-54.3	-178	0	0	0	111.5	W135 I138 L139 D145 I146 A153 L157 M246	W135-I143 HydrophobicContact CH2-CD1 4.38Å; W135-I143 HydrophobicContact CZ3-CD1 4.49Å; I138-I143 HydrophobicContact CG2-CD1 4.28Å; I138-I143 PolarHBondContact O-N 3.32Å; L139-I143 HydrophobicContact CD1-CB 4.32Å; L139-I143 HydrophobicContact CD1-CG2 4.36Å; L139-I143 PolarHBondContact O-N 3.11Å; I143-D145 PolarHBondContact O-N 2.81Å; I143-D145 VanDerWaalsContact O-N 3.12Å; I143-I146 VanDerWaalsContact O-CB 3.25Å; I143-I146 WeakPolarHBondContact O-CB 3.43Å; I143-I146 WeakPolarHBondContact O-CG1 3.48Å; I143-I146 PolarHBondContact O-N 3.5Å; I143-A153 HydrophobicContact CG2-CB 4.45Å; I143-A153 WeakPolarHBondContact O-CB 3.36Å; I143-L157 HydrophobicContact CG2-CD2 4.35Å; I143-M246 HydrophobicContact CD1-CB 4.02Å; I143-M246 HydrophobicContact CD1-CE 3.97Å; I143-M246 HydrophobicContact CG2-CE 4.15Å
144	Q	80.5	Confident	78.3	Confident	103 Å²	103	51.2 Å²	51.2	48%	0.481	27%	0.268	S	S	.	.	I	π-helix	trans	-62.9	-25.2	-169.1	-165	170.6	-16.7	0	0	114.8	L139 R140 I146 A153	L139-Q144 VanDerWaalsContact O-CB 3.3Å; L139-Q144 WeakPolarHBondContact O-CB 3.27Å; L139-Q144 PolarHBondContact O-N 3.49Å; R140-Q144 WeakPolarHBondContact O-CB 3.29Å; R140-Q144 PolarHBondContact O-N 3.27Å; Q144-I146 VanDerWaalsContact C-N 3.3Å; Q144-A153 VanDerWaalsContact CA-CB 3.44Å
145	D	73.6	Confident	78	Confident	101 Å²	101	56.5 Å²	56.5	54%	0.54	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-0	177.1	-62.6	-34.9	0	0	0	113.3	R140 I143 S147	R140-D145 IonicContact CZ-OD1 3.79Å; R140-D145 VanDerWaalsContact CZ-OD1 3.27Å; R140-D145 IonicContact CZ-OD2 2.7Å; R140-D145 IonicContact NH1-OD1 3.48Å; R140-D145 PolarHBondContact NH1-OD1 2.96Å; R140-D145 IonicContact NH1-OD2 2.97Å; R140-D145 PolarHBondContact NH1-OD2 3.11Å; R140-D145 IonicContact NH2-OD1 2.81Å; R140-D145 PolarHBondContact NH2-OD1 3.5Å; R140-D145 IonicContact NH2-OD2 2.87Å; R140-D145 PolarHBondContact NH2-OD2 3.07Å; I143-D145 PolarHBondContact O-N 2.81Å; I143-D145 VanDerWaalsContact O-N 3.12Å; D145-S147 PolarHBondContact O-N 3.3Å
146	I	75.4	Confident	77.8	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.01	29%	0.289	C	S	.	.			trans	-79.6	98.4	175.7	-58.7	177.9	0	0	0	108.5	I143 Q144 V148 A153 L157 Y253	I143-I146 VanDerWaalsContact O-CB 3.25Å; I143-I146 WeakPolarHBondContact O-CB 3.43Å; I143-I146 WeakPolarHBondContact O-CG1 3.48Å; I143-I146 PolarHBondContact O-N 3.5Å; Q144-I146 VanDerWaalsContact C-N 3.3Å; I146-V148 HydrophobicContact CG2-CG2 4.49Å; I146-A153 WeakPolarHBondContact O-CA 3.45Å; I146-L157 HydrophobicContact CD1-CD1 3.99Å; I146-L157 HydrophobicContact CD1-CD2 4.41Å; I146-L157 HydrophobicContact CG2-CB 4.35Å; I146-Y253 HydrophobicContact CB-CE1 4.22Å; I146-Y253 HydrophobicContact CD1-CD1 3.58Å; I146-Y253 HydrophobicContact CD1-CE1 4.04Å; I146-Y253 HydrophobicContact CD1-CG 4Å; I146-Y253 HydrophobicContact CG1-CD1 3.78Å; I146-Y253 HydrophobicContact CG1-CE1 3.71Å; I146-Y253 HydrophobicContact CG2-CD1 4.19Å; I146-Y253 HydrophobicContact CG2-CD2 4.3Å; I146-Y253 HydrophobicContact CG2-CE1 3.75Å; I146-Y253 HydrophobicContact CG2-CE2 3.88Å; I146-Y253 HydrophobicContact CG2-CG 4.46Å
147	S	67.3	Low	77.8	Confident	89 Å²	89	54 Å²	54	62%	0.622	28%	0.28	S	S	*	.			trans	-108.9	118.5	172.6	69	0	0	0	0	111	D145	D145-S147 PolarHBondContact O-N 3.3Å
148	V	64.5	Low	77.8	Confident	26 Å²	26	55.4 Å²	55.4	16%	0.158	29%	0.288	C	S	.	.	S	Bend	trans	-122.8	115.5	170.8	-178.6	0	0	0	0	106.8	I146 E150 T151 L159 W160 Y253	I146-V148 HydrophobicContact CG2-CG2 4.49Å; V148-E150 PolarHBondContact O-N 3.31Å; V148-T151 PolarHBondContact O-N 3.01Å; V148-T151 PolarHBondContact O-OG1 3Å; V148-L159 HydrophobicContact CG1-CD2 4.28Å; V148-W160 HydrophobicContact CG2-CB 4.41Å; V148-Y253 HydrophobicContact CG2-CE2 4.41Å
149	E	60.8	Low	77.7	Confident	112 Å²	112	57.2 Å²	57.2	52%	0.523	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	46.5	177.7	-60.3	-178.4	166.9	0	0	114.5	T151 R163	E149-T151 PolarHBondContact O-N 3.19Å; E149-R163 IonicContact OE1-CZ 3.84Å; E149-R163 IonicContact OE1-NH1 2.74Å; E149-R163 PolarHBondContact OE1-NH1 2.61Å; E149-R163 IonicContact OE1-NH2 2.86Å; E149-R163 PolarHBondContact OE1-NH2 3.18Å; E149-R163 IonicContact OE2-CZ 2.68Å; E149-R163 IonicContact OE2-NH1 3.11Å; E149-R163 IonicContact OE2-NH2 3.12Å; E149-R163 PolarHBondContact OE2-NH2 3.01Å
150	E	58.3	Low	77.8	Confident	202 Å²	202	55.4 Å²	55.4	94%	0.944	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	12.4	175.5	-57.4	-176.6	165.5	0	0	115.5	V148	V148-E150 PolarHBondContact O-N 3.31Å
151	T	71.1	Confident	77.9	Confident	49 Å²	49	53 Å²	53	30%	0.301	28%	0.277	S	S	.	.			trans	-81.3	159.4	176.5	59.4	0	0	0	0	112.6	V148 E149 G156	V148-T151 PolarHBondContact O-N 3.01Å; V148-T151 PolarHBondContact O-OG1 3Å; E149-T151 PolarHBondContact O-N 3.19Å; T151-G156 VanDerWaalsContact OG1-CA 3.23Å; T151-G156 WeakPolarHBondContact OG1-CA 3.12Å; T151-G156 PolarHBondContact OG1-N 3.21Å
152	S	75.2	Confident	78.2	Confident	63 Å²	63	54.3 Å²	54.3	44%	0.441	28%	0.284	S	S	.	.			trans	-61.4	149.1	176.3	74.6	0	0	0	0	110.8	K154 E155 G156	S152-K154 VanDerWaalsContact C-N 3.26Å; S152-K154 PolarHBondContact O-N 3.02Å; S152-E155 WeakPolarHBondContact CB-OE2 3.43Å; S152-E155 PolarHBondContact N-OE2 3.45Å; S152-E155 CarbonylContact O-C 3.53Å; S152-E155 WeakPolarHBondContact O-CA 3.47Å; S152-E155 WeakPolarHBondContact O-CB 3.35Å; S152-E155 PolarHBondContact O-N 3.16Å; S152-E155 WeakPolarHBondContact OG-CG 3.41Å; S152-E155 PolarHBondContact OG-OE2 3.03Å; S152-G156 PolarHBondContact O-N 3.46Å
153	A	76.5	Confident	78.3	Confident	20 Å²	20	60.1 Å²	60.1	17%	0.165	30%	0.304	C	S	.	.	H	α-helix	trans	-53	-36.8	-170.2	0	0	0	0	0	116.4	I143 Q144 I146 L157	I143-A153 HydrophobicContact CG2-CB 4.45Å; I143-A153 WeakPolarHBondContact O-CB 3.36Å; Q144-A153 VanDerWaalsContact CA-CB 3.44Å; I146-A153 WeakPolarHBondContact O-CA 3.45Å; A153-L157 WeakPolarHBondContact O-CB 3.02Å; A153-L157 PolarHBondContact O-N 3.44Å; A153-L157 VanDerWaalsContact O-N 3.1Å
154	K	81.6	Confident	78.5	Confident	92 Å²	92	61.7 Å²	61.7	40%	0.4	31%	0.31	S	S	.	.	H	α-helix	trans	-68.1	-44.5	175	177.6	-179.2	179.4	-176.1	0	111.2	S152 L158 F176 E242 M246	S152-K154 VanDerWaalsContact C-N 3.26Å; S152-K154 PolarHBondContact O-N 3.02Å; K154-L158 WeakPolarHBondContact O-CB 3.36Å; K154-L158 PolarHBondContact O-N 3.01Å; K154-F176 HydrophobicContact CG-CE2 4.17Å; K154-E242 WeakPolarHBondContact CE-OE1 3.44Å; K154-E242 IonicContact NZ-OE1 3.49Å; K154-E242 PolarHBondContact NZ-OE1 3.05Å; K154-E242 IonicContact NZ-OE2 2.63Å; K154-M246 HydrophobicContact CB-CE 4.07Å; K154-M246 HydrophobicContact CD-CE 4.22Å; K154-M246 HydrophobicContact CD-SD 4.28Å; K154-M246 HydrophobicContact CG-CE 3.72Å; K154-M246 HydrophobicContact CG-SD 4.2Å
155	E	82.8	Confident	78.8	Confident	112 Å²	112	56.9 Å²	56.9	52%	0.523	29%	0.288	S	S	.	.	H	α-helix	trans	-68.9	-38.3	178.5	-67.6	167.5	159.1	0	0	111.2	S152 L158 L159	S152-E155 WeakPolarHBondContact CB-OE2 3.43Å; S152-E155 PolarHBondContact N-OE2 3.45Å; S152-E155 CarbonylContact O-C 3.53Å; S152-E155 WeakPolarHBondContact O-CA 3.47Å; S152-E155 WeakPolarHBondContact O-CB 3.35Å; S152-E155 PolarHBondContact O-N 3.16Å; S152-E155 WeakPolarHBondContact OG-CG 3.41Å; S152-E155 PolarHBondContact OG-OE2 3.03Å; E155-L158 PolarHBondContact O-N 2.79Å; E155-L159 VanDerWaalsContact O-CB 3.26Å; E155-L159 WeakPolarHBondContact O-CB 3.5Å; E155-L159 PolarHBondContact O-N 3.19Å
156	G	83.4	Confident	79.5	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-63.1	-43.6	175.6	0	0	0	0	0	112.4	T151 S152 L158 L159 W160	T151-G156 VanDerWaalsContact OG1-CA 3.23Å; T151-G156 WeakPolarHBondContact OG1-CA 3.12Å; T151-G156 PolarHBondContact OG1-N 3.21Å; S152-G156 PolarHBondContact O-N 3.46Å; G156-L158 VanDerWaalsContact C-N 3.34Å; G156-L159 PolarHBondContact O-N 3.16Å; G156-W160 WeakPolarHBondContact O-CB 3.24Å; G156-W160 PolarHBondContact O-N 3.08Å
157	L	86.8	Confident	80.1	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-64.3	-39.3	173.4	-176.3	59.7	0	0	0	111.7	I143 I146 A153 W160 C161 F176 V249 Y253	I143-L157 HydrophobicContact CG2-CD2 4.35Å; I146-L157 HydrophobicContact CD1-CD1 3.99Å; I146-L157 HydrophobicContact CD1-CD2 4.41Å; I146-L157 HydrophobicContact CG2-CB 4.35Å; A153-L157 WeakPolarHBondContact O-CB 3.02Å; A153-L157 PolarHBondContact O-N 3.44Å; A153-L157 VanDerWaalsContact O-N 3.1Å; L157-W160 HydrophobicContact CD1-CE3 4.28Å; L157-C161 PolarHBondContact O-N 3.1Å; L157-C161 VanDerWaalsContact O-N 3.09Å; L157-C161 PolarHBondContact O-SG 2.79Å; L157-F176 HydrophobicContact CB-CZ 4.1Å; L157-F176 HydrophobicContact CD2-CE1 4.26Å; L157-F176 HydrophobicContact CD2-CZ 4.01Å; L157-F176 HydrophobicContact CG-CE1 4.21Å; L157-F176 HydrophobicContact CG-CZ 3.8Å; L157-V249 HydrophobicContact CD1-CG1 4.28Å; L157-V249 HydrophobicContact CG-CG1 4.43Å; L157-Y253 HydrophobicContact CD1-CD2 4.12Å; L157-Y253 HydrophobicContact CD1-CG 4.04Å
158	L	87.9	Confident	81	Confident	31 Å²	31	56.8 Å²	56.8	16%	0.162	29%	0.293	C	S	.	.	H	α-helix	trans	-66.6	-45.2	177.8	-176.6	62.8	0	0	0	111.5	K154 E155 G156 W160 C161 Q162 V173 F176	K154-L158 WeakPolarHBondContact O-CB 3.36Å; K154-L158 PolarHBondContact O-N 3.01Å; E155-L158 PolarHBondContact O-N 2.79Å; G156-L158 VanDerWaalsContact C-N 3.34Å; L158-W160 VanDerWaalsContact C-N 3.33Å; L158-W160 PolarHBondContact O-N 3.26Å; L158-C161 WeakPolarHBondContact O-CB 3.27Å; L158-C161 PolarHBondContact O-N 2.82Å; L158-Q162 WeakPolarHBondContact O-CG 3.26Å; L158-Q162 PolarHBondContact O-N 3.42Å; L158-V173 HydrophobicContact CD1-CG1 3.82Å; L158-F176 HydrophobicContact CB-CE2 3.82Å; L158-F176 HydrophobicContact CB-CZ 3.89Å; L158-F176 HydrophobicContact CD1-CE2 4.16Å; L158-F176 HydrophobicContact CD1-CZ 4.19Å; L158-F176 HydrophobicContact CG-CE2 4.5Å
159	L	85.1	Confident	81.9	Confident	38 Å²	38	67.2 Å²	67.2	20%	0.199	33%	0.33	C	S	.	.	H	α-helix	trans	-62.2	-41.1	177.6	-178.9	62.2	0	0	0	111.2	V148 E155 G156 Q162 R163	V148-L159 HydrophobicContact CG1-CD2 4.28Å; E155-L159 VanDerWaalsContact O-CB 3.26Å; E155-L159 WeakPolarHBondContact O-CB 3.5Å; E155-L159 PolarHBondContact O-N 3.19Å; G156-L159 PolarHBondContact O-N 3.16Å; L159-Q162 PolarHBondContact O-N 3.15Å; L159-R163 HydrophobicContact CD1-CG 4.42Å; L159-R163 WeakPolarHBondContact O-CB 3.48Å; L159-R163 WeakPolarHBondContact O-CG 3.38Å; L159-R163 PolarHBondContact O-N 2.74Å
160	W	87.4	Confident	82.9	Confident	19 Å²	19	67.4 Å²	67.4	7%	0.072	34%	0.335	C	S	.	.	H	α-helix	trans	-59	-47.9	172.9	176.2	88	0	0	0	111.4	V148 G156 L157 L158 Q162 R163 K164 L189 H193 Y253 F256	V148-W160 HydrophobicContact CG2-CB 4.41Å; G156-W160 WeakPolarHBondContact O-CB 3.24Å; G156-W160 PolarHBondContact O-N 3.08Å; L157-W160 HydrophobicContact CD1-CE3 4.28Å; L158-W160 VanDerWaalsContact C-N 3.33Å; L158-W160 PolarHBondContact O-N 3.26Å; W160-Q162 PolarHBondContact O-N 2.73Å; W160-R163 PolarHBondContact O-N 3.07Å; W160-K164 HydrophobicContact CD2-CG 4.25Å; W160-K164 HydrophobicContact CG-CG 4.45Å; W160-K164 HydrophobicContact CZ2-CG 4.32Å; W160-K164 WeakPolarHBondContact O-CB 3.41Å; W160-K164 VanDerWaalsContact O-CG 3.32Å; W160-K164 WeakPolarHBondContact O-CG 3.39Å; W160-K164 PolarHBondContact O-N 2.82Å; W160-L189 HydrophobicContact CE3-CD2 4.48Å; W160-L189 HydrophobicContact CH2-CD1 4.28Å; W160-L189 HydrophobicContact CH2-CD2 4.05Å; W160-L189 HydrophobicContact CZ3-CD1 3.82Å; W160-L189 HydrophobicContact CZ3-CD2 3.92Å; W160-H193 AromaticContact CZ2-CE1 3.55Å; W160-H193 AromaticContact CZ2-NE2 3.81Å; W160-Y253 HydrophobicContact CB-CD2 4.28Å; W160-Y253 HydrophobicContact CB-CE2 4.25Å; W160-Y253 AromaticContact CD1-CD2 3.82Å; W160-Y253 AromaticContact CD1-CE2 3.63Å; W160-Y253 AromaticContact CD2-CD2 3.49Å; W160-Y253 HydrophobicContact CD2-CD2 3.49Å; W160-Y253 VanDerWaalsContact CD2-CD2 3.49Å; W160-Y253 HydrophobicContact CD2-CE2 4.11Å; W160-Y253 AromaticContact CE2-CD2 3.64Å; W160-Y253 AromaticContact CE3-CD2 3.91Å; W160-Y253 HydrophobicContact CE3-CD2 3.91Å; W160-Y253 AromaticContact CG-CD2 3.64Å; W160-Y253 HydrophobicContact CG-CD2 3.64Å; W160-Y253 AromaticContact CG-CE2 3.76Å; W160-Y253 HydrophobicContact CG-CE2 3.76Å; W160-Y253 HydrophobicContact CZ2-CD2 4.2Å; W160-Y253 HydrophobicContact CZ3-CD2 4.42Å; W160-Y253 AromaticContact NE1-CD2 3.81Å; W160-Y253 AromaticContact NE1-CE2 3.89Å; W160-F256 HydrophobicContact CH2-CD2 4.08Å; W160-F256 HydrophobicContact CZ2-CB 4.4Å; W160-F256 HydrophobicContact CZ2-CD2 4.21Å
161	C	89	Confident	84.4	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-57.9	-50.8	176.8	-65.1	0	0	0	0	110.7	L157 L158 R163 K164 T165 V173 W180 V249	L157-C161 PolarHBondContact O-N 3.1Å; L157-C161 VanDerWaalsContact O-N 3.09Å; L157-C161 PolarHBondContact O-SG 2.79Å; L158-C161 WeakPolarHBondContact O-CB 3.27Å; L158-C161 PolarHBondContact O-N 2.82Å; C161-R163 PolarHBondContact O-N 3.44Å; C161-K164 PolarHBondContact O-N 2.95Å; C161-T165 WeakPolarHBondContact O-CB 3.34Å; C161-T165 WeakPolarHBondContact O-CG2 3.39Å; C161-T165 PolarHBondContact O-N 3.43Å; C161-T165 PolarHBondContact O-OG1 3.5Å; C161-V173 HydrophobicContact CB-CG1 4.18Å; C161-W180 HydrophobicContact CB-CH2 4.25Å; C161-W180 HydrophobicContact CB-CZ2 4.07Å; C161-V249 WeakPolarHBondContact SG-CG1 3.35Å
162	Q	88.7	Confident	85.2	Confident	70 Å²	70	61 Å²	61	33%	0.327	31%	0.306	S	S	.	.	H	α-helix	trans	-55.5	-47.6	179.2	-76.3	171.5	-9.2	0	0	112.5	L158 L159 W160 T165 A166 V173	L158-Q162 WeakPolarHBondContact O-CG 3.26Å; L158-Q162 PolarHBondContact O-N 3.42Å; L159-Q162 PolarHBondContact O-N 3.15Å; W160-Q162 PolarHBondContact O-N 2.73Å; Q162-T165 CarbonylContact O-C 3.59Å; Q162-T165 PolarHBondContact O-N 2.92Å; Q162-A166 WeakPolarHBondContact O-CA 3.48Å; Q162-A166 VanDerWaalsContact O-CB 3.26Å; Q162-A166 WeakPolarHBondContact O-CB 3.46Å; Q162-A166 PolarHBondContact O-N 3.33Å; Q162-V173 HydrophobicContact CG-CB 4.31Å; Q162-V173 WeakPolarHBondContact CG-O 3.17Å; Q162-V173 PolarHBondContact NE2-O 2.82Å
163	R	85.6	Confident	85.9	Confident	134 Å²	134	58.1 Å²	58.1	51%	0.506	29%	0.285	S	S	.	.	H	α-helix	trans	-66.1	-42.8	-179.8	-77.2	-169.9	172	-177.3	3.4	112.5	E149 L159 W160 C161 T165	E149-R163 IonicContact OE1-CZ 3.84Å; E149-R163 IonicContact OE1-NH1 2.74Å; E149-R163 PolarHBondContact OE1-NH1 2.61Å; E149-R163 IonicContact OE1-NH2 2.86Å; E149-R163 PolarHBondContact OE1-NH2 3.18Å; E149-R163 IonicContact OE2-CZ 2.68Å; E149-R163 IonicContact OE2-NH1 3.11Å; E149-R163 IonicContact OE2-NH2 3.12Å; E149-R163 PolarHBondContact OE2-NH2 3.01Å; L159-R163 HydrophobicContact CD1-CG 4.42Å; L159-R163 WeakPolarHBondContact O-CB 3.48Å; L159-R163 WeakPolarHBondContact O-CG 3.38Å; L159-R163 PolarHBondContact O-N 2.74Å; W160-R163 PolarHBondContact O-N 3.07Å; C161-R163 PolarHBondContact O-N 3.44Å; R163-T165 VanDerWaalsContact C-N 3.31Å; R163-T165 PolarHBondContact O-N 2.99Å
164	K	87.6	Confident	86.5	Confident	33 Å²	33	63.2 Å²	63.2	14%	0.143	31%	0.306	C	S	.	.	H	α-helix	trans	-70.7	-30.2	-179.6	-64.6	-67.1	-171.6	172.2	0	111.3	W160 C161 L189 R192 H193 E260	W160-K164 HydrophobicContact CD2-CG 4.25Å; W160-K164 HydrophobicContact CG-CG 4.45Å; W160-K164 HydrophobicContact CZ2-CG 4.32Å; W160-K164 WeakPolarHBondContact O-CB 3.41Å; W160-K164 VanDerWaalsContact O-CG 3.32Å; W160-K164 WeakPolarHBondContact O-CG 3.39Å; W160-K164 PolarHBondContact O-N 2.82Å; C161-K164 PolarHBondContact O-N 2.95Å; K164-L189 HydrophobicContact CB-CD2 3.63Å; K164-R192 HydrophobicContact CB-CG 4.23Å; K164-R192 HydrophobicContact CD-CG 4.27Å; K164-R192 WeakPolarHBondContact O-CG 3.47Å; K164-H193 WeakPolarHBondContact CD-NE2 3.49Å; K164-H193 VanDerWaalsContact CE-NE2 3.29Å; K164-H193 WeakPolarHBondContact CE-NE2 3.2Å; K164-H193 PolarHBondContact NZ-NE2 3.04Å; K164-E260 VanDerWaalsContact NZ-CD 3.29Å; K164-E260 IonicContact NZ-OE1 2.78Å; K164-E260 PolarHBondContact NZ-OE1 3.01Å; K164-E260 IonicContact NZ-OE2 3.47Å; K164-E260 PolarHBondContact NZ-OE2 2.94Å; K164-E260 VanDerWaalsContact NZ-OE2 3.08Å
165	T	87.4	Confident	86.8	Confident	2 Å²	2	60.6 Å²	60.6	1%	0.012	30%	0.296	C	S	.	.	H	α-helix	trans	-93.8	-9.8	176.7	64.7	0	0	0	0	114.9	C161 Q162 R163 P167 Y168 V171 V173 A188 L189	C161-T165 WeakPolarHBondContact O-CB 3.34Å; C161-T165 WeakPolarHBondContact O-CG2 3.39Å; C161-T165 PolarHBondContact O-N 3.43Å; C161-T165 PolarHBondContact O-OG1 3.5Å; Q162-T165 CarbonylContact O-C 3.59Å; Q162-T165 PolarHBondContact O-N 2.92Å; R163-T165 VanDerWaalsContact C-N 3.31Å; R163-T165 PolarHBondContact O-N 2.99Å; T165-P167 VanDerWaalsContact C-N 3.31Å; T165-Y168 WeakPolarHBondContact O-CB 3.41Å; T165-Y168 WeakPolarHBondContact O-CD2 3.17Å; T165-Y168 PolarHBondContact O-N 3.27Å; T165-V171 HydrophobicContact CG2-CG1 4.17Å; T165-V173 HydrophobicContact CG2-CG2 4.5Å; T165-A188 HydrophobicContact CG2-CB 3.83Å; T165-L189 HydrophobicContact CG2-CD2 3.8Å; T165-L189 HydrophobicContact CG2-CG 3.92Å
166	A	87.9	Confident	87.1	Confident	75 Å²	75	55.3 Å²	55.3	62%	0.62	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-35.4	-178.5	0	0	0	0	0	115.2	Q162 Y168	Q162-A166 WeakPolarHBondContact O-CA 3.48Å; Q162-A166 VanDerWaalsContact O-CB 3.26Å; Q162-A166 WeakPolarHBondContact O-CB 3.46Å; Q162-A166 PolarHBondContact O-N 3.33Å; A166-Y168 PolarHBondContact O-N 3.49Å
167	P	86.8	Confident	87.2	Confident	85 Å²	85	57 Å²	57	55%	0.552	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-17.1	176.5	-23.4	35.7	0	0	0	114.6	T165 R169	T165-P167 VanDerWaalsContact C-N 3.31Å; P167-R169 PolarHBondContact O-N 3.35Å
168	Y	87.7	Confident	87.2	Confident	29 Å²	29	60.6 Å²	60.6	11%	0.114	30%	0.301	C	S	.	.			trans	-93.8	102.6	-175.1	-59.7	-92.5	0	0	0	110.5	T165 A166 N170 V171 A188 H191 R192 F200	T165-Y168 WeakPolarHBondContact O-CB 3.41Å; T165-Y168 WeakPolarHBondContact O-CD2 3.17Å; T165-Y168 PolarHBondContact O-N 3.27Å; A166-Y168 PolarHBondContact O-N 3.49Å; Y168-N170 PolarHBondContact O-N 3.31Å; Y168-V171 PolarHBondContact O-N 2.97Å; Y168-A188 HydrophobicContact CD1-CB 4.23Å; Y168-A188 HydrophobicContact CD2-CB 3.77Å; Y168-A188 HydrophobicContact CE1-CB 4.41Å; Y168-A188 HydrophobicContact CE2-CB 3.96Å; Y168-A188 HydrophobicContact CG-CB 3.88Å; Y168-A188 PolarHBondContact OH-O 2.64Å; Y168-H191 AromaticContact CE1-ND1 3.47Å; Y168-H191 WeakPolarHBondContact CE1-ND1 3.16Å; Y168-H191 AromaticContact CZ-ND1 3.54Å; Y168-H191 PolarHBondContact OH-ND1 2.94Å; Y168-R192 HydrophobicContact CE2-CB 4.18Å; Y168-R192 WeakPolarHBondContact OH-CA 3.41Å; Y168-R192 PolarHBondContact OH-N 3.18Å; Y168-R192 VanDerWaalsContact OH-N 3.11Å; Y168-F200 AromaticContact CD1-CD1 3.6Å; Y168-F200 HydrophobicContact CD1-CD1 3.6Å; Y168-F200 HydrophobicContact CD1-CD2 4.04Å; Y168-F200 AromaticContact CD1-CE1 3.47Å; Y168-F200 HydrophobicContact CD1-CE1 3.47Å; Y168-F200 VanDerWaalsContact CD1-CE1 3.47Å; Y168-F200 AromaticContact CD1-CE2 3.93Å; Y168-F200 HydrophobicContact CD1-CE2 3.93Å; Y168-F200 AromaticContact CD1-CG 3.89Å; Y168-F200 HydrophobicContact CD1-CG 3.89Å; Y168-F200 AromaticContact CD1-CZ 3.64Å; Y168-F200 HydrophobicContact CD1-CZ 3.64Å; Y168-F200 HydrophobicContact CE1-CB 4.34Å; Y168-F200 AromaticContact CE1-CD1 3.92Å; Y168-F200 HydrophobicContact CE1-CD1 3.92Å; Y168-F200 AromaticContact CE1-CD2 3.89Å; Y168-F200 HydrophobicContact CE1-CD2 3.89Å; Y168-F200 HydrophobicContact CE1-CE1 4.21Å; Y168-F200 HydrophobicContact CE1-CE2 4.19Å; Y168-F200 AromaticContact CE1-CG 3.76Å; Y168-F200 HydrophobicContact CE1-CG 3.76Å; Y168-F200 HydrophobicContact CE1-CZ 4.33Å; Y168-F200 HydrophobicContact CG-CE1 4.32Å; Y168-F200 HydrophobicContact CG-CZ 4.23Å
169	R	81.6	Confident	87.3	Confident	245 Å²	245	60 Å²	60	93%	0.925	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-29.5	-174.5	-65.2	-176.6	179.2	-178.8	-0.4	115	P167 V171	P167-R169 PolarHBondContact O-N 3.35Å; R169-V171 VanDerWaalsContact C-N 3.33Å
170	N	83.3	Confident	87.6	Confident	116 Å²	116	58.2 Å²	58.2	62%	0.62	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	4.7	-176.2	-60.6	-14.6	0	0	0	113	Y168 L184	Y168-N170 PolarHBondContact O-N 3.31Å; N170-L184 HydrophobicContact CB-CD1 4.37Å
171	V	88.6	Confident	87.7	Confident	14 Å²	14	60 Å²	60	9%	0.085	30%	0.298	C	S	.	.			trans	-122	121.9	-176.9	-179.5	0	0	0	0	109.7	T165 Y168 R169 V173 L184 A185 A188 F200	T165-V171 HydrophobicContact CG2-CG1 4.17Å; Y168-V171 PolarHBondContact O-N 2.97Å; R169-V171 VanDerWaalsContact C-N 3.33Å; V171-V173 HydrophobicContact CG1-CG2 3.94Å; V171-L184 HydrophobicContact CG2-CB 3.72Å; V171-A185 HydrophobicContact CG1-CB 3.95Å; V171-A188 HydrophobicContact CG2-CB 4.1Å; V171-F200 HydrophobicContact CG2-CZ 3.94Å
172	N	88.8	Confident	87.6	Confident	104 Å²	104	61.3 Å²	61.3	56%	0.556	31%	0.305	S	S	*	.			trans	-132.6	101.5	175.7	-178.6	19.1	0	0	0	110.4	Q174 S179	N172-Q174 PolarHBondContact ND2-NE2 2.87Å; N172-Q174 VanDerWaalsContact ND2-NE2 3.1Å; N172-S179 PolarHBondContact O-OG 3.37Å
173	V	90.5	Very high	87.6	Confident	2 Å²	2	58 Å²	58	1%	0.012	29%	0.29	C	S	.	.			trans	-91.7	108.4	-177.1	-173.4	0	0	0	0	110	L158 C161 Q162 T165 V171 W180 A185	L158-V173 HydrophobicContact CD1-CG1 3.82Å; C161-V173 HydrophobicContact CB-CG1 4.18Å; Q162-V173 HydrophobicContact CG-CB 4.31Å; Q162-V173 WeakPolarHBondContact CG-O 3.17Å; Q162-V173 PolarHBondContact NE2-O 2.82Å; T165-V173 HydrophobicContact CG2-CG2 4.5Å; V171-V173 HydrophobicContact CG1-CG2 3.94Å; V173-W180 HydrophobicContact CG1-CZ2 3.77Å; V173-A185 HydrophobicContact CG2-CB 3.9Å
174	Q	87.8	Confident	87.8	Confident	127 Å²	127	51.8 Å²	51.8	59%	0.593	27%	0.266	S	S	*	.			trans	-116.6	-23.2	179.6	-66.2	-177.3	-16.6	0	0	113	N172 S179	N172-Q174 PolarHBondContact ND2-NE2 2.87Å; N172-Q174 VanDerWaalsContact ND2-NE2 3.1Å; Q174-S179 PolarHBondContact N-OG 3.43Å
175	N	88.6	Confident	88	Confident	37 Å²	37	50.2 Å²	50.2	20%	0.198	26%	0.26	C	S	.	.	S	Bend	trans	-149.1	170.5	-178.7	54.7	64	0	0	0	110.5	H177 V178 S179 W180	N175-H177 PolarHBondContact OD1-N 2.95Å; N175-H177 VanDerWaalsContact OD1-N 3.11Å; N175-H177 PolarHBondContact OD1-ND1 3.34Å; N175-V178 PolarHBondContact OD1-N 3.3Å; N175-S179 PolarHBondContact N-OG 3.2Å; N175-S179 WeakPolarHBondContact O-CB 3.29Å; N175-S179 PolarHBondContact OD1-N 3.42Å; N175-W180 PolarHBondContact O-NE1 3.02Å
176	F	88.9	Confident	88.2	Confident	1 Å²	1	50.1 Å²	50.1	0%	0.004	26%	0.259	C	S	.	.	S	Bend	trans	-94.2	26.2	175	-67.7	-74.3	0	0	0	113.2	K154 L157 L158 W180 E242 I245 M246 V249	K154-F176 HydrophobicContact CG-CE2 4.17Å; L157-F176 HydrophobicContact CB-CZ 4.1Å; L157-F176 HydrophobicContact CD2-CE1 4.26Å; L157-F176 HydrophobicContact CD2-CZ 4.01Å; L157-F176 HydrophobicContact CG-CE1 4.21Å; L157-F176 HydrophobicContact CG-CZ 3.8Å; L158-F176 HydrophobicContact CB-CE2 3.82Å; L158-F176 HydrophobicContact CB-CZ 3.89Å; L158-F176 HydrophobicContact CD1-CE2 4.16Å; L158-F176 HydrophobicContact CD1-CZ 4.19Å; L158-F176 HydrophobicContact CG-CE2 4.5Å; F176-W180 HydrophobicContact CD1-CZ2 4.32Å; F176-W180 AromaticContact CD1-NE1 3.84Å; F176-W180 HydrophobicContact CE1-CZ2 4.29Å; F176-E242 HydrophobicContact CB-CG 3.72Å; F176-E242 WeakPolarHBondContact O-CA 3.3Å; F176-I245 HydrophobicContact CB-CG2 4.21Å; F176-I245 HydrophobicContact CD1-CG2 4.27Å; F176-I245 WeakPolarHBondContact O-CB 3.36Å; F176-I245 WeakPolarHBondContact O-CD1 3.39Å; F176-I245 WeakPolarHBondContact O-CG2 3.23Å; F176-M246 HydrophobicContact CB-CG 3.57Å; F176-M246 HydrophobicContact CB-SD 4.46Å; F176-M246 HydrophobicContact CD1-CG 3.81Å; F176-M246 HydrophobicContact CD2-CG 3.43Å; F176-M246 VanDerWaalsContact CD2-CG 3.43Å; F176-M246 HydrophobicContact CD2-SD 3.83Å; F176-M246 HydrophobicContact CE1-CG 4.32Å; F176-M246 HydrophobicContact CE2-CG 3.98Å; F176-M246 HydrophobicContact CE2-SD 4.33Å; F176-M246 HydrophobicContact CG-CG 3.33Å; F176-M246 HydrophobicContact CG-SD 4.28Å; F176-M246 HydrophobicContact CZ-CG 4.39Å; F176-V249 HydrophobicContact CE1-CB 4.39Å; F176-V249 HydrophobicContact CE1-CG1 4.11Å
177	H	85.6	Confident	88.4	Confident	36 Å²	36	46.6 Å²	46.6	17%	0.167	23%	0.23	C	C	.	.	S	Bend	trans	-128.5	-71	176.8	49.3	86	0	0	0	113.6	N175 K239 P240	N175-H177 PolarHBondContact OD1-N 2.95Å; N175-H177 VanDerWaalsContact OD1-N 3.11Å; N175-H177 PolarHBondContact OD1-ND1 3.34Å; H177-K239 HydrophobicContact CB-CG 4.15Å; H177-P240 WeakPolarHBondContact CB-O 3.38Å; H177-P240 WeakPolarHBondContact O-CG 3.49Å
178	V	87.3	Confident	88.5	Confident	74 Å²	74	42.5 Å²	42.5	45%	0.448	20%	0.203	S	C	.	.	S	Bend	trans	-84.2	-30.9	-173.3	167	0	0	0	0	111.9	N175 W180 K181	N175-V178 PolarHBondContact OD1-N 3.3Å; V178-W180 PolarHBondContact O-N 3.16Å; V178-W180 VanDerWaalsContact O-N 3.1Å; V178-K181 WeakPolarHBondContact O-CB 3.15Å; V178-K181 PolarHBondContact O-N 3.43Å
179	S	89.8	Confident	88.6	Confident	19 Å²	19	41.2 Å²	41.2	13%	0.133	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-15.6	178.9	-68.5	0	0	0	0	115	N172 Q174 N175	N172-S179 PolarHBondContact O-OG 3.37Å; Q174-S179 PolarHBondContact N-OG 3.43Å; N175-S179 PolarHBondContact N-OG 3.2Å; N175-S179 WeakPolarHBondContact O-CB 3.29Å; N175-S179 PolarHBondContact OD1-N 3.42Å
180	W	91.3	Very high	89	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-3	-178	-61.3	82.9	0	0	0	112.9	C161 V173 N175 F176 V178 D182 G183 A185 F186 L189 I245 V249	C161-W180 HydrophobicContact CB-CH2 4.25Å; C161-W180 HydrophobicContact CB-CZ2 4.07Å; V173-W180 HydrophobicContact CG1-CZ2 3.77Å; N175-W180 PolarHBondContact O-NE1 3.02Å; F176-W180 HydrophobicContact CD1-CZ2 4.32Å; F176-W180 AromaticContact CD1-NE1 3.84Å; F176-W180 HydrophobicContact CE1-CZ2 4.29Å; V178-W180 PolarHBondContact O-N 3.16Å; V178-W180 VanDerWaalsContact O-N 3.1Å; W180-D182 VanDerWaalsContact C-N 3.33Å; W180-D182 PolarHBondContact O-N 2.96Å; W180-G183 PolarHBondContact O-N 3.34Å; W180-A185 HydrophobicContact CD2-CB 3.94Å; W180-A185 HydrophobicContact CE3-CB 3.49Å; W180-A185 VanDerWaalsContact CE3-CB 3.49Å; W180-A185 HydrophobicContact CH2-CB 4.38Å; W180-A185 HydrophobicContact CZ3-CB 3.75Å; W180-F186 HydrophobicContact CB-CE2 4.06Å; W180-F186 HydrophobicContact CD2-CE2 4.37Å; W180-F186 HydrophobicContact CD2-CZ 4.26Å; W180-F186 AromaticContact CE3-CD1 3.78Å; W180-F186 HydrophobicContact CE3-CD1 3.78Å; W180-F186 AromaticContact CE3-CD2 3.78Å; W180-F186 HydrophobicContact CE3-CD2 3.78Å; W180-F186 AromaticContact CE3-CE1 3.64Å; W180-F186 HydrophobicContact CE3-CE1 3.64Å; W180-F186 AromaticContact CE3-CE2 3.65Å; W180-F186 HydrophobicContact CE3-CE2 3.65Å; W180-F186 AromaticContact CE3-CG 3.85Å; W180-F186 HydrophobicContact CE3-CG 3.85Å; W180-F186 AromaticContact CE3-CZ 3.57Å; W180-F186 HydrophobicContact CE3-CZ 3.57Å; W180-F186 AromaticContact CZ3-CD1 3.66Å; W180-F186 HydrophobicContact CZ3-CD1 3.66Å; W180-F186 HydrophobicContact CZ3-CD2 4.42Å; W180-F186 AromaticContact CZ3-CE1 3.73Å; W180-F186 HydrophobicContact CZ3-CE1 3.73Å; W180-F186 HydrophobicContact CZ3-CE2 4.5Å; W180-F186 HydrophobicContact CZ3-CG 4.02Å; W180-F186 HydrophobicContact CZ3-CZ 4.16Å; W180-L189 HydrophobicContact CH2-CD1 3.6Å; W180-L189 HydrophobicContact CZ3-CD1 3.93Å; W180-I245 HydrophobicContact CB-CD1 4.28Å; W180-I245 HydrophobicContact CB-CG2 4.27Å; W180-I245 HydrophobicContact CD2-CG2 4.12Å; W180-I245 HydrophobicContact CG-CG2 3.8Å; W180-V249 HydrophobicContact CD2-CG2 4.25Å; W180-V249 HydrophobicContact CE3-CG2 4.04Å; W180-V249 HydrophobicContact CH2-CB 4.35Å; W180-V249 HydrophobicContact CH2-CG1 3.78Å; W180-V249 HydrophobicContact CH2-CG2 3.51Å; W180-V249 HydrophobicContact CZ2-CG1 4.06Å; W180-V249 HydrophobicContact CZ2-CG2 3.75Å; W180-V249 HydrophobicContact CZ3-CG2 3.68Å
181	K	88.3	Confident	89.3	Confident	57 Å²	57	26.3 Å²	26.3	25%	0.248	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-28	-169.6	-173.9	168.2	179.6	162.9	0	113.8	V178 G183 I234 I235 T237 P240	V178-K181 WeakPolarHBondContact O-CB 3.15Å; V178-K181 PolarHBondContact O-N 3.43Å; K181-G183 VanDerWaalsContact C-N 3.34Å; K181-I234 HydrophobicContact CG-CG2 4.36Å; K181-I235 WeakPolarHBondContact CE-O 3.45Å; K181-I235 PolarHBondContact NZ-O 3.43Å; K181-T237 PolarHBondContact NZ-O 2.72Å; K181-P240 HydrophobicContact CB-CG 4.5Å; K181-P240 HydrophobicContact CD-CG 4.41Å
182	D	88	Confident	89.2	Confident	27 Å²	27	31.7 Å²	31.7	14%	0.144	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-3.4	178.6	62.7	15.2	0	0	0	114.2	W180 L184 K205 N211	W180-D182 VanDerWaalsContact C-N 3.33Å; W180-D182 PolarHBondContact O-N 2.96Å; D182-L184 PolarHBondContact O-N 3.43Å; D182-L184 VanDerWaalsContact O-N 3.12Å; D182-L184 PolarHBondContact OD1-N 3.42Å; D182-L184 VanDerWaalsContact OD1-N 3.16Å; D182-K205 HydrophobicContact CB-CG 4.07Å; D182-K205 WeakPolarHBondContact OD2-CE 3.49Å; D182-N211 WeakPolarHBondContact O-CB 3.37Å; D182-N211 PolarHBondContact O-ND2 3.37Å
183	G	87.9	Confident	89	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.135	C	C	.	.	S	Bend	trans	73	-8.9	178.6	0	0	0	0	0	115.9	W180 K181 A185 F186 C187	W180-G183 PolarHBondContact O-N 3.34Å; K181-G183 VanDerWaalsContact C-N 3.34Å; G183-A185 VanDerWaalsContact C-N 3.33Å; G183-A185 PolarHBondContact O-N 3.36Å; G183-F186 PolarHBondContact O-N 2.9Å; G183-C187 PolarHBondContact O-N 2.87Å; G183-C187 PolarHBondContact O-SG 3.3Å
184	L	91	Very high	88.6	Confident	4 Å²	4	33 Å²	33	2%	0.021	15%	0.153	C	C	.	.	H	α-helix	trans	-69.5	-32.1	-176.7	-66.5	175.7	0	0	0	112	N170 V171 D182 C187 A188 L203 K205	N170-L184 HydrophobicContact CB-CD1 4.37Å; V171-L184 HydrophobicContact CG2-CB 3.72Å; D182-L184 PolarHBondContact O-N 3.43Å; D182-L184 VanDerWaalsContact O-N 3.12Å; D182-L184 PolarHBondContact OD1-N 3.42Å; D182-L184 VanDerWaalsContact OD1-N 3.16Å; L184-C187 PolarHBondContact O-N 3Å; L184-A188 VanDerWaalsContact O-CB 3.31Å; L184-A188 WeakPolarHBondContact O-CB 3.3Å; L184-A188 PolarHBondContact O-N 3.36Å; L184-L203 HydrophobicContact CD2-CB 3.75Å; L184-L203 HydrophobicContact CD2-CD1 4.44Å; L184-K205 HydrophobicContact CD1-CB 3.99Å; L184-K205 HydrophobicContact CD1-CG 4.34Å
185	A	90.6	Very high	88.5	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.7	-42.5	177	0	0	0	0	0	112.8	V171 V173 W180 G183 A188 L189	V171-A185 HydrophobicContact CG1-CB 3.95Å; V173-A185 HydrophobicContact CG2-CB 3.9Å; W180-A185 HydrophobicContact CD2-CB 3.94Å; W180-A185 HydrophobicContact CE3-CB 3.49Å; W180-A185 VanDerWaalsContact CE3-CB 3.49Å; W180-A185 HydrophobicContact CH2-CB 4.38Å; W180-A185 HydrophobicContact CZ3-CB 3.75Å; G183-A185 VanDerWaalsContact C-N 3.33Å; G183-A185 PolarHBondContact O-N 3.36Å; A185-A188 PolarHBondContact O-N 3.07Å; A185-L189 PolarHBondContact O-N 3.41Å; A185-L189 VanDerWaalsContact O-N 3.17Å
186	F	92.3	Very high	88.2	Confident	1 Å²	1	33.8 Å²	33.8	0%	0.004	17%	0.165	C	C	.	.	H	α-helix	trans	-65.3	-44.8	175.4	-71.1	-69.2	0	0	0	111.7	W180 G183 A188 L189 I190 L212 A215 F216 L229 I245 Y248 V249 F252	W180-F186 HydrophobicContact CB-CE2 4.06Å; W180-F186 HydrophobicContact CD2-CE2 4.37Å; W180-F186 HydrophobicContact CD2-CZ 4.26Å; W180-F186 AromaticContact CE3-CD1 3.78Å; W180-F186 HydrophobicContact CE3-CD1 3.78Å; W180-F186 AromaticContact CE3-CD2 3.78Å; W180-F186 HydrophobicContact CE3-CD2 3.78Å; W180-F186 AromaticContact CE3-CE1 3.64Å; W180-F186 HydrophobicContact CE3-CE1 3.64Å; W180-F186 AromaticContact CE3-CE2 3.65Å; W180-F186 HydrophobicContact CE3-CE2 3.65Å; W180-F186 AromaticContact CE3-CG 3.85Å; W180-F186 HydrophobicContact CE3-CG 3.85Å; W180-F186 AromaticContact CE3-CZ 3.57Å; W180-F186 HydrophobicContact CE3-CZ 3.57Å; W180-F186 AromaticContact CZ3-CD1 3.66Å; W180-F186 HydrophobicContact CZ3-CD1 3.66Å; W180-F186 HydrophobicContact CZ3-CD2 4.42Å; W180-F186 AromaticContact CZ3-CE1 3.73Å; W180-F186 HydrophobicContact CZ3-CE1 3.73Å; W180-F186 HydrophobicContact CZ3-CE2 4.5Å; W180-F186 HydrophobicContact CZ3-CG 4.02Å; W180-F186 HydrophobicContact CZ3-CZ 4.16Å; G183-F186 PolarHBondContact O-N 2.9Å; F186-A188 VanDerWaalsContact C-N 3.33Å; F186-A188 PolarHBondContact O-N 3.12Å; F186-L189 PolarHBondContact O-N 3.28Å; F186-I190 WeakPolarHBondContact O-CG1 3.5Å; F186-I190 PolarHBondContact O-N 2.96Å; F186-L212 HydrophobicContact CD2-CD2 3.77Å; F186-L212 HydrophobicContact CE2-CD2 3.97Å; F186-A215 HydrophobicContact CB-CB 3.63Å; F186-F216 HydrophobicContact CD2-CE1 4.02Å; F186-F216 HydrophobicContact CE2-CE1 4.05Å; F186-F216 HydrophobicContact CE2-CZ 4.3Å; F186-F216 HydrophobicContact CG-CE1 4.27Å; F186-F216 HydrophobicContact CZ-CE1 4.34Å; F186-L229 HydrophobicContact CZ-CD1 4.04Å; F186-I245 HydrophobicContact CZ-CG2 4.44Å; F186-Y248 HydrophobicContact CD1-CD1 4.35Å; F186-Y248 HydrophobicContact CD1-CE1 4.45Å; F186-Y248 AromaticContact CE1-CD1 3.62Å; F186-Y248 HydrophobicContact CE1-CD1 3.62Å; F186-Y248 HydrophobicContact CE1-CE1 4.14Å; F186-Y248 AromaticContact CZ-CD1 3.96Å; F186-Y248 HydrophobicContact CZ-CD1 3.96Å; F186-V249 HydrophobicContact CE1-CG2 3.61Å; F186-V249 HydrophobicContact CZ-CG2 4.1Å; F186-F252 HydrophobicContact CD1-CE2 4.11Å; F186-F252 HydrophobicContact CE1-CE2 4.42Å
187	C	90.8	Very high	88	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.5	-39.2	177.9	-64.3	0	0	0	0	112.4	G183 L184 I190 H191 L198 F200 L203 N211	G183-C187 PolarHBondContact O-N 2.87Å; G183-C187 PolarHBondContact O-SG 3.3Å; L184-C187 PolarHBondContact O-N 3Å; C187-I190 PolarHBondContact O-N 3.33Å; C187-H191 WeakPolarHBondContact O-CB 3.38Å; C187-H191 PolarHBondContact O-N 2.76Å; C187-L198 HydrophobicContact CB-CD1 3.9Å; C187-L198 HydrophobicContact CB-CD2 4.21Å; C187-F200 HydrophobicContact CB-CD2 4.26Å; C187-F200 HydrophobicContact CB-CE2 4.09Å; C187-L203 HydrophobicContact CB-CD1 3.38Å; C187-L203 VanDerWaalsContact SG-CD1 3.6Å; C187-N211 PolarHBondContact SG-O 2.95Å
188	A	90.1	Very high	88	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-66.1	-40.3	179.4	0	0	0	0	0	112	T165 Y168 V171 L184 A185 F186 R192 F200	T165-A188 HydrophobicContact CG2-CB 3.83Å; Y168-A188 HydrophobicContact CD1-CB 4.23Å; Y168-A188 HydrophobicContact CD2-CB 3.77Å; Y168-A188 HydrophobicContact CE1-CB 4.41Å; Y168-A188 HydrophobicContact CE2-CB 3.96Å; Y168-A188 HydrophobicContact CG-CB 3.88Å; Y168-A188 PolarHBondContact OH-O 2.64Å; V171-A188 HydrophobicContact CG2-CB 4.1Å; L184-A188 VanDerWaalsContact O-CB 3.31Å; L184-A188 WeakPolarHBondContact O-CB 3.3Å; L184-A188 PolarHBondContact O-N 3.36Å; A185-A188 PolarHBondContact O-N 3.07Å; F186-A188 VanDerWaalsContact C-N 3.33Å; F186-A188 PolarHBondContact O-N 3.12Å; A188-R192 VanDerWaalsContact O-CB 3.27Å; A188-R192 WeakPolarHBondContact O-CB 3.1Å; A188-R192 PolarHBondContact O-N 2.71Å; A188-F200 HydrophobicContact CB-CD2 4.47Å; A188-F200 HydrophobicContact CB-CE2 3.67Å; A188-F200 HydrophobicContact CB-CZ 4.17Å
189	L	89.6	Confident	88	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-63.1	-42	175.5	-77	-177.3	0	0	0	112.4	W160 K164 T165 W180 A185 F186 H193	W160-L189 HydrophobicContact CE3-CD2 4.48Å; W160-L189 HydrophobicContact CH2-CD1 4.28Å; W160-L189 HydrophobicContact CH2-CD2 4.05Å; W160-L189 HydrophobicContact CZ3-CD1 3.82Å; W160-L189 HydrophobicContact CZ3-CD2 3.92Å; K164-L189 HydrophobicContact CB-CD2 3.63Å; T165-L189 HydrophobicContact CG2-CD2 3.8Å; T165-L189 HydrophobicContact CG2-CG 3.92Å; W180-L189 HydrophobicContact CH2-CD1 3.6Å; W180-L189 HydrophobicContact CZ3-CD1 3.93Å; A185-L189 PolarHBondContact O-N 3.41Å; A185-L189 VanDerWaalsContact O-N 3.17Å; F186-L189 PolarHBondContact O-N 3.28Å; L189-H193 PolarHBondContact O-ND1 3.48Å
190	I	89.3	Confident	87.9	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-64.5	-52.7	176.4	-64.3	169	0	0	0	110.1	F186 C187 R192 H193 R194 L197 A215 I218 L223 F252	F186-I190 WeakPolarHBondContact O-CG1 3.5Å; F186-I190 PolarHBondContact O-N 2.96Å; C187-I190 PolarHBondContact O-N 3.33Å; I190-R192 VanDerWaalsContact C-N 3.26Å; I190-R192 PolarHBondContact O-N 2.89Å; I190-H193 PolarHBondContact O-N 2.99Å; I190-R194 CarbonylContact O-C 3.35Å; I190-R194 WeakPolarHBondContact O-CA 3.48Å; I190-R194 PolarHBondContact O-N 3Å; I190-L197 HydrophobicContact CG2-CB 4.46Å; I190-A215 HydrophobicContact CD1-CB 4.08Å; I190-I218 HydrophobicContact CD1-CG2 4.45Å; I190-I218 HydrophobicContact CG2-CG2 3.96Å; I190-L223 HydrophobicContact CG1-CD1 4.31Å; I190-F252 HydrophobicContact CD1-CE1 3.8Å; I190-F252 HydrophobicContact CD1-CZ 4.23Å; I190-F252 HydrophobicContact CG1-CD1 4.26Å; I190-F252 HydrophobicContact CG1-CE1 3.63Å; I190-F252 HydrophobicContact CG1-CZ 4.47Å
191	H	90.3	Very high	87.5	Confident	49 Å²	49	39.7 Å²	39.7	23%	0.227	20%	0.2	C	C	.	.	H	α-helix	trans	-62.7	-31.1	-178.7	-178.2	-106.4	0	0	0	112.8	Y168 C187 H193 P195 L198 F200	Y168-H191 AromaticContact CE1-ND1 3.47Å; Y168-H191 WeakPolarHBondContact CE1-ND1 3.16Å; Y168-H191 AromaticContact CZ-ND1 3.54Å; Y168-H191 PolarHBondContact OH-ND1 2.94Å; C187-H191 WeakPolarHBondContact O-CB 3.38Å; C187-H191 PolarHBondContact O-N 2.76Å; H191-H193 VanDerWaalsContact C-N 3.35Å; H191-H193 PolarHBondContact O-N 3.02Å; H191-P195 VanDerWaalsContact O-CA 3.28Å; H191-P195 WeakPolarHBondContact O-CA 3.41Å; H191-P195 WeakPolarHBondContact O-CB 3.43Å; H191-P195 WeakPolarHBondContact O-CD 3.17Å; H191-P195 VanDerWaalsContact O-N 3.16Å; H191-L198 HydrophobicContact CB-CD2 3.94Å; H191-L198 PolarHBondContact CD2-O 2.85Å; H191-F200 HydrophobicContact CB-CB 4.46Å; H191-F200 HydrophobicContact CB-CD2 4.47Å
192	R	86.8	Confident	87.3	Confident	126 Å²	126	44.7 Å²	44.7	48%	0.475	22%	0.222	S	C	.	.	H	α-helix	trans	-65.2	-37.4	179.5	-175.9	64.5	179	105.7	-4	112.9	K164 Y168 A188 I190	K164-R192 HydrophobicContact CB-CG 4.23Å; K164-R192 HydrophobicContact CD-CG 4.27Å; K164-R192 WeakPolarHBondContact O-CG 3.47Å; Y168-R192 HydrophobicContact CE2-CB 4.18Å; Y168-R192 WeakPolarHBondContact OH-CA 3.41Å; Y168-R192 PolarHBondContact OH-N 3.18Å; Y168-R192 VanDerWaalsContact OH-N 3.11Å; A188-R192 VanDerWaalsContact O-CB 3.27Å; A188-R192 WeakPolarHBondContact O-CB 3.1Å; A188-R192 PolarHBondContact O-N 2.71Å; I190-R192 VanDerWaalsContact C-N 3.26Å; I190-R192 PolarHBondContact O-N 2.89Å
193	H	83.9	Confident	87.2	Confident	33 Å²	33	44.9 Å²	44.9	15%	0.153	22%	0.223	C	C	.	.	H	α-helix	trans	-97.9	-30.9	-177.6	-61.5	90.2	0	0	0	112.1	W160 K164 L189 I190 H191 F256 E260	W160-H193 AromaticContact CZ2-CE1 3.55Å; W160-H193 AromaticContact CZ2-NE2 3.81Å; K164-H193 WeakPolarHBondContact CD-NE2 3.49Å; K164-H193 VanDerWaalsContact CE-NE2 3.29Å; K164-H193 WeakPolarHBondContact CE-NE2 3.2Å; K164-H193 PolarHBondContact NZ-NE2 3.04Å; L189-H193 PolarHBondContact O-ND1 3.48Å; I190-H193 PolarHBondContact O-N 2.99Å; H191-H193 VanDerWaalsContact C-N 3.35Å; H191-H193 PolarHBondContact O-N 3.02Å; H193-F256 HydrophobicContact CB-CB 4.44Å; H193-F256 HydrophobicContact CB-CD1 3.55Å; H193-F256 HydrophobicContact CB-CD2 4.09Å; H193-F256 HydrophobicContact CB-CE1 3.68Å; H193-F256 HydrophobicContact CB-CE2 4.19Å; H193-F256 HydrophobicContact CB-CG 3.78Å; H193-F256 HydrophobicContact CB-CZ 4Å; H193-F256 AromaticContact CD2-CG 3.83Å; H193-F256 AromaticContact CE1-CD2 3.77Å; H193-F256 AromaticContact CG-CD1 3.88Å; H193-F256 AromaticContact CG-CD2 3.65Å; H193-F256 AromaticContact CG-CG 3.54Å; H193-F256 AromaticContact ND1-CD2 3.39Å; H193-F256 WeakPolarHBondContact ND1-CD2 3.24Å; H193-F256 AromaticContact ND1-CE2 3.69Å; H193-F256 AromaticContact ND1-CG 3.81Å; H193-E260 IonicContact CD2-OE1 2.76Å; H193-E260 IonicContact NE2-OE1 3.11Å
194	R	83.4	Confident	87	Confident	101 Å²	101	49.2 Å²	49.2	38%	0.381	25%	0.246	S	C	.	.			trans	-136.5	74.4	-178.8	-69.3	-61.7	-61.6	-93.2	-3.2	110.2	I190 D196 L197 L223 F256	I190-R194 CarbonylContact O-C 3.35Å; I190-R194 WeakPolarHBondContact O-CA 3.48Å; I190-R194 PolarHBondContact O-N 3Å; R194-D196 VanDerWaalsContact C-OD1 3.24Å; R194-D196 VanDerWaalsContact CA-OD1 3.31Å; R194-D196 WeakPolarHBondContact CA-OD1 3.47Å; R194-D196 WeakPolarHBondContact CB-OD1 3.43Å; R194-D196 IonicContact CZ-OD1 3.07Å; R194-D196 IonicContact CZ-OD2 3.86Å; R194-D196 IonicContact NE-OD1 2.59Å; R194-D196 PolarHBondContact NE-OD1 2.73Å; R194-D196 IonicContact NE-OD2 2.8Å; R194-D196 PolarHBondContact NE-OD2 3.36Å; R194-D196 IonicContact NH2-OD1 3.2Å; R194-D196 IonicContact NH2-OD2 2.97Å; R194-D196 PolarHBondContact NH2-OD2 2.76Å; R194-D196 PolarHBondContact O-N 2.99Å; R194-L197 HydrophobicContact CB-CB 4.44Å; R194-L197 HydrophobicContact CB-CD1 3.66Å; R194-L197 HydrophobicContact CB-CG 3.94Å; R194-L197 HydrophobicContact CG-CD1 4.12Å; R194-L197 PolarHBondContact O-N 3.37Å; R194-L223 HydrophobicContact CG-CD2 4.49Å; R194-F256 HydrophobicContact CG-CE1 4.29Å
195	P	84.6	Confident	86.7	Confident	79 Å²	79	54.9 Å²	54.9	51%	0.513	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-18.2	-179.5	26.5	-34.1	0	0	0	112.8	H191 L197	H191-P195 VanDerWaalsContact O-CA 3.28Å; H191-P195 WeakPolarHBondContact O-CA 3.41Å; H191-P195 WeakPolarHBondContact O-CB 3.43Å; H191-P195 WeakPolarHBondContact O-CD 3.17Å; H191-P195 VanDerWaalsContact O-N 3.16Å; P195-L197 VanDerWaalsContact C-N 3.28Å; P195-L197 PolarHBondContact O-N 3.48Å
196	D	83.1	Confident	86.4	Confident	102 Å²	102	61.4 Å²	61.4	55%	0.545	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-23.7	175.8	60.1	-53.5	0	0	0	113.9	R194	R194-D196 VanDerWaalsContact C-OD1 3.24Å; R194-D196 VanDerWaalsContact CA-OD1 3.31Å; R194-D196 WeakPolarHBondContact CA-OD1 3.47Å; R194-D196 WeakPolarHBondContact CB-OD1 3.43Å; R194-D196 IonicContact CZ-OD1 3.07Å; R194-D196 IonicContact CZ-OD2 3.86Å; R194-D196 IonicContact NE-OD1 2.59Å; R194-D196 PolarHBondContact NE-OD1 2.73Å; R194-D196 IonicContact NE-OD2 2.8Å; R194-D196 PolarHBondContact NE-OD2 3.36Å; R194-D196 IonicContact NH2-OD1 3.2Å; R194-D196 IonicContact NH2-OD2 2.97Å; R194-D196 PolarHBondContact NH2-OD2 2.76Å; R194-D196 PolarHBondContact O-N 2.99Å
197	L	84.8	Confident	86.3	Confident	36 Å²	36	65.4 Å²	65.4	19%	0.188	33%	0.327	C	S	.	.	S	Bend	trans	-91.9	-19.3	-171.3	-63.3	180	0	0	0	114.5	I190 R194 P195 I218 H222 L223	I190-L197 HydrophobicContact CG2-CB 4.46Å; R194-L197 HydrophobicContact CB-CB 4.44Å; R194-L197 HydrophobicContact CB-CD1 3.66Å; R194-L197 HydrophobicContact CB-CG 3.94Å; R194-L197 HydrophobicContact CG-CD1 4.12Å; R194-L197 PolarHBondContact O-N 3.37Å; P195-L197 VanDerWaalsContact C-N 3.28Å; P195-L197 PolarHBondContact O-N 3.48Å; L197-I218 HydrophobicContact CB-CG2 4Å; L197-I218 HydrophobicContact CD1-CG2 4.25Å; L197-H222 HydrophobicContact CD1-CB 3.82Å; L197-H222 HydrophobicContact CD2-CB 4.02Å; L197-L223 HydrophobicContact CD1-CD2 3.99Å; L197-L223 HydrophobicContact CD1-CG 4.49Å
198	L	86.1	Confident	86.1	Confident	11 Å²	11	67.1 Å²	67.1	6%	0.058	34%	0.338	C	S	.	.			trans	-147.2	136.6	-172.6	179.4	139.1	0	0	0	110.9	C187 H191 F200 L203 L214 I218	C187-L198 HydrophobicContact CB-CD1 3.9Å; C187-L198 HydrophobicContact CB-CD2 4.21Å; H191-L198 HydrophobicContact CB-CD2 3.94Å; H191-L198 PolarHBondContact CD2-O 2.85Å; L198-F200 HydrophobicContact CD2-CB 4.04Å; L198-F200 HydrophobicContact CD2-CD2 4.07Å; L198-L203 HydrophobicContact CD1-CD1 4.34Å; L198-L203 HydrophobicContact CD2-CD1 3.93Å; L198-L214 HydrophobicContact CD1-CD2 3.85Å; L198-L214 HydrophobicContact CD1-CG 4.19Å; L198-I218 HydrophobicContact CB-CD1 4Å; L198-I218 HydrophobicContact CD1-CD1 3.71Å; L198-I218 HydrophobicContact CG-CD1 4.32Å
199	D	86.4	Confident	86	Confident	74 Å²	74	70.4 Å²	70.4	40%	0.396	36%	0.355	S	S	.	.			trans	-97.1	101.5	171.8	-177.1	-4.9	0	0	0	110.3	S201 K202	D199-S201 PolarHBondContact O-N 2.69Å; D199-S201 WeakPolarHBondContact OD1-CB 3.49Å; D199-S201 PolarHBondContact OD1-N 3.11Å; D199-S201 VanDerWaalsContact OD1-N 3.11Å; D199-S201 PolarHBondContact OD1-OG 2.8Å; D199-K202 PolarHBondContact O-N 2.94Å; D199-K202 IonicContact OD2-NZ 3.91Å; D199-K202 PolarHBondContact OD2-NZ 3.35Å
200	F	86.9	Confident	86	Confident	29 Å²	29	71.7 Å²	71.7	13%	0.127	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-66.8	-22.5	-175	-162.9	-90.2	0	0	0	113.1	Y168 V171 C187 A188 H191 L198 K202 L203	Y168-F200 AromaticContact CD1-CD1 3.6Å; Y168-F200 HydrophobicContact CD1-CD1 3.6Å; Y168-F200 HydrophobicContact CD1-CD2 4.04Å; Y168-F200 AromaticContact CD1-CE1 3.47Å; Y168-F200 HydrophobicContact CD1-CE1 3.47Å; Y168-F200 VanDerWaalsContact CD1-CE1 3.47Å; Y168-F200 AromaticContact CD1-CE2 3.93Å; Y168-F200 HydrophobicContact CD1-CE2 3.93Å; Y168-F200 AromaticContact CD1-CG 3.89Å; Y168-F200 HydrophobicContact CD1-CG 3.89Å; Y168-F200 AromaticContact CD1-CZ 3.64Å; Y168-F200 HydrophobicContact CD1-CZ 3.64Å; Y168-F200 HydrophobicContact CE1-CB 4.34Å; Y168-F200 AromaticContact CE1-CD1 3.92Å; Y168-F200 HydrophobicContact CE1-CD1 3.92Å; Y168-F200 AromaticContact CE1-CD2 3.89Å; Y168-F200 HydrophobicContact CE1-CD2 3.89Å; Y168-F200 HydrophobicContact CE1-CE1 4.21Å; Y168-F200 HydrophobicContact CE1-CE2 4.19Å; Y168-F200 AromaticContact CE1-CG 3.76Å; Y168-F200 HydrophobicContact CE1-CG 3.76Å; Y168-F200 HydrophobicContact CE1-CZ 4.33Å; Y168-F200 HydrophobicContact CG-CE1 4.32Å; Y168-F200 HydrophobicContact CG-CZ 4.23Å; V171-F200 HydrophobicContact CG2-CZ 3.94Å; C187-F200 HydrophobicContact CB-CD2 4.26Å; C187-F200 HydrophobicContact CB-CE2 4.09Å; A188-F200 HydrophobicContact CB-CD2 4.47Å; A188-F200 HydrophobicContact CB-CE2 3.67Å; A188-F200 HydrophobicContact CB-CZ 4.17Å; H191-F200 HydrophobicContact CB-CB 4.46Å; H191-F200 HydrophobicContact CB-CD2 4.47Å; L198-F200 HydrophobicContact CD2-CB 4.04Å; L198-F200 HydrophobicContact CD2-CD2 4.07Å; F200-K202 PolarHBondContact O-N 3.32Å; F200-L203 HydrophobicContact CD2-CD1 4Å; F200-L203 HydrophobicContact CE2-CD1 4.27Å; F200-L203 PolarHBondContact O-N 2.87Å
201	S	83.8	Confident	86.1	Confident	103 Å²	103	71.9 Å²	71.9	72%	0.72	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-68.7	-21.5	-177.1	70.1	0	0	0	0	113.8	D199	D199-S201 PolarHBondContact O-N 2.69Å; D199-S201 WeakPolarHBondContact OD1-CB 3.49Å; D199-S201 PolarHBondContact OD1-N 3.11Å; D199-S201 VanDerWaalsContact OD1-N 3.11Å; D199-S201 PolarHBondContact OD1-OG 2.8Å
202	K	84.9	Confident	86.1	Confident	163 Å²	163	69.6 Å²	69.6	71%	0.709	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-87.7	-7.2	-178.2	-63.7	-169.3	176.1	98	0	113.9	D199 F200	D199-K202 PolarHBondContact O-N 2.94Å; D199-K202 IonicContact OD2-NZ 3.91Å; D199-K202 PolarHBondContact OD2-NZ 3.35Å; F200-K202 PolarHBondContact O-N 3.32Å
203	L	85.7	Confident	86.3	Confident	31 Å²	31	66.6 Å²	66.6	16%	0.162	35%	0.353	C	S	.	.			trans	-88.2	137.7	-175	-56.4	178.7	0	0	0	111.3	L184 C187 L198 F200 L214	L184-L203 HydrophobicContact CD2-CB 3.75Å; L184-L203 HydrophobicContact CD2-CD1 4.44Å; C187-L203 HydrophobicContact CB-CD1 3.38Å; C187-L203 VanDerWaalsContact SG-CD1 3.6Å; L198-L203 HydrophobicContact CD1-CD1 4.34Å; L198-L203 HydrophobicContact CD2-CD1 3.93Å; F200-L203 HydrophobicContact CD2-CD1 4Å; F200-L203 HydrophobicContact CE2-CD1 4.27Å; F200-L203 PolarHBondContact O-N 2.87Å; L203-L214 HydrophobicContact CD2-CD2 3.66Å
204	N	83.6	Confident	86.6	Confident	90 Å²	90	68.2 Å²	68.2	48%	0.481	36%	0.362	S	S	.	.			trans	-124.9	145.1	177	-170.8	11.5	0	0	0	110.9	D206 D207 N211	N204-D206 PolarHBondContact ND2-OD2 3.03Å; N204-D206 PolarHBondContact O-N 3.47Å; N204-D207 PolarHBondContact O-N 3.4Å; N204-N211 PolarHBondContact O-ND2 2.88Å
205	K	84.1	Confident	86.9	Confident	124 Å²	124	63.4 Å²	63.4	54%	0.539	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-26.1	177.9	-170	173.3	-176.9	174	0	113.1	D182 L184 D207	D182-K205 HydrophobicContact CB-CG 4.07Å; D182-K205 WeakPolarHBondContact OD2-CE 3.49Å; L184-K205 HydrophobicContact CD1-CB 3.99Å; L184-K205 HydrophobicContact CD1-CG 4.34Å; K205-D207 PolarHBondContact O-N 3.37Å
206	D	85.1	Confident	87.3	Confident	136 Å²	136	59.7 Å²	59.7	73%	0.727	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-7.8	-178.8	-55	-45.3	0	0	0	113.9	N204 P208	N204-D206 PolarHBondContact ND2-OD2 3.03Å; N204-D206 PolarHBondContact O-N 3.47Å; D206-P208 WeakPolarHBondContact O-CD 3.44Å
207	D	89.4	Confident	87.6	Confident	85 Å²	85	57.6 Å²	57.6	46%	0.455	31%	0.309	S	S	.	.			trans	-119.2	70.7	172.9	-175.7	18	0	0	0	112.8	N204 K205 L209 G210 N211	N204-D207 PolarHBondContact O-N 3.4Å; K205-D207 PolarHBondContact O-N 3.37Å; D207-L209 VanDerWaalsContact C-N 3.26Å; D207-L209 PolarHBondContact O-N 3.47Å; D207-G210 PolarHBondContact O-N 2.94Å; D207-G210 PolarHBondContact OD1-N 2.9Å; D207-N211 PolarHBondContact O-N 3.34Å; D207-N211 PolarHBondContact O-ND2 2.95Å
208	P	86.2	Confident	87.8	Confident	37 Å²	37	56.6 Å²	56.6	24%	0.24	30%	0.303	C	S	.	.	H	α-helix	trans	-59.2	-35.1	177.2	-26.7	36.5	0	0	0	113.9	D206 L212 I235	D206-P208 WeakPolarHBondContact O-CD 3.44Å; P208-L212 WeakPolarHBondContact O-CB 3.24Å; P208-L212 VanDerWaalsContact O-CG 3.28Å; P208-L212 WeakPolarHBondContact O-CG 2.94Å; P208-L212 PolarHBondContact O-N 3.09Å; P208-L212 VanDerWaalsContact O-N 3.07Å; P208-I235 HydrophobicContact CB-CD1 3.84Å; P208-I235 HydrophobicContact CB-CG1 4.04Å
209	L	89	Confident	87.9	Confident	69 Å²	69	56.1 Å²	56.1	36%	0.361	30%	0.301	S	S	.	.	H	α-helix	trans	-70.4	-42.4	-175.4	-171.4	71.1	0	0	0	111.1	D207 N213 A231 E232 I235	D207-L209 VanDerWaalsContact C-N 3.26Å; D207-L209 PolarHBondContact O-N 3.47Å; L209-N213 WeakPolarHBondContact O-CB 3.49Å; L209-N213 PolarHBondContact O-N 3.22Å; L209-N213 PolarHBondContact O-ND2 2.81Å; L209-A231 HydrophobicContact CD1-CB 3.87Å; L209-E232 HydrophobicContact CD1-CG 3.88Å; L209-I235 HydrophobicContact CB-CD1 3.66Å; L209-I235 HydrophobicContact CD1-CD1 3.73Å; L209-I235 HydrophobicContact CG-CD1 4.31Å
210	G	89.1	Confident	87.9	Confident	28 Å²	28	56.8 Å²	56.8	29%	0.289	30%	0.301	S	S	.	.	H	α-helix	trans	-64.9	-45.8	174.4	0	0	0	0	0	112.5	D207 L212 N213 L214	D207-G210 PolarHBondContact O-N 2.94Å; D207-G210 PolarHBondContact OD1-N 2.9Å; G210-L212 PolarHBondContact O-N 2.77Å; G210-N213 PolarHBondContact O-N 3.4Å; G210-L214 VanDerWaalsContact O-CB 3.31Å; G210-L214 WeakPolarHBondContact O-CB 3.37Å; G210-L214 PolarHBondContact O-N 3.29Å
211	N	90.6	Very high	87.9	Confident	4 Å²	4	62.4 Å²	62.4	2%	0.021	33%	0.326	C	S	.	.	H	α-helix	trans	-61.9	-45.6	-178.9	-65.2	-22.9	0	0	0	112.5	D182 C187 N204 D207 A215	D182-N211 WeakPolarHBondContact O-CB 3.37Å; D182-N211 PolarHBondContact O-ND2 3.37Å; C187-N211 PolarHBondContact SG-O 2.95Å; N204-N211 PolarHBondContact O-ND2 2.88Å; D207-N211 PolarHBondContact O-N 3.34Å; D207-N211 PolarHBondContact O-ND2 2.95Å; N211-A215 PolarHBondContact O-N 3.42Å; N211-A215 VanDerWaalsContact O-N 3.09Å
212	L	90.4	Very high	88	Confident	0 Å²	0	63 Å²	63	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-64.5	-48.6	-179.9	-73.9	168.3	0	0	0	111.5	F186 P208 G210 L214 A215 F216 A231 I234 I235	F186-L212 HydrophobicContact CD2-CD2 3.77Å; F186-L212 HydrophobicContact CE2-CD2 3.97Å; P208-L212 WeakPolarHBondContact O-CB 3.24Å; P208-L212 VanDerWaalsContact O-CG 3.28Å; P208-L212 WeakPolarHBondContact O-CG 2.94Å; P208-L212 PolarHBondContact O-N 3.09Å; P208-L212 VanDerWaalsContact O-N 3.07Å; G210-L212 PolarHBondContact O-N 2.77Å; L212-L214 VanDerWaalsContact C-N 3.34Å; L212-L214 PolarHBondContact O-N 3.01Å; L212-A215 PolarHBondContact O-N 3.39Å; L212-F216 HydrophobicContact CB-CE2 4.11Å; L212-F216 HydrophobicContact CB-CZ 4.24Å; L212-F216 HydrophobicContact CD2-CE1 4.34Å; L212-F216 HydrophobicContact CD2-CE2 4.45Å; L212-F216 HydrophobicContact CD2-CZ 3.8Å; L212-F216 WeakPolarHBondContact O-CD1 3.38Å; L212-F216 WeakPolarHBondContact O-CD2 3.28Å; L212-F216 WeakPolarHBondContact O-CG 3.2Å; L212-F216 PolarHBondContact O-N 2.78Å; L212-A231 HydrophobicContact CB-CB 3.7Å; L212-A231 HydrophobicContact CD1-CB 4.23Å; L212-I234 HydrophobicContact CD1-CB 4.19Å; L212-I234 HydrophobicContact CD1-CD1 4.42Å; L212-I234 HydrophobicContact CD1-CG2 3.99Å; L212-I234 HydrophobicContact CD2-CD1 4.34Å; L212-I235 HydrophobicContact CD1-CD1 4.24Å; L212-I235 HydrophobicContact CD1-CG1 4.11Å
213	N	91.3	Very high	87.9	Confident	64 Å²	64	56.7 Å²	56.7	34%	0.342	29%	0.291	S	S	.	.	H	α-helix	trans	-63.3	-39.7	179.5	-77.7	-51.1	0	0	0	112.3	L209 G210 F216 D217	L209-N213 WeakPolarHBondContact O-CB 3.49Å; L209-N213 PolarHBondContact O-N 3.22Å; L209-N213 PolarHBondContact O-ND2 2.81Å; G210-N213 PolarHBondContact O-N 3.4Å; N213-F216 PolarHBondContact O-N 2.83Å; N213-D217 WeakPolarHBondContact O-CB 3.38Å; N213-D217 PolarHBondContact O-N 2.72Å
214	L	90.4	Very high	87.8	Confident	67 Å²	67	60 Å²	60	35%	0.351	31%	0.309	S	S	.	.	H	α-helix	trans	-60.9	-47.5	176	179.4	66	0	0	0	111.7	L198 L203 G210 L212 F216 D217 I218	L198-L214 HydrophobicContact CD1-CD2 3.85Å; L198-L214 HydrophobicContact CD1-CG 4.19Å; L203-L214 HydrophobicContact CD2-CD2 3.66Å; G210-L214 VanDerWaalsContact O-CB 3.31Å; G210-L214 WeakPolarHBondContact O-CB 3.37Å; G210-L214 PolarHBondContact O-N 3.29Å; L212-L214 VanDerWaalsContact C-N 3.34Å; L212-L214 PolarHBondContact O-N 3.01Å; L214-F216 VanDerWaalsContact C-N 3.33Å; L214-F216 PolarHBondContact O-N 2.95Å; L214-D217 PolarHBondContact O-N 2.77Å; L214-I218 HydrophobicContact CD1-CD1 3.81Å; L214-I218 HydrophobicContact CD1-CG1 4.33Å; L214-I218 HydrophobicContact CG-CD1 3.9Å; L214-I218 WeakPolarHBondContact O-CG1 3.33Å; L214-I218 PolarHBondContact O-N 3.4Å
215	A	90.4	Very high	87.9	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.8	-44	178.4	0	0	0	0	0	111.6	F186 I190 N211 L212 I218 A219	F186-A215 HydrophobicContact CB-CB 3.63Å; I190-A215 HydrophobicContact CD1-CB 4.08Å; N211-A215 PolarHBondContact O-N 3.42Å; N211-A215 VanDerWaalsContact O-N 3.09Å; L212-A215 PolarHBondContact O-N 3.39Å; A215-I218 PolarHBondContact O-N 3.35Å; A215-A219 VanDerWaalsContact O-CB 3.25Å; A215-A219 WeakPolarHBondContact O-CB 3.23Å; A215-A219 PolarHBondContact O-N 3.28Å
216	F	92.1	Very high	87.8	Confident	1 Å²	1	51.5 Å²	51.5	0%	0.004	27%	0.27	C	S	.	.	H	α-helix	trans	-69.1	-37.2	-179.2	-57.9	-15.7	0	0	0	112.1	F186 L212 N213 L214 E220 K227 L229 A231 I234 Y248	F186-F216 HydrophobicContact CD2-CE1 4.02Å; F186-F216 HydrophobicContact CE2-CE1 4.05Å; F186-F216 HydrophobicContact CE2-CZ 4.3Å; F186-F216 HydrophobicContact CG-CE1 4.27Å; F186-F216 HydrophobicContact CZ-CE1 4.34Å; L212-F216 HydrophobicContact CB-CE2 4.11Å; L212-F216 HydrophobicContact CB-CZ 4.24Å; L212-F216 HydrophobicContact CD2-CE1 4.34Å; L212-F216 HydrophobicContact CD2-CE2 4.45Å; L212-F216 HydrophobicContact CD2-CZ 3.8Å; L212-F216 WeakPolarHBondContact O-CD1 3.38Å; L212-F216 WeakPolarHBondContact O-CD2 3.28Å; L212-F216 WeakPolarHBondContact O-CG 3.2Å; L212-F216 PolarHBondContact O-N 2.78Å; N213-F216 PolarHBondContact O-N 2.83Å; L214-F216 VanDerWaalsContact C-N 3.33Å; L214-F216 PolarHBondContact O-N 2.95Å; F216-E220 PolarHBondContact O-N 3.45Å; F216-E220 VanDerWaalsContact O-N 3.08Å; F216-K227 HydrophobicContact CB-CD 4Å; F216-K227 HydrophobicContact CB-CG 4.05Å; F216-L229 HydrophobicContact CE2-CB 3.85Å; F216-L229 WeakPolarHBondContact CE2-O 3.43Å; F216-L229 HydrophobicContact CZ-CB 3.76Å; F216-L229 HydrophobicContact CZ-CD1 4.23Å; F216-A231 HydrophobicContact CE2-CB 4.44Å; F216-I234 HydrophobicContact CE2-CD1 4.44Å; F216-I234 HydrophobicContact CZ-CD1 4.07Å; F216-Y248 HydrophobicContact CD1-CD1 4.41Å; F216-Y248 AromaticContact CD1-CE1 3.37Å; F216-Y248 HydrophobicContact CD1-CE1 3.37Å; F216-Y248 AromaticContact CD1-CZ 3.86Å; F216-Y248 AromaticContact CE1-CD1 3.98Å; F216-Y248 HydrophobicContact CE1-CD1 3.98Å; F216-Y248 AromaticContact CE1-CE1 3.34Å; F216-Y248 HydrophobicContact CE1-CE1 3.34Å; F216-Y248 HydrophobicContact CG-CE1 4.36Å; F216-Y248 HydrophobicContact CZ-CE1 4.31Å
217	D	89.4	Confident	87.9	Confident	58 Å²	58	48.6 Å²	48.6	31%	0.31	25%	0.251	S	S	.	.	H	α-helix	trans	-64	-44	174.6	-87.6	-27.2	0	0	0	112.6	N213 L214 E220 K221 K227	N213-D217 WeakPolarHBondContact O-CB 3.38Å; N213-D217 PolarHBondContact O-N 2.72Å; L214-D217 PolarHBondContact O-N 2.77Å; D217-E220 PolarHBondContact O-N 3.27Å; D217-K221 WeakPolarHBondContact O-CB 3.39Å; D217-K221 WeakPolarHBondContact O-CG 3.47Å; D217-K221 PolarHBondContact O-N 3.29Å; D217-K227 WeakPolarHBondContact OD1-CE 3.44Å; D217-K227 IonicContact OD1-NZ 3.13Å; D217-K227 PolarHBondContact OD1-NZ 2.62Å
218	I	88.9	Confident	87.7	Confident	15 Å²	15	44.8 Å²	44.8	8%	0.077	23%	0.231	C	C	.	.	H	α-helix	trans	-67.5	-42.2	178.5	-68.8	167.9	0	0	0	110.2	I190 L197 L198 L214 A215 E220 K221 H222	I190-I218 HydrophobicContact CD1-CG2 4.45Å; I190-I218 HydrophobicContact CG2-CG2 3.96Å; L197-I218 HydrophobicContact CB-CG2 4Å; L197-I218 HydrophobicContact CD1-CG2 4.25Å; L198-I218 HydrophobicContact CB-CD1 4Å; L198-I218 HydrophobicContact CD1-CD1 3.71Å; L198-I218 HydrophobicContact CG-CD1 4.32Å; L214-I218 HydrophobicContact CD1-CD1 3.81Å; L214-I218 HydrophobicContact CD1-CG1 4.33Å; L214-I218 HydrophobicContact CG-CD1 3.9Å; L214-I218 WeakPolarHBondContact O-CG1 3.33Å; L214-I218 PolarHBondContact O-N 3.4Å; A215-I218 PolarHBondContact O-N 3.35Å; I218-E220 VanDerWaalsContact C-N 3.31Å; I218-E220 PolarHBondContact O-N 3.05Å; I218-K221 PolarHBondContact O-N 2.72Å; I218-H222 WeakPolarHBondContact O-CB 3.37Å; I218-H222 PolarHBondContact O-N 3.34Å
219	A	88.3	Confident	87.8	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-58.6	-43.1	177.8	0	0	0	0	0	111.9	A215 L223 D224 I225 F252	A215-A219 VanDerWaalsContact O-CB 3.25Å; A215-A219 WeakPolarHBondContact O-CB 3.23Å; A215-A219 PolarHBondContact O-N 3.28Å; A219-L223 CarbonylContact O-C 3.5Å; A219-L223 WeakPolarHBondContact O-CA 3.32Å; A219-L223 WeakPolarHBondContact O-CB 3.31Å; A219-L223 PolarHBondContact O-N 3.34Å; A219-L223 VanDerWaalsContact O-N 3.14Å; A219-D224 PolarHBondContact O-N 3.27Å; A219-D224 VanDerWaalsContact O-N 3.12Å; A219-I225 CarbonylContact C-O 3.52Å; A219-I225 VanDerWaalsContact C-O 3.31Å; A219-I225 HydrophobicContact CB-CB 4.1Å; A219-I225 PolarHBondContact O-N 2.76Å; A219-F252 HydrophobicContact CB-CE1 3.82Å; A219-F252 HydrophobicContact CB-CZ 3.49Å; A219-F252 VanDerWaalsContact CB-CZ 3.49Å
220	E	87.1	Confident	87.6	Confident	88 Å²	88	43 Å²	43	41%	0.411	22%	0.22	S	C	.	.	H	α-helix	trans	-71.4	-46.7	178.9	-175.5	173	-137.6	0	0	112.6	F216 D217 I218 I225 K227	F216-E220 PolarHBondContact O-N 3.45Å; F216-E220 VanDerWaalsContact O-N 3.08Å; D217-E220 PolarHBondContact O-N 3.27Å; I218-E220 VanDerWaalsContact C-N 3.31Å; I218-E220 PolarHBondContact O-N 3.05Å; E220-I225 WeakPolarHBondContact CA-O 3.08Å; E220-I225 PolarHBondContact N-O 3.26Å; E220-K227 HydrophobicContact CB-CG 4.21Å; E220-K227 WeakPolarHBondContact OE2-CE 3.44Å; E220-K227 IonicContact OE2-NZ 2.77Å; E220-K227 PolarHBondContact OE2-NZ 3.05Å
221	K	86.9	Confident	87.4	Confident	148 Å²	148	41.7 Å²	41.7	64%	0.643	21%	0.206	S	C	*	.	H	α-helix	trans	-75.3	-36.1	-173.8	-71.8	174.8	-178.2	165.6	0	113.8	D217 I218	D217-K221 WeakPolarHBondContact O-CB 3.39Å; D217-K221 WeakPolarHBondContact O-CG 3.47Å; D217-K221 PolarHBondContact O-N 3.29Å; I218-K221 PolarHBondContact O-N 2.72Å
222	H	85.2	Confident	87.1	Confident	116 Å²	116	47 Å²	47	54%	0.537	23%	0.231	S	C	.	.	H	α-helix	trans	-116	-21.8	-168.9	-65.4	-71.7	0	0	0	114.2	L197 I218	L197-H222 HydrophobicContact CD1-CB 3.82Å; L197-H222 HydrophobicContact CD2-CB 4.02Å; I218-H222 WeakPolarHBondContact O-CB 3.37Å; I218-H222 PolarHBondContact O-N 3.34Å
223	L	82.6	Confident	86.7	Confident	29 Å²	29	48.9 Å²	48.9	15%	0.152	24%	0.241	C	C	.	.	H	α-helix	trans	-113.5	-0.5	-178.5	-52.6	176.8	0	0	0	113	I190 R194 L197 A219 I225 F252 F256	I190-L223 HydrophobicContact CG1-CD1 4.31Å; R194-L223 HydrophobicContact CG-CD2 4.49Å; L197-L223 HydrophobicContact CD1-CD2 3.99Å; L197-L223 HydrophobicContact CD1-CG 4.49Å; A219-L223 CarbonylContact O-C 3.5Å; A219-L223 WeakPolarHBondContact O-CA 3.32Å; A219-L223 WeakPolarHBondContact O-CB 3.31Å; A219-L223 PolarHBondContact O-N 3.34Å; A219-L223 VanDerWaalsContact O-N 3.14Å; L223-I225 HydrophobicContact CB-CD1 4.02Å; L223-I225 HydrophobicContact CB-CG1 4.1Å; L223-I225 HydrophobicContact CD1-CD1 4.44Å; L223-I225 PolarHBondContact O-N 3.49Å; L223-F252 HydrophobicContact CD1-CD1 4.37Å; L223-F252 HydrophobicContact CD1-CE1 4.09Å; L223-F256 HydrophobicContact CD1-CE1 3.98Å; L223-F256 HydrophobicContact CD1-CZ 3.7Å; L223-F256 HydrophobicContact CD2-CE1 4.08Å
224	D	83.1	Confident	86.4	Confident	102 Å²	102	45.8 Å²	45.8	55%	0.545	22%	0.224	S	C	.	.			trans	52.1	31.4	-174.8	-171.1	32	0	0	0	113.7	R53 A219	R53-D224 IonicContact CZ-OD1 2.69Å; R53-D224 IonicContact CZ-OD2 3Å; R53-D224 IonicContact NH1-OD1 2.71Å; R53-D224 PolarHBondContact NH1-OD1 3.3Å; R53-D224 VanDerWaalsContact NH2-CG 3.29Å; R53-D224 PolarHBondContact NH2-O 3.27Å; R53-D224 IonicContact NH2-OD1 2.62Å; R53-D224 PolarHBondContact NH2-OD1 2.9Å; R53-D224 IonicContact NH2-OD2 2.75Å; R53-D224 PolarHBondContact NH2-OD2 3.33Å; R53-D224 VanDerWaalsContact NH2-OD2 3.12Å; A219-D224 PolarHBondContact O-N 3.27Å; A219-D224 VanDerWaalsContact O-N 3.12Å
225	I	85.8	Confident	86.1	Confident	8 Å²	8	44.8 Å²	44.8	4%	0.041	22%	0.219	C	C	.	.			trans	-98	111.6	173.7	-59	172.1	0	0	0	107.7	A219 E220 L223 Y248 C251 F252 A255	A219-I225 CarbonylContact C-O 3.52Å; A219-I225 VanDerWaalsContact C-O 3.31Å; A219-I225 HydrophobicContact CB-CB 4.1Å; A219-I225 PolarHBondContact O-N 2.76Å; E220-I225 WeakPolarHBondContact CA-O 3.08Å; E220-I225 PolarHBondContact N-O 3.26Å; L223-I225 HydrophobicContact CB-CD1 4.02Å; L223-I225 HydrophobicContact CB-CG1 4.1Å; L223-I225 HydrophobicContact CD1-CD1 4.44Å; L223-I225 PolarHBondContact O-N 3.49Å; I225-Y248 HydrophobicContact CG2-CD2 4.44Å; I225-Y248 HydrophobicContact CG2-CE2 3.7Å; I225-C251 HydrophobicContact CG2-CB 3.93Å; I225-F252 HydrophobicContact CD1-CB 4.49Å; I225-F252 HydrophobicContact CD1-CD1 3.67Å; I225-F252 HydrophobicContact CD1-CD2 4.32Å; I225-F252 HydrophobicContact CD1-CE1 3.91Å; I225-F252 HydrophobicContact CD1-CG 3.91Å; I225-F252 HydrophobicContact CD1-CZ 4.35Å; I225-A255 HydrophobicContact CD1-CB 3.94Å; I225-A255 HydrophobicContact CG1-CB 4.44Å
226	P	83.6	Confident	85.7	Confident	26 Å²	26	50.8 Å²	50.8	17%	0.169	25%	0.251	C	S	.	.			trans	-69.3	152.6	-173.6	28.5	-34	0	0	0	111.6	M228 Y248	P226-M228 HydrophobicContact CG-CE 3.6Å; P226-M228 HydrophobicContact CG-CG 4.39Å; P226-M228 WeakPolarHBondContact O-CG 3.32Å; P226-M228 PolarHBondContact O-N 2.7Å; P226-Y248 WeakPolarHBondContact O-CE2 3.02Å
227	K	87.1	Confident	85.1	Confident	75 Å²	75	51.9 Å²	51.9	33%	0.326	26%	0.258	S	S	.	.			trans	-69	102.6	176.6	-59.4	-163.6	-180	104.4	0	111.1	F216 D217 E220	F216-K227 HydrophobicContact CB-CD 4Å; F216-K227 HydrophobicContact CB-CG 4.05Å; D217-K227 WeakPolarHBondContact OD1-CE 3.44Å; D217-K227 IonicContact OD1-NZ 3.13Å; D217-K227 PolarHBondContact OD1-NZ 2.62Å; E220-K227 HydrophobicContact CB-CG 4.21Å; E220-K227 WeakPolarHBondContact OE2-CE 3.44Å; E220-K227 IonicContact OE2-NZ 2.77Å; E220-K227 PolarHBondContact OE2-NZ 3.05Å
228	M	85.1	Confident	84.6	Confident	6 Å²	6	54.2 Å²	54.2	3%	0.03	28%	0.276	C	S	.	.			trans	-97.3	-20	179.7	-52.4	-173.7	-173.5	0	0	113.1	T43 A46 W47 P226 T247 Y248	T43-M228 VanDerWaalsContact CA-O 3.27Å; T43-M228 WeakPolarHBondContact CA-O 3.3Å; T43-M228 HydrophobicContact CG2-CB 3.84Å; T43-M228 PolarHBondContact OG1-O 3.11Å; A46-M228 HydrophobicContact CB-CB 3.89Å; A46-M228 HydrophobicContact CB-CG 3.79Å; W47-M228 HydrophobicContact CB-CE 4.23Å; W47-M228 HydrophobicContact CB-SD 3.74Å; W47-M228 HydrophobicContact CG-CE 4.46Å; W47-M228 HydrophobicContact CG-SD 4.31Å; P226-M228 HydrophobicContact CG-CE 3.6Å; P226-M228 HydrophobicContact CG-CG 4.39Å; P226-M228 WeakPolarHBondContact O-CG 3.32Å; P226-M228 PolarHBondContact O-N 2.7Å; M228-T247 HydrophobicContact SD-CG2 4.44Å; M228-Y248 HydrophobicContact CB-CD2 3.71Å; M228-Y248 HydrophobicContact CB-CE2 4.17Å; M228-Y248 HydrophobicContact CG-CD2 3.79Å; M228-Y248 HydrophobicContact CG-CE2 4.08Å; M228-Y248 HydrophobicContact SD-CD2 4.06Å
229	L	86.9	Confident	84.3	Confident	10 Å²	10	59.8 Å²	59.8	5%	0.052	30%	0.3	C	S	.	.	S	Bend	trans	-111.9	144.5	-178	-64.5	176.4	0	0	0	110.8	T43 F186 F216 I234 A244 I245 Y248	T43-L229 HydrophobicContact CG2-CD2 3.9Å; T43-L229 WeakPolarHBondContact OG1-CD2 3.4Å; F186-L229 HydrophobicContact CZ-CD1 4.04Å; F216-L229 HydrophobicContact CE2-CB 3.85Å; F216-L229 WeakPolarHBondContact CE2-O 3.43Å; F216-L229 HydrophobicContact CZ-CB 3.76Å; F216-L229 HydrophobicContact CZ-CD1 4.23Å; L229-I234 HydrophobicContact CB-CD1 3.94Å; L229-I234 HydrophobicContact CD1-CD1 4.01Å; L229-I234 HydrophobicContact CG-CD1 4.44Å; L229-A244 HydrophobicContact CD2-CB 3.86Å; L229-I245 HydrophobicContact CD1-CG1 4.24Å; L229-Y248 HydrophobicContact CD1-CD1 3.56Å; L229-Y248 HydrophobicContact CD1-CE1 4.48Å; L229-Y248 HydrophobicContact CD1-CG 3.83Å; L229-Y248 HydrophobicContact CG-CD1 4.1Å; L229-Y248 HydrophobicContact CG-CG 4.04Å
230	D	85.3	Confident	84.2	Confident	58 Å²	58	59.8 Å²	59.8	31%	0.31	30%	0.3	S	S	.	.			trans	-99.5	124.9	173.8	-166.5	-27.2	0	0	0	109	K42 E232 D233 I234	K42-D230 HydrophobicContact CD-CB 4.47Å; K42-D230 IonicContact NZ-OD2 3.09Å; K42-D230 PolarHBondContact NZ-OD2 2.7Å; D230-E232 VanDerWaalsContact C-N 3.27Å; D230-E232 PolarHBondContact O-N 3.49Å; D230-E232 PolarHBondContact OD1-N 3.23Å; D230-D233 HydrophobicContact CB-CB 4.08Å; D230-D233 WeakPolarHBondContact CB-OD2 3.41Å; D230-D233 PolarHBondContact O-N 3.41Å; D230-I234 WeakPolarHBondContact O-CG1 3.34Å; D230-I234 PolarHBondContact O-N 3.03Å
231	A	85.6	Confident	84.2	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.008	29%	0.286	C	S	.	.	H	α-helix	trans	-65.3	-33.1	-176.1	0	0	0	0	0	111.9	L209 L212 F216 I235	L209-A231 HydrophobicContact CD1-CB 3.87Å; L212-A231 HydrophobicContact CB-CB 3.7Å; L212-A231 HydrophobicContact CD1-CB 4.23Å; F216-A231 HydrophobicContact CE2-CB 4.44Å; A231-I235 WeakPolarHBondContact O-CD1 3.45Å; A231-I235 VanDerWaalsContact O-CG1 3.31Å; A231-I235 WeakPolarHBondContact O-CG1 3.44Å; A231-I235 PolarHBondContact O-N 2.99Å
232	E	83.4	Confident	84.1	Confident	115 Å²	115	52.4 Å²	52.4	54%	0.537	27%	0.268	S	S	.	.	H	α-helix	trans	-69.2	-40.3	178.8	-64.1	-175.5	177.9	0	0	111.2	L209 D230 I234 I235 N236	L209-E232 HydrophobicContact CD1-CG 3.88Å; D230-E232 VanDerWaalsContact C-N 3.27Å; D230-E232 PolarHBondContact O-N 3.49Å; D230-E232 PolarHBondContact OD1-N 3.23Å; E232-I234 PolarHBondContact O-N 2.92Å; E232-I235 PolarHBondContact O-N 2.88Å; E232-N236 VanDerWaalsContact O-CB 3.32Å; E232-N236 WeakPolarHBondContact O-CB 3.48Å; E232-N236 VanDerWaalsContact O-CG 3.24Å; E232-N236 PolarHBondContact O-N 3.46Å; E232-N236 PolarHBondContact O-ND2 2.96Å
233	D	82.7	Confident	84.2	Confident	39 Å²	39	51.4 Å²	51.4	21%	0.209	26%	0.26	C	S	.	.	H	α-helix	trans	-64.9	-38.7	179.2	-68.2	-12.5	0	0	0	111.9	K42 D230 T237	K42-D233 WeakPolarHBondContact CD-OD2 3.42Å; K42-D233 WeakPolarHBondContact CE-OD2 3.39Å; K42-D233 IonicContact NZ-OD1 3.96Å; K42-D233 PolarHBondContact NZ-OD1 2.9Å; K42-D233 IonicContact NZ-OD2 3.05Å; K42-D233 PolarHBondContact NZ-OD2 3.31Å; D230-D233 HydrophobicContact CB-CB 4.08Å; D230-D233 WeakPolarHBondContact CB-OD2 3.41Å; D230-D233 PolarHBondContact O-N 3.41Å; D233-T237 VanDerWaalsContact O-CB 3.32Å; D233-T237 WeakPolarHBondContact O-CB 3.29Å; D233-T237 PolarHBondContact O-N 3.39Å; D233-T237 PolarHBondContact O-OG1 2.7Å
234	I	84	Confident	84.4	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-66.2	-38.9	178.1	-67.5	170.2	0	0	0	111.2	K181 L212 F216 L229 D230 E232 P240	K181-I234 HydrophobicContact CG-CG2 4.36Å; L212-I234 HydrophobicContact CD1-CB 4.19Å; L212-I234 HydrophobicContact CD1-CD1 4.42Å; L212-I234 HydrophobicContact CD1-CG2 3.99Å; L212-I234 HydrophobicContact CD2-CD1 4.34Å; F216-I234 HydrophobicContact CE2-CD1 4.44Å; F216-I234 HydrophobicContact CZ-CD1 4.07Å; L229-I234 HydrophobicContact CB-CD1 3.94Å; L229-I234 HydrophobicContact CD1-CD1 4.01Å; L229-I234 HydrophobicContact CG-CD1 4.44Å; D230-I234 WeakPolarHBondContact O-CG1 3.34Å; D230-I234 PolarHBondContact O-N 3.03Å; E232-I234 PolarHBondContact O-N 2.92Å; I234-P240 HydrophobicContact CG2-CB 4.34Å; I234-P240 HydrophobicContact CG2-CG 3.92Å
235	I	84.5	Confident	84.7	Confident	46 Å²	46	45.1 Å²	45.1	24%	0.236	23%	0.227	C	C	.	.	H	α-helix	trans	-77.2	-46.1	-175.5	-66.7	166.4	0	0	0	110.9	K181 P208 L209 L212 A231 E232 T237	K181-I235 WeakPolarHBondContact CE-O 3.45Å; K181-I235 PolarHBondContact NZ-O 3.43Å; P208-I235 HydrophobicContact CB-CD1 3.84Å; P208-I235 HydrophobicContact CB-CG1 4.04Å; L209-I235 HydrophobicContact CB-CD1 3.66Å; L209-I235 HydrophobicContact CD1-CD1 3.73Å; L209-I235 HydrophobicContact CG-CD1 4.31Å; L212-I235 HydrophobicContact CD1-CD1 4.24Å; L212-I235 HydrophobicContact CD1-CG1 4.11Å; A231-I235 WeakPolarHBondContact O-CD1 3.45Å; A231-I235 VanDerWaalsContact O-CG1 3.31Å; A231-I235 WeakPolarHBondContact O-CG1 3.44Å; A231-I235 PolarHBondContact O-N 2.99Å; E232-I235 PolarHBondContact O-N 2.88Å; I235-T237 VanDerWaalsContact C-N 3.27Å; I235-T237 PolarHBondContact O-N 2.73Å
236	N	82.1	Confident	84.8	Confident	125 Å²	125	45 Å²	45	67%	0.668	23%	0.226	S	C	*	.	H	α-helix	trans	-71	-23.6	-175	-68.2	-32.1	0	0	0	112.7	E232	E232-N236 VanDerWaalsContact O-CB 3.32Å; E232-N236 WeakPolarHBondContact O-CB 3.48Å; E232-N236 VanDerWaalsContact O-CG 3.24Å; E232-N236 PolarHBondContact O-N 3.46Å; E232-N236 PolarHBondContact O-ND2 2.96Å
237	T	80	Confident	85	Confident	24 Å²	24	43.7 Å²	43.7	15%	0.147	22%	0.218	C	C	.	.	S	Bend	trans	-84.4	129.3	177.4	-51	0	0	0	0	110.6	K181 D233 I235 K239	K181-T237 PolarHBondContact NZ-O 2.72Å; D233-T237 VanDerWaalsContact O-CB 3.32Å; D233-T237 WeakPolarHBondContact O-CB 3.29Å; D233-T237 PolarHBondContact O-N 3.39Å; D233-T237 PolarHBondContact O-OG1 2.7Å; I235-T237 VanDerWaalsContact C-N 3.27Å; I235-T237 PolarHBondContact O-N 2.73Å; T237-K239 VanDerWaalsContact C-N 3.29Å; T237-K239 VanDerWaalsContact CG2-O 3.24Å; T237-K239 WeakPolarHBondContact CG2-O 3.36Å; T237-K239 PolarHBondContact O-N 2.91Å
238	P	79	Confident	85.2	Confident	108 Å²	108	40.1 Å²	40.1	70%	0.701	20%	0.202	S	C	*	.	S	Bend	trans	-61.2	-37.4	-179.9	21.5	-31.3	0	0	0	112.4
239	K	82.6	Confident	85.4	Confident	131 Å²	131	39.9 Å²	39.9	57%	0.57	20%	0.201	S	C	*	.	S	Bend	trans	-127.1	104.8	173.2	-176.2	178.5	179.1	179.2	0	109.3	H177 T237	H177-K239 HydrophobicContact CB-CG 4.15Å; T237-K239 VanDerWaalsContact C-N 3.29Å; T237-K239 VanDerWaalsContact CG2-O 3.24Å; T237-K239 WeakPolarHBondContact CG2-O 3.36Å; T237-K239 PolarHBondContact O-N 2.91Å
240	P	86.1	Confident	85.5	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.006	20%	0.198	C	C	.	.			trans	-57	147	174.8	-27.2	36.9	0	0	0	112	H177 K181 I234 E242 I245	H177-P240 WeakPolarHBondContact CB-O 3.38Å; H177-P240 WeakPolarHBondContact O-CG 3.49Å; K181-P240 HydrophobicContact CB-CG 4.5Å; K181-P240 HydrophobicContact CD-CG 4.41Å; I234-P240 HydrophobicContact CG2-CB 4.34Å; I234-P240 HydrophobicContact CG2-CG 3.92Å; P240-E242 PolarHBondContact O-N 3.28Å; P240-I245 HydrophobicContact CB-CD1 3.55Å
241	D	85.9	Confident	85.5	Confident	21 Å²	21	37.8 Å²	37.8	11%	0.112	19%	0.191	C	C	.	.			trans	-65.6	124.5	-179.5	-179	73.2	0	0	0	112.1	Q39 Q40 R243 A244 I245	Q39-D241 HydrophobicContact CB-CB 4.5Å; Q39-D241 HydrophobicContact CG-CB 4.41Å; Q40-D241 WeakPolarHBondContact CG-OD2 3.36Å; Q40-D241 VanDerWaalsContact NE2-CG 3.3Å; Q40-D241 PolarHBondContact NE2-OD1 3.38Å; Q40-D241 PolarHBondContact NE2-OD2 3.38Å; D241-R243 VanDerWaalsContact C-N 3.34Å; D241-R243 PolarHBondContact O-N 2.9Å; D241-R243 WeakPolarHBondContact OD2-CB 3.22Å; D241-R243 PolarHBondContact OD2-N 3.26Å; D241-A244 HydrophobicContact CB-CB 4.06Å; D241-A244 PolarHBondContact O-N 3.15Å; D241-A244 WeakPolarHBondContact OD2-CB 3.36Å; D241-A244 PolarHBondContact OD2-N 3.25Å; D241-I245 PolarHBondContact O-N 3.49Å
242	E	86.5	Confident	85.6	Confident	59 Å²	59	37.8 Å²	37.8	28%	0.276	19%	0.191	S	C	.	.	H	α-helix	trans	-64.9	-38.5	-175.5	-166.4	-175.5	-173.3	0	0	112.1	K154 F176 P240 M246	K154-E242 WeakPolarHBondContact CE-OE1 3.44Å; K154-E242 IonicContact NZ-OE1 3.49Å; K154-E242 PolarHBondContact NZ-OE1 3.05Å; K154-E242 IonicContact NZ-OE2 2.63Å; F176-E242 HydrophobicContact CB-CG 3.72Å; F176-E242 WeakPolarHBondContact O-CA 3.3Å; P240-E242 PolarHBondContact O-N 3.28Å; E242-M246 HydrophobicContact CG-SD 4.24Å; E242-M246 WeakPolarHBondContact O-CB 3.42Å; E242-M246 VanDerWaalsContact O-CG 3.28Å; E242-M246 WeakPolarHBondContact O-CG 3.48Å; E242-M246 PolarHBondContact O-N 2.93Å
243	R	87.2	Confident	85.8	Confident	95 Å²	95	34 Å²	34	36%	0.358	17%	0.172	S	C	.	.	H	α-helix	trans	-69.8	-40.3	-177.2	-63.2	-177.1	175.5	177	1	111.1	F44 W135 D241 T247	F44-R243 HydrophobicContact CE1-CB 4.5Å; F44-R243 HydrophobicContact CZ-CB 4.1Å; W135-R243 HydrophobicContact CD2-CB 4Å; W135-R243 VanDerWaalsContact CD2-CD 3.49Å; W135-R243 HydrophobicContact CD2-CG 3.77Å; W135-R243 HydrophobicContact CE3-CB 3.57Å; W135-R243 HydrophobicContact CE3-CG 3.86Å; W135-R243 HydrophobicContact CG-CG 4.47Å; W135-R243 HydrophobicContact CH2-CB 3.87Å; W135-R243 HydrophobicContact CH2-CG 3.78Å; W135-R243 HydrophobicContact CZ2-CB 4.3Å; W135-R243 HydrophobicContact CZ2-CG 3.71Å; W135-R243 HydrophobicContact CZ3-CB 3.5Å; W135-R243 VanDerWaalsContact CZ3-CB 3.5Å; W135-R243 HydrophobicContact CZ3-CG 3.87Å; W135-R243 WeakPolarHBondContact CZ3-O 3.44Å; D241-R243 VanDerWaalsContact C-N 3.34Å; D241-R243 PolarHBondContact O-N 2.9Å; D241-R243 WeakPolarHBondContact OD2-CB 3.22Å; D241-R243 PolarHBondContact OD2-N 3.26Å; R243-T247 WeakPolarHBondContact O-CB 3.42Å; R243-T247 PolarHBondContact O-N 2.84Å; R243-T247 PolarHBondContact O-OG1 3.48Å
244	A	86.6	Confident	85.8	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.2	-48.4	175.9	0	0	0	0	0	111.8	Q39 T43 L229 D241 T247 Y248	Q39-A244 HydrophobicContact CG-CB 4.23Å; T43-A244 HydrophobicContact CG2-CB 4.08Å; T43-A244 WeakPolarHBondContact OG1-CB 3.4Å; L229-A244 HydrophobicContact CD2-CB 3.86Å; D241-A244 HydrophobicContact CB-CB 4.06Å; D241-A244 PolarHBondContact O-N 3.15Å; D241-A244 WeakPolarHBondContact OD2-CB 3.36Å; D241-A244 PolarHBondContact OD2-N 3.25Å; A244-T247 PolarHBondContact O-N 3.19Å; A244-Y248 PolarHBondContact O-N 3.31Å
245	I	89.6	Confident	85.6	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-66.5	-44.7	179.3	-69.8	166.1	0	0	0	111.2	F176 W180 F186 L229 P240 D241 T247 Y248 V249	F176-I245 HydrophobicContact CB-CG2 4.21Å; F176-I245 HydrophobicContact CD1-CG2 4.27Å; F176-I245 WeakPolarHBondContact O-CB 3.36Å; F176-I245 WeakPolarHBondContact O-CD1 3.39Å; F176-I245 WeakPolarHBondContact O-CG2 3.23Å; W180-I245 HydrophobicContact CB-CD1 4.28Å; W180-I245 HydrophobicContact CB-CG2 4.27Å; W180-I245 HydrophobicContact CD2-CG2 4.12Å; W180-I245 HydrophobicContact CG-CG2 3.8Å; F186-I245 HydrophobicContact CZ-CG2 4.44Å; L229-I245 HydrophobicContact CD1-CG1 4.24Å; P240-I245 HydrophobicContact CB-CD1 3.55Å; D241-I245 PolarHBondContact O-N 3.49Å; I245-T247 VanDerWaalsContact C-N 3.28Å; I245-T247 PolarHBondContact O-N 2.92Å; I245-Y248 PolarHBondContact O-N 3.08Å; I245-Y248 VanDerWaalsContact O-N 3.11Å; I245-V249 HydrophobicContact CG2-CG2 3.96Å; I245-V249 WeakPolarHBondContact O-CB 3.25Å; I245-V249 VanDerWaalsContact O-CG2 3.3Å; I245-V249 WeakPolarHBondContact O-CG2 3.43Å; I245-V249 PolarHBondContact O-N 2.99Å
246	M	87.7	Confident	85.5	Confident	4 Å²	4	36.9 Å²	36.9	2%	0.02	19%	0.19	C	C	.	.	H	α-helix	trans	-57.1	-42	176.7	-78.3	-178.4	65.3	0	0	112.5	W135 I143 K154 F176 E242 Y248 V249 S250	W135-M246 HydrophobicContact CH2-CB 4.28Å; W135-M246 HydrophobicContact CH2-CE 4.2Å; W135-M246 HydrophobicContact CH2-SD 4.13Å; I143-M246 HydrophobicContact CD1-CB 4.02Å; I143-M246 HydrophobicContact CD1-CE 3.97Å; I143-M246 HydrophobicContact CG2-CE 4.15Å; K154-M246 HydrophobicContact CB-CE 4.07Å; K154-M246 HydrophobicContact CD-CE 4.22Å; K154-M246 HydrophobicContact CD-SD 4.28Å; K154-M246 HydrophobicContact CG-CE 3.72Å; K154-M246 HydrophobicContact CG-SD 4.2Å; F176-M246 HydrophobicContact CB-CG 3.57Å; F176-M246 HydrophobicContact CB-SD 4.46Å; F176-M246 HydrophobicContact CD1-CG 3.81Å; F176-M246 HydrophobicContact CD2-CG 3.43Å; F176-M246 VanDerWaalsContact CD2-CG 3.43Å; F176-M246 HydrophobicContact CD2-SD 3.83Å; F176-M246 HydrophobicContact CE1-CG 4.32Å; F176-M246 HydrophobicContact CE2-CG 3.98Å; F176-M246 HydrophobicContact CE2-SD 4.33Å; F176-M246 HydrophobicContact CG-CG 3.33Å; F176-M246 HydrophobicContact CG-SD 4.28Å; F176-M246 HydrophobicContact CZ-CG 4.39Å; E242-M246 HydrophobicContact CG-SD 4.24Å; E242-M246 WeakPolarHBondContact O-CB 3.42Å; E242-M246 VanDerWaalsContact O-CG 3.28Å; E242-M246 WeakPolarHBondContact O-CG 3.48Å; E242-M246 PolarHBondContact O-N 2.93Å; M246-Y248 VanDerWaalsContact C-N 3.28Å; M246-Y248 PolarHBondContact O-N 3.43Å; M246-V249 PolarHBondContact O-N 3.03Å; M246-S250 WeakPolarHBondContact O-CB 3.33Å; M246-S250 PolarHBondContact O-N 3.44Å; M246-S250 PolarHBondContact O-OG 3.37Å
247	T	87.5	Confident	84.9	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.9	-40.1	177.7	-57.1	0	0	0	0	111.4	T43 W47 I138 M228 R243 A244 I245 S250 C251	T43-T247 HydrophobicContact CG2-CG2 4.43Å; W47-T247 HydrophobicContact CB-CG2 3.96Å; W47-T247 HydrophobicContact CG-CG2 3.75Å; I138-T247 HydrophobicContact CD1-CG2 3.93Å; I138-T247 HydrophobicContact CG2-CG2 3.89Å; M228-T247 HydrophobicContact SD-CG2 4.44Å; R243-T247 WeakPolarHBondContact O-CB 3.42Å; R243-T247 PolarHBondContact O-N 2.84Å; R243-T247 PolarHBondContact O-OG1 3.48Å; A244-T247 PolarHBondContact O-N 3.19Å; I245-T247 VanDerWaalsContact C-N 3.28Å; I245-T247 PolarHBondContact O-N 2.92Å; T247-S250 PolarHBondContact O-OG 3.08Å; T247-C251 PolarHBondContact O-SG 3.21Å
248	Y	90.6	Very high	84.1	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-76.8	-42.3	-178.9	-164.8	-124.5	0	0	0	112.1	F186 F216 I225 P226 M228 L229 A244 I245 M246 S250 C251 F252	F186-Y248 HydrophobicContact CD1-CD1 4.35Å; F186-Y248 HydrophobicContact CD1-CE1 4.45Å; F186-Y248 AromaticContact CE1-CD1 3.62Å; F186-Y248 HydrophobicContact CE1-CD1 3.62Å; F186-Y248 HydrophobicContact CE1-CE1 4.14Å; F186-Y248 AromaticContact CZ-CD1 3.96Å; F186-Y248 HydrophobicContact CZ-CD1 3.96Å; F216-Y248 HydrophobicContact CD1-CD1 4.41Å; F216-Y248 AromaticContact CD1-CE1 3.37Å; F216-Y248 HydrophobicContact CD1-CE1 3.37Å; F216-Y248 AromaticContact CD1-CZ 3.86Å; F216-Y248 AromaticContact CE1-CD1 3.98Å; F216-Y248 HydrophobicContact CE1-CD1 3.98Å; F216-Y248 AromaticContact CE1-CE1 3.34Å; F216-Y248 HydrophobicContact CE1-CE1 3.34Å; F216-Y248 HydrophobicContact CG-CE1 4.36Å; F216-Y248 HydrophobicContact CZ-CE1 4.31Å; I225-Y248 HydrophobicContact CG2-CD2 4.44Å; I225-Y248 HydrophobicContact CG2-CE2 3.7Å; P226-Y248 WeakPolarHBondContact O-CE2 3.02Å; M228-Y248 HydrophobicContact CB-CD2 3.71Å; M228-Y248 HydrophobicContact CB-CE2 4.17Å; M228-Y248 HydrophobicContact CG-CD2 3.79Å; M228-Y248 HydrophobicContact CG-CE2 4.08Å; M228-Y248 HydrophobicContact SD-CD2 4.06Å; L229-Y248 HydrophobicContact CD1-CD1 3.56Å; L229-Y248 HydrophobicContact CD1-CE1 4.48Å; L229-Y248 HydrophobicContact CD1-CG 3.83Å; L229-Y248 HydrophobicContact CG-CD1 4.1Å; L229-Y248 HydrophobicContact CG-CG 4.04Å; A244-Y248 PolarHBondContact O-N 3.31Å; I245-Y248 PolarHBondContact O-N 3.08Å; I245-Y248 VanDerWaalsContact O-N 3.11Å; M246-Y248 VanDerWaalsContact C-N 3.28Å; M246-Y248 PolarHBondContact O-N 3.43Å; Y248-S250 VanDerWaalsContact C-N 3.35Å; Y248-S250 PolarHBondContact O-N 3.31Å; Y248-C251 WeakPolarHBondContact O-CB 3.2Å; Y248-C251 PolarHBondContact O-N 3.12Å; Y248-F252 AromaticContact CD1-CE2 3.92Å; Y248-F252 HydrophobicContact CD1-CE2 3.92Å; Y248-F252 AromaticContact CE1-CE2 3.5Å; Y248-F252 HydrophobicContact CE1-CE2 3.5Å; Y248-F252 VanDerWaalsContact CE1-CE2 3.5Å; Y248-F252 HydrophobicContact CE1-CZ 4.15Å; Y248-F252 HydrophobicContact CE2-CE2 4.39Å; Y248-F252 AromaticContact CZ-CE2 3.77Å; Y248-F252 WeakPolarHBondContact O-CD2 3.31Å
249	V	90	Very high	83.2	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65.6	-35.8	178.4	175.5	0	0	0	0	111.9	L157 C161 F176 W180 F186 I245 M246 C251 F252 Y253	L157-V249 HydrophobicContact CD1-CG1 4.28Å; L157-V249 HydrophobicContact CG-CG1 4.43Å; C161-V249 WeakPolarHBondContact SG-CG1 3.35Å; F176-V249 HydrophobicContact CE1-CB 4.39Å; F176-V249 HydrophobicContact CE1-CG1 4.11Å; W180-V249 HydrophobicContact CD2-CG2 4.25Å; W180-V249 HydrophobicContact CE3-CG2 4.04Å; W180-V249 HydrophobicContact CH2-CB 4.35Å; W180-V249 HydrophobicContact CH2-CG1 3.78Å; W180-V249 HydrophobicContact CH2-CG2 3.51Å; W180-V249 HydrophobicContact CZ2-CG1 4.06Å; W180-V249 HydrophobicContact CZ2-CG2 3.75Å; W180-V249 HydrophobicContact CZ3-CG2 3.68Å; F186-V249 HydrophobicContact CE1-CG2 3.61Å; F186-V249 HydrophobicContact CZ-CG2 4.1Å; I245-V249 HydrophobicContact CG2-CG2 3.96Å; I245-V249 WeakPolarHBondContact O-CB 3.25Å; I245-V249 VanDerWaalsContact O-CG2 3.3Å; I245-V249 WeakPolarHBondContact O-CG2 3.43Å; I245-V249 PolarHBondContact O-N 2.99Å; M246-V249 PolarHBondContact O-N 3.03Å; V249-C251 PolarHBondContact O-N 3.3Å; V249-F252 WeakPolarHBondContact O-CB 3.22Å; V249-F252 PolarHBondContact O-N 2.91Å; V249-F252 VanDerWaalsContact O-N 3.08Å; V249-Y253 PolarHBondContact O-N 3.46Å; V249-Y253 VanDerWaalsContact O-N 3.1Å
250	S	87.9	Confident	82.2	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.2	-30.3	175.2	68.7	0	0	0	0	112.6	M246 T247 Y248 F252 Y253 H254	M246-S250 WeakPolarHBondContact O-CB 3.33Å; M246-S250 PolarHBondContact O-N 3.44Å; M246-S250 PolarHBondContact O-OG 3.37Å; T247-S250 PolarHBondContact O-OG 3.08Å; Y248-S250 VanDerWaalsContact C-N 3.35Å; Y248-S250 PolarHBondContact O-N 3.31Å; S250-F252 VanDerWaalsContact C-N 3.33Å; S250-F252 PolarHBondContact O-N 3.44Å; S250-Y253 WeakPolarHBondContact O-CB 3.46Å; S250-Y253 PolarHBondContact O-N 3.5Å; S250-H254 PolarHBondContact O-CD2 3.12Å; S250-H254 PolarHBondContact O-N 3.4Å; S250-H254 VanDerWaalsContact O-N 3.1Å
251	C	86.9	Confident	81	Confident	24 Å²	24	34.3 Å²	34.3	16%	0.162	19%	0.191	C	C	.	.	H	α-helix	trans	-64.3	-37.6	173	-62.2	0	0	0	0	111.9	I225 T247 Y248 V249 A255	I225-C251 HydrophobicContact CG2-CB 3.93Å; T247-C251 PolarHBondContact O-SG 3.21Å; Y248-C251 WeakPolarHBondContact O-CB 3.2Å; Y248-C251 PolarHBondContact O-N 3.12Å; V249-C251 PolarHBondContact O-N 3.3Å; C251-A255 WeakPolarHBondContact O-CB 3.22Å; C251-A255 PolarHBondContact O-N 2.96Å
252	F	87.4	Confident	79.7	Confident	1 Å²	1	34 Å²	34	0%	0.004	19%	0.192	C	C	.	.	H	α-helix	trans	-67.2	-39.1	173.2	-75.9	-87.4	0	0	0	112.5	F186 I190 A219 L223 I225 Y248 V249 S250 A255 F256	F186-F252 HydrophobicContact CD1-CE2 4.11Å; F186-F252 HydrophobicContact CE1-CE2 4.42Å; I190-F252 HydrophobicContact CD1-CE1 3.8Å; I190-F252 HydrophobicContact CD1-CZ 4.23Å; I190-F252 HydrophobicContact CG1-CD1 4.26Å; I190-F252 HydrophobicContact CG1-CE1 3.63Å; I190-F252 HydrophobicContact CG1-CZ 4.47Å; A219-F252 HydrophobicContact CB-CE1 3.82Å; A219-F252 HydrophobicContact CB-CZ 3.49Å; A219-F252 VanDerWaalsContact CB-CZ 3.49Å; L223-F252 HydrophobicContact CD1-CD1 4.37Å; L223-F252 HydrophobicContact CD1-CE1 4.09Å; I225-F252 HydrophobicContact CD1-CB 4.49Å; I225-F252 HydrophobicContact CD1-CD1 3.67Å; I225-F252 HydrophobicContact CD1-CD2 4.32Å; I225-F252 HydrophobicContact CD1-CE1 3.91Å; I225-F252 HydrophobicContact CD1-CG 3.91Å; I225-F252 HydrophobicContact CD1-CZ 4.35Å; Y248-F252 AromaticContact CD1-CE2 3.92Å; Y248-F252 HydrophobicContact CD1-CE2 3.92Å; Y248-F252 AromaticContact CE1-CE2 3.5Å; Y248-F252 HydrophobicContact CE1-CE2 3.5Å; Y248-F252 VanDerWaalsContact CE1-CE2 3.5Å; Y248-F252 HydrophobicContact CE1-CZ 4.15Å; Y248-F252 HydrophobicContact CE2-CE2 4.39Å; Y248-F252 AromaticContact CZ-CE2 3.77Å; Y248-F252 WeakPolarHBondContact O-CD2 3.31Å; V249-F252 WeakPolarHBondContact O-CB 3.22Å; V249-F252 PolarHBondContact O-N 2.91Å; V249-F252 VanDerWaalsContact O-N 3.08Å; S250-F252 VanDerWaalsContact C-N 3.33Å; S250-F252 PolarHBondContact O-N 3.44Å; F252-A255 PolarHBondContact O-N 3.25Å; F252-F256 HydrophobicContact CB-CE2 4.33Å; F252-F256 AromaticContact CD1-CE2 3.89Å; F252-F256 HydrophobicContact CD1-CE2 3.89Å; F252-F256 HydrophobicContact CD1-CZ 4.24Å; F252-F256 VanDerWaalsContact O-CD2 3.24Å; F252-F256 WeakPolarHBondContact O-CD2 3.38Å; F252-F256 PolarHBondContact O-N 2.67Å; F252-F256 VanDerWaalsContact O-N 3.12Å
253	Y	86.2	Confident	78.5	Confident	36 Å²	36	37.1 Å²	37.1	14%	0.141	21%	0.206	C	C	.	.	H	α-helix	trans	-58.1	-52.2	176.5	176.9	-90.9	0	0	0	111.4	I146 V148 L157 W160 V249 S250 A255 F256 A257	I146-Y253 HydrophobicContact CB-CE1 4.22Å; I146-Y253 HydrophobicContact CD1-CD1 3.58Å; I146-Y253 HydrophobicContact CD1-CE1 4.04Å; I146-Y253 HydrophobicContact CD1-CG 4Å; I146-Y253 HydrophobicContact CG1-CD1 3.78Å; I146-Y253 HydrophobicContact CG1-CE1 3.71Å; I146-Y253 HydrophobicContact CG2-CD1 4.19Å; I146-Y253 HydrophobicContact CG2-CD2 4.3Å; I146-Y253 HydrophobicContact CG2-CE1 3.75Å; I146-Y253 HydrophobicContact CG2-CE2 3.88Å; I146-Y253 HydrophobicContact CG2-CG 4.46Å; V148-Y253 HydrophobicContact CG2-CE2 4.41Å; L157-Y253 HydrophobicContact CD1-CD2 4.12Å; L157-Y253 HydrophobicContact CD1-CG 4.04Å; W160-Y253 HydrophobicContact CB-CD2 4.28Å; W160-Y253 HydrophobicContact CB-CE2 4.25Å; W160-Y253 AromaticContact CD1-CD2 3.82Å; W160-Y253 AromaticContact CD1-CE2 3.63Å; W160-Y253 AromaticContact CD2-CD2 3.49Å; W160-Y253 HydrophobicContact CD2-CD2 3.49Å; W160-Y253 VanDerWaalsContact CD2-CD2 3.49Å; W160-Y253 HydrophobicContact CD2-CE2 4.11Å; W160-Y253 AromaticContact CE2-CD2 3.64Å; W160-Y253 AromaticContact CE3-CD2 3.91Å; W160-Y253 HydrophobicContact CE3-CD2 3.91Å; W160-Y253 AromaticContact CG-CD2 3.64Å; W160-Y253 HydrophobicContact CG-CD2 3.64Å; W160-Y253 AromaticContact CG-CE2 3.76Å; W160-Y253 HydrophobicContact CG-CE2 3.76Å; W160-Y253 HydrophobicContact CZ2-CD2 4.2Å; W160-Y253 HydrophobicContact CZ3-CD2 4.42Å; W160-Y253 AromaticContact NE1-CD2 3.81Å; W160-Y253 AromaticContact NE1-CE2 3.89Å; V249-Y253 PolarHBondContact O-N 3.46Å; V249-Y253 VanDerWaalsContact O-N 3.1Å; S250-Y253 WeakPolarHBondContact O-CB 3.46Å; S250-Y253 PolarHBondContact O-N 3.5Å; Y253-A255 VanDerWaalsContact C-N 3.32Å; Y253-A255 PolarHBondContact O-N 2.67Å; Y253-F256 PolarHBondContact O-N 3.22Å; Y253-A257 HydrophobicContact CD1-CB 4.5Å; Y253-A257 HydrophobicContact CE1-CB 4.16Å; Y253-A257 VanDerWaalsContact O-CB 3.23Å; Y253-A257 WeakPolarHBondContact O-CB 3.45Å; Y253-A257 PolarHBondContact O-N 2.84Å
254	H	82.7	Confident	77.2	Confident	92 Å²	92	36.2 Å²	36.2	43%	0.426	21%	0.212	S	C	.	.	H	α-helix	trans	-64.5	-35.2	-179.1	-71.1	-56.3	0	0	0	112.9	A142 S250	A142-H254 PolarHBondContact O-NE2 3.16Å; S250-H254 PolarHBondContact O-CD2 3.12Å; S250-H254 PolarHBondContact O-N 3.4Å; S250-H254 VanDerWaalsContact O-N 3.1Å
255	A	80.8	Confident	76	Confident	44 Å²	44	36.4 Å²	36.4	36%	0.364	21%	0.213	S	C	.	.	H	α-helix	trans	-66.5	-39.2	177.1	0	0	0	0	0	112.9	I225 C251 F252 Y253	I225-A255 HydrophobicContact CD1-CB 3.94Å; I225-A255 HydrophobicContact CG1-CB 4.44Å; C251-A255 WeakPolarHBondContact O-CB 3.22Å; C251-A255 PolarHBondContact O-N 2.96Å; F252-A255 PolarHBondContact O-N 3.25Å; Y253-A255 VanDerWaalsContact C-N 3.32Å; Y253-A255 PolarHBondContact O-N 2.67Å
256	F	81.6	Confident	74.6	Confident	10 Å²	10	36.7 Å²	36.7	4%	0.044	22%	0.216	C	C	.	.	H	α-helix	trans	-88.2	-35.8	-178.1	-63.3	-43.9	0	0	0	113.9	W160 H193 R194 L223 F252 Y253 G258 A259 E260	W160-F256 HydrophobicContact CH2-CD2 4.08Å; W160-F256 HydrophobicContact CZ2-CB 4.4Å; W160-F256 HydrophobicContact CZ2-CD2 4.21Å; H193-F256 HydrophobicContact CB-CB 4.44Å; H193-F256 HydrophobicContact CB-CD1 3.55Å; H193-F256 HydrophobicContact CB-CD2 4.09Å; H193-F256 HydrophobicContact CB-CE1 3.68Å; H193-F256 HydrophobicContact CB-CE2 4.19Å; H193-F256 HydrophobicContact CB-CG 3.78Å; H193-F256 HydrophobicContact CB-CZ 4Å; H193-F256 AromaticContact CD2-CG 3.83Å; H193-F256 AromaticContact CE1-CD2 3.77Å; H193-F256 AromaticContact CG-CD1 3.88Å; H193-F256 AromaticContact CG-CD2 3.65Å; H193-F256 AromaticContact CG-CG 3.54Å; H193-F256 AromaticContact ND1-CD2 3.39Å; H193-F256 WeakPolarHBondContact ND1-CD2 3.24Å; H193-F256 AromaticContact ND1-CE2 3.69Å; H193-F256 AromaticContact ND1-CG 3.81Å; R194-F256 HydrophobicContact CG-CE1 4.29Å; L223-F256 HydrophobicContact CD1-CE1 3.98Å; L223-F256 HydrophobicContact CD1-CZ 3.7Å; L223-F256 HydrophobicContact CD2-CE1 4.08Å; F252-F256 HydrophobicContact CB-CE2 4.33Å; F252-F256 AromaticContact CD1-CE2 3.89Å; F252-F256 HydrophobicContact CD1-CE2 3.89Å; F252-F256 HydrophobicContact CD1-CZ 4.24Å; F252-F256 VanDerWaalsContact O-CD2 3.24Å; F252-F256 WeakPolarHBondContact O-CD2 3.38Å; F252-F256 PolarHBondContact O-N 2.67Å; F252-F256 VanDerWaalsContact O-N 3.12Å; Y253-F256 PolarHBondContact O-N 3.22Å; F256-G258 VanDerWaalsContact C-N 3.31Å; F256-G258 PolarHBondContact O-N 2.65Å; F256-A259 PolarHBondContact O-N 3.38Å; F256-A259 VanDerWaalsContact O-N 3.1Å; F256-E260 PolarHBondContact O-N 2.89Å
257	A	70.7	Confident	73.6	Confident	19 Å²	19	41.3 Å²	41.3	16%	0.157	24%	0.24	C	C	.	.	H	α-helix	trans	-62.4	-37.1	-178.7	0	0	0	0	0	112.6	Y253 A259 Q261	Y253-A257 HydrophobicContact CD1-CB 4.5Å; Y253-A257 HydrophobicContact CE1-CB 4.16Å; Y253-A257 VanDerWaalsContact O-CB 3.23Å; Y253-A257 WeakPolarHBondContact O-CB 3.45Å; Y253-A257 PolarHBondContact O-N 2.84Å; A257-A259 VanDerWaalsContact C-N 3.27Å; A257-A259 PolarHBondContact O-N 3.39Å; A257-Q261 PolarHBondContact O-N 3.39Å
258	G	62.8	Low	72.6	Confident	46 Å²	46	47.8 Å²	47.8	47%	0.474	27%	0.265	S	S	.	.	H	α-helix	trans	-65.2	-26.7	175.3	0	0	0	0	0	114.1	F256	F256-G258 VanDerWaalsContact C-N 3.31Å; F256-G258 PolarHBondContact O-N 2.65Å
259	A	60.4	Low	71.7	Confident	61 Å²	61	47.9 Å²	47.9	50%	0.504	27%	0.265	S	S	.	.	H	α-helix	trans	-79.2	-39.6	179.1	0	0	0	0	0	112.8	F256 A257 Q261 A262 E263	F256-A259 PolarHBondContact O-N 3.38Å; F256-A259 VanDerWaalsContact O-N 3.1Å; A257-A259 VanDerWaalsContact C-N 3.27Å; A257-A259 PolarHBondContact O-N 3.39Å; A259-Q261 VanDerWaalsContact C-N 3.33Å; A259-Q261 PolarHBondContact O-N 3.12Å; A259-A262 PolarHBondContact O-N 3.45Å; A259-E263 PolarHBondContact O-N 3.26Å
260	E	60.2	Low	70.8	Confident	85 Å²	85	48.8 Å²	48.8	40%	0.397	27%	0.271	S	S	.	.	H	α-helix	trans	-67.5	-32.5	178.8	-71	-173.7	162.6	0	0	112.5	K164 H193 F256 T264	K164-E260 VanDerWaalsContact NZ-CD 3.29Å; K164-E260 IonicContact NZ-OE1 2.78Å; K164-E260 PolarHBondContact NZ-OE1 3.01Å; K164-E260 IonicContact NZ-OE2 3.47Å; K164-E260 PolarHBondContact NZ-OE2 2.94Å; K164-E260 VanDerWaalsContact NZ-OE2 3.08Å; H193-E260 IonicContact CD2-OE1 2.76Å; H193-E260 IonicContact NE2-OE1 3.11Å; F256-E260 PolarHBondContact O-N 2.89Å; E260-T264 PolarHBondContact O-N 2.8Å; E260-T264 PolarHBondContact O-OG1 3.2Å
261	Q	62.7	Low	69.9	Low	123 Å²	123	56.8 Å²	56.8	58%	0.575	31%	0.306	S	S	*	.	H	α-helix	trans	-68	-39.9	175.7	-70.4	179.2	-2.6	0	0	112	A257 A259 A265 I837	A257-Q261 PolarHBondContact O-N 3.39Å; A259-Q261 VanDerWaalsContact C-N 3.33Å; A259-Q261 PolarHBondContact O-N 3.12Å; Q261-A265 WeakPolarHBondContact O-CB 3.44Å; Q261-A265 PolarHBondContact O-N 2.97Å; Q261-I837 HydrophobicContact CB-CG2 4.06Å; Q261-I837 WeakPolarHBondContact O-CG2 3.37Å
262	A	57.3	Low	69.2	Low	15 Å²	15	56.6 Å²	56.6	12%	0.124	30%	0.304	C	S	.	.	H	α-helix	trans	-65.3	-40.1	177.7	0	0	0	0	0	112.8	A259 A265 A266	A259-A262 PolarHBondContact O-N 3.45Å; A262-A265 PolarHBondContact O-N 2.71Å; A262-A266 WeakPolarHBondContact O-CB 3.42Å; A262-A266 PolarHBondContact O-N 3.42Å
263	E	60.8	Low	68.4	Low	124 Å²	124	56.8 Å²	56.8	58%	0.579	31%	0.305	S	S	*	.	H	α-helix	trans	-67.6	-41.8	179.9	-172.6	-179.3	-178.9	0	0	112.8	A259 A265 A266 N267	A259-E263 PolarHBondContact O-N 3.26Å; E263-A265 VanDerWaalsContact C-N 3.32Å; E263-A265 PolarHBondContact O-N 2.87Å; E263-A266 WeakPolarHBondContact O-CB 3.42Å; E263-A266 PolarHBondContact O-N 2.93Å; E263-N267 PolarHBondContact O-N 3.38Å; E263-N267 PolarHBondContact O-ND2 3.49Å
264	T	61.4	Low	67.7	Low	77 Å²	77	56.3 Å²	56.3	47%	0.472	31%	0.312	S	S	.	.	H	α-helix	trans	-67	-37.4	179	-51.5	0	0	0	0	111.3	E260 R268	E260-T264 PolarHBondContact O-N 2.8Å; E260-T264 PolarHBondContact O-OG1 3.2Å; T264-R268 WeakPolarHBondContact O-CG 3.02Å; T264-R268 PolarHBondContact O-N 3.38Å
265	A	60.3	Low	67.3	Low	3 Å²	3	54.5 Å²	54.5	3%	0.025	31%	0.307	C	S	.	.	H	α-helix	trans	-64.6	-45	172.7	0	0	0	0	0	112.2	Q261 A262 E263 N267 R268 I269 S834 I837 L838	Q261-A265 WeakPolarHBondContact O-CB 3.44Å; Q261-A265 PolarHBondContact O-N 2.97Å; A262-A265 PolarHBondContact O-N 2.71Å; E263-A265 VanDerWaalsContact C-N 3.32Å; E263-A265 PolarHBondContact O-N 2.87Å; A265-N267 PolarHBondContact O-N 3.05Å; A265-R268 PolarHBondContact O-N 3.3Å; A265-I269 WeakPolarHBondContact O-CD1 3.31Å; A265-I269 PolarHBondContact O-N 3.06Å; A265-I269 VanDerWaalsContact O-N 3.15Å; A265-S834 VanDerWaalsContact CB-O 3.31Å; A265-S834 WeakPolarHBondContact CB-O 3.45Å; A265-I837 HydrophobicContact CB-CB 3.92Å; A265-I837 HydrophobicContact CB-CD1 4.25Å; A265-I837 HydrophobicContact CB-CG2 3.98Å; A265-L838 HydrophobicContact CB-CD1 4.23Å; A265-L838 HydrophobicContact CB-CG 4.28Å
266	A	61.5	Low	67.1	Low	7 Å²	7	53.6 Å²	53.6	6%	0.058	30%	0.296	C	S	.	.	H	α-helix	trans	-56.7	-47.5	176.3	0	0	0	0	0	111.8	A262 E263 R268 I269 C270 L838 L854	A262-A266 WeakPolarHBondContact O-CB 3.42Å; A262-A266 PolarHBondContact O-N 3.42Å; E263-A266 WeakPolarHBondContact O-CB 3.42Å; E263-A266 PolarHBondContact O-N 2.93Å; A266-R268 PolarHBondContact O-N 2.96Å; A266-I269 PolarHBondContact O-N 3.1Å; A266-C270 PolarHBondContact O-N 3.27Å; A266-C270 PolarHBondContact O-SG 3.11Å; A266-L838 HydrophobicContact CB-CD2 4.2Å; A266-L854 HydrophobicContact CB-CD2 4.12Å
267	N	65.8	Low	66.7	Low	100 Å²	100	56.6 Å²	56.6	54%	0.535	31%	0.31	S	S	.	.	H	α-helix	trans	-63.1	-39.1	-179.2	-78.5	-38	0	0	0	113.5	E263 A265 I269 C270 K271	E263-N267 PolarHBondContact O-N 3.38Å; E263-N267 PolarHBondContact O-ND2 3.49Å; A265-N267 PolarHBondContact O-N 3.05Å; N267-I269 VanDerWaalsContact C-N 3.35Å; N267-C270 PolarHBondContact O-N 2.97Å; N267-K271 PolarHBondContact O-N 3.11Å
268	R	67.2	Low	67	Low	137 Å²	137	60.9 Å²	60.9	52%	0.517	33%	0.327	S	S	.	.	H	α-helix	trans	-63	-43	175	-73.4	178	179.9	-177	-1.7	111.4	T264 A265 A266 K271 V272	T264-R268 WeakPolarHBondContact O-CG 3.02Å; T264-R268 PolarHBondContact O-N 3.38Å; A265-R268 PolarHBondContact O-N 3.3Å; A266-R268 PolarHBondContact O-N 2.96Å; R268-K271 PolarHBondContact O-N 3.28Å; R268-V272 WeakPolarHBondContact O-CG2 3.31Å; R268-V272 PolarHBondContact O-N 3.22Å
269	I	70.2	Confident	67.8	Low	1 Å²	1	58.7 Å²	58.7	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-65.3	-44.9	177.8	-75.7	159.1	0	0	0	111.5	A265 A266 N267 K271 V272 L273 F835 L838 L854	A265-I269 WeakPolarHBondContact O-CD1 3.31Å; A265-I269 PolarHBondContact O-N 3.06Å; A265-I269 VanDerWaalsContact O-N 3.15Å; A266-I269 PolarHBondContact O-N 3.1Å; N267-I269 VanDerWaalsContact C-N 3.35Å; I269-K271 VanDerWaalsContact C-N 3.27Å; I269-K271 PolarHBondContact O-N 3.3Å; I269-V272 PolarHBondContact O-N 2.98Å; I269-V272 VanDerWaalsContact O-N 3.12Å; I269-L273 HydrophobicContact CG2-CD1 3.55Å; I269-L273 HydrophobicContact CG2-CG 4.03Å; I269-L273 WeakPolarHBondContact O-CB 3.37Å; I269-L273 VanDerWaalsContact O-CG 3.25Å; I269-L273 WeakPolarHBondContact O-CG 3.48Å; I269-L273 PolarHBondContact O-N 3Å; I269-F835 HydrophobicContact CB-CE1 4.44Å; I269-F835 HydrophobicContact CB-CE2 4.43Å; I269-F835 HydrophobicContact CB-CZ 4.14Å; I269-F835 HydrophobicContact CD1-CB 4.18Å; I269-F835 HydrophobicContact CD1-CD1 3.42Å; I269-F835 VanDerWaalsContact CD1-CD1 3.42Å; I269-F835 HydrophobicContact CD1-CD2 3.71Å; I269-F835 HydrophobicContact CD1-CE1 3.62Å; I269-F835 HydrophobicContact CD1-CE2 3.91Å; I269-F835 HydrophobicContact CD1-CG 3.47Å; I269-F835 VanDerWaalsContact CD1-CG 3.47Å; I269-F835 HydrophobicContact CD1-CZ 3.87Å; I269-F835 HydrophobicContact CG1-CD1 4.22Å; I269-F835 HydrophobicContact CG1-CD2 3.83Å; I269-F835 HydrophobicContact CG1-CE1 4.03Å; I269-F835 HydrophobicContact CG1-CE2 3.64Å; I269-F835 HydrophobicContact CG1-CG 4.12Å; I269-F835 HydrophobicContact CG1-CZ 3.75Å; I269-F835 HydrophobicContact CG2-CE1 3.61Å; I269-F835 HydrophobicContact CG2-CE2 4.01Å; I269-F835 HydrophobicContact CG2-CZ 3.3Å; I269-L838 HydrophobicContact CD1-CD1 3.13Å; I269-L854 HydrophobicContact CG2-CD1 4.35Å; I269-L854 HydrophobicContact CG2-CD2 4.12Å
270	C	71.1	Confident	68.7	Low	20 Å²	20	57.3 Å²	57.3	14%	0.135	29%	0.287	C	S	.	.	H	α-helix	trans	-56.2	-42.1	178.1	-65.7	0	0	0	0	112.1	A266 N267 L273 G274 Q858	A266-C270 PolarHBondContact O-N 3.27Å; A266-C270 PolarHBondContact O-SG 3.11Å; N267-C270 PolarHBondContact O-N 2.97Å; C270-L273 PolarHBondContact O-N 3.17Å; C270-G274 PolarHBondContact O-N 3.13Å; C270-Q858 PolarHBondContact SG-OE1 2.97Å
271	K	70.9	Confident	69.7	Low	168 Å²	168	59.6 Å²	59.6	73%	0.73	30%	0.296	S	S	*	.	H	α-helix	trans	-63.6	-43.6	177.5	-170.5	179.1	180	-174.9	0	111.9	N267 R268 I269 V275	N267-K271 PolarHBondContact O-N 3.11Å; R268-K271 PolarHBondContact O-N 3.28Å; I269-K271 VanDerWaalsContact C-N 3.27Å; I269-K271 PolarHBondContact O-N 3.3Å; K271-V275 WeakPolarHBondContact O-CG2 3.25Å; K271-V275 PolarHBondContact O-N 3.47Å
272	V	72.3	Confident	70.6	Confident	20 Å²	20	55.8 Å²	55.8	12%	0.121	28%	0.279	C	S	.	.	H	α-helix	trans	-68.8	-37.6	-179	171.9	0	0	0	0	111.9	R268 I269 N276 R357 V831 L888 Y889	R268-V272 WeakPolarHBondContact O-CG2 3.31Å; R268-V272 PolarHBondContact O-N 3.22Å; I269-V272 PolarHBondContact O-N 2.98Å; I269-V272 VanDerWaalsContact O-N 3.12Å; V272-N276 PolarHBondContact O-N 2.94Å; V272-R357 PolarHBondContact O-NH2 3.34Å; V272-R357 VanDerWaalsContact O-NH2 3.1Å; V272-V831 HydrophobicContact CG1-CG1 4.26Å; V272-V831 HydrophobicContact CG2-CG1 4.4Å; V272-V831 HydrophobicContact CG2-CG2 3.74Å; V272-L888 HydrophobicContact CG1-CD2 3.2Å; V272-Y889 HydrophobicContact CG1-CE2 4.35Å
273	L	69.7	Low	71.8	Confident	4 Å²	4	57.6 Å²	57.6	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-68.6	-42.6	176.4	-69	175.4	0	0	0	112.4	I269 C270 V275 N276 Q277 Q858 Y861 C862 F884	I269-L273 HydrophobicContact CG2-CD1 3.55Å; I269-L273 HydrophobicContact CG2-CG 4.03Å; I269-L273 WeakPolarHBondContact O-CB 3.37Å; I269-L273 VanDerWaalsContact O-CG 3.25Å; I269-L273 WeakPolarHBondContact O-CG 3.48Å; I269-L273 PolarHBondContact O-N 3Å; C270-L273 PolarHBondContact O-N 3.17Å; L273-V275 VanDerWaalsContact C-N 3.32Å; L273-V275 PolarHBondContact O-N 2.91Å; L273-N276 WeakPolarHBondContact O-CB 3.5Å; L273-N276 PolarHBondContact O-N 2.9Å; L273-Q277 PolarHBondContact O-N 2.9Å; L273-Q858 HydrophobicContact CD1-CB 4.1Å; L273-Y861 HydrophobicContact CD2-CD1 3.95Å; L273-Y861 HydrophobicContact CD2-CE1 3.94Å; L273-C862 WeakPolarHBondContact CD1-SG 3.38Å; L273-F884 HydrophobicContact CD2-CE1 3.65Å; L273-F884 HydrophobicContact CD2-CZ 3.44Å; L273-F884 VanDerWaalsContact CD2-CZ 3.44Å
274	G	71.7	Confident	72.9	Confident	27 Å²	27	58.1 Å²	58.1	28%	0.278	29%	0.288	S	S	.	.	H	α-helix	trans	-57.4	-44	177	0	0	0	0	0	112.5	C270 N276 Q277 E278	C270-G274 PolarHBondContact O-N 3.13Å; G274-N276 VanDerWaalsContact C-N 3.29Å; G274-N276 PolarHBondContact O-N 3.38Å; G274-Q277 PolarHBondContact O-N 2.98Å; G274-E278 PolarHBondContact O-N 2.89Å
275	V	74.4	Confident	73.9	Confident	54 Å²	54	57.8 Å²	57.8	33%	0.327	28%	0.281	S	S	.	.	H	α-helix	trans	-62.4	-35	175.1	175.7	0	0	0	0	111.8	K271 L273 N279	K271-V275 WeakPolarHBondContact O-CG2 3.25Å; K271-V275 PolarHBondContact O-N 3.47Å; L273-V275 VanDerWaalsContact C-N 3.32Å; L273-V275 PolarHBondContact O-N 2.91Å; V275-N279 PolarHBondContact O-N 2.83Å; V275-N279 PolarHBondContact O-ND2 3Å
276	N	76	Confident	75.3	Confident	25 Å²	25	57.7 Å²	57.7	13%	0.134	28%	0.28	C	S	.	.	H	α-helix	trans	-69.7	-42	178.2	-154	35.9	0	0	0	112.9	V272 L273 G274 E278 N279 E280 R357 Y861	V272-N276 PolarHBondContact O-N 2.94Å; L273-N276 WeakPolarHBondContact O-CB 3.5Å; L273-N276 PolarHBondContact O-N 2.9Å; G274-N276 VanDerWaalsContact C-N 3.29Å; G274-N276 PolarHBondContact O-N 3.38Å; N276-E278 VanDerWaalsContact C-N 3.32Å; N276-E278 PolarHBondContact O-N 3.4Å; N276-N279 PolarHBondContact O-N 2.86Å; N276-N279 VanDerWaalsContact O-N 3.16Å; N276-E280 PolarHBondContact O-N 3.01Å; N276-R357 PolarHBondContact OD1-NH1 3.46Å; N276-Y861 PolarHBondContact ND2-OH 3.46Å
277	Q	74.1	Confident	76.4	Confident	73 Å²	73	60.6 Å²	60.6	34%	0.341	29%	0.293	S	S	.	.	H	α-helix	trans	-66.1	-35	-179.1	-163.7	179.9	24.7	0	0	112.2	L273 G274 K281	L273-Q277 PolarHBondContact O-N 2.9Å; G274-Q277 PolarHBondContact O-N 2.98Å; Q277-K281 WeakPolarHBondContact O-CG 3.43Å; Q277-K281 PolarHBondContact O-N 2.97Å
278	E	76.5	Confident	77.4	Confident	109 Å²	109	61 Å²	61	51%	0.509	29%	0.286	S	S	.	.	H	α-helix	trans	-64.7	-40.6	171.6	-73.2	-173.7	-175.1	0	0	112.5	G274 N276 K281 L282 K351	G274-E278 PolarHBondContact O-N 2.89Å; N276-E278 VanDerWaalsContact C-N 3.32Å; N276-E278 PolarHBondContact O-N 3.4Å; E278-K281 PolarHBondContact O-N 3.49Å; E278-L282 WeakPolarHBondContact O-CG 3.34Å; E278-L282 PolarHBondContact O-N 3.37Å; E278-L282 VanDerWaalsContact O-N 3.15Å; E278-K351 IonicContact OE2-NZ 3.06Å; E278-K351 PolarHBondContact OE2-NZ 2.73Å
279	N	80.4	Confident	78.4	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65	-39.7	178.2	-66.7	-19.1	0	0	0	111.4	V275 N276 L282 M283 L348 L352	V275-N279 PolarHBondContact O-N 2.83Å; V275-N279 PolarHBondContact O-ND2 3Å; N276-N279 PolarHBondContact O-N 2.86Å; N276-N279 VanDerWaalsContact O-N 3.16Å; N279-L282 PolarHBondContact O-N 2.98Å; N279-M283 WeakPolarHBondContact O-CG 3.39Å; N279-M283 PolarHBondContact O-N 3.07Å; N279-L348 HydrophobicContact CB-CD1 4.02Å; N279-L352 HydrophobicContact CB-CD2 4.44Å
280	E	78.7	Confident	79.3	Confident	32 Å²	32	55.1 Å²	55.1	15%	0.15	27%	0.266	C	S	.	.	H	α-helix	trans	-60.8	-44	174.9	-73	-177	-167.7	0	0	112.8	N276 L282 M283 E284 Y861 R865	N276-E280 PolarHBondContact O-N 3.01Å; E280-L282 VanDerWaalsContact C-N 3.31Å; E280-L282 PolarHBondContact O-N 2.79Å; E280-M283 HydrophobicContact CB-CE 4.19Å; E280-M283 HydrophobicContact CG-CE 3.74Å; E280-M283 WeakPolarHBondContact O-CB 3.49Å; E280-M283 PolarHBondContact O-N 3.18Å; E280-M283 VanDerWaalsContact O-N 3.17Å; E280-E284 PolarHBondContact O-N 2.73Å; E280-E284 VanDerWaalsContact O-N 3.08Å; E280-Y861 PolarHBondContact OE1-OH 3.33Å; E280-R865 IonicContact OE1-CZ 2.78Å; E280-R865 IonicContact OE1-NE 2.83Å; E280-R865 PolarHBondContact OE1-NE 3.4Å; E280-R865 IonicContact OE1-NH2 2.72Å; E280-R865 PolarHBondContact OE1-NH2 3.31Å; E280-R865 VanDerWaalsContact OE1-NH2 3.17Å; E280-R865 IonicContact OE2-CZ 2.97Å; E280-R865 IonicContact OE2-NE 3.08Å; E280-R865 IonicContact OE2-NH2 2.67Å; E280-R865 PolarHBondContact OE2-NH2 3.27Å
281	K	81.2	Confident	80.1	Confident	132 Å²	132	56 Å²	56	57%	0.574	27%	0.272	S	S	*	.	H	α-helix	trans	-61.6	-39.3	175.9	-70.8	175.6	-178.8	175	0	112.6	Q277 E278 M283 E284 E285	Q277-K281 WeakPolarHBondContact O-CG 3.43Å; Q277-K281 PolarHBondContact O-N 2.97Å; E278-K281 PolarHBondContact O-N 3.49Å; K281-M283 VanDerWaalsContact C-N 3.34Å; K281-E284 PolarHBondContact O-N 3.49Å; K281-E285 PolarHBondContact O-N 3.16Å; K281-E285 VanDerWaalsContact O-N 3.13Å
282	L	81.6	Confident	81.1	Confident	43 Å²	43	52 Å²	52	23%	0.225	26%	0.256	C	S	.	.	H	α-helix	trans	-67.4	-34.1	176.6	-72.6	171.8	0	0	0	112.3	E278 N279 E280 Y286 L348 K351	E278-L282 WeakPolarHBondContact O-CG 3.34Å; E278-L282 PolarHBondContact O-N 3.37Å; E278-L282 VanDerWaalsContact O-N 3.15Å; N279-L282 PolarHBondContact O-N 2.98Å; E280-L282 VanDerWaalsContact C-N 3.31Å; E280-L282 PolarHBondContact O-N 2.79Å; L282-Y286 PolarHBondContact O-N 3.05Å; L282-Y286 VanDerWaalsContact O-N 3.11Å; L282-L348 HydrophobicContact CB-CD1 4.15Å; L282-K351 HydrophobicContact CD1-CD 4.32Å
283	M	81.8	Confident	82	Confident	53 Å²	53	51.1 Å²	51.1	26%	0.261	25%	0.25	S	S	.	.	H	α-helix	trans	-64.7	-47.3	174.2	-72.9	-174.2	-68.9	0	0	111.9	N279 E280 K281 E285 Y286 E287 L348 F360	N279-M283 WeakPolarHBondContact O-CG 3.39Å; N279-M283 PolarHBondContact O-N 3.07Å; E280-M283 HydrophobicContact CB-CE 4.19Å; E280-M283 HydrophobicContact CG-CE 3.74Å; E280-M283 WeakPolarHBondContact O-CB 3.49Å; E280-M283 PolarHBondContact O-N 3.18Å; E280-M283 VanDerWaalsContact O-N 3.17Å; K281-M283 VanDerWaalsContact C-N 3.34Å; M283-E285 PolarHBondContact O-N 3.27Å; M283-Y286 PolarHBondContact O-N 3.04Å; M283-E287 PolarHBondContact O-N 2.9Å; M283-E287 VanDerWaalsContact O-N 3.11Å; M283-L348 HydrophobicContact CB-CD2 4.46Å; M283-L348 HydrophobicContact CG-CD1 4.36Å; M283-L348 HydrophobicContact CG-CD2 3.46Å; M283-L348 VanDerWaalsContact CG-CD2 3.46Å; M283-F360 HydrophobicContact CB-CD2 4.31Å; M283-F360 HydrophobicContact CB-CE2 3.83Å; M283-F360 HydrophobicContact CB-CZ 4.14Å; M283-F360 HydrophobicContact CG-CD2 3.5Å; M283-F360 VanDerWaalsContact CG-CD2 3.5Å; M283-F360 HydrophobicContact CG-CE2 3.54Å; M283-F360 HydrophobicContact CG-CG 4.01Å; M283-F360 HydrophobicContact CG-CZ 4.08Å; M283-F360 HydrophobicContact SD-CD2 3.32Å; M283-F360 WeakPolarHBondContact SD-CD2 3.27Å; M283-F360 HydrophobicContact SD-CE2 3.72Å; M283-F360 HydrophobicContact SD-CG 4.12Å
284	E	84.1	Confident	82.9	Confident	136 Å²	136	51.7 Å²	51.7	64%	0.636	25%	0.253	S	S	*	.	H	α-helix	trans	-62.3	-42.7	178.7	-70.4	179.2	176.2	0	0	112.1	E280 K281 E287 R288	E280-E284 PolarHBondContact O-N 2.73Å; E280-E284 VanDerWaalsContact O-N 3.08Å; K281-E284 PolarHBondContact O-N 3.49Å; E284-E287 PolarHBondContact O-N 3.2Å; E284-R288 PolarHBondContact O-N 2.92Å
285	E	83.1	Confident	83.8	Confident	69 Å²	69	56.9 Å²	56.9	32%	0.322	27%	0.27	S	S	.	.	H	α-helix	trans	-67	-37.8	179.3	-176.5	60	-171.6	0	0	112.2	K281 M283 E287 R288 L289	K281-E285 PolarHBondContact O-N 3.16Å; K281-E285 VanDerWaalsContact O-N 3.13Å; M283-E285 PolarHBondContact O-N 3.27Å; E285-E287 VanDerWaalsContact C-N 3.34Å; E285-E287 PolarHBondContact O-N 3.45Å; E285-R288 IonicContact OE1-CZ 3.73Å; E285-R288 IonicContact OE1-NE 2.69Å; E285-R288 IonicContact OE1-NH2 3.09Å; E285-R288 PolarHBondContact OE1-NH2 3.28Å; E285-R288 IonicContact OE2-CZ 3.91Å; E285-R288 IonicContact OE2-NE 2.73Å; E285-R288 PolarHBondContact OE2-NE 3.09Å; E285-R288 IonicContact OE2-NH2 3.46Å; E285-R288 PolarHBondContact OE2-NH2 3.21Å; E285-L289 HydrophobicContact CG-CD1 4.05Å; E285-L289 WeakPolarHBondContact O-CB 3.43Å; E285-L289 WeakPolarHBondContact O-CG 3.16Å; E285-L289 PolarHBondContact O-N 3.32Å; E285-L289 VanDerWaalsContact O-N 3.09Å
286	Y	88.4	Confident	84.8	Confident	1 Å²	1	56.6 Å²	56.6	0%	0.004	26%	0.264	C	S	.	.	H	α-helix	trans	-58.3	-47.8	171.3	174.6	-82.9	0	0	0	110.9	L282 M283 R288 L289 A290 L341 F345 F360 P362 K366 V368	L282-Y286 PolarHBondContact O-N 3.05Å; L282-Y286 VanDerWaalsContact O-N 3.11Å; M283-Y286 PolarHBondContact O-N 3.04Å; Y286-R288 PolarHBondContact O-N 2.86Å; Y286-L289 PolarHBondContact O-N 3.05Å; Y286-A290 HydrophobicContact CE1-CB 4.28Å; Y286-A290 VanDerWaalsContact O-CB 3.24Å; Y286-A290 WeakPolarHBondContact O-CB 3.43Å; Y286-A290 PolarHBondContact O-N 3.48Å; Y286-L341 HydrophobicContact CD2-CD2 4.04Å; Y286-L341 HydrophobicContact CD2-CG 3.88Å; Y286-L341 HydrophobicContact CE2-CD1 4.48Å; Y286-L341 HydrophobicContact CE2-CD2 3.31Å; Y286-L341 HydrophobicContact CE2-CG 3.66Å; Y286-F345 HydrophobicContact CD2-CB 3.99Å; Y286-F345 HydrophobicContact CD2-CD2 4.32Å; Y286-F345 HydrophobicContact CE2-CB 3.73Å; Y286-F345 AromaticContact CE2-CD2 3.83Å; Y286-F345 HydrophobicContact CE2-CD2 3.83Å; Y286-F345 HydrophobicContact CE2-CG 4.13Å; Y286-F360 AromaticContact CD1-CE1 3.67Å; Y286-F360 HydrophobicContact CD1-CE1 3.67Å; Y286-F360 HydrophobicContact CD1-CZ 4.03Å; Y286-F360 HydrophobicContact CE1-CE1 4.17Å; Y286-F360 AromaticContact CG-CE1 4Å; Y286-F360 HydrophobicContact CG-CE1 4Å; Y286-P362 HydrophobicContact CD1-CB 4.44Å; Y286-P362 HydrophobicContact CD1-CG 4.24Å; Y286-P362 HydrophobicContact CE1-CB 3.67Å; Y286-P362 HydrophobicContact CE1-CG 3.44Å; Y286-P362 VanDerWaalsContact CE1-CG 3.44Å; Y286-K366 PolarHBondContact OH-O 3.39Å; Y286-V368 HydrophobicContact CE2-CG2 4.01Å; Y286-V368 WeakPolarHBondContact OH-CG2 3.47Å; Y286-V368 PolarHBondContact OH-N 3.11Å
287	E	84.7	Confident	85.6	Confident	68 Å²	68	55.7 Å²	55.7	32%	0.318	26%	0.259	S	S	.	.	H	α-helix	trans	-68.6	-36.1	-175.1	-174.5	160	-161.5	0	0	113	M283 E284 E285 S291 S363 K366	M283-E287 PolarHBondContact O-N 2.9Å; M283-E287 VanDerWaalsContact O-N 3.11Å; E284-E287 PolarHBondContact O-N 3.2Å; E285-E287 VanDerWaalsContact C-N 3.34Å; E285-E287 PolarHBondContact O-N 3.45Å; E287-S291 WeakPolarHBondContact O-CB 2.98Å; E287-S291 PolarHBondContact O-N 2.76Å; E287-S291 VanDerWaalsContact O-N 3.16Å; E287-S291 PolarHBondContact O-OG 3.33Å; E287-S363 WeakPolarHBondContact OE1-CB 3.05Å; E287-S363 PolarHBondContact OE1-OG 3.34Å; E287-K366 HydrophobicContact CG-CD 4.1Å; E287-K366 IonicContact OE1-NZ 3.82Å; E287-K366 PolarHBondContact OE1-NZ 2.85Å
288	R	87.4	Confident	86.4	Confident	108 Å²	108	60.3 Å²	60.3	41%	0.408	27%	0.273	S	S	.	.	H	α-helix	trans	-63	-54.2	173.8	-171.1	-172.7	70.5	76.3	-0.1	111.3	E284 E285 Y286 A290 S291 E292	E284-R288 PolarHBondContact O-N 2.92Å; E285-R288 IonicContact OE1-CZ 3.73Å; E285-R288 IonicContact OE1-NE 2.69Å; E285-R288 IonicContact OE1-NH2 3.09Å; E285-R288 PolarHBondContact OE1-NH2 3.28Å; E285-R288 IonicContact OE2-CZ 3.91Å; E285-R288 IonicContact OE2-NE 2.73Å; E285-R288 PolarHBondContact OE2-NE 3.09Å; E285-R288 IonicContact OE2-NH2 3.46Å; E285-R288 PolarHBondContact OE2-NH2 3.21Å; Y286-R288 PolarHBondContact O-N 2.86Å; R288-A290 VanDerWaalsContact C-N 3.34Å; R288-A290 PolarHBondContact O-N 3.02Å; R288-S291 PolarHBondContact O-N 3.02Å; R288-E292 IonicContact CZ-OE1 2.71Å; R288-E292 VanDerWaalsContact NH1-CD 3.27Å; R288-E292 IonicContact NH1-OE1 2.77Å; R288-E292 PolarHBondContact NH1-OE1 3.07Å; R288-E292 IonicContact NH1-OE2 3.58Å; R288-E292 PolarHBondContact NH1-OE2 3.2Å; R288-E292 VanDerWaalsContact NH1-OE2 3.11Å; R288-E292 PolarHBondContact O-N 3Å; R288-E292 VanDerWaalsContact O-N 3.13Å
289	L	88	Confident	87.1	Confident	16 Å²	16	65.4 Å²	65.4	8%	0.084	29%	0.288	C	S	.	.	H	α-helix	trans	-61.5	-41	-179.6	-70.9	173.6	0	0	0	112.1	E285 Y286 S291 E292 L293 L341	E285-L289 HydrophobicContact CG-CD1 4.05Å; E285-L289 WeakPolarHBondContact O-CB 3.43Å; E285-L289 WeakPolarHBondContact O-CG 3.16Å; E285-L289 PolarHBondContact O-N 3.32Å; E285-L289 VanDerWaalsContact O-N 3.09Å; Y286-L289 PolarHBondContact O-N 3.05Å; L289-S291 VanDerWaalsContact C-N 3.31Å; L289-S291 PolarHBondContact O-N 3.04Å; L289-E292 PolarHBondContact O-N 2.6Å; L289-L293 WeakPolarHBondContact O-CB 3.44Å; L289-L293 PolarHBondContact O-N 2.93Å; L289-L341 HydrophobicContact CB-CD1 4.33Å
290	A	88.8	Confident	87.7	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-59.3	-42.7	176.2	0	0	0	0	0	111.9	Y286 R288 L294 L341 K366 I371	Y286-A290 HydrophobicContact CE1-CB 4.28Å; Y286-A290 VanDerWaalsContact O-CB 3.24Å; Y286-A290 WeakPolarHBondContact O-CB 3.43Å; Y286-A290 PolarHBondContact O-N 3.48Å; R288-A290 VanDerWaalsContact C-N 3.34Å; R288-A290 PolarHBondContact O-N 3.02Å; A290-L294 WeakPolarHBondContact O-CB 3.43Å; A290-L294 WeakPolarHBondContact O-CD1 3.47Å; A290-L294 VanDerWaalsContact O-CG 3.24Å; A290-L294 WeakPolarHBondContact O-CG 3.47Å; A290-L294 PolarHBondContact O-N 3.34Å; A290-L341 VanDerWaalsContact CA-CD1 3.45Å; A290-L341 HydrophobicContact CB-CD1 3.76Å; A290-K366 HydrophobicContact CB-CB 4.31Å; A290-K366 HydrophobicContact CB-CD 4.46Å; A290-I371 HydrophobicContact CB-CD1 3.96Å
291	S	89.4	Confident	88.3	Confident	39 Å²	39	66 Å²	66	27%	0.273	29%	0.293	S	S	.	.	H	α-helix	trans	-67.8	-46.1	-177.4	-54.8	0	0	0	0	111.7	E287 R288 L289 E295 K366	E287-S291 WeakPolarHBondContact O-CB 2.98Å; E287-S291 PolarHBondContact O-N 2.76Å; E287-S291 VanDerWaalsContact O-N 3.16Å; E287-S291 PolarHBondContact O-OG 3.33Å; R288-S291 PolarHBondContact O-N 3.02Å; L289-S291 VanDerWaalsContact C-N 3.31Å; L289-S291 PolarHBondContact O-N 3.04Å; S291-E295 WeakPolarHBondContact O-CB 3.4Å; S291-E295 PolarHBondContact O-N 2.99Å; S291-E295 VanDerWaalsContact O-N 3.07Å; S291-K366 VanDerWaalsContact OG-CE 3.3Å; S291-K366 WeakPolarHBondContact OG-CE 3.35Å; S291-K366 PolarHBondContact OG-NZ 3.19Å
292	E	90.1	Very high	88.9	Confident	83 Å²	83	63.4 Å²	63.4	39%	0.388	29%	0.29	S	S	.	.	H	α-helix	trans	-62.7	-42.9	178.1	-71.1	174	-169	0	0	111.9	R288 L289 W296	R288-E292 IonicContact CZ-OE1 2.71Å; R288-E292 VanDerWaalsContact NH1-CD 3.27Å; R288-E292 IonicContact NH1-OE1 2.77Å; R288-E292 PolarHBondContact NH1-OE1 3.07Å; R288-E292 IonicContact NH1-OE2 3.58Å; R288-E292 PolarHBondContact NH1-OE2 3.2Å; R288-E292 VanDerWaalsContact NH1-OE2 3.11Å; R288-E292 PolarHBondContact O-N 3Å; R288-E292 VanDerWaalsContact O-N 3.13Å; L289-E292 PolarHBondContact O-N 2.6Å; E292-W296 PolarHBondContact O-N 3.41Å; E292-W296 VanDerWaalsContact O-N 3.09Å
293	L	91.3	Very high	89.4	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-66.7	-46.1	179.7	-175.2	62.3	0	0	0	111.9	L289 E295 W296 I297 K334 K338 I371 W375	L289-L293 WeakPolarHBondContact O-CB 3.44Å; L289-L293 PolarHBondContact O-N 2.93Å; L293-E295 VanDerWaalsContact C-N 3.35Å; L293-E295 PolarHBondContact O-N 3.18Å; L293-W296 PolarHBondContact O-N 2.59Å; L293-I297 HydrophobicContact CG-CD1 4.26Å; L293-I297 WeakPolarHBondContact O-CG1 3.48Å; L293-I297 PolarHBondContact O-N 3Å; L293-K334 HydrophobicContact CD1-CB 4.23Å; L293-K334 HydrophobicContact CD1-CD 4.47Å; L293-K338 HydrophobicContact CD2-CB 3.94Å; L293-K338 HydrophobicContact CD2-CG 4.43Å; L293-I371 HydrophobicContact CD2-CG2 3.89Å; L293-W375 HydrophobicContact CD1-CZ3 4.1Å
294	L	90.1	Very high	89.8	Confident	16 Å²	16	63.7 Å²	63.7	8%	0.084	29%	0.285	C	S	.	.	H	α-helix	trans	-65.4	-35.9	179.3	-73.4	170.4	0	0	0	112.6	A290 R298 G365 K366 I371 A374	A290-L294 WeakPolarHBondContact O-CB 3.43Å; A290-L294 WeakPolarHBondContact O-CD1 3.47Å; A290-L294 VanDerWaalsContact O-CG 3.24Å; A290-L294 WeakPolarHBondContact O-CG 3.47Å; A290-L294 PolarHBondContact O-N 3.34Å; L294-R298 WeakPolarHBondContact O-CG 3.46Å; L294-R298 PolarHBondContact O-N 3.1Å; L294-R298 VanDerWaalsContact O-N 3.1Å; L294-R298 PolarHBondContact O-NE 3.43Å; L294-G365 WeakPolarHBondContact CD1-O 3.29Å; L294-K366 HydrophobicContact CD1-CG 4.23Å; L294-I371 HydrophobicContact CD1-CG1 4.15Å; L294-I371 HydrophobicContact CD2-CG1 4.01Å; L294-I371 HydrophobicContact CG-CG1 4.12Å; L294-A374 HydrophobicContact CD2-CB 3.99Å
295	E	90.7	Very high	90.1	Very high	136 Å²	136	62.8 Å²	62.8	64%	0.636	28%	0.281	S	S	*	.	H	α-helix	trans	-65.2	-44	173.5	-172.7	176.2	176.3	0	0	112	S291 L293 I297 R298 R299	S291-E295 WeakPolarHBondContact O-CB 3.4Å; S291-E295 PolarHBondContact O-N 2.99Å; S291-E295 VanDerWaalsContact O-N 3.07Å; L293-E295 VanDerWaalsContact C-N 3.35Å; L293-E295 PolarHBondContact O-N 3.18Å; E295-I297 PolarHBondContact O-N 3.39Å; E295-R298 PolarHBondContact O-N 2.88Å; E295-R299 PolarHBondContact O-N 2.94Å
296	W	93.7	Very high	90.4	Very high	49 Å²	49	63 Å²	63	19%	0.186	28%	0.284	C	S	.	.	H	α-helix	trans	-61.1	-44	176.7	178.8	84.2	0	0	0	112.4	E292 L293 R299 T300 Y326 K334 W375 L378	E292-W296 PolarHBondContact O-N 3.41Å; E292-W296 VanDerWaalsContact O-N 3.09Å; L293-W296 PolarHBondContact O-N 2.59Å; W296-R299 PolarHBondContact O-N 3.44Å; W296-T300 HydrophobicContact CZ2-CG2 4.34Å; W296-T300 WeakPolarHBondContact O-CB 3.49Å; W296-T300 PolarHBondContact O-N 2.74Å; W296-T300 PolarHBondContact O-OG1 2.89Å; W296-Y326 HydrophobicContact CH2-CE2 4.01Å; W296-Y326 AromaticContact CZ2-CE2 3.76Å; W296-Y326 HydrophobicContact CZ2-CE2 3.76Å; W296-K334 HydrophobicContact CD2-CG 3.96Å; W296-K334 HydrophobicContact CE3-CB 4.33Å; W296-K334 HydrophobicContact CE3-CG 4.11Å; W296-K334 HydrophobicContact CH2-CB 4.27Å; W296-K334 HydrophobicContact CH2-CG 4.22Å; W296-K334 HydrophobicContact CZ2-CG 4.05Å; W296-K334 HydrophobicContact CZ3-CB 4.12Å; W296-K334 HydrophobicContact CZ3-CG 4.24Å; W296-W375 HydrophobicContact CZ3-CZ3 4.09Å; W296-L378 HydrophobicContact CE3-CD2 4.49Å; W296-L378 HydrophobicContact CH2-CD2 3.94Å; W296-L378 HydrophobicContact CZ3-CD2 3.49Å; W296-L378 VanDerWaalsContact CZ3-CD2 3.49Å
297	I	92.7	Very high	90.4	Very high	6 Å²	6	67 Å²	67	3%	0.031	30%	0.299	C	S	.	.	H	α-helix	trans	-58.2	-52.4	175.4	-66.6	168.5	0	0	0	109.8	L293 E295 R299 T300 T301 A374 W375 L378	L293-I297 HydrophobicContact CG-CD1 4.26Å; L293-I297 WeakPolarHBondContact O-CG1 3.48Å; L293-I297 PolarHBondContact O-N 3Å; E295-I297 PolarHBondContact O-N 3.39Å; I297-R299 PolarHBondContact O-N 2.75Å; I297-T300 PolarHBondContact O-N 3.11Å; I297-T301 PolarHBondContact O-N 2.75Å; I297-T301 PolarHBondContact O-OG1 3.43Å; I297-A374 HydrophobicContact CD1-CB 4.16Å; I297-A374 HydrophobicContact CG2-CB 4.28Å; I297-W375 HydrophobicContact CD1-CE3 4.05Å; I297-W375 HydrophobicContact CG1-CE3 4.47Å; I297-L378 HydrophobicContact CG1-CD2 4.37Å; I297-L378 HydrophobicContact CG2-CB 4.25Å
298	R	91.2	Very high	90.5	Very high	169 Å²	169	67 Å²	67	64%	0.638	30%	0.304	S	S	*	.	H	α-helix	trans	-57	-35.1	-179.3	-79.1	-176.1	-71.5	-133.2	-0.3	113.6	L294 E295 P302	L294-R298 WeakPolarHBondContact O-CG 3.46Å; L294-R298 PolarHBondContact O-N 3.1Å; L294-R298 VanDerWaalsContact O-N 3.1Å; L294-R298 PolarHBondContact O-NE 3.43Å; E295-R298 PolarHBondContact O-N 2.88Å; R298-P302 VanDerWaalsContact O-CD 3.25Å; R298-P302 WeakPolarHBondContact O-CD 3.36Å
299	R	92.9	Very high	90.1	Very high	217 Å²	217	65.9 Å²	65.9	82%	0.819	31%	0.311	S	S	*	.	H	α-helix	trans	-77.1	-32.4	177.5	-178.1	177.8	168.7	-174.9	-3.7	113	E295 W296 I297	E295-R299 PolarHBondContact O-N 2.94Å; W296-R299 PolarHBondContact O-N 3.44Å; I297-R299 PolarHBondContact O-N 2.75Å
300	T	92.6	Very high	89.9	Confident	16 Å²	16	68.1 Å²	68.1	10%	0.098	32%	0.321	C	S	.	.	H	α-helix	trans	-84.9	-35.2	-172.6	-54.1	0	0	0	0	112.2	W296 I297 W303 L304 Y326 L378	W296-T300 HydrophobicContact CZ2-CG2 4.34Å; W296-T300 WeakPolarHBondContact O-CB 3.49Å; W296-T300 PolarHBondContact O-N 2.74Å; W296-T300 PolarHBondContact O-OG1 2.89Å; I297-T300 PolarHBondContact O-N 3.11Å; T300-W303 HydrophobicContact CG2-CE3 4.43Å; T300-W303 WeakPolarHBondContact O-CB 3.36Å; T300-W303 PolarHBondContact O-N 3.42Å; T300-W303 VanDerWaalsContact O-N 3.11Å; T300-L304 HydrophobicContact CG2-CD1 4.06Å; T300-L304 HydrophobicContact CG2-CG 4.37Å; T300-L304 PolarHBondContact O-N 3.23Å; T300-Y326 HydrophobicContact CG2-CE2 3.73Å; T300-L378 HydrophobicContact CG2-CD1 4.14Å
301	T	91.3	Very high	89.2	Confident	27 Å²	27	76.8 Å²	76.8	17%	0.166	36%	0.359	C	S	.	.	H	α-helix	trans	-53.4	-46.8	-178.7	-55.2	0	0	0	0	113.5	I297 W303 L304 E305 A381	I297-T301 PolarHBondContact O-N 2.75Å; I297-T301 PolarHBondContact O-OG1 3.43Å; T301-W303 VanDerWaalsContact C-N 3.29Å; T301-W303 PolarHBondContact O-N 3.28Å; T301-L304 CarbonylContact O-C 3.57Å; T301-L304 PolarHBondContact O-N 3.06Å; T301-L304 VanDerWaalsContact O-N 3.11Å; T301-E305 HydrophobicContact CG2-CG 4.21Å; T301-E305 WeakPolarHBondContact O-CG 3.28Å; T301-E305 PolarHBondContact O-N 3Å; T301-A381 HydrophobicContact CG2-CB 4.28Å
302	P	92.6	Very high	88.8	Confident	78 Å²	78	78 Å²	78	51%	0.506	36%	0.364	S	S	.	.	H	α-helix	trans	-63.7	-31.6	179.5	-23.6	35	0	0	0	114.1	R298 E305 N306	R298-P302 VanDerWaalsContact O-CD 3.25Å; R298-P302 WeakPolarHBondContact O-CD 3.36Å; P302-E305 PolarHBondContact O-N 2.92Å; P302-N306 PolarHBondContact O-N 3.35Å
303	W	92.3	Very high	88.4	Confident	103 Å²	103	76.5 Å²	76.5	39%	0.39	36%	0.358	S	S	.	.	H	α-helix	trans	-67.7	-41.6	175	173.6	77.6	0	0	0	110.9	T300 T301 E305 N306 F323 Y326	T300-W303 HydrophobicContact CG2-CE3 4.43Å; T300-W303 WeakPolarHBondContact O-CB 3.36Å; T300-W303 PolarHBondContact O-N 3.42Å; T300-W303 VanDerWaalsContact O-N 3.11Å; T301-W303 VanDerWaalsContact C-N 3.29Å; T301-W303 PolarHBondContact O-N 3.28Å; W303-E305 VanDerWaalsContact C-N 3.3Å; W303-E305 PolarHBondContact O-N 2.95Å; W303-N306 PolarHBondContact O-N 3.46Å; W303-F323 HydrophobicContact CH2-CD2 4.28Å; W303-Y326 HydrophobicContact CH2-CG 4.16Å; W303-Y326 HydrophobicContact CZ3-CD1 4.18Å; W303-Y326 HydrophobicContact CZ3-CD2 4.06Å; W303-Y326 AromaticContact CZ3-CG 3.85Å; W303-Y326 HydrophobicContact CZ3-CG 3.85Å
304	L	91	Very high	88.1	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-72.2	-17.8	174.2	-68.7	170.3	0	0	0	113.7	T300 T301 R307 F323 Y326 L378 A381 E382 F385	T300-L304 HydrophobicContact CG2-CD1 4.06Å; T300-L304 HydrophobicContact CG2-CG 4.37Å; T300-L304 PolarHBondContact O-N 3.23Å; T301-L304 CarbonylContact O-C 3.57Å; T301-L304 PolarHBondContact O-N 3.06Å; T301-L304 VanDerWaalsContact O-N 3.11Å; L304-R307 PolarHBondContact O-NH1 2.94Å; L304-R307 PolarHBondContact O-NH2 3.16Å; L304-F323 HydrophobicContact CD2-CD2 4.27Å; L304-F323 HydrophobicContact CD2-CE2 3.94Å; L304-Y326 HydrophobicContact CD2-CE1 4.46Å; L304-L378 HydrophobicContact CD1-CD1 3.54Å; L304-L378 HydrophobicContact CD1-CG 4.23Å; L304-A381 HydrophobicContact CB-CB 3.97Å; L304-E382 HydrophobicContact CD1-CB 4.49Å; L304-E382 HydrophobicContact CD1-CG 3.44Å; L304-E382 VanDerWaalsContact CD1-CG 3.44Å; L304-E382 HydrophobicContact CD2-CG 4.08Å; L304-E382 HydrophobicContact CG-CG 4.38Å; L304-F385 HydrophobicContact CD2-CB 4.42Å; L304-F385 HydrophobicContact CD2-CD1 3.94Å; L304-F385 HydrophobicContact CD2-CG 4.36Å; L304-F385 WeakPolarHBondContact O-CB 3.29Å
305	E	90.8	Very high	87.8	Confident	117 Å²	117	83 Å²	83	55%	0.547	40%	0.399	S	S	.	.	H	α-helix	trans	-92.5	-9.5	176.4	-74.9	-178.4	168.4	0	0	113.5	T301 P302 W303 R307 A381	T301-E305 HydrophobicContact CG2-CG 4.21Å; T301-E305 WeakPolarHBondContact O-CG 3.28Å; T301-E305 PolarHBondContact O-N 3Å; P302-E305 PolarHBondContact O-N 2.92Å; W303-E305 VanDerWaalsContact C-N 3.3Å; W303-E305 PolarHBondContact O-N 2.95Å; E305-R307 VanDerWaalsContact CA-NH1 3.33Å; E305-R307 PolarHBondContact O-N 2.92Å; E305-R307 PolarHBondContact O-NH1 3.39Å; E305-A381 HydrophobicContact CG-CB 4.16Å
306	N	89.5	Confident	87.6	Confident	73 Å²	73	76.5 Å²	76.5	39%	0.39	37%	0.369	S	S	.	.			trans	-65.8	121.4	175.8	-174.5	-2	0	0	0	110.7	P302 W303 T308	P302-N306 PolarHBondContact O-N 3.35Å; W303-N306 PolarHBondContact O-N 3.46Å; N306-T308 PolarHBondContact ND2-OG1 3.48Å; N306-T308 WeakPolarHBondContact OD1-CB 3.47Å; N306-T308 VanDerWaalsContact OD1-CG2 3.3Å; N306-T308 WeakPolarHBondContact OD1-CG2 3.39Å; N306-T308 PolarHBondContact OD1-N 3.39Å; N306-T308 VanDerWaalsContact OD1-N 3.11Å; N306-T308 PolarHBondContact OD1-OG1 2.98Å
307	R	87.8	Confident	87.1	Confident	84 Å²	84	78.9 Å²	78.9	32%	0.317	38%	0.382	S	S	.	.			trans	-116.2	27.6	-178.9	-60.7	-69.9	171.6	-79.5	-1	113	L304 E305 P309 A381 W388	L304-R307 PolarHBondContact O-NH1 2.94Å; L304-R307 PolarHBondContact O-NH2 3.16Å; E305-R307 VanDerWaalsContact CA-NH1 3.33Å; E305-R307 PolarHBondContact O-N 2.92Å; E305-R307 PolarHBondContact O-NH1 3.39Å; R307-P309 VanDerWaalsContact O-CD 3.28Å; R307-P309 WeakPolarHBondContact O-CD 3.49Å; R307-A381 PolarHBondContact NH2-O 3.43Å; R307-W388 VanDerWaalsContact C-CZ2 3.4Å; R307-W388 WeakPolarHBondContact O-CZ2 3.4Å
308	T	85.8	Confident	86.9	Confident	69 Å²	69	87.4 Å²	87.4	42%	0.423	41%	0.413	S	S	.	.			trans	-70.5	114.7	179.2	43.8	0	0	0	0	111.5	N306 K319 W388	N306-T308 PolarHBondContact ND2-OG1 3.48Å; N306-T308 WeakPolarHBondContact OD1-CB 3.47Å; N306-T308 VanDerWaalsContact OD1-CG2 3.3Å; N306-T308 WeakPolarHBondContact OD1-CG2 3.39Å; N306-T308 PolarHBondContact OD1-N 3.39Å; N306-T308 VanDerWaalsContact OD1-N 3.11Å; N306-T308 PolarHBondContact OD1-OG1 2.98Å; T308-K319 PolarHBondContact O-NZ 3.33Å; T308-W388 WeakPolarHBondContact O-CH2 3.43Å; T308-W388 WeakPolarHBondContact O-CZ2 3.41Å
309	P	80.1	Confident	86.7	Confident	84 Å²	84	81.3 Å²	81.3	55%	0.545	39%	0.392	S	S	.	.			trans	-74.4	136.4	179.6	30.6	-33	0	0	0	110.4	R307	R307-P309 VanDerWaalsContact O-CD 3.28Å; R307-P309 WeakPolarHBondContact O-CD 3.49Å
310	E	83.3	Confident	86.4	Confident	63 Å²	63	72.7 Å²	72.7	29%	0.294	36%	0.362	S	S	.	.			trans	-90.9	156.9	172.3	-59.5	-61.1	162	0	0	110.7	E315 M316 K319	E310-E315 HydrophobicContact CB-CB 3.73Å; E310-E315 HydrophobicContact CG-CB 4Å; E310-M316 HydrophobicContact CB-CG 4.03Å; E310-M316 HydrophobicContact CB-SD 3.97Å; E310-M316 HydrophobicContact CG-SD 4.07Å; E310-K319 HydrophobicContact CG-CD 4.14Å; E310-K319 WeakPolarHBondContact OE1-CE 3.31Å; E310-K319 IonicContact OE1-NZ 3.26Å; E310-K319 PolarHBondContact OE1-NZ 3.49Å
311	K	74.2	Confident	86.1	Confident	183 Å²	183	75.9 Å²	75.9	80%	0.796	38%	0.375	S	S	*	.	S	Bend	trans	-82.6	-21.5	-172.6	-65.8	-178.5	-178.8	179	0	113.2
312	T	80.6	Confident	86	Confident	63 Å²	63	78.4 Å²	78.4	39%	0.387	39%	0.388	S	S	.	.	S	Bend	trans	-122.4	147.7	-174.1	68.5	0	0	0	0	112.1	A314 E315 M316	T312-A314 PolarHBondContact O-N 3.37Å; T312-E315 PolarHBondContact N-OE2 2.91Å; T312-E315 PolarHBondContact O-N 3.23Å; T312-E315 WeakPolarHBondContact OG1-CB 3.46Å; T312-E315 WeakPolarHBondContact OG1-CG 2.97Å; T312-E315 PolarHBondContact OG1-N 3.47Å; T312-E315 PolarHBondContact OG1-OE2 3.25Å; T312-M316 PolarHBondContact O-N 3.17Å
313	M	82.9	Confident	85.9	Confident	52 Å²	52	74.9 Å²	74.9	26%	0.256	37%	0.365	S	S	.	.	H	α-helix	trans	-57.8	-37	175.2	-169.5	-170.8	-162.9	0	0	111.8	M316 Q317 E397	M313-M316 PolarHBondContact O-N 3.48Å; M313-Q317 VanDerWaalsContact O-CG 3.32Å; M313-Q317 WeakPolarHBondContact O-CG 3.48Å; M313-Q317 PolarHBondContact O-N 3.11Å; M313-E397 HydrophobicContact CE-CB 4.18Å; M313-E397 HydrophobicContact CE-CG 4.28Å
314	A	83.5	Confident	85.7	Confident	65 Å²	65	76.6 Å²	76.6	54%	0.537	37%	0.371	S	S	.	.	H	α-helix	trans	-65.1	-39.2	-179.4	0	0	0	0	0	112.9	T312 Q317 R318	T312-A314 PolarHBondContact O-N 3.37Å; A314-Q317 PolarHBondContact O-N 3.29Å; A314-R318 PolarHBondContact O-N 3.49Å; A314-R318 VanDerWaalsContact O-N 3.08Å
315	E	84.8	Confident	85.6	Confident	89 Å²	89	79.3 Å²	79.3	42%	0.416	39%	0.386	S	S	.	.	H	α-helix	trans	-68.9	-38.4	176.5	-71.9	162.3	158.5	0	0	111.5	E310 T312 R318 K319	E310-E315 HydrophobicContact CB-CB 3.73Å; E310-E315 HydrophobicContact CG-CB 4Å; T312-E315 PolarHBondContact N-OE2 2.91Å; T312-E315 PolarHBondContact O-N 3.23Å; T312-E315 WeakPolarHBondContact OG1-CB 3.46Å; T312-E315 WeakPolarHBondContact OG1-CG 2.97Å; T312-E315 PolarHBondContact OG1-N 3.47Å; T312-E315 PolarHBondContact OG1-OE2 3.25Å; E315-R318 WeakPolarHBondContact O-CB 3.5Å; E315-R318 PolarHBondContact O-N 3.13Å; E315-K319 PolarHBondContact O-N 2.75Å; E315-K319 VanDerWaalsContact O-N 3.12Å
316	M	86.2	Confident	85.6	Confident	0 Å²	0	74.4 Å²	74.4	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-67.9	-36.2	173.7	-74.1	-60.1	-66.7	0	0	112.9	E310 T312 M313 R318 K319 L320 W388 L389 E392 I393 L396	E310-M316 HydrophobicContact CB-CG 4.03Å; E310-M316 HydrophobicContact CB-SD 3.97Å; E310-M316 HydrophobicContact CG-SD 4.07Å; T312-M316 PolarHBondContact O-N 3.17Å; M313-M316 PolarHBondContact O-N 3.48Å; M316-R318 VanDerWaalsContact C-N 3.3Å; M316-R318 PolarHBondContact O-N 3.19Å; M316-K319 PolarHBondContact O-N 3.3Å; M316-K319 HydrophobicContact SD-CD 4.3Å; M316-L320 PolarHBondContact O-N 3.07Å; M316-W388 HydrophobicContact CE-CH2 4.22Å; M316-W388 HydrophobicContact CE-CZ3 4.43Å; M316-W388 HydrophobicContact SD-CH2 4.46Å; M316-L389 HydrophobicContact CE-CD2 3.62Å; M316-E392 HydrophobicContact CE-CB 3.71Å; M316-E392 HydrophobicContact CE-CG 3.68Å; M316-E392 HydrophobicContact SD-CG 4.26Å; M316-I393 HydrophobicContact CB-CG1 3.97Å; M316-I393 HydrophobicContact CE-CG1 4.33Å; M316-L396 HydrophobicContact CB-CD1 4.23Å; M316-L396 HydrophobicContact CG-CD1 3.53Å
317	Q	83.4	Confident	85.6	Confident	98 Å²	98	76.6 Å²	76.6	46%	0.458	37%	0.365	S	S	.	.	H	α-helix	trans	-63.2	-37.1	172.7	-77.1	173.4	-9.5	0	0	111.9	M313 A314 L320 E321	M313-Q317 VanDerWaalsContact O-CG 3.32Å; M313-Q317 WeakPolarHBondContact O-CG 3.48Å; M313-Q317 PolarHBondContact O-N 3.11Å; A314-Q317 PolarHBondContact O-N 3.29Å; Q317-L320 WeakPolarHBondContact O-CB 3.48Å; Q317-L320 PolarHBondContact O-N 3.46Å; Q317-E321 PolarHBondContact O-N 3.05Å
318	R	87.2	Confident	85.4	Confident	185 Å²	185	82 Å²	82	70%	0.698	39%	0.385	S	S	*	.	H	α-helix	trans	-64.8	-43.7	174.1	-170.3	178.5	177.7	177	0.5	111.9	A314 E315 M316 L320 E321 D322	A314-R318 PolarHBondContact O-N 3.49Å; A314-R318 VanDerWaalsContact O-N 3.08Å; E315-R318 WeakPolarHBondContact O-CB 3.5Å; E315-R318 PolarHBondContact O-N 3.13Å; M316-R318 VanDerWaalsContact C-N 3.3Å; M316-R318 PolarHBondContact O-N 3.19Å; R318-L320 VanDerWaalsContact C-N 3.27Å; R318-L320 PolarHBondContact O-N 3.34Å; R318-E321 PolarHBondContact O-N 3.19Å; R318-E321 VanDerWaalsContact O-N 3.1Å; R318-D322 PolarHBondContact O-N 3.05Å
319	K	87	Confident	85.3	Confident	41 Å²	41	84.2 Å²	84.2	18%	0.178	39%	0.391	C	S	.	.	H	α-helix	trans	-60.2	-36.5	173.1	-74.4	-170.6	177.9	-179.7	0	112.6	T308 E310 E315 M316 E321 F323 L389	T308-K319 PolarHBondContact O-NZ 3.33Å; E310-K319 HydrophobicContact CG-CD 4.14Å; E310-K319 WeakPolarHBondContact OE1-CE 3.31Å; E310-K319 IonicContact OE1-NZ 3.26Å; E310-K319 PolarHBondContact OE1-NZ 3.49Å; E315-K319 PolarHBondContact O-N 2.75Å; E315-K319 VanDerWaalsContact O-N 3.12Å; M316-K319 PolarHBondContact O-N 3.3Å; M316-K319 HydrophobicContact SD-CD 4.3Å; K319-E321 VanDerWaalsContact C-N 3.34Å; K319-F323 WeakPolarHBondContact O-CB 3.48Å; K319-F323 PolarHBondContact O-N 3.35Å; K319-L389 HydrophobicContact CB-CD2 4.08Å
320	L	87.1	Confident	85.6	Confident	36 Å²	36	85.5 Å²	85.5	19%	0.188	39%	0.389	C	S	.	.	H	α-helix	trans	-65.1	-38.5	174.4	-177.5	67	0	0	0	111.8	M316 Q317 R318 F323 R324 I393	M316-L320 PolarHBondContact O-N 3.07Å; Q317-L320 WeakPolarHBondContact O-CB 3.48Å; Q317-L320 PolarHBondContact O-N 3.46Å; R318-L320 VanDerWaalsContact C-N 3.27Å; R318-L320 PolarHBondContact O-N 3.34Å; L320-F323 PolarHBondContact O-N 3.48Å; L320-R324 WeakPolarHBondContact O-CG 3.37Å; L320-R324 PolarHBondContact O-N 3.33Å; L320-I393 HydrophobicContact CB-CD1 4.24Å; L320-I393 HydrophobicContact CD2-CD1 4.03Å
321	E	86.3	Confident	85.9	Confident	83 Å²	83	83.9 Å²	83.9	39%	0.388	38%	0.382	S	S	.	.	H	α-helix	trans	-69.4	-43.1	177.4	-161.7	60.2	-157.2	0	0	111.8	Q317 R318 K319 F323 R324 D325	Q317-E321 PolarHBondContact O-N 3.05Å; R318-E321 PolarHBondContact O-N 3.19Å; R318-E321 VanDerWaalsContact O-N 3.1Å; K319-E321 VanDerWaalsContact C-N 3.34Å; E321-F323 PolarHBondContact O-N 2.85Å; E321-R324 WeakPolarHBondContact O-CB 3.33Å; E321-R324 PolarHBondContact O-N 3.33Å; E321-R324 VanDerWaalsContact OE2-CD 3.31Å; E321-R324 WeakPolarHBondContact OE2-CD 3.42Å; E321-R324 IonicContact OE2-CZ 2.65Å; E321-R324 IonicContact OE2-NH1 2.91Å; E321-R324 PolarHBondContact OE2-NH1 3.49Å; E321-D325 PolarHBondContact O-N 3.37Å
322	D	89.4	Confident	86.6	Confident	80 Å²	80	78 Å²	78	43%	0.428	36%	0.362	S	S	.	.	H	α-helix	trans	-57.5	-38.3	172.8	-64.8	-23.8	0	0	0	111.2	R318 Y326	R318-D322 PolarHBondContact O-N 3.05Å; D322-Y326 PolarHBondContact O-N 2.89Å
323	F	90.8	Very high	86.9	Confident	5 Å²	5	77.8 Å²	77.8	2%	0.022	36%	0.361	C	S	.	.	H	α-helix	trans	-68.6	-35.6	174.3	-175.6	-116	0	0	0	113.4	W303 L304 K319 L320 E321 Y326 R327 F385 E386 L389	W303-F323 HydrophobicContact CH2-CD2 4.28Å; L304-F323 HydrophobicContact CD2-CD2 4.27Å; L304-F323 HydrophobicContact CD2-CE2 3.94Å; K319-F323 WeakPolarHBondContact O-CB 3.48Å; K319-F323 PolarHBondContact O-N 3.35Å; L320-F323 PolarHBondContact O-N 3.48Å; E321-F323 PolarHBondContact O-N 2.85Å; F323-Y326 HydrophobicContact CD2-CD1 4.1Å; F323-Y326 HydrophobicContact CE2-CD1 4.11Å; F323-Y326 HydrophobicContact CE2-CE1 4.41Å; F323-Y326 WeakPolarHBondContact O-CB 3.33Å; F323-R327 HydrophobicContact CE1-CG 4.39Å; F323-R327 HydrophobicContact CE2-CG 4.4Å; F323-R327 HydrophobicContact CZ-CG 4.22Å; F323-R327 WeakPolarHBondContact O-CG 3.45Å; F323-R327 PolarHBondContact O-N 2.88Å; F323-F385 HydrophobicContact CB-CE1 4.13Å; F323-F385 AromaticContact CD2-CD1 3.56Å; F323-F385 HydrophobicContact CD2-CD1 3.56Å; F323-F385 AromaticContact CD2-CE1 3.72Å; F323-F385 HydrophobicContact CD2-CE1 3.72Å; F323-F385 AromaticContact CE2-CD1 3.77Å; F323-F385 HydrophobicContact CE2-CD1 3.77Å; F323-F385 HydrophobicContact CE2-CE1 4.4Å; F323-F385 HydrophobicContact CG-CD1 4.12Å; F323-F385 HydrophobicContact CG-CE1 4.06Å; F323-F385 HydrophobicContact CZ-CD1 4.47Å; F323-E386 HydrophobicContact CE1-CB 3.99Å; F323-E386 HydrophobicContact CE1-CG 4.21Å; F323-E386 HydrophobicContact CZ-CB 4.13Å; F323-L389 HydrophobicContact CB-CD1 4.16Å; F323-L389 HydrophobicContact CD1-CD1 4.27Å; F323-L389 HydrophobicContact CG-CD1 4.22Å
324	R	86.9	Confident	87.3	Confident	138 Å²	138	77.1 Å²	77.1	52%	0.521	36%	0.357	S	S	.	.	H	α-helix	trans	-66.8	-43	174.3	-75.8	168.8	171.9	177.6	-1	111.7	L320 E321 Y326 R327 R328	L320-R324 WeakPolarHBondContact O-CG 3.37Å; L320-R324 PolarHBondContact O-N 3.33Å; E321-R324 WeakPolarHBondContact O-CB 3.33Å; E321-R324 PolarHBondContact O-N 3.33Å; E321-R324 VanDerWaalsContact OE2-CD 3.31Å; E321-R324 WeakPolarHBondContact OE2-CD 3.42Å; E321-R324 IonicContact OE2-CZ 2.65Å; E321-R324 IonicContact OE2-NH1 2.91Å; E321-R324 PolarHBondContact OE2-NH1 3.49Å; R324-Y326 VanDerWaalsContact C-N 3.35Å; R324-R327 PolarHBondContact O-N 3.24Å; R324-R328 VanDerWaalsContact O-CB 3.29Å; R324-R328 WeakPolarHBondContact O-CB 3.33Å; R324-R328 PolarHBondContact O-N 3.42Å
325	D	89.1	Confident	87.5	Confident	58 Å²	58	77.2 Å²	77.2	31%	0.31	35%	0.351	S	S	.	.	H	α-helix	trans	-63.1	-42	176	-86.1	-24.4	0	0	0	111.6	E321 R327 R328 Q329	E321-D325 PolarHBondContact O-N 3.37Å; D325-R327 PolarHBondContact O-N 3.19Å; D325-R328 PolarHBondContact O-N 2.89Å; D325-Q329 WeakPolarHBondContact O-CB 3.36Å; D325-Q329 PolarHBondContact O-N 3.47Å; D325-Q329 PolarHBondContact OD1-NE2 3.28Å
326	Y	92.4	Very high	87.6	Confident	14 Å²	14	79.6 Å²	79.6	6%	0.055	36%	0.362	C	S	.	.	I	π-helix	trans	-52.9	-51.5	169.3	166.1	-100.2	0	0	0	112.2	W296 T300 W303 L304 D322 F323 R324 R328 H330 K331 E382	W296-Y326 HydrophobicContact CH2-CE2 4.01Å; W296-Y326 AromaticContact CZ2-CE2 3.76Å; W296-Y326 HydrophobicContact CZ2-CE2 3.76Å; T300-Y326 HydrophobicContact CG2-CE2 3.73Å; W303-Y326 HydrophobicContact CH2-CG 4.16Å; W303-Y326 HydrophobicContact CZ3-CD1 4.18Å; W303-Y326 HydrophobicContact CZ3-CD2 4.06Å; W303-Y326 AromaticContact CZ3-CG 3.85Å; W303-Y326 HydrophobicContact CZ3-CG 3.85Å; L304-Y326 HydrophobicContact CD2-CE1 4.46Å; D322-Y326 PolarHBondContact O-N 2.89Å; F323-Y326 HydrophobicContact CD2-CD1 4.1Å; F323-Y326 HydrophobicContact CE2-CD1 4.11Å; F323-Y326 HydrophobicContact CE2-CE1 4.41Å; F323-Y326 WeakPolarHBondContact O-CB 3.33Å; R324-Y326 VanDerWaalsContact C-N 3.35Å; Y326-R328 PolarHBondContact O-N 2.89Å; Y326-H330 HydrophobicContact CD2-CB 4.3Å; Y326-H330 PolarHBondContact O-N 3.29Å; Y326-K331 HydrophobicContact CE1-CB 4.37Å; Y326-K331 HydrophobicContact CE1-CD 4.29Å; Y326-K331 HydrophobicContact CE2-CB 4.49Å; Y326-K331 PolarHBondContact O-N 3.39Å; Y326-E382 HydrophobicContact CE1-CG 4.21Å; Y326-E382 WeakPolarHBondContact CE1-OE1 3.49Å; Y326-E382 PolarHBondContact OH-OE1 2.7Å
327	R	88.6	Confident	87.6	Confident	118 Å²	118	81.9 Å²	81.9	45%	0.445	37%	0.373	S	S	.	.	I	π-helix	trans	-69.3	-31	-178.7	-73.3	-172.2	69.8	165.5	4.7	113.9	F323 R324 D325 P332 E386	F323-R327 HydrophobicContact CE1-CG 4.39Å; F323-R327 HydrophobicContact CE2-CG 4.4Å; F323-R327 HydrophobicContact CZ-CG 4.22Å; F323-R327 WeakPolarHBondContact O-CG 3.45Å; F323-R327 PolarHBondContact O-N 2.88Å; R324-R327 PolarHBondContact O-N 3.24Å; D325-R327 PolarHBondContact O-N 3.19Å; R327-P332 WeakPolarHBondContact O-CD 3.24Å; R327-P332 WeakPolarHBondContact O-CG 3.48Å; R327-E386 IonicContact NH1-OE1 3.22Å; R327-E386 PolarHBondContact NH1-OE1 3.41Å; R327-E386 IonicContact NH1-OE2 3.44Å; R327-E386 PolarHBondContact NH1-OE2 3.07Å
328	R	83.2	Confident	87.8	Confident	198 Å²	198	78.9 Å²	78.9	75%	0.747	36%	0.358	S	S	*	.	I	π-helix	trans	-86.2	-37.3	-175.9	179.4	179.3	-95.9	179	-6	113	R324 D325 Y326	R324-R328 VanDerWaalsContact O-CB 3.29Å; R324-R328 WeakPolarHBondContact O-CB 3.33Å; R324-R328 PolarHBondContact O-N 3.42Å; D325-R328 PolarHBondContact O-N 2.89Å; Y326-R328 PolarHBondContact O-N 2.89Å
329	Q	84.1	Confident	87.7	Confident	115 Å²	115	73.1 Å²	73.1	54%	0.537	35%	0.345	S	S	.	.	I	π-helix	trans	-115.2	-44	-168.3	-54.4	-172.4	33	0	0	112.5	D325 P333	D325-Q329 WeakPolarHBondContact O-CB 3.36Å; D325-Q329 PolarHBondContact O-N 3.47Å; D325-Q329 PolarHBondContact OD1-NE2 3.28Å; Q329-P333 VanDerWaalsContact O-CD 3.31Å; Q329-P333 WeakPolarHBondContact O-CD 3.29Å
330	H	86.7	Confident	87.4	Confident	111 Å²	111	75.1 Å²	75.1	51%	0.514	36%	0.355	S	S	.	.	I	π-helix	trans	-90.3	-39	-169.8	-62.3	-67.8	0	0	0	113.7	Y326 P333	Y326-H330 HydrophobicContact CD2-CB 4.3Å; Y326-H330 PolarHBondContact O-N 3.29Å; H330-P333 WeakPolarHBondContact O-CG 3.35Å
331	K	89.3	Confident	87.4	Confident	30 Å²	30	73.5 Å²	73.5	13%	0.13	35%	0.347	C	S	.	.	H	α-helix	trans	-71.8	-44.6	179.6	-175.2	177.5	-176.2	173.4	0	114.5	Y326 K334 V335 E382	Y326-K331 HydrophobicContact CE1-CB 4.37Å; Y326-K331 HydrophobicContact CE1-CD 4.29Å; Y326-K331 HydrophobicContact CE2-CB 4.49Å; Y326-K331 PolarHBondContact O-N 3.39Å; K331-K334 PolarHBondContact O-N 3.02Å; K331-V335 HydrophobicContact CG-CG2 4.2Å; K331-V335 PolarHBondContact O-N 2.68Å; K331-V335 VanDerWaalsContact O-N 3.14Å; K331-E382 WeakPolarHBondContact CD-OE1 3.47Å; K331-E382 WeakPolarHBondContact CE-OE1 3.37Å; K331-E382 IonicContact NZ-OE1 2.77Å; K331-E382 PolarHBondContact NZ-OE1 3.08Å; K331-E382 IonicContact NZ-OE2 2.59Å; K331-E382 PolarHBondContact NZ-OE2 3.5Å
332	P	89.1	Confident	87.3	Confident	60 Å²	60	72.6 Å²	72.6	39%	0.39	34%	0.343	S	S	.	.	H	α-helix	trans	-54.7	-45.4	-174.7	-28	37.7	0	0	0	116.1	R327 K334 V335 Q336	R327-P332 WeakPolarHBondContact O-CD 3.24Å; R327-P332 WeakPolarHBondContact O-CG 3.48Å; P332-K334 PolarHBondContact O-N 2.77Å; P332-V335 WeakPolarHBondContact O-CB 3.46Å; P332-V335 PolarHBondContact O-N 3.23Å; P332-Q336 PolarHBondContact O-N 3.44Å
333	P	87.7	Confident	87	Confident	57 Å²	57	72.4 Å²	72.4	37%	0.37	34%	0.341	S	S	.	.	H	α-helix	trans	-63.5	-31.4	177.1	24.4	-33.7	0	0	0	112.4	Q329 H330 Q336 E337	Q329-P333 VanDerWaalsContact O-CD 3.31Å; Q329-P333 WeakPolarHBondContact O-CD 3.29Å; H330-P333 WeakPolarHBondContact O-CG 3.35Å; P333-Q336 WeakPolarHBondContact O-CB 3.21Å; P333-Q336 PolarHBondContact O-N 3.32Å; P333-E337 WeakPolarHBondContact O-CG 3.49Å; P333-E337 PolarHBondContact O-N 3.2Å
334	K	89.5	Confident	86.5	Confident	39 Å²	39	73.1 Å²	73.1	17%	0.17	35%	0.345	C	S	.	.	H	α-helix	trans	-72.6	-29.8	177.9	-60.1	-50.7	-173.6	-172.5	0	113.5	L293 W296 K331 P332 Q336 E337 K338 W375	L293-K334 HydrophobicContact CD1-CB 4.23Å; L293-K334 HydrophobicContact CD1-CD 4.47Å; W296-K334 HydrophobicContact CD2-CG 3.96Å; W296-K334 HydrophobicContact CE3-CB 4.33Å; W296-K334 HydrophobicContact CE3-CG 4.11Å; W296-K334 HydrophobicContact CH2-CB 4.27Å; W296-K334 HydrophobicContact CH2-CG 4.22Å; W296-K334 HydrophobicContact CZ2-CG 4.05Å; W296-K334 HydrophobicContact CZ3-CB 4.12Å; W296-K334 HydrophobicContact CZ3-CG 4.24Å; K331-K334 PolarHBondContact O-N 3.02Å; P332-K334 PolarHBondContact O-N 2.77Å; K334-Q336 VanDerWaalsContact C-N 3.32Å; K334-E337 WeakPolarHBondContact CD-OE2 3.43Å; K334-E337 WeakPolarHBondContact CE-OE2 3.38Å; K334-E337 IonicContact NZ-OE1 2.64Å; K334-E337 PolarHBondContact NZ-OE1 3.18Å; K334-E337 IonicContact NZ-OE2 3.36Å; K334-E337 PolarHBondContact NZ-OE2 2.74Å; K334-E337 PolarHBondContact O-N 3.11Å; K334-K338 PolarHBondContact O-N 3.16Å; K334-W375 HydrophobicContact CB-CH2 4.34Å; K334-W375 HydrophobicContact CB-CZ3 4.36Å
335	V	89.3	Confident	86.4	Confident	67 Å²	67	68.6 Å²	68.6	41%	0.406	33%	0.329	S	S	.	.	H	α-helix	trans	-63.7	-42.2	169.1	178.6	0	0	0	0	110.4	K331 P332 K338 C339 W375	K331-V335 HydrophobicContact CG-CG2 4.2Å; K331-V335 PolarHBondContact O-N 2.68Å; K331-V335 VanDerWaalsContact O-N 3.14Å; P332-V335 WeakPolarHBondContact O-CB 3.46Å; P332-V335 PolarHBondContact O-N 3.23Å; V335-K338 PolarHBondContact O-N 3.41Å; V335-C339 PolarHBondContact O-N 2.94Å; V335-W375 HydrophobicContact CG2-CH2 3.91Å; V335-W375 HydrophobicContact CG2-CZ2 3.74Å
336	Q	85.3	Confident	86	Confident	139 Å²	139	70.5 Å²	70.5	65%	0.65	34%	0.339	S	S	*	.	H	α-helix	trans	-66.6	-42.3	177.6	-170.4	174.7	3.2	0	0	111.7	P332 P333 K334 K338 C339 Q340	P332-Q336 PolarHBondContact O-N 3.44Å; P333-Q336 WeakPolarHBondContact O-CB 3.21Å; P333-Q336 PolarHBondContact O-N 3.32Å; K334-Q336 VanDerWaalsContact C-N 3.32Å; Q336-K338 PolarHBondContact O-N 3.09Å; Q336-C339 PolarHBondContact O-N 2.68Å; Q336-Q340 WeakPolarHBondContact O-CB 3.1Å; Q336-Q340 PolarHBondContact O-N 3.47Å
337	E	86.7	Confident	85.3	Confident	47 Å²	47	72.8 Å²	72.8	22%	0.22	36%	0.355	C	S	.	.	H	α-helix	trans	-59.7	-42.6	174	-73	172.1	-156.4	0	0	112.2	P333 K334 Q340 L341	P333-E337 WeakPolarHBondContact O-CG 3.49Å; P333-E337 PolarHBondContact O-N 3.2Å; K334-E337 WeakPolarHBondContact CD-OE2 3.43Å; K334-E337 WeakPolarHBondContact CE-OE2 3.38Å; K334-E337 IonicContact NZ-OE1 2.64Å; K334-E337 PolarHBondContact NZ-OE1 3.18Å; K334-E337 IonicContact NZ-OE2 3.36Å; K334-E337 PolarHBondContact NZ-OE2 2.74Å; K334-E337 PolarHBondContact O-N 3.11Å; E337-Q340 PolarHBondContact O-N 3.42Å; E337-L341 WeakPolarHBondContact O-CB 3.13Å; E337-L341 PolarHBondContact O-N 2.93Å
338	K	87.6	Confident	84.9	Confident	36 Å²	36	67.2 Å²	67.2	16%	0.157	33%	0.334	C	S	.	.	H	α-helix	trans	-59.3	-48.3	173.7	-178.8	-166.5	172.3	-174.3	0	111.8	L293 K334 V335 Q336 L341 E342 W375	L293-K338 HydrophobicContact CD2-CB 3.94Å; L293-K338 HydrophobicContact CD2-CG 4.43Å; K334-K338 PolarHBondContact O-N 3.16Å; V335-K338 PolarHBondContact O-N 3.41Å; Q336-K338 PolarHBondContact O-N 3.09Å; K338-L341 WeakPolarHBondContact O-CB 3.45Å; K338-L341 PolarHBondContact O-N 2.99Å; K338-E342 VanDerWaalsContact CE-OE1 3.27Å; K338-E342 WeakPolarHBondContact CE-OE1 3.33Å; K338-E342 PolarHBondContact O-N 3.42Å; K338-E342 VanDerWaalsContact O-N 3.12Å; K338-W375 HydrophobicContact CD-CD2 3.74Å; K338-W375 HydrophobicContact CD-CE3 4.16Å; K338-W375 HydrophobicContact CD-CG 3.87Å; K338-W375 VanDerWaalsContact NZ-CD1 3.27Å
339	C	85	Confident	84.7	Confident	63 Å²	63	60.5 Å²	60.5	43%	0.426	31%	0.311	S	S	.	.	H	α-helix	trans	-62.8	-43.5	178.8	-177.3	0	0	0	0	111.5	V335 Q336 L341 E342 I343	V335-C339 PolarHBondContact O-N 2.94Å; Q336-C339 PolarHBondContact O-N 2.68Å; C339-L341 VanDerWaalsContact C-N 3.28Å; C339-L341 PolarHBondContact O-N 3.48Å; C339-E342 PolarHBondContact O-N 3.02Å; C339-I343 VanDerWaalsContact O-CG1 3.29Å; C339-I343 WeakPolarHBondContact O-CG1 3.36Å; C339-I343 PolarHBondContact O-N 3.24Å
340	Q	82	Confident	84.2	Confident	84 Å²	84	57.5 Å²	57.5	39%	0.393	30%	0.3	S	S	.	.	H	α-helix	trans	-61.7	-37.5	177.2	-171.1	61.6	54.2	0	0	111.9	Q336 E337 I343 N344	Q336-Q340 WeakPolarHBondContact O-CB 3.1Å; Q336-Q340 PolarHBondContact O-N 3.47Å; E337-Q340 PolarHBondContact O-N 3.42Å; Q340-I343 PolarHBondContact O-N 3.14Å; Q340-N344 PolarHBondContact NE2-OD1 2.7Å; Q340-N344 WeakPolarHBondContact O-CB 3.48Å; Q340-N344 PolarHBondContact O-N 3.26Å; Q340-N344 PolarHBondContact O-OD1 2.68Å
341	L	86.9	Confident	83.5	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-64.4	-44.5	176.4	-176	154.5	0	0	0	111.9	Y286 L289 A290 E337 K338 C339 N344 F345 V368 I371	Y286-L341 HydrophobicContact CD2-CD2 4.04Å; Y286-L341 HydrophobicContact CD2-CG 3.88Å; Y286-L341 HydrophobicContact CE2-CD1 4.48Å; Y286-L341 HydrophobicContact CE2-CD2 3.31Å; Y286-L341 HydrophobicContact CE2-CG 3.66Å; L289-L341 HydrophobicContact CB-CD1 4.33Å; A290-L341 VanDerWaalsContact CA-CD1 3.45Å; A290-L341 HydrophobicContact CB-CD1 3.76Å; E337-L341 WeakPolarHBondContact O-CB 3.13Å; E337-L341 PolarHBondContact O-N 2.93Å; K338-L341 WeakPolarHBondContact O-CB 3.45Å; K338-L341 PolarHBondContact O-N 2.99Å; C339-L341 VanDerWaalsContact C-N 3.28Å; C339-L341 PolarHBondContact O-N 3.48Å; L341-N344 PolarHBondContact O-N 2.92Å; L341-F345 WeakPolarHBondContact O-CB 3.45Å; L341-F345 PolarHBondContact O-N 3.48Å; L341-V368 HydrophobicContact CD2-CG2 4.31Å; L341-I371 HydrophobicContact CD1-CD1 3.75Å; L341-I371 HydrophobicContact CD2-CD1 3.64Å; L341-I371 HydrophobicContact CG-CD1 4.38Å
342	E	84.3	Confident	82.6	Confident	64 Å²	64	54.9 Å²	54.9	30%	0.299	29%	0.288	S	S	.	.	H	α-helix	trans	-63.3	-41.7	174.6	-72	173.2	-167.9	0	0	111.8	K338 C339 F345 N346 V368	K338-E342 VanDerWaalsContact CE-OE1 3.27Å; K338-E342 WeakPolarHBondContact CE-OE1 3.33Å; K338-E342 PolarHBondContact O-N 3.42Å; K338-E342 VanDerWaalsContact O-N 3.12Å; C339-E342 PolarHBondContact O-N 3.02Å; E342-F345 PolarHBondContact O-N 2.8Å; E342-N346 WeakPolarHBondContact O-CB 3.41Å; E342-N346 PolarHBondContact O-N 3.23Å; E342-N346 PolarHBondContact O-ND2 2.79Å; E342-V368 HydrophobicContact CG-CG1 4.04Å
343	I	81.8	Confident	81.7	Confident	77 Å²	77	59.9 Å²	59.9	40%	0.395	30%	0.299	S	S	.	.	H	α-helix	trans	-62	-47.2	175.2	-68.9	166.6	0	0	0	110.7	C339 Q340 F345 N346 T347	C339-I343 VanDerWaalsContact O-CG1 3.29Å; C339-I343 WeakPolarHBondContact O-CG1 3.36Å; C339-I343 PolarHBondContact O-N 3.24Å; Q340-I343 PolarHBondContact O-N 3.14Å; I343-F345 VanDerWaalsContact C-N 3.33Å; I343-F345 PolarHBondContact O-N 3.37Å; I343-N346 PolarHBondContact O-N 3.49Å; I343-T347 VanDerWaalsContact O-CB 3.24Å; I343-T347 WeakPolarHBondContact O-CB 3.3Å; I343-T347 PolarHBondContact O-N 3.31Å; I343-T347 PolarHBondContact O-OG1 3.04Å
344	N	81.9	Confident	80.7	Confident	20 Å²	20	63.2 Å²	63.2	11%	0.107	31%	0.313	C	S	.	.	H	α-helix	trans	-60.8	-43.4	179.5	-72.9	-4.1	0	0	0	110.9	Q340 L341 L348	Q340-N344 PolarHBondContact NE2-OD1 2.7Å; Q340-N344 WeakPolarHBondContact O-CB 3.48Å; Q340-N344 PolarHBondContact O-N 3.26Å; Q340-N344 PolarHBondContact O-OD1 2.68Å; L341-N344 PolarHBondContact O-N 2.92Å; N344-L348 WeakPolarHBondContact O-CB 3.42Å; N344-L348 PolarHBondContact O-N 2.86Å
345	F	83.6	Confident	79.4	Confident	42 Å²	42	62.9 Å²	62.9	18%	0.184	32%	0.315	C	S	.	.	H	α-helix	trans	-63.3	-50	176.9	-175	-99.7	0	0	0	112.4	Y286 L341 E342 I343 T347 L348 Q349 F360 P362 V368	Y286-F345 HydrophobicContact CD2-CB 3.99Å; Y286-F345 HydrophobicContact CD2-CD2 4.32Å; Y286-F345 HydrophobicContact CE2-CB 3.73Å; Y286-F345 AromaticContact CE2-CD2 3.83Å; Y286-F345 HydrophobicContact CE2-CD2 3.83Å; Y286-F345 HydrophobicContact CE2-CG 4.13Å; L341-F345 WeakPolarHBondContact O-CB 3.45Å; L341-F345 PolarHBondContact O-N 3.48Å; E342-F345 PolarHBondContact O-N 2.8Å; I343-F345 VanDerWaalsContact C-N 3.33Å; I343-F345 PolarHBondContact O-N 3.37Å; F345-T347 VanDerWaalsContact C-N 3.34Å; F345-T347 PolarHBondContact O-N 3.46Å; F345-L348 PolarHBondContact O-N 3.34Å; F345-Q349 VanDerWaalsContact O-CB 3.31Å; F345-Q349 WeakPolarHBondContact O-CB 3.24Å; F345-Q349 PolarHBondContact O-N 3.31Å; F345-F360 HydrophobicContact CD2-CD1 4.1Å; F345-F360 HydrophobicContact CD2-CE1 4.46Å; F345-F360 HydrophobicContact CE2-CD1 4.06Å; F345-P362 HydrophobicContact CE2-CG 4.15Å; F345-V368 HydrophobicContact CB-CG2 4.04Å; F345-V368 HydrophobicContact CD1-CG2 3.76Å; F345-V368 HydrophobicContact CD2-CG2 4.01Å; F345-V368 HydrophobicContact CE1-CG2 4.2Å; F345-V368 HydrophobicContact CE2-CG2 4.44Å; F345-V368 HydrophobicContact CG-CG2 3.65Å
346	N	81.1	Confident	78.1	Confident	98 Å²	98	64.6 Å²	64.6	52%	0.524	32%	0.322	S	S	.	.	H	α-helix	trans	-64.5	-39	-179.6	-73.5	-27.3	0	0	0	112.5	E342 I343 T350	E342-N346 WeakPolarHBondContact O-CB 3.41Å; E342-N346 PolarHBondContact O-N 3.23Å; E342-N346 PolarHBondContact O-ND2 2.79Å; I343-N346 PolarHBondContact O-N 3.49Å; N346-T350 VanDerWaalsContact O-CB 3.31Å; N346-T350 WeakPolarHBondContact O-CB 3.37Å; N346-T350 PolarHBondContact O-N 3.19Å; N346-T350 PolarHBondContact O-OG1 2.9Å
347	T	78.8	Confident	77.2	Confident	62 Å²	62	59 Å²	59	38%	0.38	30%	0.295	S	S	.	.	H	α-helix	trans	-64.4	-47.1	176.1	-58.2	0	0	0	0	110.4	I343 F345 T350 K351	I343-T347 VanDerWaalsContact O-CB 3.24Å; I343-T347 WeakPolarHBondContact O-CB 3.3Å; I343-T347 PolarHBondContact O-N 3.31Å; I343-T347 PolarHBondContact O-OG1 3.04Å; F345-T347 VanDerWaalsContact C-N 3.34Å; F345-T347 PolarHBondContact O-N 3.46Å; T347-T350 PolarHBondContact O-N 2.77Å; T347-K351 WeakPolarHBondContact O-CB 3.41Å; T347-K351 WeakPolarHBondContact O-CG 3.44Å; T347-K351 PolarHBondContact O-N 2.99Å
348	L	79.3	Confident	76.4	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-63.1	-45.9	177.7	-180	63.5	0	0	0	111.4	N279 L282 M283 N344 F345 T350 K351 L352 F360	N279-L348 HydrophobicContact CB-CD1 4.02Å; L282-L348 HydrophobicContact CB-CD1 4.15Å; M283-L348 HydrophobicContact CB-CD2 4.46Å; M283-L348 HydrophobicContact CG-CD1 4.36Å; M283-L348 HydrophobicContact CG-CD2 3.46Å; M283-L348 VanDerWaalsContact CG-CD2 3.46Å; N344-L348 WeakPolarHBondContact O-CB 3.42Å; N344-L348 PolarHBondContact O-N 2.86Å; F345-L348 PolarHBondContact O-N 3.34Å; L348-T350 VanDerWaalsContact C-N 3.31Å; L348-T350 PolarHBondContact O-N 3.03Å; L348-K351 PolarHBondContact O-N 3.4Å; L348-L352 HydrophobicContact CD1-CD1 4.02Å; L348-L352 HydrophobicContact CD1-CG 4.18Å; L348-L352 HydrophobicContact CG-CD1 3.91Å; L348-L352 HydrophobicContact CG-CG 4.46Å; L348-L352 WeakPolarHBondContact O-CB 3.46Å; L348-L352 VanDerWaalsContact O-CG 3.24Å; L348-L352 WeakPolarHBondContact O-CG 3.48Å; L348-L352 PolarHBondContact O-N 3.19Å; L348-F360 HydrophobicContact CD2-CB 3.86Å; L348-F360 HydrophobicContact CD2-CD1 3.52Å; L348-F360 HydrophobicContact CD2-CD2 4.41Å; L348-F360 HydrophobicContact CD2-CE1 4.11Å; L348-F360 HydrophobicContact CD2-CG 3.68Å; L348-F360 HydrophobicContact CG-CB 4.34Å
349	Q	79.1	Confident	75.7	Confident	58 Å²	58	61.8 Å²	61.8	27%	0.271	33%	0.326	S	S	.	.	H	α-helix	trans	-60.7	-40.7	178	-162.4	69.9	7.5	0	0	111.9	F345 R353	F345-Q349 VanDerWaalsContact O-CB 3.31Å; F345-Q349 WeakPolarHBondContact O-CB 3.24Å; F345-Q349 PolarHBondContact O-N 3.31Å; Q349-R353 WeakPolarHBondContact O-CB 3.45Å; Q349-R353 PolarHBondContact O-N 2.96Å
350	T	72.6	Confident	75.4	Confident	51 Å²	51	60.2 Å²	60.2	31%	0.313	31%	0.312	S	S	.	.	H	α-helix	trans	-69.8	-43.3	176.7	-59.8	0	0	0	0	111.6	N346 T347 L348 L352 R353 I354	N346-T350 VanDerWaalsContact O-CB 3.31Å; N346-T350 WeakPolarHBondContact O-CB 3.37Å; N346-T350 PolarHBondContact O-N 3.19Å; N346-T350 PolarHBondContact O-OG1 2.9Å; T347-T350 PolarHBondContact O-N 2.77Å; L348-T350 VanDerWaalsContact C-N 3.31Å; L348-T350 PolarHBondContact O-N 3.03Å; T350-L352 VanDerWaalsContact C-N 3.34Å; T350-L352 PolarHBondContact O-N 2.78Å; T350-R353 PolarHBondContact O-N 2.92Å; T350-I354 HydrophobicContact CG2-CD1 3.65Å; T350-I354 HydrophobicContact CG2-CG1 4.28Å; T350-I354 VanDerWaalsContact O-CG1 3.3Å; T350-I354 WeakPolarHBondContact O-CG1 3.27Å; T350-I354 PolarHBondContact O-N 3.32Å
351	K	72.5	Confident	75.2	Confident	74 Å²	74	64 Å²	64	32%	0.322	33%	0.332	S	S	.	.	H	α-helix	trans	-59.5	-43	175.1	-83.6	-168.7	171	-165.6	0	111.9	E278 L282 T347 L348 S355	E278-K351 IonicContact OE2-NZ 3.06Å; E278-K351 PolarHBondContact OE2-NZ 2.73Å; L282-K351 HydrophobicContact CD1-CD 4.32Å; T347-K351 WeakPolarHBondContact O-CB 3.41Å; T347-K351 WeakPolarHBondContact O-CG 3.44Å; T347-K351 PolarHBondContact O-N 2.99Å; L348-K351 PolarHBondContact O-N 3.4Å; K351-S355 WeakPolarHBondContact O-CB 3.44Å; K351-S355 PolarHBondContact O-N 2.94Å; K351-S355 PolarHBondContact O-OG 2.95Å
352	L	69.9	Low	75	Confident	12 Å²	12	64.8 Å²	64.8	6%	0.063	34%	0.337	C	S	.	.	H	α-helix	trans	-67.2	-41.9	177.1	-67.8	170.2	0	0	0	111.3	N279 L348 T350 S355 N356 R357 F360	N279-L352 HydrophobicContact CB-CD2 4.44Å; L348-L352 HydrophobicContact CD1-CD1 4.02Å; L348-L352 HydrophobicContact CD1-CG 4.18Å; L348-L352 HydrophobicContact CG-CD1 3.91Å; L348-L352 HydrophobicContact CG-CG 4.46Å; L348-L352 WeakPolarHBondContact O-CB 3.46Å; L348-L352 VanDerWaalsContact O-CG 3.24Å; L348-L352 WeakPolarHBondContact O-CG 3.48Å; L348-L352 PolarHBondContact O-N 3.19Å; T350-L352 VanDerWaalsContact C-N 3.34Å; T350-L352 PolarHBondContact O-N 2.78Å; L352-S355 CarbonylContact O-C 3.44Å; L352-S355 PolarHBondContact O-N 3.17Å; L352-N356 PolarHBondContact O-N 3.33Å; L352-R357 HydrophobicContact CB-CB 4.31Å; L352-R357 HydrophobicContact CD2-CB 3.85Å; L352-R357 PolarHBondContact O-N 3.11Å; L352-F360 HydrophobicContact CD1-CB 3.74Å
353	R	70.3	Confident	74.8	Confident	165 Å²	165	64.2 Å²	64.2	62%	0.623	34%	0.341	S	S	*	.	H	α-helix	trans	-63.7	-48.6	176.9	-176.1	178.2	64.4	-146	-4.5	113.3	Q349 T350 S355 N356	Q349-R353 WeakPolarHBondContact O-CB 3.45Å; Q349-R353 PolarHBondContact O-N 2.96Å; T350-R353 PolarHBondContact O-N 2.92Å; R353-S355 PolarHBondContact O-N 2.86Å; R353-N356 PolarHBondContact O-N 2.72Å; R353-N356 VanDerWaalsContact O-N 3.11Å
354	I	67.4	Low	74.4	Confident	128 Å²	128	70 Å²	70	66%	0.656	37%	0.366	S	S	*	.	H	α-helix	trans	-62.4	-31.5	179.5	-66.8	167.6	0	0	0	110.8	T350 N356	T350-I354 HydrophobicContact CG2-CD1 3.65Å; T350-I354 HydrophobicContact CG2-CG1 4.28Å; T350-I354 VanDerWaalsContact O-CG1 3.3Å; T350-I354 WeakPolarHBondContact O-CG1 3.27Å; T350-I354 PolarHBondContact O-N 3.32Å; I354-N356 VanDerWaalsContact C-N 3.3Å
355	S	61.4	Low	74.1	Confident	32 Å²	32	70.9 Å²	70.9	22%	0.224	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	10.1	180	-52.5	0	0	0	0	113.3	K351 L352 R353 R357 Y889	K351-S355 WeakPolarHBondContact O-CB 3.44Å; K351-S355 PolarHBondContact O-N 2.94Å; K351-S355 PolarHBondContact O-OG 2.95Å; L352-S355 CarbonylContact O-C 3.44Å; L352-S355 PolarHBondContact O-N 3.17Å; R353-S355 PolarHBondContact O-N 2.86Å; S355-R357 VanDerWaalsContact C-N 3.34Å; S355-R357 WeakPolarHBondContact O-CG 3.43Å; S355-R357 PolarHBondContact O-N 3.37Å; S355-Y889 VanDerWaalsContact O-CD1 3.26Å; S355-Y889 WeakPolarHBondContact O-CD1 3.49Å; S355-Y889 VanDerWaalsContact O-CE1 3.24Å; S355-Y889 WeakPolarHBondContact O-CE1 3.32Å
356	N	61.9	Low	74.2	Confident	103 Å²	103	71 Å²	71	55%	0.551	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	49.7	-174.7	-65.8	-35.1	0	0	0	112.8	L352 R353 I354 Y889	L352-N356 PolarHBondContact O-N 3.33Å; R353-N356 PolarHBondContact O-N 2.72Å; R353-N356 VanDerWaalsContact O-N 3.11Å; I354-N356 VanDerWaalsContact C-N 3.3Å; N356-Y889 HydrophobicContact CB-CD1 4.21Å; N356-Y889 CarbonylContact O-C 3.41Å; N356-Y889 VanDerWaalsContact O-C 3.23Å; N356-Y889 VanDerWaalsContact O-CA 3.22Å; N356-Y889 WeakPolarHBondContact O-CA 3.16Å
357	R	68.3	Low	74.4	Confident	22 Å²	22	70.2 Å²	70.2	8%	0.083	38%	0.375	C	S	.	.			trans	-113.9	156.7	179.5	-53.6	-161	176.1	177.6	3.1	111.7	V272 N276 L352 S355 L888	V272-R357 PolarHBondContact O-NH2 3.34Å; V272-R357 VanDerWaalsContact O-NH2 3.1Å; N276-R357 PolarHBondContact OD1-NH1 3.46Å; L352-R357 HydrophobicContact CB-CB 4.31Å; L352-R357 HydrophobicContact CD2-CB 3.85Å; L352-R357 PolarHBondContact O-N 3.11Å; S355-R357 VanDerWaalsContact C-N 3.34Å; S355-R357 WeakPolarHBondContact O-CG 3.43Å; S355-R357 PolarHBondContact O-N 3.37Å; R357-L888 WeakPolarHBondContact CD-O 3.36Å; R357-L888 WeakPolarHBondContact CG-O 3.49Å; R357-L888 PolarHBondContact NE-O 3.49Å; R357-L888 VanDerWaalsContact NH2-CD2 3.31Å
358	P	68.9	Low	74.7	Confident	73 Å²	73	68.9 Å²	68.9	47%	0.474	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-56.8	144.5	176.7	-23.7	34	0	0	0	112.4
359	A	73	Confident	74.9	Confident	67 Å²	67	72.2 Å²	72.2	55%	0.554	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-61.3	140.4	176.6	0	0	0	0	0	111.8	M361	A359-M361 PolarHBondContact O-N 3.5Å
360	F	78.9	Confident	75.3	Confident	30 Å²	30	71.9 Å²	71.9	13%	0.132	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-73.8	125	172.6	172.3	-119.7	0	0	0	110	M283 Y286 F345 L348 L352 P362	M283-F360 HydrophobicContact CB-CD2 4.31Å; M283-F360 HydrophobicContact CB-CE2 3.83Å; M283-F360 HydrophobicContact CB-CZ 4.14Å; M283-F360 HydrophobicContact CG-CD2 3.5Å; M283-F360 VanDerWaalsContact CG-CD2 3.5Å; M283-F360 HydrophobicContact CG-CE2 3.54Å; M283-F360 HydrophobicContact CG-CG 4.01Å; M283-F360 HydrophobicContact CG-CZ 4.08Å; M283-F360 HydrophobicContact SD-CD2 3.32Å; M283-F360 WeakPolarHBondContact SD-CD2 3.27Å; M283-F360 HydrophobicContact SD-CE2 3.72Å; M283-F360 HydrophobicContact SD-CG 4.12Å; Y286-F360 AromaticContact CD1-CE1 3.67Å; Y286-F360 HydrophobicContact CD1-CE1 3.67Å; Y286-F360 HydrophobicContact CD1-CZ 4.03Å; Y286-F360 HydrophobicContact CE1-CE1 4.17Å; Y286-F360 AromaticContact CG-CE1 4Å; Y286-F360 HydrophobicContact CG-CE1 4Å; F345-F360 HydrophobicContact CD2-CD1 4.1Å; F345-F360 HydrophobicContact CD2-CE1 4.46Å; F345-F360 HydrophobicContact CE2-CD1 4.06Å; L348-F360 HydrophobicContact CD2-CB 3.86Å; L348-F360 HydrophobicContact CD2-CD1 3.52Å; L348-F360 HydrophobicContact CD2-CD2 4.41Å; L348-F360 HydrophobicContact CD2-CE1 4.11Å; L348-F360 HydrophobicContact CD2-CG 3.68Å; L348-F360 HydrophobicContact CG-CB 4.34Å; L352-F360 HydrophobicContact CD1-CB 3.74Å; F360-P362 HydrophobicContact CD1-CG 4.24Å; F360-P362 HydrophobicContact CE1-CB 4.43Å; F360-P362 HydrophobicContact CE1-CG 3.73Å; F360-P362 HydrophobicContact CZ-CB 4.43Å; F360-P362 HydrophobicContact CZ-CG 4.2Å
361	M	78	Confident	76.1	Confident	163 Å²	163	69.6 Å²	69.6	80%	0.803	38%	0.375	S	S	*	.			trans	-116.9	111.8	174.2	-161	161.3	83.4	0	0	109.5	A359	A359-M361 PolarHBondContact O-N 3.5Å
362	P	81.6	Confident	76.9	Confident	18 Å²	18	68 Å²	68	12%	0.117	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-62.5	159.5	178.2	-23.2	33.1	0	0	0	113.4	Y286 F345 F360 K366	Y286-P362 HydrophobicContact CD1-CB 4.44Å; Y286-P362 HydrophobicContact CD1-CG 4.24Å; Y286-P362 HydrophobicContact CE1-CB 3.67Å; Y286-P362 HydrophobicContact CE1-CG 3.44Å; Y286-P362 VanDerWaalsContact CE1-CG 3.44Å; F345-P362 HydrophobicContact CE2-CG 4.15Å; F360-P362 HydrophobicContact CD1-CG 4.24Å; F360-P362 HydrophobicContact CE1-CB 4.43Å; F360-P362 HydrophobicContact CE1-CG 3.73Å; F360-P362 HydrophobicContact CZ-CB 4.43Å; F360-P362 HydrophobicContact CZ-CG 4.2Å; P362-K366 HydrophobicContact CB-CB 4.37Å
363	S	81	Confident	77.8	Confident	53 Å²	53	71 Å²	71	37%	0.371	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-51.5	148.3	171	-54.6	0	0	0	0	112.5	E287 G365 K366	E287-S363 WeakPolarHBondContact OE1-CB 3.05Å; E287-S363 PolarHBondContact OE1-OG 3.34Å; S363-G365 PolarHBondContact O-N 3.48Å; S363-K366 WeakPolarHBondContact O-CB 3.37Å; S363-K366 PolarHBondContact O-N 3.23Å
364	E	72.6	Confident	78.7	Confident	197 Å²	197	64.7 Å²	64.7	92%	0.921	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	129.6	-176.6	-166.1	-179.7	178.5	0	0	112.2	K366	E364-K366 VanDerWaalsContact C-N 3.32Å; E364-K366 PolarHBondContact O-N 3.13Å
365	G	75.6	Confident	80	Confident	40 Å²	40	58.9 Å²	58.9	41%	0.412	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	4.9	-177.9	0	0	0	0	0	115.6	L294 S363 D370	L294-G365 WeakPolarHBondContact CD1-O 3.29Å; S363-G365 PolarHBondContact O-N 3.48Å; G365-D370 VanDerWaalsContact CA-OD2 3.29Å; G365-D370 WeakPolarHBondContact CA-OD2 3.38Å
366	K	86.3	Confident	81.4	Confident	45 Å²	45	63 Å²	63	20%	0.196	36%	0.363	C	S	.	.			trans	-114.3	20.2	174.6	-55.1	-174.5	-169.3	173.3	0	112.7	Y286 E287 A290 S291 L294 P362 S363 E364	Y286-K366 PolarHBondContact OH-O 3.39Å; E287-K366 HydrophobicContact CG-CD 4.1Å; E287-K366 IonicContact OE1-NZ 3.82Å; E287-K366 PolarHBondContact OE1-NZ 2.85Å; A290-K366 HydrophobicContact CB-CB 4.31Å; A290-K366 HydrophobicContact CB-CD 4.46Å; S291-K366 VanDerWaalsContact OG-CE 3.3Å; S291-K366 WeakPolarHBondContact OG-CE 3.35Å; S291-K366 PolarHBondContact OG-NZ 3.19Å; L294-K366 HydrophobicContact CD1-CG 4.23Å; P362-K366 HydrophobicContact CB-CB 4.37Å; S363-K366 WeakPolarHBondContact O-CB 3.37Å; S363-K366 PolarHBondContact O-N 3.23Å; E364-K366 VanDerWaalsContact C-N 3.32Å; E364-K366 PolarHBondContact O-N 3.13Å
367	M	84.4	Confident	82.8	Confident	81 Å²	81	59.6 Å²	59.6	40%	0.399	35%	0.353	S	S	.	.	S	Bend	trans	-69.5	152.4	175	-63.4	-174.5	-76.4	0	0	110.2	S369 D370 I371	M367-S369 WeakPolarHBondContact CB-OG 3.47Å; M367-S369 PolarHBondContact O-N 3.28Å; M367-D370 WeakPolarHBondContact CB-OD2 3.5Å; M367-D370 WeakPolarHBondContact CE-OD2 3.34Å; M367-D370 PolarHBondContact N-OD2 2.96Å; M367-D370 WeakPolarHBondContact O-CB 3.4Å; M367-D370 PolarHBondContact O-N 3.05Å; M367-I371 WeakPolarHBondContact O-CG1 3.48Å; M367-I371 PolarHBondContact O-N 3.12Å
368	V	85.3	Confident	83.9	Confident	33 Å²	33	58.6 Å²	58.6	20%	0.2	35%	0.349	C	S	.	.	H	α-helix	trans	-56.9	-33.5	176	179.8	0	0	0	0	111.3	Y286 L341 E342 F345 T372	Y286-V368 HydrophobicContact CE2-CG2 4.01Å; Y286-V368 WeakPolarHBondContact OH-CG2 3.47Å; Y286-V368 PolarHBondContact OH-N 3.11Å; L341-V368 HydrophobicContact CD2-CG2 4.31Å; E342-V368 HydrophobicContact CG-CG1 4.04Å; F345-V368 HydrophobicContact CB-CG2 4.04Å; F345-V368 HydrophobicContact CD1-CG2 3.76Å; F345-V368 HydrophobicContact CD2-CG2 4.01Å; F345-V368 HydrophobicContact CE1-CG2 4.2Å; F345-V368 HydrophobicContact CE2-CG2 4.44Å; F345-V368 HydrophobicContact CG-CG2 3.65Å; V368-T372 WeakPolarHBondContact O-CB 2.95Å; V368-T372 PolarHBondContact O-N 3.26Å; V368-T372 PolarHBondContact O-OG1 3.39Å
369	S	85.1	Confident	85	Confident	72 Å²	72	59.3 Å²	59.3	50%	0.503	35%	0.346	S	S	.	.	H	α-helix	trans	-62.2	-43.2	172.9	54.4	0	0	0	0	112.9	M367 T372 S373	M367-S369 WeakPolarHBondContact CB-OG 3.47Å; M367-S369 PolarHBondContact O-N 3.28Å; S369-T372 PolarHBondContact O-N 3.28Å; S369-S373 WeakPolarHBondContact O-CB 3.41Å; S369-S373 PolarHBondContact O-N 2.94Å
370	D	87.1	Confident	85.8	Confident	51 Å²	51	63.3 Å²	63.3	27%	0.273	35%	0.353	S	S	.	.	H	α-helix	trans	-68.5	-40.8	-179	-55.7	-29.6	0	0	0	110.5	G365 M367 T372 S373 A374	G365-D370 VanDerWaalsContact CA-OD2 3.29Å; G365-D370 WeakPolarHBondContact CA-OD2 3.38Å; M367-D370 WeakPolarHBondContact CB-OD2 3.5Å; M367-D370 WeakPolarHBondContact CE-OD2 3.34Å; M367-D370 PolarHBondContact N-OD2 2.96Å; M367-D370 WeakPolarHBondContact O-CB 3.4Å; M367-D370 PolarHBondContact O-N 3.05Å; D370-T372 VanDerWaalsContact C-N 3.34Å; D370-S373 PolarHBondContact O-N 2.98Å; D370-A374 WeakPolarHBondContact O-CB 3.41Å; D370-A374 PolarHBondContact O-N 3.39Å
371	I	88.6	Confident	86.4	Confident	2 Å²	2	62.3 Å²	62.3	1%	0.01	35%	0.35	C	S	.	.	H	α-helix	trans	-64.1	-41.7	175	-62.1	165.6	0	0	0	110.4	A290 L293 L294 L341 M367 A374 W375	A290-I371 HydrophobicContact CB-CD1 3.96Å; L293-I371 HydrophobicContact CD2-CG2 3.89Å; L294-I371 HydrophobicContact CD1-CG1 4.15Å; L294-I371 HydrophobicContact CD2-CG1 4.01Å; L294-I371 HydrophobicContact CG-CG1 4.12Å; L341-I371 HydrophobicContact CD1-CD1 3.75Å; L341-I371 HydrophobicContact CD2-CD1 3.64Å; L341-I371 HydrophobicContact CG-CD1 4.38Å; M367-I371 WeakPolarHBondContact O-CG1 3.48Å; M367-I371 PolarHBondContact O-N 3.12Å; I371-A374 PolarHBondContact O-N 3.26Å; I371-W375 WeakPolarHBondContact O-CB 3.39Å; I371-W375 PolarHBondContact O-N 3.28Å
372	T	88.7	Confident	87	Confident	40 Å²	40	55.2 Å²	55.2	25%	0.245	32%	0.315	C	S	.	.	H	α-helix	trans	-63.3	-43.7	175.9	-59.1	0	0	0	0	111.2	V368 S369 D370 W375 Q376	V368-T372 WeakPolarHBondContact O-CB 2.95Å; V368-T372 PolarHBondContact O-N 3.26Å; V368-T372 PolarHBondContact O-OG1 3.39Å; S369-T372 PolarHBondContact O-N 3.28Å; D370-T372 VanDerWaalsContact C-N 3.34Å; T372-W375 PolarHBondContact O-N 3.13Å; T372-Q376 WeakPolarHBondContact O-CG 3.44Å; T372-Q376 PolarHBondContact O-N 3.37Å
373	S	89.9	Confident	87.3	Confident	77 Å²	77	60.6 Å²	60.6	54%	0.538	34%	0.337	S	S	.	.	H	α-helix	trans	-64.5	-45.5	177.2	-174.8	0	0	0	0	112	S369 D370 W375 Q376 G377	S369-S373 WeakPolarHBondContact O-CB 3.41Å; S369-S373 PolarHBondContact O-N 2.94Å; D370-S373 PolarHBondContact O-N 2.98Å; S373-W375 VanDerWaalsContact C-N 3.31Å; S373-W375 PolarHBondContact O-N 3.49Å; S373-Q376 PolarHBondContact O-N 3.39Å; S373-G377 PolarHBondContact O-N 3.28Å
374	A	89.8	Confident	87.7	Confident	32 Å²	32	59.3 Å²	59.3	26%	0.264	33%	0.331	S	S	.	.	H	α-helix	trans	-61.6	-39.8	175.7	0	0	0	0	0	112	L294 I297 D370 I371 G377 L378	L294-A374 HydrophobicContact CD2-CB 3.99Å; I297-A374 HydrophobicContact CD1-CB 4.16Å; I297-A374 HydrophobicContact CG2-CB 4.28Å; D370-A374 WeakPolarHBondContact O-CB 3.41Å; D370-A374 PolarHBondContact O-N 3.39Å; I371-A374 PolarHBondContact O-N 3.26Å; A374-G377 PolarHBondContact O-N 3.46Å; A374-L378 PolarHBondContact O-N 3.27Å
375	W	92.9	Very high	88.6	Confident	6 Å²	6	50.4 Å²	50.4	2%	0.023	29%	0.29	C	S	.	.	H	α-helix	trans	-66.6	-41.7	176.1	-171.6	-85.2	0	0	0	112.4	L293 W296 I297 K334 V335 K338 I371 T372 S373 G377 L378 E379	L293-W375 HydrophobicContact CD1-CZ3 4.1Å; W296-W375 HydrophobicContact CZ3-CZ3 4.09Å; I297-W375 HydrophobicContact CD1-CE3 4.05Å; I297-W375 HydrophobicContact CG1-CE3 4.47Å; K334-W375 HydrophobicContact CB-CH2 4.34Å; K334-W375 HydrophobicContact CB-CZ3 4.36Å; V335-W375 HydrophobicContact CG2-CH2 3.91Å; V335-W375 HydrophobicContact CG2-CZ2 3.74Å; K338-W375 HydrophobicContact CD-CD2 3.74Å; K338-W375 HydrophobicContact CD-CE3 4.16Å; K338-W375 HydrophobicContact CD-CG 3.87Å; K338-W375 VanDerWaalsContact NZ-CD1 3.27Å; I371-W375 WeakPolarHBondContact O-CB 3.39Å; I371-W375 PolarHBondContact O-N 3.28Å; T372-W375 PolarHBondContact O-N 3.13Å; S373-W375 VanDerWaalsContact C-N 3.31Å; S373-W375 PolarHBondContact O-N 3.49Å; W375-G377 VanDerWaalsContact C-N 3.33Å; W375-G377 PolarHBondContact O-N 3.48Å; W375-L378 HydrophobicContact CZ3-CD2 4.45Å; W375-L378 WeakPolarHBondContact O-CB 3.32Å; W375-L378 PolarHBondContact O-N 3.41Å; W375-E379 VanDerWaalsContact NE1-CD 3.33Å; W375-E379 PolarHBondContact NE1-OE1 3.42Å; W375-E379 WeakPolarHBondContact O-CG 3.37Å; W375-E379 PolarHBondContact O-N 3.32Å
376	Q	91.4	Very high	89.1	Confident	117 Å²	117	52 Å²	52	55%	0.547	29%	0.287	S	S	.	.	H	α-helix	trans	-61.4	-41	173.5	-77.7	178	-6.9	0	0	111.8	T372 S373 L378 E379 Q380	T372-Q376 WeakPolarHBondContact O-CG 3.44Å; T372-Q376 PolarHBondContact O-N 3.37Å; S373-Q376 PolarHBondContact O-N 3.39Å; Q376-L378 VanDerWaalsContact C-N 3.33Å; Q376-L378 PolarHBondContact O-N 3.2Å; Q376-E379 PolarHBondContact O-N 3.26Å; Q376-Q380 WeakPolarHBondContact O-CB 3.48Å; Q376-Q380 PolarHBondContact O-N 3.43Å
377	G	91.1	Very high	89.2	Confident	33 Å²	33	54.9 Å²	54.9	34%	0.34	30%	0.301	S	S	.	.	H	α-helix	trans	-60	-41.7	173.9	0	0	0	0	0	112.6	S373 A374 W375 Q380 A381	S373-G377 PolarHBondContact O-N 3.28Å; A374-G377 PolarHBondContact O-N 3.46Å; W375-G377 VanDerWaalsContact C-N 3.33Å; W375-G377 PolarHBondContact O-N 3.48Å; G377-Q380 PolarHBondContact O-N 3.46Å; G377-A381 PolarHBondContact O-N 3.41Å
378	L	92.8	Very high	89.6	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-62.1	-47	173.8	-174.9	75.7	0	0	0	111.8	W296 I297 T300 L304 A374 W375 Q376 Q380 A381 E382	W296-L378 HydrophobicContact CE3-CD2 4.49Å; W296-L378 HydrophobicContact CH2-CD2 3.94Å; W296-L378 HydrophobicContact CZ3-CD2 3.49Å; W296-L378 VanDerWaalsContact CZ3-CD2 3.49Å; I297-L378 HydrophobicContact CG1-CD2 4.37Å; I297-L378 HydrophobicContact CG2-CB 4.25Å; T300-L378 HydrophobicContact CG2-CD1 4.14Å; L304-L378 HydrophobicContact CD1-CD1 3.54Å; L304-L378 HydrophobicContact CD1-CG 4.23Å; A374-L378 PolarHBondContact O-N 3.27Å; W375-L378 HydrophobicContact CZ3-CD2 4.45Å; W375-L378 WeakPolarHBondContact O-CB 3.32Å; W375-L378 PolarHBondContact O-N 3.41Å; Q376-L378 VanDerWaalsContact C-N 3.33Å; Q376-L378 PolarHBondContact O-N 3.2Å; L378-Q380 VanDerWaalsContact C-N 3.28Å; L378-Q380 PolarHBondContact O-N 2.96Å; L378-A381 WeakPolarHBondContact O-CB 3.34Å; L378-A381 PolarHBondContact O-N 3.31Å; L378-E382 WeakPolarHBondContact O-CG 3.38Å; L378-E382 PolarHBondContact O-N 3.23Å
379	E	90.7	Very high	89.7	Confident	88 Å²	88	51.5 Å²	51.5	41%	0.411	28%	0.28	S	S	.	.	H	α-helix	trans	-62.1	-36.2	178.1	-73.4	-179.6	162.7	0	0	112.3	W375 Q376 E382 K383	W375-E379 VanDerWaalsContact NE1-CD 3.33Å; W375-E379 PolarHBondContact NE1-OE1 3.42Å; W375-E379 WeakPolarHBondContact O-CG 3.37Å; W375-E379 PolarHBondContact O-N 3.32Å; Q376-E379 PolarHBondContact O-N 3.26Å; E379-E382 PolarHBondContact O-N 3.01Å; E379-K383 WeakPolarHBondContact O-CB 3.2Å; E379-K383 PolarHBondContact O-N 3.25Å
380	Q	90.8	Very high	89.7	Confident	152 Å²	152	51.8 Å²	51.8	71%	0.71	28%	0.275	S	S	*	.	H	α-helix	trans	-66.3	-42.9	173.9	-171.3	174	11.9	0	0	111.7	Q376 G377 L378 E382 K383 G384	Q376-Q380 WeakPolarHBondContact O-CB 3.48Å; Q376-Q380 PolarHBondContact O-N 3.43Å; G377-Q380 PolarHBondContact O-N 3.46Å; L378-Q380 VanDerWaalsContact C-N 3.28Å; L378-Q380 PolarHBondContact O-N 2.96Å; Q380-E382 VanDerWaalsContact C-N 3.34Å; Q380-K383 PolarHBondContact O-N 3.39Å; Q380-G384 PolarHBondContact O-N 3.2Å
381	A	91.4	Very high	89.7	Confident	9 Å²	9	53 Å²	53	7%	0.074	29%	0.285	C	S	.	.	H	α-helix	trans	-62.2	-41.1	174.6	0	0	0	0	0	111.7	T301 L304 E305 R307 G377 L378 G384 F385	T301-A381 HydrophobicContact CG2-CB 4.28Å; L304-A381 HydrophobicContact CB-CB 3.97Å; E305-A381 HydrophobicContact CG-CB 4.16Å; R307-A381 PolarHBondContact NH2-O 3.43Å; G377-A381 PolarHBondContact O-N 3.41Å; L378-A381 WeakPolarHBondContact O-CB 3.34Å; L378-A381 PolarHBondContact O-N 3.31Å; A381-G384 PolarHBondContact O-N 2.76Å; A381-F385 WeakPolarHBondContact O-CB 3.24Å; A381-F385 PolarHBondContact O-N 3.17Å
382	E	90	Very high	89.6	Confident	13 Å²	13	53.9 Å²	53.9	6%	0.061	29%	0.289	C	S	.	.	H	α-helix	trans	-61.5	-49.1	174.7	-73.9	-175.2	-167.7	0	0	112.4	L304 Y326 K331 L378 E379 Q380 G384 F385 E386	L304-E382 HydrophobicContact CD1-CB 4.49Å; L304-E382 HydrophobicContact CD1-CG 3.44Å; L304-E382 VanDerWaalsContact CD1-CG 3.44Å; L304-E382 HydrophobicContact CD2-CG 4.08Å; L304-E382 HydrophobicContact CG-CG 4.38Å; Y326-E382 HydrophobicContact CE1-CG 4.21Å; Y326-E382 WeakPolarHBondContact CE1-OE1 3.49Å; Y326-E382 PolarHBondContact OH-OE1 2.7Å; K331-E382 WeakPolarHBondContact CD-OE1 3.47Å; K331-E382 WeakPolarHBondContact CE-OE1 3.37Å; K331-E382 IonicContact NZ-OE1 2.77Å; K331-E382 PolarHBondContact NZ-OE1 3.08Å; K331-E382 IonicContact NZ-OE2 2.59Å; K331-E382 PolarHBondContact NZ-OE2 3.5Å; L378-E382 WeakPolarHBondContact O-CG 3.38Å; L378-E382 PolarHBondContact O-N 3.23Å; E379-E382 PolarHBondContact O-N 3.01Å; Q380-E382 VanDerWaalsContact C-N 3.34Å; E382-G384 VanDerWaalsContact C-N 3.32Å; E382-G384 PolarHBondContact O-N 3.02Å; E382-F385 PolarHBondContact O-N 3.39Å; E382-F385 VanDerWaalsContact O-N 3.13Å; E382-E386 PolarHBondContact O-N 3.29Å
383	K	88.3	Confident	89.5	Confident	132 Å²	132	53 Å²	53	57%	0.574	28%	0.282	S	S	*	.	H	α-helix	trans	-59.4	-46.3	178.6	-178.1	177.7	174.8	-179.3	0	110.8	E379 Q380 F385 E386 E387	E379-K383 WeakPolarHBondContact O-CB 3.2Å; E379-K383 PolarHBondContact O-N 3.25Å; Q380-K383 PolarHBondContact O-N 3.39Å; K383-F385 VanDerWaalsContact C-N 3.28Å; K383-F385 PolarHBondContact O-N 3.15Å; K383-E386 PolarHBondContact O-N 3.29Å; K383-E387 WeakPolarHBondContact CE-OE1 3.36Å; K383-E387 WeakPolarHBondContact O-CB 3.44Å; K383-E387 WeakPolarHBondContact O-CG 3.44Å; K383-E387 PolarHBondContact O-N 2.86Å
384	G	89.6	Confident	89.3	Confident	25 Å²	25	56.6 Å²	56.6	26%	0.258	28%	0.284	S	S	.	.	H	α-helix	trans	-64.6	-30.9	176.9	0	0	0	0	0	113.4	Q380 A381 E382 W388	Q380-G384 PolarHBondContact O-N 3.2Å; A381-G384 PolarHBondContact O-N 2.76Å; E382-G384 VanDerWaalsContact C-N 3.32Å; E382-G384 PolarHBondContact O-N 3.02Å; G384-W388 WeakPolarHBondContact O-CB 3.33Å; G384-W388 PolarHBondContact O-N 3.37Å; G384-W388 VanDerWaalsContact O-N 3.12Å
385	F	90.8	Very high	89.3	Confident	10 Å²	10	58.6 Å²	58.6	4%	0.044	29%	0.285	C	S	.	.	H	α-helix	trans	-73.8	-43.4	176.5	-171.4	-121.1	0	0	0	112	L304 F323 A381 E382 K383 W388 L389	L304-F385 HydrophobicContact CD2-CB 4.42Å; L304-F385 HydrophobicContact CD2-CD1 3.94Å; L304-F385 HydrophobicContact CD2-CG 4.36Å; L304-F385 WeakPolarHBondContact O-CB 3.29Å; F323-F385 HydrophobicContact CB-CE1 4.13Å; F323-F385 AromaticContact CD2-CD1 3.56Å; F323-F385 HydrophobicContact CD2-CD1 3.56Å; F323-F385 AromaticContact CD2-CE1 3.72Å; F323-F385 HydrophobicContact CD2-CE1 3.72Å; F323-F385 AromaticContact CE2-CD1 3.77Å; F323-F385 HydrophobicContact CE2-CD1 3.77Å; F323-F385 HydrophobicContact CE2-CE1 4.4Å; F323-F385 HydrophobicContact CG-CD1 4.12Å; F323-F385 HydrophobicContact CG-CE1 4.06Å; F323-F385 HydrophobicContact CZ-CD1 4.47Å; A381-F385 WeakPolarHBondContact O-CB 3.24Å; A381-F385 PolarHBondContact O-N 3.17Å; E382-F385 PolarHBondContact O-N 3.39Å; E382-F385 VanDerWaalsContact O-N 3.13Å; K383-F385 VanDerWaalsContact C-N 3.28Å; K383-F385 PolarHBondContact O-N 3.15Å; F385-W388 AromaticContact CD2-CE3 3.74Å; F385-W388 HydrophobicContact CD2-CE3 3.74Å; F385-W388 AromaticContact CD2-CZ3 3.99Å; F385-W388 HydrophobicContact CD2-CZ3 3.99Å; F385-W388 AromaticContact CE2-CE3 3.75Å; F385-W388 HydrophobicContact CE2-CE3 3.75Å; F385-W388 AromaticContact CE2-CZ3 3.49Å; F385-W388 HydrophobicContact CE2-CZ3 3.49Å; F385-W388 VanDerWaalsContact CE2-CZ3 3.49Å; F385-W388 HydrophobicContact CZ-CZ3 4.3Å; F385-W388 PolarHBondContact O-N 3.17Å; F385-L389 HydrophobicContact CD1-CD1 3.73Å; F385-L389 HydrophobicContact CD1-CG 4.37Å; F385-L389 HydrophobicContact CD2-CG 4.49Å; F385-L389 HydrophobicContact CE1-CD1 3.45Å; F385-L389 VanDerWaalsContact CE1-CD1 3.45Å; F385-L389 HydrophobicContact CE1-CG 4.16Å; F385-L389 HydrophobicContact CE2-CD1 4.46Å; F385-L389 HydrophobicContact CE2-CG 4.31Å; F385-L389 HydrophobicContact CG-CD1 4.36Å; F385-L389 HydrophobicContact CZ-CD1 3.86Å; F385-L389 HydrophobicContact CZ-CD2 4.3Å; F385-L389 HydrophobicContact CZ-CG 4.13Å; F385-L389 WeakPolarHBondContact O-CB 3.36Å; F385-L389 WeakPolarHBondContact O-CG 3.31Å; F385-L389 PolarHBondContact O-N 3.43Å
386	E	86.9	Confident	89	Confident	74 Å²	74	58.9 Å²	58.9	35%	0.346	29%	0.287	S	S	.	.	H	α-helix	trans	-62.4	-47.1	176.2	-177.6	166.8	-156.8	0	0	111.2	F323 R327 E382 K383 W388 L389 L390	F323-E386 HydrophobicContact CE1-CB 3.99Å; F323-E386 HydrophobicContact CE1-CG 4.21Å; F323-E386 HydrophobicContact CZ-CB 4.13Å; R327-E386 IonicContact NH1-OE1 3.22Å; R327-E386 PolarHBondContact NH1-OE1 3.41Å; R327-E386 IonicContact NH1-OE2 3.44Å; R327-E386 PolarHBondContact NH1-OE2 3.07Å; E382-E386 PolarHBondContact O-N 3.29Å; K383-E386 PolarHBondContact O-N 3.29Å; E386-W388 VanDerWaalsContact C-N 3.35Å; E386-W388 PolarHBondContact O-N 3.03Å; E386-L389 PolarHBondContact O-N 3.45Å; E386-L390 HydrophobicContact CG-CD1 4.08Å; E386-L390 WeakPolarHBondContact O-CB 3.43Å; E386-L390 VanDerWaalsContact O-CG 3.27Å; E386-L390 WeakPolarHBondContact O-CG 3.44Å; E386-L390 PolarHBondContact O-N 2.74Å
387	E	87.5	Confident	88.8	Confident	105 Å²	105	57.2 Å²	57.2	49%	0.491	28%	0.279	S	S	.	.	H	α-helix	trans	-60.6	-43.1	176.3	-74.6	176.5	-174.7	0	0	112.1	K383 T391	K383-E387 WeakPolarHBondContact CE-OE1 3.36Å; K383-E387 WeakPolarHBondContact O-CB 3.44Å; K383-E387 WeakPolarHBondContact O-CG 3.44Å; K383-E387 PolarHBondContact O-N 2.86Å; E387-T391 VanDerWaalsContact O-CB 3.31Å; E387-T391 WeakPolarHBondContact O-CB 3.44Å; E387-T391 PolarHBondContact O-N 3.41Å; E387-T391 PolarHBondContact O-OG1 2.89Å
388	W	92.6	Very high	88.7	Confident	42 Å²	42	62.1 Å²	62.1	16%	0.159	29%	0.287	C	S	.	.	H	α-helix	trans	-64.4	-49.2	176.1	170.2	77.2	0	0	0	112.1	R307 T308 M316 G384 F385 E386 L390 T391 E392	R307-W388 VanDerWaalsContact C-CZ2 3.4Å; R307-W388 WeakPolarHBondContact O-CZ2 3.4Å; T308-W388 WeakPolarHBondContact O-CH2 3.43Å; T308-W388 WeakPolarHBondContact O-CZ2 3.41Å; M316-W388 HydrophobicContact CE-CH2 4.22Å; M316-W388 HydrophobicContact CE-CZ3 4.43Å; M316-W388 HydrophobicContact SD-CH2 4.46Å; G384-W388 WeakPolarHBondContact O-CB 3.33Å; G384-W388 PolarHBondContact O-N 3.37Å; G384-W388 VanDerWaalsContact O-N 3.12Å; F385-W388 AromaticContact CD2-CE3 3.74Å; F385-W388 HydrophobicContact CD2-CE3 3.74Å; F385-W388 AromaticContact CD2-CZ3 3.99Å; F385-W388 HydrophobicContact CD2-CZ3 3.99Å; F385-W388 AromaticContact CE2-CE3 3.75Å; F385-W388 HydrophobicContact CE2-CE3 3.75Å; F385-W388 AromaticContact CE2-CZ3 3.49Å; F385-W388 HydrophobicContact CE2-CZ3 3.49Å; F385-W388 VanDerWaalsContact CE2-CZ3 3.49Å; F385-W388 HydrophobicContact CZ-CZ3 4.3Å; F385-W388 PolarHBondContact O-N 3.17Å; E386-W388 VanDerWaalsContact C-N 3.35Å; E386-W388 PolarHBondContact O-N 3.03Å; W388-L390 VanDerWaalsContact C-N 3.34Å; W388-L390 PolarHBondContact O-N 2.9Å; W388-T391 PolarHBondContact O-N 2.94Å; W388-E392 WeakPolarHBondContact O-CB 3.48Å; W388-E392 PolarHBondContact O-N 2.93Å
389	L	87.8	Confident	88.5	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-56	-47.8	178	-82.3	175.5	0	0	0	111.3	M316 K319 F323 F385 E386 T391 E392 I393	M316-L389 HydrophobicContact CE-CD2 3.62Å; K319-L389 HydrophobicContact CB-CD2 4.08Å; F323-L389 HydrophobicContact CB-CD1 4.16Å; F323-L389 HydrophobicContact CD1-CD1 4.27Å; F323-L389 HydrophobicContact CG-CD1 4.22Å; F385-L389 HydrophobicContact CD1-CD1 3.73Å; F385-L389 HydrophobicContact CD1-CG 4.37Å; F385-L389 HydrophobicContact CD2-CG 4.49Å; F385-L389 HydrophobicContact CE1-CD1 3.45Å; F385-L389 VanDerWaalsContact CE1-CD1 3.45Å; F385-L389 HydrophobicContact CE1-CG 4.16Å; F385-L389 HydrophobicContact CE2-CD1 4.46Å; F385-L389 HydrophobicContact CE2-CG 4.31Å; F385-L389 HydrophobicContact CG-CD1 4.36Å; F385-L389 HydrophobicContact CZ-CD1 3.86Å; F385-L389 HydrophobicContact CZ-CD2 4.3Å; F385-L389 HydrophobicContact CZ-CG 4.13Å; F385-L389 WeakPolarHBondContact O-CB 3.36Å; F385-L389 WeakPolarHBondContact O-CG 3.31Å; F385-L389 PolarHBondContact O-N 3.43Å; E386-L389 PolarHBondContact O-N 3.45Å; L389-T391 PolarHBondContact O-N 2.95Å; L389-E392 PolarHBondContact O-N 2.85Å; L389-I393 WeakPolarHBondContact O-CB 3.44Å; L389-I393 VanDerWaalsContact O-CG1 3.23Å; L389-I393 WeakPolarHBondContact O-CG1 3.45Å; L389-I393 PolarHBondContact O-N 3.47Å
390	L	85.1	Confident	88.4	Confident	78 Å²	78	62 Å²	62	41%	0.408	29%	0.289	S	S	.	.	H	α-helix	trans	-67.4	-36.2	-179.7	-69.3	174.5	0	0	0	112.3	E386 W388 R394	E386-L390 HydrophobicContact CG-CD1 4.08Å; E386-L390 WeakPolarHBondContact O-CB 3.43Å; E386-L390 VanDerWaalsContact O-CG 3.27Å; E386-L390 WeakPolarHBondContact O-CG 3.44Å; E386-L390 PolarHBondContact O-N 2.74Å; W388-L390 VanDerWaalsContact C-N 3.34Å; W388-L390 PolarHBondContact O-N 2.9Å; L390-R394 WeakPolarHBondContact O-CB 3.39Å; L390-R394 WeakPolarHBondContact O-CG 3.46Å; L390-R394 PolarHBondContact O-N 2.77Å; L390-R394 VanDerWaalsContact O-N 3.12Å; L390-R394 PolarHBondContact O-NE 3.41Å
391	T	87.5	Confident	88.3	Confident	76 Å²	76	60.4 Å²	60.4	47%	0.466	28%	0.282	S	S	.	.	H	α-helix	trans	-68.9	-42.5	177.4	-58.3	0	0	0	0	111	E387 W388 L389 R394 R395	E387-T391 VanDerWaalsContact O-CB 3.31Å; E387-T391 WeakPolarHBondContact O-CB 3.44Å; E387-T391 PolarHBondContact O-N 3.41Å; E387-T391 PolarHBondContact O-OG1 2.89Å; W388-T391 PolarHBondContact O-N 2.94Å; L389-T391 PolarHBondContact O-N 2.95Å; T391-R394 PolarHBondContact O-N 3.34Å; T391-R394 PolarHBondContact OG1-NH2 3.05Å; T391-R395 WeakPolarHBondContact O-CB 3.47Å; T391-R395 PolarHBondContact O-N 2.98Å
392	E	87	Confident	88.3	Confident	21 Å²	21	60.7 Å²	60.7	10%	0.098	28%	0.282	C	S	.	.	H	α-helix	trans	-71.3	-38.8	180	-169.8	59.8	-160	0	0	112.2	M316 W388 L389 R394 R395 L396	M316-E392 HydrophobicContact CE-CB 3.71Å; M316-E392 HydrophobicContact CE-CG 3.68Å; M316-E392 HydrophobicContact SD-CG 4.26Å; W388-E392 WeakPolarHBondContact O-CB 3.48Å; W388-E392 PolarHBondContact O-N 2.93Å; L389-E392 PolarHBondContact O-N 2.85Å; E392-R394 PolarHBondContact O-N 3.49Å; E392-R395 WeakPolarHBondContact O-CB 3.35Å; E392-R395 PolarHBondContact O-N 2.86Å; E392-R395 IonicContact OE1-CZ 3.2Å; E392-R395 VanDerWaalsContact OE1-CZ 3.26Å; E392-R395 IonicContact OE1-NE 2.73Å; E392-R395 PolarHBondContact OE1-NE 2.97Å; E392-R395 IonicContact OE1-NH2 3.22Å; E392-R395 PolarHBondContact OE1-NH2 3.35Å; E392-R395 IonicContact OE2-NE 3.57Å; E392-R395 PolarHBondContact OE2-NE 2.96Å; E392-R395 VanDerWaalsContact OE2-NE 3.09Å; E392-L396 WeakPolarHBondContact O-CG 3.46Å; E392-L396 PolarHBondContact O-N 3.19Å
393	I	86.1	Confident	88.3	Confident	22 Å²	22	60.4 Å²	60.4	11%	0.113	28%	0.282	C	S	.	.	H	α-helix	trans	-60.7	-45.4	172.4	-72	169	0	0	0	110.7	M316 L320 L389 R395 L396 E397	M316-I393 HydrophobicContact CB-CG1 3.97Å; M316-I393 HydrophobicContact CE-CG1 4.33Å; L320-I393 HydrophobicContact CB-CD1 4.24Å; L320-I393 HydrophobicContact CD2-CD1 4.03Å; L389-I393 WeakPolarHBondContact O-CB 3.44Å; L389-I393 VanDerWaalsContact O-CG1 3.23Å; L389-I393 WeakPolarHBondContact O-CG1 3.45Å; L389-I393 PolarHBondContact O-N 3.47Å; I393-R395 VanDerWaalsContact C-N 3.31Å; I393-R395 PolarHBondContact O-N 3.22Å; I393-L396 PolarHBondContact O-N 3.31Å; I393-E397 VanDerWaalsContact O-CB 3.29Å; I393-E397 WeakPolarHBondContact O-CB 3.2Å; I393-E397 PolarHBondContact O-N 2.84Å
394	R	85.5	Confident	88.4	Confident	153 Å²	153	57.4 Å²	57.4	58%	0.577	27%	0.27	S	S	*	.	H	α-helix	trans	-63.1	-37.2	176.4	-75.8	178.9	-70.7	178.2	0.8	112.2	L390 T391 E392 R398	L390-R394 WeakPolarHBondContact O-CB 3.39Å; L390-R394 WeakPolarHBondContact O-CG 3.46Å; L390-R394 PolarHBondContact O-N 2.77Å; L390-R394 VanDerWaalsContact O-N 3.12Å; L390-R394 PolarHBondContact O-NE 3.41Å; T391-R394 PolarHBondContact O-N 3.34Å; T391-R394 PolarHBondContact OG1-NH2 3.05Å; E392-R394 PolarHBondContact O-N 3.49Å; R394-R398 WeakPolarHBondContact O-CB 3.5Å; R394-R398 PolarHBondContact O-N 3.28Å
395	R	89.4	Confident	88.5	Confident	74 Å²	74	61 Å²	61	28%	0.279	28%	0.278	S	S	.	.	H	α-helix	trans	-64.4	-49.3	176.4	-168.3	-170.9	75	82.3	4.9	111.2	T391 E392 I393 R398 L399 L471	T391-R395 WeakPolarHBondContact O-CB 3.47Å; T391-R395 PolarHBondContact O-N 2.98Å; E392-R395 WeakPolarHBondContact O-CB 3.35Å; E392-R395 PolarHBondContact O-N 2.86Å; E392-R395 IonicContact OE1-CZ 3.2Å; E392-R395 VanDerWaalsContact OE1-CZ 3.26Å; E392-R395 IonicContact OE1-NE 2.73Å; E392-R395 PolarHBondContact OE1-NE 2.97Å; E392-R395 IonicContact OE1-NH2 3.22Å; E392-R395 PolarHBondContact OE1-NH2 3.35Å; E392-R395 IonicContact OE2-NE 3.57Å; E392-R395 PolarHBondContact OE2-NE 2.96Å; E392-R395 VanDerWaalsContact OE2-NE 3.09Å; I393-R395 VanDerWaalsContact C-N 3.31Å; I393-R395 PolarHBondContact O-N 3.22Å; R395-R398 PolarHBondContact O-N 3.3Å; R395-L399 VanDerWaalsContact NH1-CD1 3.32Å; R395-L399 WeakPolarHBondContact O-CG 3.23Å; R395-L399 PolarHBondContact O-N 3.41Å; R395-L471 PolarHBondContact NH1-O 3.13Å
396	L	87.4	Confident	88.7	Confident	11 Å²	11	60.9 Å²	60.9	6%	0.058	28%	0.278	C	S	.	.	H	α-helix	trans	-64.5	-41.6	178.2	-70.8	175.1	0	0	0	111.9	M316 E392 I393 R398 L399 D400	M316-L396 HydrophobicContact CB-CD1 4.23Å; M316-L396 HydrophobicContact CG-CD1 3.53Å; E392-L396 WeakPolarHBondContact O-CG 3.46Å; E392-L396 PolarHBondContact O-N 3.19Å; I393-L396 PolarHBondContact O-N 3.31Å; L396-R398 PolarHBondContact O-N 3.43Å; L396-L399 HydrophobicContact CD2-CD1 4.41Å; L396-L399 WeakPolarHBondContact O-CB 3.38Å; L396-L399 PolarHBondContact O-N 3.19Å; L396-D400 PolarHBondContact O-N 3.19Å
397	E	86.7	Confident	88.9	Confident	82 Å²	82	63.3 Å²	63.3	38%	0.383	28%	0.284	S	S	.	.	H	α-helix	trans	-60.2	-45.2	174.5	-175.9	175.5	-158.2	0	0	111.2	M313 I393 L399 D400 H401	M313-E397 HydrophobicContact CE-CB 4.18Å; M313-E397 HydrophobicContact CE-CG 4.28Å; I393-E397 VanDerWaalsContact O-CB 3.29Å; I393-E397 WeakPolarHBondContact O-CB 3.2Å; I393-E397 PolarHBondContact O-N 2.84Å; E397-L399 VanDerWaalsContact C-N 3.34Å; E397-L399 PolarHBondContact O-N 3.3Å; E397-D400 PolarHBondContact O-N 3.37Å; E397-H401 PolarHBondContact O-N 3.41Å; E397-H401 PolarHBondContact O-ND1 3.38Å; E397-H401 IonicContact OE1-CE1 2.69Å
398	R	89	Confident	89.1	Confident	137 Å²	137	63.2 Å²	63.2	52%	0.517	28%	0.283	S	S	.	.	H	α-helix	trans	-60.8	-42.9	175.1	-177.2	178.3	-178.4	171.3	1.8	111.6	R394 R395 L396 H401 L402 E467 L471	R394-R398 WeakPolarHBondContact O-CB 3.5Å; R394-R398 PolarHBondContact O-N 3.28Å; R395-R398 PolarHBondContact O-N 3.3Å; L396-R398 PolarHBondContact O-N 3.43Å; R398-H401 PolarHBondContact O-N 3.48Å; R398-L402 HydrophobicContact CG-CD1 3.81Å; R398-L402 HydrophobicContact CG-CG 4.2Å; R398-L402 WeakPolarHBondContact O-CB 3.43Å; R398-L402 VanDerWaalsContact O-CG 3.24Å; R398-L402 WeakPolarHBondContact O-CG 3.18Å; R398-L402 PolarHBondContact O-N 3.11Å; R398-E467 IonicContact CZ-OE1 3.67Å; R398-E467 IonicContact NE-OE1 3.5Å; R398-E467 PolarHBondContact NE-OE1 3.04Å; R398-E467 IonicContact NH2-OE1 3.94Å; R398-E467 PolarHBondContact NH2-OE1 3.43Å; R398-L471 HydrophobicContact CG-CD1 4.43Å
399	L	89.4	Confident	89.1	Confident	8 Å²	8	63.4 Å²	63.4	4%	0.042	29%	0.285	C	S	.	.	H	α-helix	trans	-59.5	-47.7	176.9	-82.2	176.9	0	0	0	112	R395 L396 E397 H401 L402 A403 L468 L471 Y473	R395-L399 VanDerWaalsContact NH1-CD1 3.32Å; R395-L399 WeakPolarHBondContact O-CG 3.23Å; R395-L399 PolarHBondContact O-N 3.41Å; L396-L399 HydrophobicContact CD2-CD1 4.41Å; L396-L399 WeakPolarHBondContact O-CB 3.38Å; L396-L399 PolarHBondContact O-N 3.19Å; E397-L399 VanDerWaalsContact C-N 3.34Å; E397-L399 PolarHBondContact O-N 3.3Å; L399-H401 VanDerWaalsContact C-N 3.35Å; L399-H401 PolarHBondContact O-N 2.79Å; L399-L402 PolarHBondContact O-N 3.49Å; L399-A403 VanDerWaalsContact O-CB 3.26Å; L399-A403 WeakPolarHBondContact O-CB 3.38Å; L399-A403 PolarHBondContact O-N 2.87Å; L399-L468 HydrophobicContact CD2-CD2 3.83Å; L399-L471 HydrophobicContact CD2-CB 3.47Å; L399-L471 VanDerWaalsContact CD2-CB 3.47Å; L399-L471 HydrophobicContact CD2-CD1 4.03Å; L399-L471 HydrophobicContact CD2-CG 4.42Å; L399-L471 HydrophobicContact CG-CB 4.19Å; L399-L471 HydrophobicContact CG-CD1 4.48Å; L399-Y473 HydrophobicContact CB-CD2 4.33Å; L399-Y473 HydrophobicContact CD2-CD2 4.05Å; L399-Y473 HydrophobicContact CD2-CG 4.42Å
400	D	87.4	Confident	89.3	Confident	77 Å²	77	63.3 Å²	63.3	41%	0.412	29%	0.285	S	S	.	.	H	α-helix	trans	-62.4	-43	178.8	-76.1	-19.6	0	0	0	111.4	L396 E397 A403 E404	L396-D400 PolarHBondContact O-N 3.19Å; E397-D400 PolarHBondContact O-N 3.37Å; D400-A403 PolarHBondContact O-N 3.16Å; D400-E404 WeakPolarHBondContact O-CB 3.24Å; D400-E404 PolarHBondContact O-N 2.83Å
401	H	88.4	Confident	89.7	Confident	119 Å²	119	62 Å²	62	55%	0.551	28%	0.28	S	S	*	.	H	α-helix	trans	-64.4	-44.7	176.5	-77	85.5	0	0	0	112.5	E397 R398 L399 K405	E397-H401 PolarHBondContact O-N 3.41Å; E397-H401 PolarHBondContact O-ND1 3.38Å; E397-H401 IonicContact OE1-CE1 2.69Å; R398-H401 PolarHBondContact O-N 3.48Å; L399-H401 VanDerWaalsContact C-N 3.35Å; L399-H401 PolarHBondContact O-N 2.79Å; H401-K405 WeakPolarHBondContact O-CB 2.91Å; H401-K405 PolarHBondContact O-N 3.43Å
402	L	91.8	Very high	89.9	Confident	15 Å²	15	62.6 Å²	62.6	8%	0.079	28%	0.28	C	S	.	.	H	α-helix	trans	-65.9	-40.7	178.3	-72.6	174.2	0	0	0	111.5	R398 L399 K405 F406 I464 E467 L468 L471	R398-L402 HydrophobicContact CG-CD1 3.81Å; R398-L402 HydrophobicContact CG-CG 4.2Å; R398-L402 WeakPolarHBondContact O-CB 3.43Å; R398-L402 VanDerWaalsContact O-CG 3.24Å; R398-L402 WeakPolarHBondContact O-CG 3.18Å; R398-L402 PolarHBondContact O-N 3.11Å; L399-L402 PolarHBondContact O-N 3.49Å; L402-K405 PolarHBondContact O-N 3.12Å; L402-F406 WeakPolarHBondContact O-CB 3.47Å; L402-F406 PolarHBondContact O-N 3.33Å; L402-I464 HydrophobicContact CB-CG2 4.44Å; L402-I464 HydrophobicContact CD2-CG2 4.35Å; L402-E467 HydrophobicContact CD1-CG 3.91Å; L402-E467 WeakPolarHBondContact CD1-OE1 3.31Å; L402-L468 HydrophobicContact CB-CD1 4.48Å; L402-L468 HydrophobicContact CB-CD2 3.61Å; L402-L468 HydrophobicContact CB-CG 3.97Å; L402-L468 HydrophobicContact CD1-CD2 4.48Å; L402-L471 HydrophobicContact CD1-CD1 3.99Å
403	A	90.6	Very high	90.1	Very high	7 Å²	7	61.7 Å²	61.7	6%	0.058	28%	0.276	C	S	.	.	H	α-helix	trans	-64.8	-42.4	177.9	0	0	0	0	0	111.7	L399 D400 F406 R407 L468 Y473	L399-A403 VanDerWaalsContact O-CB 3.26Å; L399-A403 WeakPolarHBondContact O-CB 3.38Å; L399-A403 PolarHBondContact O-N 2.87Å; D400-A403 PolarHBondContact O-N 3.16Å; A403-F406 PolarHBondContact O-N 3.42Å; A403-R407 WeakPolarHBondContact O-CB 3.34Å; A403-R407 PolarHBondContact O-N 3.23Å; A403-L468 HydrophobicContact CB-CD2 4.3Å; A403-Y473 HydrophobicContact CB-CE1 4.35Å; A403-Y473 HydrophobicContact CB-CE2 3.85Å
404	E	90.7	Very high	90.3	Very high	68 Å²	68	64 Å²	64	32%	0.318	29%	0.286	S	S	.	.	H	α-helix	trans	-65.1	-44.3	173.9	-175.4	57	-147	0	0	111.4	D400 F406 R407 Q408	D400-E404 WeakPolarHBondContact O-CB 3.24Å; D400-E404 PolarHBondContact O-N 2.83Å; E404-F406 VanDerWaalsContact C-N 3.35Å; E404-F406 PolarHBondContact O-N 2.72Å; E404-R407 WeakPolarHBondContact O-CB 3.47Å; E404-R407 PolarHBondContact O-N 3.43Å; E404-R407 IonicContact OE2-CZ 3.59Å; E404-R407 IonicContact OE2-NH1 2.83Å; E404-R407 PolarHBondContact OE2-NH1 2.88Å; E404-R407 IonicContact OE2-NH2 3.58Å; E404-Q408 WeakPolarHBondContact O-CG 3.45Å; E404-Q408 PolarHBondContact O-N 3.01Å; E404-Q408 PolarHBondContact OE1-NE2 3.4Å
405	K	90.9	Very high	90.6	Very high	102 Å²	102	62 Å²	62	44%	0.443	29%	0.287	S	S	.	.	H	α-helix	trans	-61.4	-41.6	177.5	-170.5	179.4	-178.4	-177.2	0	111.9	H401 L402 K409 I464	H401-K405 WeakPolarHBondContact O-CB 2.91Å; H401-K405 PolarHBondContact O-N 3.43Å; L402-K405 PolarHBondContact O-N 3.12Å; K405-K409 HydrophobicContact CG-CD 4.16Å; K405-K409 WeakPolarHBondContact O-CB 3.45Å; K405-K409 WeakPolarHBondContact O-CG 3.45Å; K405-K409 PolarHBondContact O-N 3.29Å; K405-I464 HydrophobicContact CD-CD1 3.99Å; K405-I464 HydrophobicContact CG-CD1 4.07Å
406	F	94.2	Very high	90.6	Very high	7 Å²	7	60.1 Å²	60.1	3%	0.031	28%	0.28	C	S	.	.	H	α-helix	trans	-59.7	-51	172.7	176.7	-96	0	0	0	110.6	L402 A403 E404 Q408 K409 A410 I461 I464 A465 L468 V479 R482 C483	L402-F406 WeakPolarHBondContact O-CB 3.47Å; L402-F406 PolarHBondContact O-N 3.33Å; A403-F406 PolarHBondContact O-N 3.42Å; E404-F406 VanDerWaalsContact C-N 3.35Å; E404-F406 PolarHBondContact O-N 2.72Å; F406-Q408 VanDerWaalsContact C-N 3.33Å; F406-Q408 PolarHBondContact O-N 3.24Å; F406-K409 PolarHBondContact O-N 3.19Å; F406-A410 HydrophobicContact CE1-CB 4.38Å; F406-A410 HydrophobicContact CZ-CB 4.39Å; F406-A410 WeakPolarHBondContact O-CB 3.43Å; F406-A410 PolarHBondContact O-N 2.78Å; F406-I461 HydrophobicContact CD2-CG2 4.14Å; F406-I461 HydrophobicContact CE2-CG2 3.65Å; F406-I464 HydrophobicContact CB-CG2 3.88Å; F406-A465 HydrophobicContact CD2-CB 4.19Å; F406-A465 HydrophobicContact CE2-CB 3.84Å; F406-L468 HydrophobicContact CB-CD1 4.09Å; F406-V479 HydrophobicContact CD1-CB 4.46Å; F406-V479 HydrophobicContact CD1-CG1 3.94Å; F406-V479 HydrophobicContact CD1-CG2 4.09Å; F406-V479 HydrophobicContact CD2-CG1 4.09Å; F406-V479 HydrophobicContact CE1-CB 4.08Å; F406-V479 HydrophobicContact CE1-CG1 3.69Å; F406-V479 HydrophobicContact CE1-CG2 4.07Å; F406-V479 HydrophobicContact CE2-CG1 3.84Å; F406-V479 HydrophobicContact CG-CG1 4.14Å; F406-V479 HydrophobicContact CZ-CB 4.35Å; F406-V479 HydrophobicContact CZ-CG1 3.64Å; F406-V479 WeakPolarHBondContact CZ-O 3.49Å; F406-R482 HydrophobicContact CZ-CB 4.45Å; F406-C483 HydrophobicContact CE2-CB 4.32Å; F406-C483 HydrophobicContact CZ-CB 4.34Å
407	R	92.3	Very high	90.7	Very high	124 Å²	124	59.8 Å²	59.8	47%	0.468	28%	0.279	S	S	.	.	H	α-helix	trans	-57.5	-45.4	-179	-166.5	-172.3	-56.1	137.1	11.5	111.8	A403 E404 T411	A403-R407 WeakPolarHBondContact O-CB 3.34Å; A403-R407 PolarHBondContact O-N 3.23Å; E404-R407 WeakPolarHBondContact O-CB 3.47Å; E404-R407 PolarHBondContact O-N 3.43Å; E404-R407 IonicContact OE2-CZ 3.59Å; E404-R407 IonicContact OE2-NH1 2.83Å; E404-R407 PolarHBondContact OE2-NH1 2.88Å; E404-R407 IonicContact OE2-NH2 3.58Å; R407-T411 VanDerWaalsContact O-CB 3.32Å; R407-T411 WeakPolarHBondContact O-CB 3.38Å; R407-T411 PolarHBondContact O-N 2.75Å; R407-T411 VanDerWaalsContact O-N 3.1Å; R407-T411 PolarHBondContact O-OG1 3.03Å
408	Q	92.3	Very high	90.9	Very high	104 Å²	104	60.3 Å²	60.3	49%	0.486	29%	0.292	S	S	.	.	H	α-helix	trans	-66.5	-49.3	178.6	-69.5	179.1	12.5	0	0	111.8	E404 F406 T411 N412	E404-Q408 WeakPolarHBondContact O-CG 3.45Å; E404-Q408 PolarHBondContact O-N 3.01Å; E404-Q408 PolarHBondContact OE1-NE2 3.4Å; F406-Q408 VanDerWaalsContact C-N 3.33Å; F406-Q408 PolarHBondContact O-N 3.24Å; Q408-T411 PolarHBondContact O-N 2.73Å; Q408-N412 VanDerWaalsContact O-CB 3.31Å; Q408-N412 WeakPolarHBondContact O-CB 3.48Å; Q408-N412 PolarHBondContact O-N 3.16Å; Q408-N412 PolarHBondContact O-ND2 2.83Å
409	K	91.9	Very high	90.7	Very high	45 Å²	45	55.8 Å²	55.8	20%	0.196	29%	0.288	C	S	.	.	H	α-helix	trans	-64.2	-43.1	-178.9	-76.7	178.8	172.6	-87	0	112.3	K405 F406 N412 H413 I461 I464	K405-K409 HydrophobicContact CG-CD 4.16Å; K405-K409 WeakPolarHBondContact O-CB 3.45Å; K405-K409 WeakPolarHBondContact O-CG 3.45Å; K405-K409 PolarHBondContact O-N 3.29Å; F406-K409 PolarHBondContact O-N 3.19Å; K409-N412 PolarHBondContact O-N 3.28Å; K409-H413 WeakPolarHBondContact O-CB 3.46Å; K409-H413 PolarHBondContact O-N 3.15Å; K409-I461 HydrophobicContact CB-CD1 4.15Å; K409-I461 HydrophobicContact CB-CG1 3.71Å; K409-I464 HydrophobicContact CD-CD1 3.7Å
410	A	92.3	Very high	90.6	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.4	-49.7	176.7	0	0	0	0	0	111.4	F406 N412 H413 E414 I486	F406-A410 HydrophobicContact CE1-CB 4.38Å; F406-A410 HydrophobicContact CZ-CB 4.39Å; F406-A410 WeakPolarHBondContact O-CB 3.43Å; F406-A410 PolarHBondContact O-N 2.78Å; A410-N412 VanDerWaalsContact C-N 3.34Å; A410-N412 PolarHBondContact O-N 2.65Å; A410-H413 PolarHBondContact O-N 2.65Å; A410-E414 WeakPolarHBondContact O-CG 3.29Å; A410-E414 PolarHBondContact O-N 2.94Å; A410-I486 HydrophobicContact CB-CD1 3.84Å
411	T	93.2	Very high	90.6	Very high	49 Å²	49	57.3 Å²	57.3	30%	0.301	29%	0.291	S	S	.	.	H	α-helix	trans	-61.7	-42.1	178.9	-52.6	0	0	0	0	111.8	R407 Q408 H413 E414 N415 R482	R407-T411 VanDerWaalsContact O-CB 3.32Å; R407-T411 WeakPolarHBondContact O-CB 3.38Å; R407-T411 PolarHBondContact O-N 2.75Å; R407-T411 VanDerWaalsContact O-N 3.1Å; R407-T411 PolarHBondContact O-OG1 3.03Å; Q408-T411 PolarHBondContact O-N 2.73Å; T411-H413 VanDerWaalsContact C-N 3.33Å; T411-H413 PolarHBondContact O-N 3.29Å; T411-E414 PolarHBondContact O-N 3.43Å; T411-N415 WeakPolarHBondContact O-CB 3.16Å; T411-N415 PolarHBondContact O-N 3.47Å; T411-N415 PolarHBondContact O-ND2 3.38Å; T411-R482 PolarHBondContact OG1-NH2 3.06Å
412	N	90.6	Very high	90.4	Very high	90 Å²	90	57.4 Å²	57.4	48%	0.481	30%	0.295	S	S	.	.	H	α-helix	trans	-66	-36.1	177.8	-70.8	-13.7	0	0	0	112.2	Q408 K409 A410 W416	Q408-N412 VanDerWaalsContact O-CB 3.31Å; Q408-N412 WeakPolarHBondContact O-CB 3.48Å; Q408-N412 PolarHBondContact O-N 3.16Å; Q408-N412 PolarHBondContact O-ND2 2.83Å; K409-N412 PolarHBondContact O-N 3.28Å; A410-N412 VanDerWaalsContact C-N 3.34Å; A410-N412 PolarHBondContact O-N 2.65Å; N412-W416 WeakPolarHBondContact O-CB 3.37Å; N412-W416 PolarHBondContact O-N 2.84Å; N412-W416 VanDerWaalsContact O-N 3.12Å
413	H	92	Very high	90.1	Very high	2 Å²	2	61 Å²	61	1%	0.009	31%	0.314	C	S	.	.	H	α-helix	trans	-69.6	-45.4	176.5	-175.6	87.2	0	0	0	111.7	K409 A410 T411 N415 W416 A417 V458 I461 I486 W490	K409-H413 WeakPolarHBondContact O-CB 3.46Å; K409-H413 PolarHBondContact O-N 3.15Å; A410-H413 PolarHBondContact O-N 2.65Å; T411-H413 VanDerWaalsContact C-N 3.33Å; T411-H413 PolarHBondContact O-N 3.29Å; H413-N415 VanDerWaalsContact C-N 3.33Å; H413-N415 PolarHBondContact O-N 3.26Å; H413-W416 AromaticContact CE1-CE3 3.88Å; H413-W416 AromaticContact CE1-CZ3 3.85Å; H413-W416 WeakPolarHBondContact O-CB 3.46Å; H413-W416 PolarHBondContact O-N 3.39Å; H413-W416 VanDerWaalsContact O-N 3.11Å; H413-A417 PolarHBondContact O-N 2.93Å; H413-V458 WeakPolarHBondContact CE1-CG2 3.4Å; H413-I461 HydrophobicContact CB-CD1 3.77Å; H413-I486 WeakPolarHBondContact CD2-CG2 3.36Å; H413-W490 AromaticContact CE1-CE3 3.67Å; H413-W490 AromaticContact CE1-CZ3 3.67Å
414	E	91.3	Very high	89.8	Confident	69 Å²	69	61.5 Å²	61.5	32%	0.322	32%	0.315	S	S	.	.	H	α-helix	trans	-59.1	-43.5	176	-71.2	163.5	-178.2	0	0	111.7	A410 T411 W416 A417 S418 R482 I486	A410-E414 WeakPolarHBondContact O-CG 3.29Å; A410-E414 PolarHBondContact O-N 2.94Å; T411-E414 PolarHBondContact O-N 3.43Å; E414-W416 VanDerWaalsContact C-N 3.3Å; E414-W416 PolarHBondContact O-N 2.96Å; E414-A417 PolarHBondContact O-N 3.26Å; E414-S418 PolarHBondContact O-N 3.46Å; E414-R482 IonicContact OE1-CZ 3.17Å; E414-R482 IonicContact OE1-NE 2.71Å; E414-R482 PolarHBondContact OE1-NE 3.49Å; E414-R482 IonicContact OE1-NH2 3.04Å; E414-R482 PolarHBondContact OE1-NH2 2.92Å; E414-R482 IonicContact OE2-CZ 3.51Å; E414-R482 IonicContact OE2-NE 3.93Å; E414-R482 IonicContact OE2-NH2 3.37Å; E414-R482 PolarHBondContact OE2-NH2 2.88Å; E414-I486 HydrophobicContact CG-CD1 4.14Å; E414-I486 HydrophobicContact CG-CG1 4.06Å
415	N	90.8	Very high	89.7	Confident	112 Å²	112	64 Å²	64	60%	0.599	33%	0.33	S	S	*	.	H	α-helix	trans	-61.9	-37.7	175	-74.3	-21.7	0	0	0	112.5	T411 H413	T411-N415 WeakPolarHBondContact O-CB 3.16Å; T411-N415 PolarHBondContact O-N 3.47Å; T411-N415 PolarHBondContact O-ND2 3.38Å; H413-N415 VanDerWaalsContact C-N 3.33Å; H413-N415 PolarHBondContact O-N 3.26Å
416	W	90.5	Very high	89.4	Confident	34 Å²	34	64.2 Å²	64.2	13%	0.129	33%	0.332	C	S	.	.	H	α-helix	trans	-69.8	-40.7	177.1	167.5	89.8	0	0	0	112.4	N412 H413 E414 S418 K420 F447 D450 L451 H454 W490 L493	N412-W416 WeakPolarHBondContact O-CB 3.37Å; N412-W416 PolarHBondContact O-N 2.84Å; N412-W416 VanDerWaalsContact O-N 3.12Å; H413-W416 AromaticContact CE1-CE3 3.88Å; H413-W416 AromaticContact CE1-CZ3 3.85Å; H413-W416 WeakPolarHBondContact O-CB 3.46Å; H413-W416 PolarHBondContact O-N 3.39Å; H413-W416 VanDerWaalsContact O-N 3.11Å; E414-W416 VanDerWaalsContact C-N 3.3Å; E414-W416 PolarHBondContact O-N 2.96Å; W416-S418 VanDerWaalsContact C-N 3.27Å; W416-S418 PolarHBondContact O-N 3.19Å; W416-K420 WeakPolarHBondContact O-CE 3.42Å; W416-K420 VanDerWaalsContact O-CG 3.29Å; W416-K420 WeakPolarHBondContact O-CG 3.46Å; W416-F447 HydrophobicContact CH2-CE2 4.32Å; W416-F447 HydrophobicContact CH2-CZ 4.27Å; W416-F447 AromaticContact CZ2-CE2 3.8Å; W416-F447 HydrophobicContact CZ2-CE2 3.8Å; W416-F447 HydrophobicContact CZ2-CZ 4.2Å; W416-D450 HydrophobicContact CZ2-CB 4.31Å; W416-D450 PolarHBondContact NE1-OD1 2.86Å; W416-D450 PolarHBondContact NE1-OD2 3.26Å; W416-L451 HydrophobicContact CH2-CD1 4.47Å; W416-H454 AromaticContact CD1-CE1 3.27Å; W416-H454 AromaticContact CD1-ND1 3.93Å; W416-H454 AromaticContact CD1-NE2 3.82Å; W416-H454 AromaticContact CD2-CE1 3.56Å; W416-H454 AromaticContact CD2-ND1 3.38Å; W416-H454 AromaticContact CE2-CE1 3.61Å; W416-H454 AromaticContact CE2-CG 3.91Å; W416-H454 AromaticContact CE2-ND1 3.55Å; W416-H454 AromaticContact CE3-ND1 3.77Å; W416-H454 AromaticContact CG-CE1 3.36Å; W416-H454 AromaticContact CG-ND1 3.67Å; W416-H454 HydrophobicContact CH2-CB 4.23Å; W416-H454 HydrophobicContact CZ2-CB 4.25Å; W416-H454 HydrophobicContact CZ3-CB 4.5Å; W416-H454 AromaticContact NE1-CE1 3.38Å; W416-H454 PolarHBondContact NE1-CE1 3.2Å; W416-H454 AromaticContact NE1-ND1 3.81Å; W416-H454 AromaticContact NE1-NE2 3.61Å; W416-W490 HydrophobicContact CH2-CE3 4.3Å; W416-W490 HydrophobicContact CH2-CH2 4.18Å; W416-W490 AromaticContact CH2-CZ3 3.46Å; W416-W490 HydrophobicContact CH2-CZ3 3.46Å; W416-W490 VanDerWaalsContact CH2-CZ3 3.46Å; W416-W490 HydrophobicContact CZ3-CE3 4.03Å; W416-W490 AromaticContact CZ3-CZ3 3.46Å; W416-W490 HydrophobicContact CZ3-CZ3 3.46Å; W416-W490 VanDerWaalsContact CZ3-CZ3 3.46Å; W416-L493 HydrophobicContact CH2-CD1 4.27Å; W416-L493 HydrophobicContact CZ3-CD1 4.02Å
417	A	88.1	Confident	88.8	Confident	5 Å²	5	70.4 Å²	70.4	4%	0.041	36%	0.359	C	S	.	.	H	α-helix	trans	-71	-25	-176.7	0	0	0	0	0	112.5	H413 E414 G419 K420 L489 L493	H413-A417 PolarHBondContact O-N 2.93Å; E414-A417 PolarHBondContact O-N 3.26Å; A417-G419 PolarHBondContact O-N 3.12Å; A417-K420 PolarHBondContact O-N 3.05Å; A417-L489 HydrophobicContact CB-CD2 3.6Å; A417-L489 HydrophobicContact CB-CG 4.4Å; A417-L493 HydrophobicContact CB-CD1 4.28Å
418	S	90.8	Very high	88.3	Confident	93 Å²	93	66.9 Å²	66.9	65%	0.65	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	127.8	-179.1	-169.5	0	0	0	0	112.8	E414 W416 K420	E414-S418 PolarHBondContact O-N 3.46Å; W416-S418 VanDerWaalsContact C-N 3.27Å; W416-S418 PolarHBondContact O-N 3.19Å; S418-K420 VanDerWaalsContact C-N 3.25Å; S418-K420 PolarHBondContact O-N 2.98Å
419	G	84.6	Confident	87.7	Confident	42 Å²	42	62.9 Å²	62.9	43%	0.433	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	-11.2	175.2	0	0	0	0	0	116.4	A417 E421 L422	A417-G419 PolarHBondContact O-N 3.12Å; G419-E421 VanDerWaalsContact C-N 3.28Å; G419-E421 PolarHBondContact O-N 3.23Å; G419-L422 PolarHBondContact O-N 3.27Å
420	K	87.6	Confident	86.8	Confident	50 Å²	50	66.2 Å²	66.2	22%	0.217	35%	0.347	C	S	.	.	H	α-helix	trans	-62.2	-34.4	180	-60.9	-67.4	-176	156.7	0	112.8	W416 A417 S418 L422 I423 L424 F447 D450 L493	W416-K420 WeakPolarHBondContact O-CE 3.42Å; W416-K420 VanDerWaalsContact O-CG 3.29Å; W416-K420 WeakPolarHBondContact O-CG 3.46Å; A417-K420 PolarHBondContact O-N 3.05Å; S418-K420 VanDerWaalsContact C-N 3.25Å; S418-K420 PolarHBondContact O-N 2.98Å; K420-L422 VanDerWaalsContact C-N 3.3Å; K420-L422 PolarHBondContact O-N 2.99Å; K420-I423 PolarHBondContact O-N 3.19Å; K420-L424 PolarHBondContact O-N 3.12Å; K420-F447 HydrophobicContact CB-CE2 4.27Å; K420-F447 HydrophobicContact CB-CZ 4.07Å; K420-F447 HydrophobicContact CD-CD2 4.4Å; K420-F447 HydrophobicContact CD-CE2 3.73Å; K420-F447 HydrophobicContact CD-CZ 4.4Å; K420-F447 HydrophobicContact CG-CE2 4.08Å; K420-F447 HydrophobicContact CG-CZ 4.32Å; K420-D450 IonicContact NZ-OD2 2.83Å; K420-D450 PolarHBondContact NZ-OD2 3.05Å; K420-L493 HydrophobicContact CB-CD2 4.01Å
421	E	87.2	Confident	85.9	Confident	66 Å²	66	71.7 Å²	71.7	31%	0.308	38%	0.38	S	S	.	.	H	α-helix	trans	-57.6	-40.1	175.9	-176.8	172.7	-176.9	0	0	112.7	G419 I423 I425 K492 L493 L496	G419-E421 VanDerWaalsContact C-N 3.28Å; G419-E421 PolarHBondContact O-N 3.23Å; E421-I423 VanDerWaalsContact C-N 3.31Å; E421-I423 PolarHBondContact O-N 3.38Å; E421-I425 WeakPolarHBondContact O-CD1 3.47Å; E421-K492 WeakPolarHBondContact OE1-CE 3.41Å; E421-K492 IonicContact OE1-NZ 2.73Å; E421-K492 PolarHBondContact OE1-NZ 3.18Å; E421-K492 WeakPolarHBondContact OE2-CE 3.44Å; E421-K492 IonicContact OE2-NZ 2.66Å; E421-K492 PolarHBondContact OE2-NZ 3.11Å; E421-L493 HydrophobicContact CB-CD2 4.31Å; E421-L496 HydrophobicContact CG-CD1 3.81Å
422	L	85.6	Confident	84.9	Confident	121 Å²	121	70 Å²	70	63%	0.634	37%	0.371	S	S	*	.	H	α-helix	trans	-71.6	-24.9	-179	-68.8	173.8	0	0	0	113.1	G419 K420 Q426	G419-L422 PolarHBondContact O-N 3.27Å; K420-L422 VanDerWaalsContact C-N 3.3Å; K420-L422 PolarHBondContact O-N 2.99Å; L422-Q426 VanDerWaalsContact O-CG 3.25Å; L422-Q426 WeakPolarHBondContact O-CG 3.47Å; L422-Q426 PolarHBondContact O-NE2 3.33Å
423	I	84.5	Confident	84.1	Confident	90 Å²	90	67.5 Å²	67.5	46%	0.462	36%	0.359	S	S	.	.	H	α-helix	trans	-76.2	-38.5	-179.8	-61.1	171.3	0	0	0	110.4	K420 E421 I425 Q426	K420-I423 PolarHBondContact O-N 3.19Å; E421-I423 VanDerWaalsContact C-N 3.31Å; E421-I423 PolarHBondContact O-N 3.38Å; I423-I425 PolarHBondContact O-N 3.15Å; I423-Q426 WeakPolarHBondContact O-CB 3.13Å; I423-Q426 PolarHBondContact O-N 3.18Å
424	L	85.4	Confident	83.4	Confident	18 Å²	18	68.2 Å²	68.2	9%	0.094	36%	0.363	C	S	.	.	H	α-helix	trans	-65.8	-21.8	-177.8	-67.5	174.8	0	0	0	113.4	K420 Q426 F447 L496 T497 R500	K420-L424 PolarHBondContact O-N 3.12Å; L424-Q426 VanDerWaalsContact C-N 3.32Å; L424-F447 HydrophobicContact CD1-CD1 4.49Å; L424-F447 HydrophobicContact CD1-CE1 3.99Å; L424-F447 HydrophobicContact CD2-CD1 3.86Å; L424-F447 HydrophobicContact CD2-CE1 4.19Å; L424-F447 HydrophobicContact CG-CE1 4.45Å; L424-L496 HydrophobicContact CD1-CB 3.84Å; L424-T497 WeakPolarHBondContact CD1-OG1 3.43Å; L424-T497 HydrophobicContact CD2-CG2 4.33Å; L424-R500 WeakPolarHBondContact O-CD 3.44Å
425	I	87.2	Confident	82.7	Confident	122 Å²	122	68.9 Å²	68.9	63%	0.626	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-11	-180	-64	166.7	0	0	0	112.2	E421 I423	E421-I425 WeakPolarHBondContact O-CD1 3.47Å; I423-I425 PolarHBondContact O-N 3.15Å
426	Q	85.3	Confident	82.2	Confident	106 Å²	106	67.8 Å²	67.8	50%	0.495	36%	0.363	S	S	.	.			trans	-87.1	153.3	-164.3	-58	-177	22.3	0	0	114.7	L422 I423 L424 R500	L422-Q426 VanDerWaalsContact O-CG 3.25Å; L422-Q426 WeakPolarHBondContact O-CG 3.47Å; L422-Q426 PolarHBondContact O-NE2 3.33Å; I423-Q426 WeakPolarHBondContact O-CB 3.13Å; I423-Q426 PolarHBondContact O-N 3.18Å; L424-Q426 VanDerWaalsContact C-N 3.32Å; Q426-R500 PolarHBondContact O-NH1 2.75Å
427	K	82.4	Confident	81.9	Confident	137 Å²	137	66.2 Å²	66.2	60%	0.596	36%	0.357	S	S	*	.			trans	-112.8	138	168.5	-79.4	-173.4	161.1	-154.4	0	110.6	Y429 E430	K427-Y429 WeakPolarHBondContact CE-OH 3.33Å; K427-Y429 HydrophobicContact CG-CE1 4.22Å; K427-E430 WeakPolarHBondContact CD-OE2 3.08Å; K427-E430 WeakPolarHBondContact CE-OE1 3.37Å; K427-E430 IonicContact NZ-OE1 2.72Å; K427-E430 PolarHBondContact NZ-OE1 3.18Å; K427-E430 IonicContact NZ-OE2 2.77Å; K427-E430 PolarHBondContact NZ-OE2 3.44Å
428	D	81.9	Confident	81.6	Confident	49 Å²	49	69.1 Å²	69.1	26%	0.262	37%	0.367	S	S	.	.			trans	-152.5	-46.5	-170.4	43.3	8.6	0	0	0	110.9	E430 T431 L440 R500	D428-E430 PolarHBondContact O-N 3.46Å; D428-E430 VanDerWaalsContact O-N 3.09Å; D428-T431 PolarHBondContact O-N 3.27Å; D428-T431 PolarHBondContact O-OG1 3.08Å; D428-L440 HydrophobicContact CB-CD1 3.92Å; D428-L440 WeakPolarHBondContact OD2-CD2 3.38Å; D428-R500 VanDerWaalsContact CG-NH1 3.31Å; D428-R500 IonicContact OD1-CZ 3.63Å; D428-R500 IonicContact OD1-NH1 2.84Å; D428-R500 PolarHBondContact OD1-NH1 3.42Å; D428-R500 IonicContact OD1-NH2 3.33Å; D428-R500 PolarHBondContact OD1-NH2 3.09Å; D428-R500 IonicContact OD2-CZ 3.39Å; D428-R500 IonicContact OD2-NH1 3.15Å; D428-R500 PolarHBondContact OD2-NH1 3.43Å; D428-R500 VanDerWaalsContact OD2-NH1 3.15Å; D428-R500 IonicContact OD2-NH2 3.56Å; D428-R500 PolarHBondContact OD2-NH2 3.35Å
429	Y	78.9	Confident	81.1	Confident	21 Å²	21	66.5 Å²	66.5	8%	0.082	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-58.3	-21.7	-178.5	63.9	-88.8	0	0	0	115.1	K427 T431 A432 A503 L504 A507	K427-Y429 WeakPolarHBondContact CE-OH 3.33Å; K427-Y429 HydrophobicContact CG-CE1 4.22Å; Y429-T431 PolarHBondContact O-N 2.87Å; Y429-A432 WeakPolarHBondContact O-CB 3.33Å; Y429-A432 PolarHBondContact O-N 2.64Å; Y429-A432 VanDerWaalsContact O-N 3.13Å; Y429-A503 HydrophobicContact CE1-CB 4.09Å; Y429-A503 HydrophobicContact CE2-CB 4.23Å; Y429-A503 WeakPolarHBondContact OH-CB 3.3Å; Y429-L504 HydrophobicContact CD1-CD2 3.5Å; Y429-L504 HydrophobicContact CD1-CG 4.16Å; Y429-L504 HydrophobicContact CE1-CD2 4.48Å; Y429-L504 HydrophobicContact CG-CD2 3.77Å; Y429-A507 HydrophobicContact CD2-CB 4.09Å
430	E	73.9	Confident	81.1	Confident	115 Å²	115	65.6 Å²	65.6	54%	0.537	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-72.9	4.9	-177.2	-58.7	-172	162.7	0	0	114.2	K427 D428	K427-E430 WeakPolarHBondContact CD-OE2 3.08Å; K427-E430 WeakPolarHBondContact CE-OE1 3.37Å; K427-E430 IonicContact NZ-OE1 2.72Å; K427-E430 PolarHBondContact NZ-OE1 3.18Å; K427-E430 IonicContact NZ-OE2 2.77Å; K427-E430 PolarHBondContact NZ-OE2 3.44Å; D428-E430 PolarHBondContact O-N 3.46Å; D428-E430 VanDerWaalsContact O-N 3.09Å
431	T	71.4	Confident	81	Confident	115 Å²	115	63.7 Å²	63.7	71%	0.706	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-131.8	7.1	169.7	61.5	0	0	0	0	113.7	D428 Y429 K592	D428-T431 PolarHBondContact O-N 3.27Å; D428-T431 PolarHBondContact O-OG1 3.08Å; Y429-T431 PolarHBondContact O-N 2.87Å; T431-K592 WeakPolarHBondContact O-CE 3.47Å; T431-K592 PolarHBondContact O-NZ 3.19Å
432	A	73.1	Confident	80.8	Confident	12 Å²	12	67.7 Å²	67.7	10%	0.099	34%	0.34	C	S	.	.			trans	-93.3	153.1	-160.2	0	0	0	0	0	114.4	Y429 E436 V437 L440	Y429-A432 WeakPolarHBondContact O-CB 3.33Å; Y429-A432 PolarHBondContact O-N 2.64Å; Y429-A432 VanDerWaalsContact O-N 3.13Å; A432-E436 VanDerWaalsContact CA-OE2 3.27Å; A432-E436 WeakPolarHBondContact CA-OE2 3.3Å; A432-E436 HydrophobicContact CB-CB 3.64Å; A432-V437 HydrophobicContact CB-CG2 3.63Å; A432-L440 HydrophobicContact CB-CD1 4.25Å
433	T	74.6	Confident	80.7	Confident	38 Å²	38	68.3 Å²	68.3	23%	0.233	34%	0.338	C	S	.	.			trans	-70.6	171.2	167.6	63.9	0	0	0	0	111.9	T435 E436 V437 K592	T433-T435 VanDerWaalsContact C-N 3.33Å; T433-T435 PolarHBondContact O-N 3.35Å; T433-T435 PolarHBondContact OG1-OG1 2.73Å; T433-E436 WeakPolarHBondContact CB-OE1 3.32Å; T433-E436 WeakPolarHBondContact CG2-OE1 3.42Å; T433-E436 PolarHBondContact N-OE2 3.09Å; T433-E436 CarbonylContact O-C 3.55Å; T433-E436 PolarHBondContact O-N 3.37Å; T433-E436 WeakPolarHBondContact OG1-CB 3.26Å; T433-E436 VanDerWaalsContact OG1-CG 3.3Å; T433-E436 WeakPolarHBondContact OG1-CG 3.41Å; T433-E436 PolarHBondContact OG1-N 2.87Å; T433-E436 VanDerWaalsContact OG1-N 3.09Å; T433-E436 PolarHBondContact OG1-OE1 3.03Å; T433-E436 PolarHBondContact OG1-OE2 3.15Å; T433-V437 WeakPolarHBondContact O-CB 3.49Å; T433-V437 VanDerWaalsContact O-CG2 3.29Å; T433-V437 WeakPolarHBondContact O-CG2 3.5Å; T433-V437 PolarHBondContact O-N 3.44Å; T433-K592 HydrophobicContact CG2-CD 4.19Å
434	L	76.4	Confident	80.9	Confident	17 Å²	17	64.2 Å²	64.2	9%	0.089	32%	0.317	C	S	.	.	H	α-helix	trans	-58.3	-44.5	175.9	-175	57.5	0	0	0	112.7	V437 R438 E508 L511 E512 D515	L434-V437 PolarHBondContact O-N 3.49Å; L434-R438 HydrophobicContact CD1-CG 4.18Å; L434-R438 WeakPolarHBondContact O-CB 3.22Å; L434-R438 PolarHBondContact O-N 2.92Å; L434-E508 HydrophobicContact CD1-CG 3.71Å; L434-L511 HydrophobicContact CB-CB 3.93Å; L434-L511 HydrophobicContact CD1-CB 3.86Å; L434-L511 HydrophobicContact CG-CB 4.37Å; L434-E512 HydrophobicContact CD1-CB 4.45Å; L434-D515 HydrophobicContact CD2-CB 3.26Å; L434-D515 WeakPolarHBondContact CD2-OD1 3.24Å
435	T	76	Confident	81	Confident	83 Å²	83	66.2 Å²	66.2	51%	0.509	33%	0.325	S	S	.	.	H	α-helix	trans	-70	-35.1	179	42.2	0	0	0	0	111.2	T433 A439	T433-T435 VanDerWaalsContact C-N 3.33Å; T433-T435 PolarHBondContact O-N 3.35Å; T433-T435 PolarHBondContact OG1-OG1 2.73Å; T435-A439 WeakPolarHBondContact O-CB 3.48Å; T435-A439 PolarHBondContact O-N 2.96Å
436	E	81.7	Confident	80.7	Confident	89 Å²	89	63.1 Å²	63.1	42%	0.416	32%	0.318	S	S	.	.	H	α-helix	trans	-64.1	-54.7	167.8	-72.9	141.5	-127.8	0	0	111.6	A432 T433 R438 A439 L440 K592	A432-E436 VanDerWaalsContact CA-OE2 3.27Å; A432-E436 WeakPolarHBondContact CA-OE2 3.3Å; A432-E436 HydrophobicContact CB-CB 3.64Å; T433-E436 WeakPolarHBondContact CB-OE1 3.32Å; T433-E436 WeakPolarHBondContact CG2-OE1 3.42Å; T433-E436 PolarHBondContact N-OE2 3.09Å; T433-E436 CarbonylContact O-C 3.55Å; T433-E436 PolarHBondContact O-N 3.37Å; T433-E436 WeakPolarHBondContact OG1-CB 3.26Å; T433-E436 VanDerWaalsContact OG1-CG 3.3Å; T433-E436 WeakPolarHBondContact OG1-CG 3.41Å; T433-E436 PolarHBondContact OG1-N 2.87Å; T433-E436 VanDerWaalsContact OG1-N 3.09Å; T433-E436 PolarHBondContact OG1-OE1 3.03Å; T433-E436 PolarHBondContact OG1-OE2 3.15Å; E436-R438 PolarHBondContact O-N 3.1Å; E436-A439 CarbonylContact O-C 3.39Å; E436-A439 PolarHBondContact O-N 2.92Å; E436-A439 VanDerWaalsContact O-N 3.1Å; E436-L440 WeakPolarHBondContact O-CB 3.38Å; E436-L440 VanDerWaalsContact O-CG 3.23Å; E436-L440 WeakPolarHBondContact O-CG 3.44Å; E436-L440 PolarHBondContact O-N 3.44Å; E436-K592 IonicContact OE2-NZ 2.65Å
437	V	83.3	Confident	80.9	Confident	1 Å²	1	59 Å²	59	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-54.2	-55	-179.5	169.2	0	0	0	0	111.1	A432 T433 L434 A439 L440 L441 A507 E508 L511	A432-V437 HydrophobicContact CB-CG2 3.63Å; T433-V437 WeakPolarHBondContact O-CB 3.49Å; T433-V437 VanDerWaalsContact O-CG2 3.29Å; T433-V437 WeakPolarHBondContact O-CG2 3.5Å; T433-V437 PolarHBondContact O-N 3.44Å; L434-V437 PolarHBondContact O-N 3.49Å; V437-A439 VanDerWaalsContact C-N 3.31Å; V437-A439 PolarHBondContact O-N 3.43Å; V437-L440 PolarHBondContact O-N 3.05Å; V437-L441 WeakPolarHBondContact O-CB 3.27Å; V437-L441 PolarHBondContact O-N 3.36Å; V437-A507 HydrophobicContact CG1-CB 4.13Å; V437-A507 HydrophobicContact CG2-CB 4.48Å; V437-E508 HydrophobicContact CG1-CB 4.33Å; V437-L511 HydrophobicContact CG2-CD1 4.03Å
438	R	82.7	Confident	81.2	Confident	67 Å²	67	54.3 Å²	54.3	25%	0.253	28%	0.279	S	S	.	.	H	α-helix	trans	-61	-37.9	177.1	-77.6	178.4	172.9	155.7	4.5	112	L434 E436 L440 L441 R442 E508 E512 D515	L434-R438 HydrophobicContact CD1-CG 4.18Å; L434-R438 WeakPolarHBondContact O-CB 3.22Å; L434-R438 PolarHBondContact O-N 2.92Å; E436-R438 PolarHBondContact O-N 3.1Å; R438-L440 VanDerWaalsContact C-N 3.32Å; R438-L441 WeakPolarHBondContact O-CB 3.29Å; R438-L441 PolarHBondContact O-N 3.38Å; R438-R442 WeakPolarHBondContact O-CB 3.34Å; R438-R442 PolarHBondContact O-N 3.36Å; R438-E508 HydrophobicContact CG-CG 3.9Å; R438-E508 WeakPolarHBondContact CG-OE2 3.28Å; R438-E508 IonicContact CZ-OE1 3.57Å; R438-E508 IonicContact NE-OE1 3.02Å; R438-E508 PolarHBondContact NE-OE1 3.46Å; R438-E508 IonicContact NE-OE2 3.43Å; R438-E508 IonicContact NH2-OE1 3.99Å; R438-E508 PolarHBondContact NH2-OE1 2.99Å; R438-E508 VanDerWaalsContact NH2-OE1 3.1Å; R438-E512 IonicContact NH2-OE1 2.76Å; R438-E512 PolarHBondContact NH2-OE1 3.23Å; R438-D515 IonicContact CZ-OD1 2.79Å; R438-D515 IonicContact NH1-OD1 3.84Å; R438-D515 PolarHBondContact NH1-OD1 3.27Å; R438-D515 IonicContact NH2-OD1 2.64Å; R438-D515 PolarHBondContact NH2-OD1 3.44Å
439	A	80.5	Confident	81.3	Confident	37 Å²	37	55.4 Å²	55.4	31%	0.306	29%	0.29	S	S	.	.	H	α-helix	trans	-77.3	-13.6	175.7	0	0	0	0	0	113.6	T435 E436 V437 K443	T435-A439 WeakPolarHBondContact O-CB 3.48Å; T435-A439 PolarHBondContact O-N 2.96Å; E436-A439 CarbonylContact O-C 3.39Å; E436-A439 PolarHBondContact O-N 2.92Å; E436-A439 VanDerWaalsContact O-N 3.1Å; V437-A439 VanDerWaalsContact C-N 3.31Å; V437-A439 PolarHBondContact O-N 3.43Å; A439-K443 VanDerWaalsContact O-CB 3.27Å; A439-K443 WeakPolarHBondContact O-CB 3.34Å; A439-K443 WeakPolarHBondContact O-CD 3.25Å; A439-K443 WeakPolarHBondContact O-CE 3.34Å; A439-K443 WeakPolarHBondContact O-CG 3.42Å; A439-K443 PolarHBondContact O-N 2.84Å
440	L	84.4	Confident	81.7	Confident	24 Å²	24	56.4 Å²	56.4	13%	0.126	30%	0.297	C	S	.	.	H	α-helix	trans	-84.1	-43.3	168	-68.7	171	0	0	0	109.7	D428 A432 E436 V437 R438 R442 K443 H444 L504	D428-L440 HydrophobicContact CB-CD1 3.92Å; D428-L440 WeakPolarHBondContact OD2-CD2 3.38Å; A432-L440 HydrophobicContact CB-CD1 4.25Å; E436-L440 WeakPolarHBondContact O-CB 3.38Å; E436-L440 VanDerWaalsContact O-CG 3.23Å; E436-L440 WeakPolarHBondContact O-CG 3.44Å; E436-L440 PolarHBondContact O-N 3.44Å; V437-L440 PolarHBondContact O-N 3.05Å; R438-L440 VanDerWaalsContact C-N 3.32Å; L440-R442 VanDerWaalsContact C-N 3.26Å; L440-R442 PolarHBondContact O-N 3.35Å; L440-K443 HydrophobicContact CD2-CD 4.37Å; L440-K443 PolarHBondContact O-N 3.02Å; L440-H444 WeakPolarHBondContact O-CB 3.35Å; L440-H444 PolarHBondContact O-N 3.38Å; L440-L504 HydrophobicContact CB-CD2 3.77Å
441	L	85.1	Confident	82.4	Confident	9 Å²	9	52.2 Å²	52.2	5%	0.047	28%	0.278	C	S	.	.	H	α-helix	trans	-53	-43.5	166.9	-157.9	174.6	0	0	0	110.6	V437 R438 H444 E445 L504 E505 E508	V437-L441 WeakPolarHBondContact O-CB 3.27Å; V437-L441 PolarHBondContact O-N 3.36Å; R438-L441 WeakPolarHBondContact O-CB 3.29Å; R438-L441 PolarHBondContact O-N 3.38Å; L441-H444 CarbonylContact O-C 3.22Å; L441-H444 WeakPolarHBondContact O-CB 3.48Å; L441-H444 PolarHBondContact O-N 3.34Å; L441-E445 PolarHBondContact O-N 3.44Å; L441-L504 HydrophobicContact CB-CB 4.05Å; L441-L504 HydrophobicContact CG-CB 3.99Å; L441-E505 HydrophobicContact CD1-CB 4.49Å; L441-E505 HydrophobicContact CD1-CG 3.95Å; L441-E505 HydrophobicContact CG-CG 4.29Å; L441-E508 WeakPolarHBondContact CD1-OE2 3.41Å
442	R	82.4	Confident	83.2	Confident	151 Å²	151	49.8 Å²	49.8	57%	0.57	27%	0.27	S	S	*	.	H	α-helix	trans	-91.5	-12.9	179.6	-66.3	-154.3	139.4	89.5	23.4	116.6	R438 L440 H444 E445 A446	R438-R442 WeakPolarHBondContact O-CB 3.34Å; R438-R442 PolarHBondContact O-N 3.36Å; L440-R442 VanDerWaalsContact C-N 3.26Å; L440-R442 PolarHBondContact O-N 3.35Å; R442-H444 VanDerWaalsContact C-N 3.29Å; R442-E445 IonicContact CZ-OE2 2.87Å; R442-E445 IonicContact NE-OE2 3.21Å; R442-E445 PolarHBondContact NE-OE2 3.02Å; R442-E445 IonicContact NH2-OE1 2.83Å; R442-E445 PolarHBondContact NH2-OE1 3.05Å; R442-E445 IonicContact NH2-OE2 3.57Å; R442-E445 PolarHBondContact NH2-OE2 3.3Å; R442-A446 WeakPolarHBondContact O-CB 3.45Å; R442-A446 PolarHBondContact O-N 3.22Å
443	K	84.6	Confident	83.8	Confident	133 Å²	133	52.4 Å²	52.4	58%	0.578	29%	0.292	S	S	*	.	H	α-helix	trans	-71.7	-30	156.6	-76.8	158.6	-152.9	158.5	0	111.1	A439 L440 F447	A439-K443 VanDerWaalsContact O-CB 3.27Å; A439-K443 WeakPolarHBondContact O-CB 3.34Å; A439-K443 WeakPolarHBondContact O-CD 3.25Å; A439-K443 WeakPolarHBondContact O-CE 3.34Å; A439-K443 WeakPolarHBondContact O-CG 3.42Å; A439-K443 PolarHBondContact O-N 2.84Å; L440-K443 HydrophobicContact CD2-CD 4.37Å; L440-K443 PolarHBondContact O-N 3.02Å; K443-F447 PolarHBondContact O-N 3.1Å; K443-F447 VanDerWaalsContact O-N 3.08Å
444	H	88.4	Confident	84.4	Confident	4 Å²	4	51.5 Å²	51.5	2%	0.019	29%	0.285	C	S	.	.	H	α-helix	trans	-76.7	-45.9	176.1	-177.9	82.6	0	0	0	112.1	L440 L441 R442 A446 F447 E448 T497 R501 L504	L440-H444 WeakPolarHBondContact O-CB 3.35Å; L440-H444 PolarHBondContact O-N 3.38Å; L441-H444 CarbonylContact O-C 3.22Å; L441-H444 WeakPolarHBondContact O-CB 3.48Å; L441-H444 PolarHBondContact O-N 3.34Å; R442-H444 VanDerWaalsContact C-N 3.29Å; H444-A446 VanDerWaalsContact C-N 3.31Å; H444-A446 PolarHBondContact O-N 3.49Å; H444-F447 CarbonylContact O-C 3.53Å; H444-F447 WeakPolarHBondContact O-CA 3.46Å; H444-F447 WeakPolarHBondContact O-CB 3.42Å; H444-F447 PolarHBondContact O-N 3.08Å; H444-E448 IonicContact CD2-OE1 2.84Å; H444-E448 PolarHBondContact CD2-OE1 3.23Å; H444-E448 VanDerWaalsContact CD2-OE1 3.23Å; H444-E448 IonicContact NE2-OE1 2.74Å; H444-E448 PolarHBondContact NE2-OE1 3.37Å; H444-E448 PolarHBondContact O-N 3.27Å; H444-T497 VanDerWaalsContact CE1-CG2 3.44Å; H444-T497 WeakPolarHBondContact CE1-CG2 3.44Å; H444-T497 PolarHBondContact CE1-O 3.06Å; H444-T497 PolarHBondContact NE2-O 3.4Å; H444-R501 PolarHBondContact NE2-N 3.5Å; H444-L504 HydrophobicContact CB-CD1 3.5Å
445	E	87.8	Confident	85.1	Confident	60 Å²	60	54.2 Å²	54.2	28%	0.28	30%	0.297	S	S	.	.	H	α-helix	trans	-64	-36.6	170.5	-176.7	171.2	-122.5	0	0	111.5	L441 R442 F447 E448 S449 R501	L441-E445 PolarHBondContact O-N 3.44Å; R442-E445 IonicContact CZ-OE2 2.87Å; R442-E445 IonicContact NE-OE2 3.21Å; R442-E445 PolarHBondContact NE-OE2 3.02Å; R442-E445 IonicContact NH2-OE1 2.83Å; R442-E445 PolarHBondContact NH2-OE1 3.05Å; R442-E445 IonicContact NH2-OE2 3.57Å; R442-E445 PolarHBondContact NH2-OE2 3.3Å; E445-F447 PolarHBondContact O-N 2.63Å; E445-E448 WeakPolarHBondContact CA-OE2 3.38Å; E445-E448 CarbonylContact O-C 3.58Å; E445-E448 WeakPolarHBondContact O-CB 3.42Å; E445-E448 PolarHBondContact O-N 2.84Å; E445-S449 WeakPolarHBondContact O-CB 3.46Å; E445-S449 PolarHBondContact O-N 3.21Å; E445-R501 VanDerWaalsContact CD-NH2 3.34Å; E445-R501 IonicContact OE1-CZ 3.21Å; E445-R501 IonicContact OE1-NH2 2.68Å; E445-R501 PolarHBondContact OE1-NH2 3.32Å
446	A	80.5	Confident	85.7	Confident	57 Å²	57	54.4 Å²	54.4	47%	0.471	30%	0.295	S	S	.	.	H	α-helix	trans	-64.7	-20.6	168.5	0	0	0	0	0	112.8	R442 H444 D450	R442-A446 WeakPolarHBondContact O-CB 3.45Å; R442-A446 PolarHBondContact O-N 3.22Å; H444-A446 VanDerWaalsContact C-N 3.31Å; H444-A446 PolarHBondContact O-N 3.49Å; A446-D450 VanDerWaalsContact O-CB 3.26Å; A446-D450 WeakPolarHBondContact O-CB 3.41Å; A446-D450 PolarHBondContact O-N 3.48Å
447	F	88.4	Confident	86.1	Confident	20 Å²	20	54.5 Å²	54.5	9%	0.088	29%	0.291	C	S	.	.	H	α-helix	trans	-84.9	-34.4	168.6	-171	-98.7	0	0	0	113	W416 K420 L424 K443 H444 E445 S449 D450 L451 T497	W416-F447 HydrophobicContact CH2-CE2 4.32Å; W416-F447 HydrophobicContact CH2-CZ 4.27Å; W416-F447 AromaticContact CZ2-CE2 3.8Å; W416-F447 HydrophobicContact CZ2-CE2 3.8Å; W416-F447 HydrophobicContact CZ2-CZ 4.2Å; K420-F447 HydrophobicContact CB-CE2 4.27Å; K420-F447 HydrophobicContact CB-CZ 4.07Å; K420-F447 HydrophobicContact CD-CD2 4.4Å; K420-F447 HydrophobicContact CD-CE2 3.73Å; K420-F447 HydrophobicContact CD-CZ 4.4Å; K420-F447 HydrophobicContact CG-CE2 4.08Å; K420-F447 HydrophobicContact CG-CZ 4.32Å; L424-F447 HydrophobicContact CD1-CD1 4.49Å; L424-F447 HydrophobicContact CD1-CE1 3.99Å; L424-F447 HydrophobicContact CD2-CD1 3.86Å; L424-F447 HydrophobicContact CD2-CE1 4.19Å; L424-F447 HydrophobicContact CG-CE1 4.45Å; K443-F447 PolarHBondContact O-N 3.1Å; K443-F447 VanDerWaalsContact O-N 3.08Å; H444-F447 CarbonylContact O-C 3.53Å; H444-F447 WeakPolarHBondContact O-CA 3.46Å; H444-F447 WeakPolarHBondContact O-CB 3.42Å; H444-F447 PolarHBondContact O-N 3.08Å; E445-F447 PolarHBondContact O-N 2.63Å; F447-S449 PolarHBondContact O-N 3.46Å; F447-D450 HydrophobicContact CD2-CB 3.7Å; F447-D450 VanDerWaalsContact CD2-OD2 3.23Å; F447-D450 WeakPolarHBondContact CD2-OD2 3.26Å; F447-D450 HydrophobicContact CE2-CB 4.15Å; F447-D450 WeakPolarHBondContact CE2-OD2 3.46Å; F447-D450 HydrophobicContact CG-CB 4.38Å; F447-D450 PolarHBondContact O-N 2.92Å; F447-L451 VanDerWaalsContact O-CB 3.26Å; F447-L451 WeakPolarHBondContact O-CB 3.14Å; F447-L451 PolarHBondContact O-N 3.27Å; F447-T497 HydrophobicContact CD1-CG2 4.04Å; F447-T497 WeakPolarHBondContact CE1-OG1 3.42Å
448	E	88.8	Confident	86.5	Confident	39 Å²	39	54.9 Å²	54.9	18%	0.182	29%	0.294	C	S	.	.	H	α-helix	trans	-57.3	-34.4	165.9	-67.1	166.2	169.7	0	0	110.4	H444 E445 A452 T497 R501	H444-E448 IonicContact CD2-OE1 2.84Å; H444-E448 PolarHBondContact CD2-OE1 3.23Å; H444-E448 VanDerWaalsContact CD2-OE1 3.23Å; H444-E448 IonicContact NE2-OE1 2.74Å; H444-E448 PolarHBondContact NE2-OE1 3.37Å; H444-E448 PolarHBondContact O-N 3.27Å; E445-E448 WeakPolarHBondContact CA-OE2 3.38Å; E445-E448 CarbonylContact O-C 3.58Å; E445-E448 WeakPolarHBondContact O-CB 3.42Å; E445-E448 PolarHBondContact O-N 2.84Å; E448-A452 WeakPolarHBondContact O-CB 3.48Å; E448-A452 PolarHBondContact O-N 3.29Å; E448-T497 HydrophobicContact CB-CG2 4.41Å; E448-T497 HydrophobicContact CG-CG2 3.31Å; E448-R501 WeakPolarHBondContact OE1-CB 3.31Å; E448-R501 IonicContact OE1-NE 2.86Å; E448-R501 PolarHBondContact OE1-NE 3.31Å; E448-R501 VanDerWaalsContact OE1-NE 3.14Å; E448-R501 IonicContact OE2-CZ 3.23Å; E448-R501 IonicContact OE2-NE 3.77Å; E448-R501 PolarHBondContact OE2-NE 3.17Å; E448-R501 IonicContact OE2-NH2 2.72Å; E448-R501 PolarHBondContact OE2-NH2 3.04Å
449	S	85.2	Confident	86.9	Confident	71 Å²	71	56.7 Å²	56.7	50%	0.497	31%	0.305	S	S	.	.	H	α-helix	trans	-83.8	-32.6	172.5	-165.9	0	0	0	0	114.5	E445 F447 L451 A452 A453	E445-S449 WeakPolarHBondContact O-CB 3.46Å; E445-S449 PolarHBondContact O-N 3.21Å; F447-S449 PolarHBondContact O-N 3.46Å; S449-L451 VanDerWaalsContact C-N 3.3Å; S449-A452 PolarHBondContact O-N 3.13Å; S449-A453 VanDerWaalsContact O-CB 3.29Å; S449-A453 WeakPolarHBondContact O-CB 3.41Å; S449-A453 PolarHBondContact O-N 3.46Å
450	D	86.1	Confident	87.5	Confident	42 Å²	42	58 Å²	58	23%	0.225	31%	0.305	C	S	.	.	H	α-helix	trans	-56.5	-48.6	170.8	-166.1	21.1	0	0	0	108	W416 K420 A446 F447 H454	W416-D450 HydrophobicContact CZ2-CB 4.31Å; W416-D450 PolarHBondContact NE1-OD1 2.86Å; W416-D450 PolarHBondContact NE1-OD2 3.26Å; K420-D450 IonicContact NZ-OD2 2.83Å; K420-D450 PolarHBondContact NZ-OD2 3.05Å; A446-D450 VanDerWaalsContact O-CB 3.26Å; A446-D450 WeakPolarHBondContact O-CB 3.41Å; A446-D450 PolarHBondContact O-N 3.48Å; F447-D450 HydrophobicContact CD2-CB 3.7Å; F447-D450 VanDerWaalsContact CD2-OD2 3.23Å; F447-D450 WeakPolarHBondContact CD2-OD2 3.26Å; F447-D450 HydrophobicContact CE2-CB 4.15Å; F447-D450 WeakPolarHBondContact CE2-OD2 3.46Å; F447-D450 HydrophobicContact CG-CB 4.38Å; F447-D450 PolarHBondContact O-N 2.92Å; D450-H454 VanDerWaalsContact O-CB 3.27Å; D450-H454 WeakPolarHBondContact O-CB 3.35Å; D450-H454 PolarHBondContact O-CD2 2.92Å; D450-H454 PolarHBondContact O-N 3.35Å; D450-H454 IonicContact OD1-CD2 2.72Å; D450-H454 IonicContact OD1-NE2 3.34Å
451	L	88.8	Confident	87.9	Confident	27 Å²	27	56.9 Å²	56.9	14%	0.141	30%	0.299	C	S	.	.	H	α-helix	trans	-57.8	-59.1	166.6	-169.9	82.7	0	0	0	110.9	W416 F447 S449 A453 H454 Q455 W490 L493	W416-L451 HydrophobicContact CH2-CD1 4.47Å; F447-L451 VanDerWaalsContact O-CB 3.26Å; F447-L451 WeakPolarHBondContact O-CB 3.14Å; F447-L451 PolarHBondContact O-N 3.27Å; S449-L451 VanDerWaalsContact C-N 3.3Å; L451-A453 PolarHBondContact O-N 3.23Å; L451-H454 PolarHBondContact O-N 2.85Å; L451-Q455 PolarHBondContact O-N 3.23Å; L451-Q455 VanDerWaalsContact O-N 3.09Å; L451-W490 HydrophobicContact CB-CH2 4.34Å; L451-W490 HydrophobicContact CD1-CD2 4.08Å; L451-W490 HydrophobicContact CD1-CE3 4Å; L451-W490 HydrophobicContact CD1-CH2 3.58Å; L451-W490 HydrophobicContact CD1-CZ2 3.63Å; L451-W490 HydrophobicContact CD1-CZ3 3.76Å; L451-W490 HydrophobicContact CG-CH2 3.88Å; L451-W490 HydrophobicContact CG-CZ2 3.71Å; L451-W490 WeakPolarHBondContact O-CH2 3.41Å; L451-W490 WeakPolarHBondContact O-CZ2 3.37Å; L451-L493 HydrophobicContact CD1-CB 4.08Å
452	A	88.3	Confident	88.3	Confident	65 Å²	65	58.2 Å²	58.2	54%	0.537	31%	0.311	S	S	.	.	H	α-helix	trans	-57.9	-35.1	-174.9	0	0	0	0	0	113.7	E448 S449 Q455	E448-A452 WeakPolarHBondContact O-CB 3.48Å; E448-A452 PolarHBondContact O-N 3.29Å; S449-A452 PolarHBondContact O-N 3.13Å; A452-Q455 WeakPolarHBondContact O-CB 3.45Å; A452-Q455 PolarHBondContact O-N 3.3Å
453	A	85.8	Confident	88.8	Confident	67 Å²	67	53.7 Å²	53.7	55%	0.554	31%	0.306	S	S	*	.	H	α-helix	trans	-76.9	-30.9	177.8	0	0	0	0	0	113.3	S449 L451 Q455	S449-A453 VanDerWaalsContact O-CB 3.29Å; S449-A453 WeakPolarHBondContact O-CB 3.41Å; S449-A453 PolarHBondContact O-N 3.46Å; L451-A453 PolarHBondContact O-N 3.23Å; A453-Q455 PolarHBondContact O-N 2.96Å
454	H	88.3	Confident	89.2	Confident	18 Å²	18	47.9 Å²	47.9	8%	0.083	28%	0.281	C	S	.	.	H	α-helix	trans	-77.3	-8.4	174.3	-81	-125.4	0	0	0	112.6	W416 D450 L451 R457 V458 W490	W416-H454 AromaticContact CD1-CE1 3.27Å; W416-H454 AromaticContact CD1-ND1 3.93Å; W416-H454 AromaticContact CD1-NE2 3.82Å; W416-H454 AromaticContact CD2-CE1 3.56Å; W416-H454 AromaticContact CD2-ND1 3.38Å; W416-H454 AromaticContact CE2-CE1 3.61Å; W416-H454 AromaticContact CE2-CG 3.91Å; W416-H454 AromaticContact CE2-ND1 3.55Å; W416-H454 AromaticContact CE3-ND1 3.77Å; W416-H454 AromaticContact CG-CE1 3.36Å; W416-H454 AromaticContact CG-ND1 3.67Å; W416-H454 HydrophobicContact CH2-CB 4.23Å; W416-H454 HydrophobicContact CZ2-CB 4.25Å; W416-H454 HydrophobicContact CZ3-CB 4.5Å; W416-H454 AromaticContact NE1-CE1 3.38Å; W416-H454 PolarHBondContact NE1-CE1 3.2Å; W416-H454 AromaticContact NE1-ND1 3.81Å; W416-H454 AromaticContact NE1-NE2 3.61Å; D450-H454 VanDerWaalsContact O-CB 3.27Å; D450-H454 WeakPolarHBondContact O-CB 3.35Å; D450-H454 PolarHBondContact O-CD2 2.92Å; D450-H454 PolarHBondContact O-N 3.35Å; D450-H454 IonicContact OD1-CD2 2.72Å; D450-H454 IonicContact OD1-NE2 3.34Å; L451-H454 PolarHBondContact O-N 2.85Å; H454-R457 PolarHBondContact CE1-NH1 3.15Å; H454-R457 WeakPolarHBondContact O-CB 3.27Å; H454-R457 PolarHBondContact O-N 3.2Å; H454-R457 VanDerWaalsContact O-N 3.16Å; H454-V458 WeakPolarHBondContact O-CG2 3.47Å; H454-V458 PolarHBondContact O-N 3.05Å; H454-W490 HydrophobicContact CB-CH2 3.42Å; H454-W490 VanDerWaalsContact CB-CH2 3.42Å; H454-W490 HydrophobicContact CB-CZ3 3.64Å
455	Q	90.8	Very high	89.3	Confident	74 Å²	74	47.8 Å²	47.8	35%	0.346	28%	0.281	S	S	.	.	H	α-helix	trans	-54.9	-56.1	172.5	-178.6	65	26.9	0	0	111.6	L451 A452 A453 R457 V458 E459 W490	L451-Q455 PolarHBondContact O-N 3.23Å; L451-Q455 VanDerWaalsContact O-N 3.09Å; A452-Q455 WeakPolarHBondContact O-CB 3.45Å; A452-Q455 PolarHBondContact O-N 3.3Å; A453-Q455 PolarHBondContact O-N 2.96Å; Q455-R457 PolarHBondContact O-N 2.83Å; Q455-V458 PolarHBondContact O-N 3.02Å; Q455-E459 WeakPolarHBondContact CG-OE1 3.43Å; Q455-E459 PolarHBondContact NE2-OE1 3.18Å; Q455-E459 WeakPolarHBondContact O-CG 3.14Å; Q455-E459 PolarHBondContact O-N 3.37Å; Q455-W490 HydrophobicContact CB-CZ2 4.04Å
456	D	88.3	Confident	89.5	Confident	87 Å²	87	50.6 Å²	50.6	47%	0.465	29%	0.294	S	S	.	.	H	α-helix	trans	-60	-31.9	178.2	173.6	44	0	0	0	111.3	E459 Q460	D456-E459 PolarHBondContact O-N 3.37Å; D456-Q460 VanDerWaalsContact O-CB 3.3Å; D456-Q460 WeakPolarHBondContact O-CB 3.44Å; D456-Q460 WeakPolarHBondContact O-CG 3.43Å; D456-Q460 PolarHBondContact O-N 2.83Å; D456-Q460 PolarHBondContact OD1-NE2 3.26Å; D456-Q460 PolarHBondContact OD2-NE2 3.02Å
457	R	89.3	Confident	90.1	Very high	91 Å²	91	50.2 Å²	50.2	34%	0.343	28%	0.283	S	S	.	.	H	α-helix	trans	-66.2	-41.6	174.8	-172.5	176.4	-61	174.9	7.5	112.2	H454 Q455 I461	H454-R457 PolarHBondContact CE1-NH1 3.15Å; H454-R457 WeakPolarHBondContact O-CB 3.27Å; H454-R457 PolarHBondContact O-N 3.2Å; H454-R457 VanDerWaalsContact O-N 3.16Å; Q455-R457 PolarHBondContact O-N 2.83Å; R457-I461 HydrophobicContact CG-CD1 4.18Å; R457-I461 WeakPolarHBondContact O-CD1 3.38Å; R457-I461 WeakPolarHBondContact O-CG1 3.36Å; R457-I461 PolarHBondContact O-N 3.01Å
458	V	92.8	Very high	90.3	Very high	10 Å²	10	49.3 Å²	49.3	6%	0.061	28%	0.279	C	S	.	.	H	α-helix	trans	-66.8	-43.5	176.3	176.6	0	0	0	0	110.1	H413 H454 Q455 Q460 I461 A462 I486 W490	H413-V458 WeakPolarHBondContact CE1-CG2 3.4Å; H454-V458 WeakPolarHBondContact O-CG2 3.47Å; H454-V458 PolarHBondContact O-N 3.05Å; Q455-V458 PolarHBondContact O-N 3.02Å; V458-Q460 PolarHBondContact O-N 3.45Å; V458-I461 PolarHBondContact O-N 3.01Å; V458-A462 PolarHBondContact O-N 3.3Å; V458-I486 HydrophobicContact CG1-CG2 4.4Å; V458-I486 HydrophobicContact CG2-CG2 4.42Å; V458-W490 HydrophobicContact CG2-CD2 4.04Å; V458-W490 HydrophobicContact CG2-CE3 3.86Å; V458-W490 HydrophobicContact CG2-CG 4.46Å; V458-W490 HydrophobicContact CG2-CZ3 4.17Å
459	E	91.4	Very high	90.4	Very high	105 Å²	105	51 Å²	51	49%	0.491	29%	0.29	S	S	.	.	H	α-helix	trans	-60.6	-42.8	175.4	-69.6	174	-170.8	0	0	111.8	Q455 D456 A462 A463	Q455-E459 WeakPolarHBondContact CG-OE1 3.43Å; Q455-E459 PolarHBondContact NE2-OE1 3.18Å; Q455-E459 WeakPolarHBondContact O-CG 3.14Å; Q455-E459 PolarHBondContact O-N 3.37Å; D456-E459 PolarHBondContact O-N 3.37Å; E459-A462 PolarHBondContact O-N 3.45Å; E459-A463 WeakPolarHBondContact O-CB 3.29Å; E459-A463 PolarHBondContact O-N 2.99Å
460	Q	92.5	Very high	90.6	Very high	64 Å²	64	53.9 Å²	53.9	30%	0.299	30%	0.295	S	S	.	.	H	α-helix	trans	-64.6	-38.7	174.4	-76	171.9	25.8	0	0	112.9	D456 V458 A462 A463 I464	D456-Q460 VanDerWaalsContact O-CB 3.3Å; D456-Q460 WeakPolarHBondContact O-CB 3.44Å; D456-Q460 WeakPolarHBondContact O-CG 3.43Å; D456-Q460 PolarHBondContact O-N 2.83Å; D456-Q460 PolarHBondContact OD1-NE2 3.26Å; D456-Q460 PolarHBondContact OD2-NE2 3.02Å; V458-Q460 PolarHBondContact O-N 3.45Å; Q460-A462 VanDerWaalsContact C-N 3.31Å; Q460-A463 PolarHBondContact O-N 3.11Å; Q460-I464 WeakPolarHBondContact O-CB 3.46Å; Q460-I464 WeakPolarHBondContact O-CD1 3.5Å; Q460-I464 WeakPolarHBondContact O-CG1 3.49Å; Q460-I464 PolarHBondContact O-N 3.44Å
461	I	93.4	Very high	90.7	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-62.2	-43.9	176.1	-72.1	162.5	0	0	0	109.6	F406 K409 H413 R457 V458 A465 I486	F406-I461 HydrophobicContact CD2-CG2 4.14Å; F406-I461 HydrophobicContact CE2-CG2 3.65Å; K409-I461 HydrophobicContact CB-CD1 4.15Å; K409-I461 HydrophobicContact CB-CG1 3.71Å; H413-I461 HydrophobicContact CB-CD1 3.77Å; R457-I461 HydrophobicContact CG-CD1 4.18Å; R457-I461 WeakPolarHBondContact O-CD1 3.38Å; R457-I461 WeakPolarHBondContact O-CG1 3.36Å; R457-I461 PolarHBondContact O-N 3.01Å; V458-I461 PolarHBondContact O-N 3.01Å; I461-A465 WeakPolarHBondContact O-CB 3.45Å; I461-A465 PolarHBondContact O-N 3.39Å; I461-A465 VanDerWaalsContact O-N 3.07Å; I461-I486 HydrophobicContact CG2-CD1 4.4Å
462	A	92.7	Very high	90.6	Very high	37 Å²	37	59.3 Å²	59.3	31%	0.306	32%	0.324	S	S	.	.	H	α-helix	trans	-65.5	-43.1	175.6	0	0	0	0	0	112.6	V458 E459 Q460 A465 Q466 C483	V458-A462 PolarHBondContact O-N 3.3Å; E459-A462 PolarHBondContact O-N 3.45Å; Q460-A462 VanDerWaalsContact C-N 3.31Å; A462-A465 PolarHBondContact O-N 3.15Å; A462-Q466 PolarHBondContact O-N 3.41Å; A462-C483 VanDerWaalsContact CA-SG 3.58Å
463	A	92.4	Very high	90.6	Very high	55 Å²	55	57.3 Å²	57.3	46%	0.455	30%	0.302	S	S	.	.	H	α-helix	trans	-64	-42.3	177.9	0	0	0	0	0	112.3	E459 Q460 A465 Q466 E467	E459-A463 WeakPolarHBondContact O-CB 3.29Å; E459-A463 PolarHBondContact O-N 2.99Å; Q460-A463 PolarHBondContact O-N 3.11Å; A463-A465 VanDerWaalsContact C-N 3.35Å; A463-Q466 PolarHBondContact O-N 2.97Å; A463-E467 WeakPolarHBondContact O-CB 3.42Å; A463-E467 PolarHBondContact O-N 3.21Å
464	I	92.8	Very high	90.6	Very high	11 Å²	11	61.2 Å²	61.2	6%	0.056	31%	0.309	C	S	.	.	H	α-helix	trans	-65.1	-39.8	176	-67.1	163.9	0	0	0	110.7	L402 K405 F406 K409 Q460 Q466 E467 L468	L402-I464 HydrophobicContact CB-CG2 4.44Å; L402-I464 HydrophobicContact CD2-CG2 4.35Å; K405-I464 HydrophobicContact CD-CD1 3.99Å; K405-I464 HydrophobicContact CG-CD1 4.07Å; F406-I464 HydrophobicContact CB-CG2 3.88Å; K409-I464 HydrophobicContact CD-CD1 3.7Å; Q460-I464 WeakPolarHBondContact O-CB 3.46Å; Q460-I464 WeakPolarHBondContact O-CD1 3.5Å; Q460-I464 WeakPolarHBondContact O-CG1 3.49Å; Q460-I464 PolarHBondContact O-N 3.44Å; I464-Q466 VanDerWaalsContact C-N 3.31Å; I464-Q466 PolarHBondContact O-N 3.1Å; I464-E467 PolarHBondContact O-N 2.96Å; I464-L468 HydrophobicContact CG2-CD1 4.17Å; I464-L468 WeakPolarHBondContact O-CB 3.23Å; I464-L468 WeakPolarHBondContact O-CG 3.49Å; I464-L468 PolarHBondContact O-N 3.45Å
465	A	92.1	Very high	90.6	Very high	3 Å²	3	63.9 Å²	63.9	3%	0.025	32%	0.324	C	S	.	.	H	α-helix	trans	-61.8	-40.8	175	0	0	0	0	0	111.7	F406 I461 A462 A463 L468 N469 V479 C483	F406-A465 HydrophobicContact CD2-CB 4.19Å; F406-A465 HydrophobicContact CE2-CB 3.84Å; I461-A465 WeakPolarHBondContact O-CB 3.45Å; I461-A465 PolarHBondContact O-N 3.39Å; I461-A465 VanDerWaalsContact O-N 3.07Å; A462-A465 PolarHBondContact O-N 3.15Å; A463-A465 VanDerWaalsContact C-N 3.35Å; A465-L468 PolarHBondContact O-N 3.02Å; A465-N469 PolarHBondContact O-N 3.14Å; A465-N469 VanDerWaalsContact O-N 3.11Å; A465-V479 HydrophobicContact CB-CG1 3.74Å; A465-C483 HydrophobicContact CB-CB 4.32Å
466	Q	91.7	Very high	90.7	Very high	118 Å²	118	62 Å²	62	55%	0.551	32%	0.316	S	S	*	.	H	α-helix	trans	-65.6	-44.2	174.8	-175.1	-179.1	-20.2	0	0	112.2	A462 A463 I464 L468 N469 E470	A462-Q466 PolarHBondContact O-N 3.41Å; A463-Q466 PolarHBondContact O-N 2.97Å; I464-Q466 VanDerWaalsContact C-N 3.31Å; I464-Q466 PolarHBondContact O-N 3.1Å; Q466-L468 VanDerWaalsContact C-N 3.32Å; Q466-L468 PolarHBondContact O-N 3.35Å; Q466-N469 WeakPolarHBondContact O-CA 3.26Å; Q466-N469 VanDerWaalsContact O-CB 3.25Å; Q466-N469 WeakPolarHBondContact O-CB 3.35Å; Q466-N469 PolarHBondContact O-N 3.32Å; Q466-E470 PolarHBondContact NE2-OE1 3.33Å; Q466-E470 VanDerWaalsContact NE2-OE1 3.15Å; Q466-E470 PolarHBondContact O-N 2.82Å
467	E	91.9	Very high	90.8	Very high	50 Å²	50	61.5 Å²	61.5	23%	0.234	32%	0.324	C	S	.	.	H	α-helix	trans	-62.5	-38.8	177.6	-170.7	-176.7	167.1	0	0	112	R398 L402 A463 I464 N469 E470 L471	R398-E467 IonicContact CZ-OE1 3.67Å; R398-E467 IonicContact NE-OE1 3.5Å; R398-E467 PolarHBondContact NE-OE1 3.04Å; R398-E467 IonicContact NH2-OE1 3.94Å; R398-E467 PolarHBondContact NH2-OE1 3.43Å; L402-E467 HydrophobicContact CD1-CG 3.91Å; L402-E467 WeakPolarHBondContact CD1-OE1 3.31Å; A463-E467 WeakPolarHBondContact O-CB 3.42Å; A463-E467 PolarHBondContact O-N 3.21Å; I464-E467 PolarHBondContact O-N 2.96Å; E467-N469 VanDerWaalsContact C-N 3.27Å; E467-N469 PolarHBondContact O-N 3.23Å; E467-E470 PolarHBondContact O-N 3.21Å; E467-L471 HydrophobicContact CG-CD1 4.5Å; E467-L471 WeakPolarHBondContact O-CG 3.19Å; E467-L471 PolarHBondContact O-N 3.18Å
468	L	92.4	Very high	91	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-63	-33.5	171.6	-77.5	168.4	0	0	0	112.4	L399 L402 A403 F406 I464 A465 Q466 Y473 I476 V479	L399-L468 HydrophobicContact CD2-CD2 3.83Å; L402-L468 HydrophobicContact CB-CD1 4.48Å; L402-L468 HydrophobicContact CB-CD2 3.61Å; L402-L468 HydrophobicContact CB-CG 3.97Å; L402-L468 HydrophobicContact CD1-CD2 4.48Å; A403-L468 HydrophobicContact CB-CD2 4.3Å; F406-L468 HydrophobicContact CB-CD1 4.09Å; I464-L468 HydrophobicContact CG2-CD1 4.17Å; I464-L468 WeakPolarHBondContact O-CB 3.23Å; I464-L468 WeakPolarHBondContact O-CG 3.49Å; I464-L468 PolarHBondContact O-N 3.45Å; A465-L468 PolarHBondContact O-N 3.02Å; Q466-L468 VanDerWaalsContact C-N 3.32Å; Q466-L468 PolarHBondContact O-N 3.35Å; L468-Y473 HydrophobicContact CD2-CD2 4.26Å; L468-Y473 HydrophobicContact CD2-CG 4.11Å; L468-Y473 VanDerWaalsContact O-CB 3.27Å; L468-Y473 WeakPolarHBondContact O-CB 3.45Å; L468-Y473 PolarHBondContact O-N 3.09Å; L468-Y473 VanDerWaalsContact O-N 3.16Å; L468-I476 HydrophobicContact CB-CD1 3.94Å; L468-V479 HydrophobicContact CD1-CG1 4.3Å
469	N	90.8	Very high	91	Very high	76 Å²	76	60.4 Å²	60.4	41%	0.406	33%	0.33	S	S	.	.	H	α-helix	trans	-70.8	-39.1	176.1	-166.7	68.2	0	0	0	111.9	A465 Q466 E467 L471 D472 I476	A465-N469 PolarHBondContact O-N 3.14Å; A465-N469 VanDerWaalsContact O-N 3.11Å; Q466-N469 WeakPolarHBondContact O-CA 3.26Å; Q466-N469 VanDerWaalsContact O-CB 3.25Å; Q466-N469 WeakPolarHBondContact O-CB 3.35Å; Q466-N469 PolarHBondContact O-N 3.32Å; E467-N469 VanDerWaalsContact C-N 3.27Å; E467-N469 PolarHBondContact O-N 3.23Å; N469-L471 VanDerWaalsContact C-N 3.28Å; N469-L471 PolarHBondContact O-N 3.25Å; N469-D472 PolarHBondContact O-N 2.9Å; N469-I476 HydrophobicContact CB-CD1 3.77Å; N469-I476 HydrophobicContact CB-CG1 3.84Å; N469-I476 WeakPolarHBondContact OD1-CG1 3.36Å
470	E	90.6	Very high	91.1	Very high	130 Å²	130	58.7 Å²	58.7	61%	0.607	32%	0.324	S	S	*	.	H	α-helix	trans	-68.3	-25.8	177.4	-70.6	173.9	-168.9	0	0	113.2	Q466 E467	Q466-E470 PolarHBondContact NE2-OE1 3.33Å; Q466-E470 VanDerWaalsContact NE2-OE1 3.15Å; Q466-E470 PolarHBondContact O-N 2.82Å; E467-E470 PolarHBondContact O-N 3.21Å
471	L	88.8	Confident	91.2	Very high	41 Å²	41	61.8 Å²	61.8	22%	0.215	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	12.1	178.6	-66.9	174.4	0	0	0	113.7	R395 R398 L399 L402 E467 N469 Y473	R395-L471 PolarHBondContact NH1-O 3.13Å; R398-L471 HydrophobicContact CG-CD1 4.43Å; L399-L471 HydrophobicContact CD2-CB 3.47Å; L399-L471 VanDerWaalsContact CD2-CB 3.47Å; L399-L471 HydrophobicContact CD2-CD1 4.03Å; L399-L471 HydrophobicContact CD2-CG 4.42Å; L399-L471 HydrophobicContact CG-CB 4.19Å; L399-L471 HydrophobicContact CG-CD1 4.48Å; L402-L471 HydrophobicContact CD1-CD1 3.99Å; E467-L471 HydrophobicContact CG-CD1 4.5Å; E467-L471 WeakPolarHBondContact O-CG 3.19Å; E467-L471 PolarHBondContact O-N 3.18Å; N469-L471 VanDerWaalsContact C-N 3.28Å; N469-L471 PolarHBondContact O-N 3.25Å; L471-Y473 PolarHBondContact O-N 3.1Å
472	D	86.4	Confident	91.2	Very high	142 Å²	142	65 Å²	65	76%	0.759	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	48.7	180	-66.1	-44.8	0	0	0	113.4	N469	N469-D472 PolarHBondContact O-N 2.9Å
473	Y	88.5	Confident	91.3	Very high	23 Å²	23	63.9 Å²	63.9	9%	0.09	34%	0.344	C	S	.	.			trans	-62	137.3	176.8	-177.9	-112	0	0	0	112.3	L399 A403 L468 L471 D475 I476 V479	L399-Y473 HydrophobicContact CB-CD2 4.33Å; L399-Y473 HydrophobicContact CD2-CD2 4.05Å; L399-Y473 HydrophobicContact CD2-CG 4.42Å; A403-Y473 HydrophobicContact CB-CE1 4.35Å; A403-Y473 HydrophobicContact CB-CE2 3.85Å; L468-Y473 HydrophobicContact CD2-CD2 4.26Å; L468-Y473 HydrophobicContact CD2-CG 4.11Å; L468-Y473 VanDerWaalsContact O-CB 3.27Å; L468-Y473 WeakPolarHBondContact O-CB 3.45Å; L468-Y473 PolarHBondContact O-N 3.09Å; L468-Y473 VanDerWaalsContact O-N 3.16Å; L471-Y473 PolarHBondContact O-N 3.1Å; Y473-D475 VanDerWaalsContact C-N 3.35Å; Y473-D475 HydrophobicContact CD1-CB 4.34Å; Y473-D475 HydrophobicContact CE1-CB 3.69Å; Y473-D475 PolarHBondContact O-N 3.31Å; Y473-I476 WeakPolarHBondContact O-CB 3.41Å; Y473-I476 PolarHBondContact O-N 3.26Å; Y473-V479 HydrophobicContact CE1-CG2 4.44Å
474	H	85.1	Confident	91.4	Very high	150 Å²	150	66.6 Å²	66.6	69%	0.694	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-30.1	-171	69.3	-84.9	0	0	0	115
475	D	88.9	Confident	91.4	Very high	74 Å²	74	69.5 Å²	69.5	40%	0.396	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	37.6	-179.8	-172.8	32.8	0	0	0	112.3	Y473 A477 S478	Y473-D475 VanDerWaalsContact C-N 3.35Å; Y473-D475 HydrophobicContact CD1-CB 4.34Å; Y473-D475 HydrophobicContact CE1-CB 3.69Å; Y473-D475 PolarHBondContact O-N 3.31Å; D475-A477 VanDerWaalsContact C-N 3.29Å; D475-A477 PolarHBondContact O-N 3.14Å; D475-S478 PolarHBondContact O-N 2.81Å; D475-S478 VanDerWaalsContact OD1-CB 3.26Å; D475-S478 WeakPolarHBondContact OD1-CB 3.34Å; D475-S478 WeakPolarHBondContact OD2-CB 3.34Å
476	I	91.9	Very high	91.5	Very high	34 Å²	34	69.7 Å²	69.7	17%	0.174	37%	0.369	C	S	.	.	H	α-helix	trans	-66.2	-28.4	-175.6	-169	57.6	0	0	0	114	L468 N469 Y473 S478 V479 N480	L468-I476 HydrophobicContact CB-CD1 3.94Å; N469-I476 HydrophobicContact CB-CD1 3.77Å; N469-I476 HydrophobicContact CB-CG1 3.84Å; N469-I476 WeakPolarHBondContact OD1-CG1 3.36Å; Y473-I476 WeakPolarHBondContact O-CB 3.41Å; Y473-I476 PolarHBondContact O-N 3.26Å; I476-S478 VanDerWaalsContact C-N 3.34Å; I476-S478 PolarHBondContact O-N 3.47Å; I476-V479 HydrophobicContact CD1-CB 4.25Å; I476-V479 HydrophobicContact CD1-CG1 4.23Å; I476-V479 PolarHBondContact O-N 3.07Å; I476-N480 PolarHBondContact O-N 3.42Å; I476-N480 VanDerWaalsContact O-N 3.07Å
477	A	91.1	Very high	91.5	Very high	77 Å²	77	65.9 Å²	65.9	64%	0.636	36%	0.355	S	S	*	.	H	α-helix	trans	-62.3	-40.1	179.7	0	0	0	0	0	112.4	D475 L481	D475-A477 VanDerWaalsContact C-N 3.29Å; D475-A477 PolarHBondContact O-N 3.14Å; A477-L481 PolarHBondContact O-N 2.87Å
478	S	92.4	Very high	91.5	Very high	66 Å²	66	68 Å²	68	46%	0.462	37%	0.368	S	S	.	.	H	α-helix	trans	-67.2	-43	177.3	-177.8	0	0	0	0	111.9	D475 I476 L481 R482	D475-S478 PolarHBondContact O-N 2.81Å; D475-S478 VanDerWaalsContact OD1-CB 3.26Å; D475-S478 WeakPolarHBondContact OD1-CB 3.34Å; D475-S478 WeakPolarHBondContact OD2-CB 3.34Å; I476-S478 VanDerWaalsContact C-N 3.34Å; I476-S478 PolarHBondContact O-N 3.47Å; S478-L481 PolarHBondContact O-N 3.38Å; S478-R482 PolarHBondContact O-N 2.65Å
479	V	93.7	Very high	91.5	Very high	12 Å²	12	71 Å²	71	7%	0.073	38%	0.384	C	S	.	.	H	α-helix	trans	-59.8	-47.2	178.1	169.6	0	0	0	0	111.4	F406 A465 L468 Y473 I476 R482 C483	F406-V479 HydrophobicContact CD1-CB 4.46Å; F406-V479 HydrophobicContact CD1-CG1 3.94Å; F406-V479 HydrophobicContact CD1-CG2 4.09Å; F406-V479 HydrophobicContact CD2-CG1 4.09Å; F406-V479 HydrophobicContact CE1-CB 4.08Å; F406-V479 HydrophobicContact CE1-CG1 3.69Å; F406-V479 HydrophobicContact CE1-CG2 4.07Å; F406-V479 HydrophobicContact CE2-CG1 3.84Å; F406-V479 HydrophobicContact CG-CG1 4.14Å; F406-V479 HydrophobicContact CZ-CB 4.35Å; F406-V479 HydrophobicContact CZ-CG1 3.64Å; F406-V479 WeakPolarHBondContact CZ-O 3.49Å; A465-V479 HydrophobicContact CB-CG1 3.74Å; L468-V479 HydrophobicContact CD1-CG1 4.3Å; Y473-V479 HydrophobicContact CE1-CG2 4.44Å; I476-V479 HydrophobicContact CD1-CB 4.25Å; I476-V479 HydrophobicContact CD1-CG1 4.23Å; I476-V479 PolarHBondContact O-N 3.07Å; V479-R482 PolarHBondContact O-N 3.14Å; V479-C483 PolarHBondContact O-N 2.89Å
480	N	92.8	Very high	91.6	Very high	68 Å²	68	68.1 Å²	68.1	36%	0.364	37%	0.367	S	S	.	.	H	α-helix	trans	-64.6	-42.6	-178.5	-73.4	-20	0	0	0	112.9	I476 R482 C483 Q484	I476-N480 PolarHBondContact O-N 3.42Å; I476-N480 VanDerWaalsContact O-N 3.07Å; N480-R482 VanDerWaalsContact C-N 3.32Å; N480-R482 PolarHBondContact O-N 3.27Å; N480-C483 PolarHBondContact O-N 3.03Å; N480-Q484 PolarHBondContact O-N 3.39Å
481	L	94.1	Very high	91.6	Very high	129 Å²	129	67.1 Å²	67.1	68%	0.675	37%	0.366	S	S	*	.	H	α-helix	trans	-61.1	-41.9	178.3	-176.4	68.5	0	0	0	111.9	A477 S478 S485	A477-L481 PolarHBondContact O-N 2.87Å; S478-L481 PolarHBondContact O-N 3.38Å; L481-S485 PolarHBondContact O-N 3Å; L481-S485 PolarHBondContact O-OG 3.49Å
482	R	94.7	Very high	91.7	Very high	69 Å²	69	69.5 Å²	69.5	26%	0.26	38%	0.375	S	S	.	.	H	α-helix	trans	-68.4	-40.6	179.1	-170.6	175.5	-177.9	-171.7	1	112.1	F406 T411 E414 S478 V479 N480 Q484 S485 I486	F406-R482 HydrophobicContact CZ-CB 4.45Å; T411-R482 PolarHBondContact OG1-NH2 3.06Å; E414-R482 IonicContact OE1-CZ 3.17Å; E414-R482 IonicContact OE1-NE 2.71Å; E414-R482 PolarHBondContact OE1-NE 3.49Å; E414-R482 IonicContact OE1-NH2 3.04Å; E414-R482 PolarHBondContact OE1-NH2 2.92Å; E414-R482 IonicContact OE2-CZ 3.51Å; E414-R482 IonicContact OE2-NE 3.93Å; E414-R482 IonicContact OE2-NH2 3.37Å; E414-R482 PolarHBondContact OE2-NH2 2.88Å; S478-R482 PolarHBondContact O-N 2.65Å; V479-R482 PolarHBondContact O-N 3.14Å; N480-R482 VanDerWaalsContact C-N 3.32Å; N480-R482 PolarHBondContact O-N 3.27Å; R482-Q484 VanDerWaalsContact C-N 3.35Å; R482-Q484 PolarHBondContact O-N 3.4Å; R482-S485 PolarHBondContact O-N 3.22Å; R482-I486 PolarHBondContact O-N 3.47Å
483	C	94.6	Very high	91.9	Very high	14 Å²	14	62.9 Å²	62.9	10%	0.095	34%	0.339	C	S	.	.	H	α-helix	trans	-60	-43.7	177.6	-170	0	0	0	0	112.1	F406 A462 A465 V479 N480 S485 I486 C487	F406-C483 HydrophobicContact CE2-CB 4.32Å; F406-C483 HydrophobicContact CZ-CB 4.34Å; A462-C483 VanDerWaalsContact CA-SG 3.58Å; A465-C483 HydrophobicContact CB-CB 4.32Å; V479-C483 PolarHBondContact O-N 2.89Å; N480-C483 PolarHBondContact O-N 3.03Å; C483-S485 VanDerWaalsContact C-N 3.34Å; C483-S485 PolarHBondContact O-N 3.43Å; C483-I486 PolarHBondContact O-N 2.9Å; C483-C487 PolarHBondContact O-N 2.9Å; C483-C487 PolarHBondContact O-SG 3.09Å
484	Q	93.4	Very high	91.9	Very high	111 Å²	111	63.1 Å²	63.1	52%	0.519	35%	0.349	S	S	.	.	H	α-helix	trans	-59.8	-43.5	179.3	-174.9	61.6	48.3	0	0	112.3	N480 R482 I486 C487 D488	N480-Q484 PolarHBondContact O-N 3.39Å; R482-Q484 VanDerWaalsContact C-N 3.35Å; R482-Q484 PolarHBondContact O-N 3.4Å; Q484-I486 PolarHBondContact O-N 2.88Å; Q484-C487 PolarHBondContact O-N 3.34Å; Q484-D488 PolarHBondContact NE2-OD1 3.03Å; Q484-D488 PolarHBondContact O-N 2.96Å
485	S	93.6	Very high	92.2	Very high	73 Å²	73	60.2 Å²	60.2	51%	0.51	34%	0.342	S	S	.	.	H	α-helix	trans	-62.5	-32.2	-178.8	-59.3	0	0	0	0	112.9	L481 R482 C483 L489	L481-S485 PolarHBondContact O-N 3Å; L481-S485 PolarHBondContact O-OG 3.49Å; R482-S485 PolarHBondContact O-N 3.22Å; C483-S485 VanDerWaalsContact C-N 3.34Å; C483-S485 PolarHBondContact O-N 3.43Å; S485-L489 PolarHBondContact O-N 3.28Å
486	I	93.6	Very high	92.2	Very high	6 Å²	6	59 Å²	59	3%	0.031	34%	0.335	C	S	.	.	H	α-helix	trans	-69.6	-43.5	176.9	-72.1	170.8	0	0	0	110.9	A410 H413 E414 V458 I461 R482 C483 Q484 D488 L489 W490	A410-I486 HydrophobicContact CB-CD1 3.84Å; H413-I486 WeakPolarHBondContact CD2-CG2 3.36Å; E414-I486 HydrophobicContact CG-CD1 4.14Å; E414-I486 HydrophobicContact CG-CG1 4.06Å; V458-I486 HydrophobicContact CG1-CG2 4.4Å; V458-I486 HydrophobicContact CG2-CG2 4.42Å; I461-I486 HydrophobicContact CG2-CD1 4.4Å; R482-I486 PolarHBondContact O-N 3.47Å; C483-I486 PolarHBondContact O-N 2.9Å; Q484-I486 PolarHBondContact O-N 2.88Å; I486-D488 PolarHBondContact O-N 2.91Å; I486-L489 PolarHBondContact O-N 2.59Å; I486-W490 PolarHBondContact O-N 3Å
487	C	92.4	Very high	92.1	Very high	38 Å²	38	57.6 Å²	57.6	26%	0.257	33%	0.328	S	S	.	.	H	α-helix	trans	-61.4	-43.7	178.8	-63.9	0	0	0	0	112	C483 Q484 L489 W490 D491	C483-C487 PolarHBondContact O-N 2.9Å; C483-C487 PolarHBondContact O-SG 3.09Å; Q484-C487 PolarHBondContact O-N 3.34Å; C487-L489 VanDerWaalsContact C-N 3.32Å; C487-L489 PolarHBondContact O-N 3.41Å; C487-W490 VanDerWaalsContact O-CB 3.28Å; C487-W490 WeakPolarHBondContact O-CB 3.44Å; C487-W490 PolarHBondContact O-N 3.12Å; C487-W490 VanDerWaalsContact O-N 3.14Å; C487-D491 PolarHBondContact O-N 3.24Å
488	D	92.3	Very high	92	Very high	95 Å²	95	60 Å²	60	51%	0.508	33%	0.326	S	S	.	.	H	α-helix	trans	-63.9	-36.3	-178.6	-63.2	-11.5	0	0	0	112.5	Q484 I486 W490	Q484-D488 PolarHBondContact NE2-OD1 3.03Å; Q484-D488 PolarHBondContact O-N 2.96Å; I486-D488 PolarHBondContact O-N 2.91Å; D488-W490 VanDerWaalsContact C-N 3.33Å
489	L	91.4	Very high	91.8	Very high	62 Å²	62	63.5 Å²	63.5	33%	0.325	33%	0.333	S	S	.	.	H	α-helix	trans	-69.6	-32	176.5	179.8	60	0	0	0	112.3	A417 S485 I486 C487 K492 L493	A417-L489 HydrophobicContact CB-CD2 3.6Å; A417-L489 HydrophobicContact CB-CG 4.4Å; S485-L489 PolarHBondContact O-N 3.28Å; I486-L489 PolarHBondContact O-N 2.59Å; C487-L489 VanDerWaalsContact C-N 3.32Å; C487-L489 PolarHBondContact O-N 3.41Å; L489-K492 HydrophobicContact CD1-CD 4.28Å; L489-K492 WeakPolarHBondContact O-CB 3.43Å; L489-K492 PolarHBondContact O-N 3.23Å; L489-L493 PolarHBondContact O-N 3.19Å
490	W	93	Very high	91.6	Very high	17 Å²	17	64 Å²	64	6%	0.064	33%	0.333	C	S	.	.	H	α-helix	trans	-62.7	-49.3	-179.5	-177	-105.7	0	0	0	112.5	H413 W416 L451 H454 Q455 V458 I486 C487 D488 K492 L493 G494	H413-W490 AromaticContact CE1-CE3 3.67Å; H413-W490 AromaticContact CE1-CZ3 3.67Å; W416-W490 HydrophobicContact CH2-CE3 4.3Å; W416-W490 HydrophobicContact CH2-CH2 4.18Å; W416-W490 AromaticContact CH2-CZ3 3.46Å; W416-W490 HydrophobicContact CH2-CZ3 3.46Å; W416-W490 VanDerWaalsContact CH2-CZ3 3.46Å; W416-W490 HydrophobicContact CZ3-CE3 4.03Å; W416-W490 AromaticContact CZ3-CZ3 3.46Å; W416-W490 HydrophobicContact CZ3-CZ3 3.46Å; W416-W490 VanDerWaalsContact CZ3-CZ3 3.46Å; L451-W490 HydrophobicContact CB-CH2 4.34Å; L451-W490 HydrophobicContact CD1-CD2 4.08Å; L451-W490 HydrophobicContact CD1-CE3 4Å; L451-W490 HydrophobicContact CD1-CH2 3.58Å; L451-W490 HydrophobicContact CD1-CZ2 3.63Å; L451-W490 HydrophobicContact CD1-CZ3 3.76Å; L451-W490 HydrophobicContact CG-CH2 3.88Å; L451-W490 HydrophobicContact CG-CZ2 3.71Å; L451-W490 WeakPolarHBondContact O-CH2 3.41Å; L451-W490 WeakPolarHBondContact O-CZ2 3.37Å; H454-W490 HydrophobicContact CB-CH2 3.42Å; H454-W490 VanDerWaalsContact CB-CH2 3.42Å; H454-W490 HydrophobicContact CB-CZ3 3.64Å; Q455-W490 HydrophobicContact CB-CZ2 4.04Å; V458-W490 HydrophobicContact CG2-CD2 4.04Å; V458-W490 HydrophobicContact CG2-CE3 3.86Å; V458-W490 HydrophobicContact CG2-CG 4.46Å; V458-W490 HydrophobicContact CG2-CZ3 4.17Å; I486-W490 PolarHBondContact O-N 3Å; C487-W490 VanDerWaalsContact O-CB 3.28Å; C487-W490 WeakPolarHBondContact O-CB 3.44Å; C487-W490 PolarHBondContact O-N 3.12Å; C487-W490 VanDerWaalsContact O-N 3.14Å; D488-W490 VanDerWaalsContact C-N 3.33Å; W490-K492 PolarHBondContact O-N 3.07Å; W490-L493 PolarHBondContact O-N 3.03Å; W490-G494 PolarHBondContact O-N 3.4Å
491	D	90.6	Very high	91.3	Very high	109 Å²	109	62.9 Å²	62.9	58%	0.583	32%	0.324	S	S	*	.	H	α-helix	trans	-58.7	-35.6	178.6	-69.6	-20.9	0	0	0	111.6	C487 T495	C487-D491 PolarHBondContact O-N 3.24Å; D491-T495 WeakPolarHBondContact O-CB 3.39Å; D491-T495 WeakPolarHBondContact O-CG2 3.15Å; D491-T495 PolarHBondContact O-N 3.2Å; D491-T495 VanDerWaalsContact O-N 3.16Å; D491-T495 PolarHBondContact O-OG1 2.76Å
492	K	90.7	Very high	91	Very high	91 Å²	91	61.4 Å²	61.4	40%	0.396	31%	0.314	S	S	.	.	H	α-helix	trans	-64.8	-36.5	177.2	-164.2	-169.2	-178.7	-161.8	0	113.1	E421 L489 W490 T495 L496	E421-K492 WeakPolarHBondContact OE1-CE 3.41Å; E421-K492 IonicContact OE1-NZ 2.73Å; E421-K492 PolarHBondContact OE1-NZ 3.18Å; E421-K492 WeakPolarHBondContact OE2-CE 3.44Å; E421-K492 IonicContact OE2-NZ 2.66Å; E421-K492 PolarHBondContact OE2-NZ 3.11Å; L489-K492 HydrophobicContact CD1-CD 4.28Å; L489-K492 WeakPolarHBondContact O-CB 3.43Å; L489-K492 PolarHBondContact O-N 3.23Å; W490-K492 PolarHBondContact O-N 3.07Å; K492-T495 PolarHBondContact O-OG1 2.99Å; K492-L496 WeakPolarHBondContact O-CD1 3.43Å; K492-L496 WeakPolarHBondContact O-CG 3.34Å
493	L	90.8	Very high	90.3	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.01	31%	0.311	C	S	.	.	H	α-helix	trans	-74.9	-40.8	179.6	-69	174.3	0	0	0	112.1	W416 A417 K420 E421 L451 L489 W490 L496 T497	W416-L493 HydrophobicContact CH2-CD1 4.27Å; W416-L493 HydrophobicContact CZ3-CD1 4.02Å; A417-L493 HydrophobicContact CB-CD1 4.28Å; K420-L493 HydrophobicContact CB-CD2 4.01Å; E421-L493 HydrophobicContact CB-CD2 4.31Å; L451-L493 HydrophobicContact CD1-CB 4.08Å; L489-L493 PolarHBondContact O-N 3.19Å; W490-L493 PolarHBondContact O-N 3.03Å; L493-L496 PolarHBondContact O-N 3.08Å; L493-T497 PolarHBondContact O-N 2.72Å; L493-T497 PolarHBondContact O-OG1 2.95Å
494	G	89.6	Confident	89.8	Confident	28 Å²	28	58.6 Å²	58.6	29%	0.289	31%	0.307	S	S	.	.	H	α-helix	trans	-64.4	-46.3	178.3	0	0	0	0	0	112.3	W490 L496 T497	W490-G494 PolarHBondContact O-N 3.4Å; G494-L496 PolarHBondContact O-N 2.99Å; G494-L496 VanDerWaalsContact O-N 3.13Å; G494-T497 PolarHBondContact O-N 3.33Å
495	T	90.6	Very high	89.4	Confident	90 Å²	90	57.7 Å²	57.7	55%	0.552	30%	0.302	S	S	*	.	H	α-helix	trans	-68.2	-8	179.6	55.3	0	0	0	0	114.3	D491 K492 K499	D491-T495 WeakPolarHBondContact O-CB 3.39Å; D491-T495 WeakPolarHBondContact O-CG2 3.15Å; D491-T495 PolarHBondContact O-N 3.2Å; D491-T495 VanDerWaalsContact O-N 3.16Å; D491-T495 PolarHBondContact O-OG1 2.76Å; K492-T495 PolarHBondContact O-OG1 2.99Å; T495-K499 WeakPolarHBondContact O-CE 3.41Å; T495-K499 PolarHBondContact O-NZ 2.84Å
496	L	90	Very high	88.8	Confident	48 Å²	48	62.2 Å²	62.2	25%	0.251	31%	0.308	S	S	.	.	H	α-helix	trans	-92.7	-50.1	169.5	-73.7	169.8	0	0	0	112.9	E421 L424 K492 L493 G494 Q498 K499	E421-L496 HydrophobicContact CG-CD1 3.81Å; L424-L496 HydrophobicContact CD1-CB 3.84Å; K492-L496 WeakPolarHBondContact O-CD1 3.43Å; K492-L496 WeakPolarHBondContact O-CG 3.34Å; L493-L496 PolarHBondContact O-N 3.08Å; G494-L496 PolarHBondContact O-N 2.99Å; G494-L496 VanDerWaalsContact O-N 3.13Å; L496-Q498 VanDerWaalsContact C-N 3.29Å; L496-Q498 PolarHBondContact O-N 3.16Å; L496-Q498 VanDerWaalsContact O-N 3.11Å; L496-K499 WeakPolarHBondContact O-CB 3.44Å; L496-K499 PolarHBondContact O-N 3.2Å
497	T	89.9	Confident	88.2	Confident	4 Å²	4	63 Å²	63	3%	0.025	32%	0.316	C	S	.	.	H	α-helix	trans	-49.2	-41.1	-169.3	-60.1	0	0	0	0	114.5	L424 H444 F447 E448 L493 G494 K499 R500	L424-T497 WeakPolarHBondContact CD1-OG1 3.43Å; L424-T497 HydrophobicContact CD2-CG2 4.33Å; H444-T497 VanDerWaalsContact CE1-CG2 3.44Å; H444-T497 WeakPolarHBondContact CE1-CG2 3.44Å; H444-T497 PolarHBondContact CE1-O 3.06Å; H444-T497 PolarHBondContact NE2-O 3.4Å; F447-T497 HydrophobicContact CD1-CG2 4.04Å; F447-T497 WeakPolarHBondContact CE1-OG1 3.42Å; E448-T497 HydrophobicContact CB-CG2 4.41Å; E448-T497 HydrophobicContact CG-CG2 3.31Å; L493-T497 PolarHBondContact O-N 2.72Å; L493-T497 PolarHBondContact O-OG1 2.95Å; G494-T497 PolarHBondContact O-N 3.33Å; T497-K499 PolarHBondContact O-N 3.31Å; T497-R500 PolarHBondContact O-N 3.09Å
498	Q	88.7	Confident	87.7	Confident	127 Å²	127	62.3 Å²	62.3	59%	0.593	31%	0.309	S	S	*	.	H	α-helix	trans	-53.7	-32.4	179.6	-170.8	62.3	24	0	0	113.9	L496 R500	L496-Q498 VanDerWaalsContact C-N 3.29Å; L496-Q498 PolarHBondContact O-N 3.16Å; L496-Q498 VanDerWaalsContact O-N 3.11Å; Q498-R500 VanDerWaalsContact C-N 3.31Å; Q498-R500 PolarHBondContact O-N 3.29Å
499	K	86.9	Confident	87.2	Confident	140 Å²	140	63.4 Å²	63.4	61%	0.609	31%	0.309	S	S	*	.	H	α-helix	trans	-79.1	-10.9	-172	-65.4	145.1	-178.4	168.4	0	113.7	T495 L496 T497	T495-K499 WeakPolarHBondContact O-CE 3.41Å; T495-K499 PolarHBondContact O-NZ 2.84Å; L496-K499 WeakPolarHBondContact O-CB 3.44Å; L496-K499 PolarHBondContact O-N 3.2Å; T497-K499 PolarHBondContact O-N 3.31Å
500	R	89.6	Confident	86.4	Confident	22 Å²	22	64.9 Å²	64.9	8%	0.083	32%	0.317	C	S	.	.	H	α-helix	trans	-98.5	-36.4	178.5	173.4	172.7	153.7	84.6	3.8	113.1	L424 Q426 D428 T497 Q498 E502 A503 L504	L424-R500 WeakPolarHBondContact O-CD 3.44Å; Q426-R500 PolarHBondContact O-NH1 2.75Å; D428-R500 VanDerWaalsContact CG-NH1 3.31Å; D428-R500 IonicContact OD1-CZ 3.63Å; D428-R500 IonicContact OD1-NH1 2.84Å; D428-R500 PolarHBondContact OD1-NH1 3.42Å; D428-R500 IonicContact OD1-NH2 3.33Å; D428-R500 PolarHBondContact OD1-NH2 3.09Å; D428-R500 IonicContact OD2-CZ 3.39Å; D428-R500 IonicContact OD2-NH1 3.15Å; D428-R500 PolarHBondContact OD2-NH1 3.43Å; D428-R500 VanDerWaalsContact OD2-NH1 3.15Å; D428-R500 IonicContact OD2-NH2 3.56Å; D428-R500 PolarHBondContact OD2-NH2 3.35Å; T497-R500 PolarHBondContact O-N 3.09Å; Q498-R500 VanDerWaalsContact C-N 3.31Å; Q498-R500 PolarHBondContact O-N 3.29Å; R500-E502 PolarHBondContact O-N 3.1Å; R500-A503 PolarHBondContact O-N 3.17Å; R500-L504 HydrophobicContact CG-CD1 3.78Å; R500-L504 HydrophobicContact CG-CG 4.49Å; R500-L504 WeakPolarHBondContact O-CG 3.31Å; R500-L504 PolarHBondContact O-N 3.36Å
501	R	86.6	Confident	85.7	Confident	45 Å²	45	65.5 Å²	65.5	17%	0.17	32%	0.321	C	S	.	.	H	α-helix	trans	-50	-44.4	167	170.7	178.9	-81.7	-97.6	11.2	111.3	H444 E445 E448 A503 L504 E505	H444-R501 PolarHBondContact NE2-N 3.5Å; E445-R501 VanDerWaalsContact CD-NH2 3.34Å; E445-R501 IonicContact OE1-CZ 3.21Å; E445-R501 IonicContact OE1-NH2 2.68Å; E445-R501 PolarHBondContact OE1-NH2 3.32Å; E448-R501 WeakPolarHBondContact OE1-CB 3.31Å; E448-R501 IonicContact OE1-NE 2.86Å; E448-R501 PolarHBondContact OE1-NE 3.31Å; E448-R501 VanDerWaalsContact OE1-NE 3.14Å; E448-R501 IonicContact OE2-CZ 3.23Å; E448-R501 IonicContact OE2-NE 3.77Å; E448-R501 PolarHBondContact OE2-NE 3.17Å; E448-R501 IonicContact OE2-NH2 2.72Å; E448-R501 PolarHBondContact OE2-NH2 3.04Å; R501-A503 PolarHBondContact O-N 3.26Å; R501-L504 PolarHBondContact O-N 3.41Å; R501-E505 WeakPolarHBondContact CD-OE1 3.44Å; R501-E505 HydrophobicContact CG-CG 4.2Å; R501-E505 VanDerWaalsContact CG-OE1 3.24Å; R501-E505 WeakPolarHBondContact CG-OE1 3.49Å; R501-E505 IonicContact CZ-OE1 3.92Å; R501-E505 IonicContact NE-OE1 3.14Å; R501-E505 IonicContact NH1-OE1 3.2Å; R501-E505 PolarHBondContact NH1-OE1 3.19Å; R501-E505 PolarHBondContact O-N 3.15Å
502	E	87.4	Confident	85.2	Confident	98 Å²	98	62.8 Å²	62.8	46%	0.458	31%	0.305	S	S	.	.	H	α-helix	trans	-44.7	-40.7	-177.6	-131.3	-141.5	-82.6	0	0	113.6	R500 R506	R500-E502 PolarHBondContact O-N 3.1Å; E502-R506 PolarHBondContact O-NE 2.86Å; E502-R506 PolarHBondContact O-NH2 3.06Å; E502-R506 IonicContact OE2-CZ 3.17Å; E502-R506 IonicContact OE2-NH1 2.74Å; E502-R506 PolarHBondContact OE2-NH1 3.23Å; E502-R506 IonicContact OE2-NH2 2.72Å; E502-R506 PolarHBondContact OE2-NH2 2.8Å
503	A	81.4	Confident	84.7	Confident	25 Å²	25	61.7 Å²	61.7	21%	0.207	31%	0.306	C	S	.	.	H	α-helix	trans	-95.9	-24.4	-177.7	0	0	0	0	0	113.9	Y429 R500 R501 R506	Y429-A503 HydrophobicContact CE1-CB 4.09Å; Y429-A503 HydrophobicContact CE2-CB 4.23Å; Y429-A503 WeakPolarHBondContact OH-CB 3.3Å; R500-A503 PolarHBondContact O-N 3.17Å; R501-A503 PolarHBondContact O-N 3.26Å; A503-R506 VanDerWaalsContact O-CB 3.29Å; A503-R506 WeakPolarHBondContact O-CB 3.44Å; A503-R506 PolarHBondContact O-N 3.39Å
504	L	83	Confident	84	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-68.4	-42.6	-179.8	-73.5	164.2	0	0	0	111.8	Y429 L440 L441 H444 R500 R501 R506	Y429-L504 HydrophobicContact CD1-CD2 3.5Å; Y429-L504 HydrophobicContact CD1-CG 4.16Å; Y429-L504 HydrophobicContact CE1-CD2 4.48Å; Y429-L504 HydrophobicContact CG-CD2 3.77Å; L440-L504 HydrophobicContact CB-CD2 3.77Å; L441-L504 HydrophobicContact CB-CB 4.05Å; L441-L504 HydrophobicContact CG-CB 3.99Å; H444-L504 HydrophobicContact CB-CD1 3.5Å; R500-L504 HydrophobicContact CG-CD1 3.78Å; R500-L504 HydrophobicContact CG-CG 4.49Å; R500-L504 WeakPolarHBondContact O-CG 3.31Å; R500-L504 PolarHBondContact O-N 3.36Å; R501-L504 PolarHBondContact O-N 3.41Å; L504-R506 PolarHBondContact O-N 3.45Å
505	E	85.8	Confident	83.5	Confident	91 Å²	91	61.5 Å²	61.5	43%	0.425	30%	0.298	S	S	.	.	H	α-helix	trans	-62.2	-32.8	174.9	-66.5	173.2	171.9	0	0	111.9	L441 R501 A507 E508	L441-E505 HydrophobicContact CD1-CB 4.49Å; L441-E505 HydrophobicContact CD1-CG 3.95Å; L441-E505 HydrophobicContact CG-CG 4.29Å; R501-E505 WeakPolarHBondContact CD-OE1 3.44Å; R501-E505 HydrophobicContact CG-CG 4.2Å; R501-E505 VanDerWaalsContact CG-OE1 3.24Å; R501-E505 WeakPolarHBondContact CG-OE1 3.49Å; R501-E505 IonicContact CZ-OE1 3.92Å; R501-E505 IonicContact NE-OE1 3.14Å; R501-E505 IonicContact NH1-OE1 3.2Å; R501-E505 PolarHBondContact NH1-OE1 3.19Å; R501-E505 PolarHBondContact O-N 3.15Å; E505-A507 VanDerWaalsContact C-N 3.25Å; E505-A507 PolarHBondContact O-N 3.26Å; E505-E508 PolarHBondContact O-N 3.18Å
506	R	81.6	Confident	83.1	Confident	168 Å²	168	62.1 Å²	62.1	63%	0.634	30%	0.295	S	S	*	.	H	α-helix	trans	-71.1	-14.4	-170.8	-150.8	160.4	-66.2	176.6	0.3	114.1	E502 A503 L504	E502-R506 PolarHBondContact O-NE 2.86Å; E502-R506 PolarHBondContact O-NH2 3.06Å; E502-R506 IonicContact OE2-CZ 3.17Å; E502-R506 IonicContact OE2-NH1 2.74Å; E502-R506 PolarHBondContact OE2-NH1 3.23Å; E502-R506 IonicContact OE2-NH2 2.72Å; E502-R506 PolarHBondContact OE2-NH2 2.8Å; A503-R506 VanDerWaalsContact O-CB 3.29Å; A503-R506 WeakPolarHBondContact O-CB 3.44Å; A503-R506 PolarHBondContact O-N 3.39Å; L504-R506 PolarHBondContact O-N 3.45Å
507	A	79.9	Confident	82.5	Confident	23 Å²	23	62.4 Å²	62.4	19%	0.19	30%	0.296	C	S	.	.	H	α-helix	trans	-97.8	-20.7	177.7	0	0	0	0	0	114	Y429 V437 E505	Y429-A507 HydrophobicContact CD2-CB 4.09Å; V437-A507 HydrophobicContact CG1-CB 4.13Å; V437-A507 HydrophobicContact CG2-CB 4.48Å; E505-A507 VanDerWaalsContact C-N 3.25Å; E505-A507 PolarHBondContact O-N 3.26Å
508	E	81.4	Confident	82.2	Confident	24 Å²	24	62.4 Å²	62.4	11%	0.112	30%	0.296	C	S	.	.	H	α-helix	trans	-67.4	-48.3	-160.2	-170.4	-178.2	132.6	0	0	114.3	L434 V437 R438 L441 E505 L510 L511 E512	L434-E508 HydrophobicContact CD1-CG 3.71Å; V437-E508 HydrophobicContact CG1-CB 4.33Å; R438-E508 HydrophobicContact CG-CG 3.9Å; R438-E508 WeakPolarHBondContact CG-OE2 3.28Å; R438-E508 IonicContact CZ-OE1 3.57Å; R438-E508 IonicContact NE-OE1 3.02Å; R438-E508 PolarHBondContact NE-OE1 3.46Å; R438-E508 IonicContact NE-OE2 3.43Å; R438-E508 IonicContact NH2-OE1 3.99Å; R438-E508 PolarHBondContact NH2-OE1 2.99Å; R438-E508 VanDerWaalsContact NH2-OE1 3.1Å; L441-E508 WeakPolarHBondContact CD1-OE2 3.41Å; E505-E508 PolarHBondContact O-N 3.18Å; E508-L510 PolarHBondContact O-N 3.11Å; E508-L510 VanDerWaalsContact O-N 3.16Å; E508-L511 PolarHBondContact O-N 2.88Å; E508-E512 PolarHBondContact O-N 2.99Å
509	K	82.4	Confident	81.8	Confident	118 Å²	118	59.7 Å²	59.7	51%	0.513	29%	0.285	S	S	.	.	H	α-helix	trans	-64.5	-26.8	-167.1	-90.1	56.2	176.4	77.6	0	113.8	L511 E512 T513	K509-L511 PolarHBondContact O-N 3.08Å; K509-E512 IonicContact NZ-OE1 3.54Å; K509-E512 PolarHBondContact NZ-OE1 3.46Å; K509-E512 IonicContact NZ-OE2 3.55Å; K509-E512 PolarHBondContact NZ-OE2 3.27Å; K509-T513 PolarHBondContact O-N 3.01Å; K509-T513 VanDerWaalsContact O-N 3.16Å; K509-T513 PolarHBondContact O-OG1 3.14Å
510	L	75.4	Confident	81.5	Confident	93 Å²	93	55.7 Å²	55.7	49%	0.487	27%	0.268	S	S	.	.	H	α-helix	trans	-66.3	-25	175.3	-59.6	179.4	0	0	0	112.9	E508 Y589	E508-L510 PolarHBondContact O-N 3.11Å; E508-L510 VanDerWaalsContact O-N 3.16Å; L510-Y589 HydrophobicContact CD2-CE1 4.2Å
511	L	77.6	Confident	81.3	Confident	30 Å²	30	55.6 Å²	55.6	16%	0.157	27%	0.269	C	S	.	.	H	α-helix	trans	-100.3	-34.6	178.6	-70.5	158.5	0	0	0	111.6	L434 V437 E508 K509 T513 I514 I591	L434-L511 HydrophobicContact CB-CB 3.93Å; L434-L511 HydrophobicContact CD1-CB 3.86Å; L434-L511 HydrophobicContact CG-CB 4.37Å; V437-L511 HydrophobicContact CG2-CD1 4.03Å; E508-L511 PolarHBondContact O-N 2.88Å; K509-L511 PolarHBondContact O-N 3.08Å; L511-T513 PolarHBondContact O-N 3.19Å; L511-I514 PolarHBondContact O-N 3.36Å; L511-I591 HydrophobicContact CD2-CD1 4.02Å; L511-I591 HydrophobicContact CD2-CG1 4.47Å; L511-I591 HydrophobicContact CD2-CG2 3.84Å
512	E	81	Confident	81	Confident	52 Å²	52	53.8 Å²	53.8	24%	0.243	26%	0.263	C	S	.	.	H	α-helix	trans	-54.2	-33.9	169.4	-179.4	177.6	-79.4	0	0	112.7	L434 R438 E508 K509 I514 D515 Q516	L434-E512 HydrophobicContact CD1-CB 4.45Å; R438-E512 IonicContact NH2-OE1 2.76Å; R438-E512 PolarHBondContact NH2-OE1 3.23Å; E508-E512 PolarHBondContact O-N 2.99Å; K509-E512 IonicContact NZ-OE1 3.54Å; K509-E512 PolarHBondContact NZ-OE1 3.46Å; K509-E512 IonicContact NZ-OE2 3.55Å; K509-E512 PolarHBondContact NZ-OE2 3.27Å; E512-I514 PolarHBondContact O-N 3.05Å; E512-D515 PolarHBondContact O-N 3.02Å; E512-Q516 PolarHBondContact O-N 3.35Å
513	T	78.9	Confident	80.9	Confident	67 Å²	67	54.8 Å²	54.8	41%	0.411	27%	0.266	S	S	.	.	H	α-helix	trans	-57.5	-14.6	175.2	-60	0	0	0	0	113.3	K509 L511 I585	K509-T513 PolarHBondContact O-N 3.01Å; K509-T513 VanDerWaalsContact O-N 3.16Å; K509-T513 PolarHBondContact O-OG1 3.14Å; L511-T513 PolarHBondContact O-N 3.19Å; T513-I585 HydrophobicContact CG2-CG2 4.04Å; T513-I585 WeakPolarHBondContact O-CD1 3.5Å
514	I	76.1	Confident	81.1	Confident	9 Å²	9	57.3 Å²	57.3	5%	0.046	27%	0.27	C	S	.	.	H	α-helix	trans	-101.1	-31.9	173.1	-48.1	178.3	0	0	0	111.5	L511 E512 F518 V582 I585 I591 I595	L511-I514 PolarHBondContact O-N 3.36Å; E512-I514 PolarHBondContact O-N 3.05Å; I514-F518 HydrophobicContact CG2-CD2 4.31Å; I514-F518 HydrophobicContact CG2-CE2 4.1Å; I514-V582 HydrophobicContact CG2-CG1 3.77Å; I514-V582 WeakPolarHBondContact O-CG1 3.33Å; I514-I585 HydrophobicContact CG1-CB 4.33Å; I514-I585 HydrophobicContact CG1-CG2 3.87Å; I514-I591 HydrophobicContact CD1-CD1 4.18Å; I514-I591 HydrophobicContact CD1-CG2 4.21Å; I514-I595 HydrophobicContact CD1-CD1 3.74Å; I514-I595 HydrophobicContact CG2-CD1 4.35Å
515	D	78.5	Confident	81.2	Confident	17 Å²	17	57.3 Å²	57.3	9%	0.091	27%	0.27	C	S	.	.	H	α-helix	trans	-63.6	-48.5	-174	127.4	-150.1	0	0	0	112.2	L434 R438 E512 L517 F518 L519 Y599	L434-D515 HydrophobicContact CD2-CB 3.26Å; L434-D515 WeakPolarHBondContact CD2-OD1 3.24Å; R438-D515 IonicContact CZ-OD1 2.79Å; R438-D515 IonicContact NH1-OD1 3.84Å; R438-D515 PolarHBondContact NH1-OD1 3.27Å; R438-D515 IonicContact NH2-OD1 2.64Å; R438-D515 PolarHBondContact NH2-OD1 3.44Å; E512-D515 PolarHBondContact O-N 3.02Å; D515-L517 PolarHBondContact O-N 3.48Å; D515-F518 PolarHBondContact O-N 3.43Å; D515-L519 WeakPolarHBondContact O-CB 3.45Å; D515-L519 PolarHBondContact O-N 3.29Å; D515-Y599 HydrophobicContact CB-CE2 4Å; D515-Y599 WeakPolarHBondContact OD2-CE2 3.41Å
516	Q	82.6	Confident	80.9	Confident	103 Å²	103	54.6 Å²	54.6	48%	0.481	26%	0.264	S	S	.	.	H	α-helix	trans	-57	-31.6	-172	178.2	61.8	97.3	0	0	113.7	E512 E520	E512-Q516 PolarHBondContact O-N 3.35Å; Q516-E520 WeakPolarHBondContact O-CB 3.49Å; Q516-E520 PolarHBondContact O-N 3.08Å
517	L	78.6	Confident	81	Confident	55 Å²	55	50.3 Å²	50.3	29%	0.288	26%	0.258	S	S	.	.	H	α-helix	trans	-85.9	-29.1	179.6	-56.9	-173.9	0	0	0	113.2	D515 L519 E520 F521 E581 V582 I585	D515-L517 PolarHBondContact O-N 3.48Å; L517-L519 VanDerWaalsContact C-N 3.32Å; L517-E520 PolarHBondContact O-N 3.08Å; L517-F521 PolarHBondContact O-N 3.04Å; L517-E581 HydrophobicContact CD1-CB 4.48Å; L517-E581 HydrophobicContact CD1-CG 3.97Å; L517-V582 HydrophobicContact CB-CB 4.39Å; L517-V582 HydrophobicContact CB-CG1 4.15Å; L517-V582 HydrophobicContact CB-CG2 3.62Å; L517-I585 HydrophobicContact CD1-CD1 3.72Å
518	F	82.4	Confident	81.3	Confident	3 Å²	3	49.8 Å²	49.8	1%	0.013	25%	0.251	C	S	.	.	H	α-helix	trans	-67.4	-37.5	166.5	-83.1	-40.2	0	0	0	111.7	I514 D515 A522 V582 I595 N597 P598 Y599	I514-F518 HydrophobicContact CG2-CD2 4.31Å; I514-F518 HydrophobicContact CG2-CE2 4.1Å; D515-F518 PolarHBondContact O-N 3.43Å; F518-A522 WeakPolarHBondContact O-CB 3.27Å; F518-A522 PolarHBondContact O-N 3.2Å; F518-A522 VanDerWaalsContact O-N 3.08Å; F518-V582 HydrophobicContact CD1-CB 3.96Å; F518-V582 HydrophobicContact CD1-CG1 3.81Å; F518-V582 HydrophobicContact CD1-CG2 3.88Å; F518-V582 HydrophobicContact CD2-CG1 3.62Å; F518-V582 HydrophobicContact CE1-CB 3.73Å; F518-V582 HydrophobicContact CE1-CG1 3.81Å; F518-V582 HydrophobicContact CE1-CG2 4.05Å; F518-V582 HydrophobicContact CE2-CB 4.36Å; F518-V582 HydrophobicContact CE2-CG1 3.6Å; F518-V582 HydrophobicContact CG-CB 4.38Å; F518-V582 HydrophobicContact CG-CG1 3.72Å; F518-V582 HydrophobicContact CG-CG2 4.42Å; F518-V582 HydrophobicContact CZ-CB 3.95Å; F518-V582 HydrophobicContact CZ-CG1 3.71Å; F518-I595 HydrophobicContact CE2-CB 4.34Å; F518-I595 HydrophobicContact CE2-CG2 3.63Å; F518-I595 HydrophobicContact CZ-CG2 4.33Å; F518-N597 HydrophobicContact CD1-CB 3.46Å; F518-N597 VanDerWaalsContact CD1-CB 3.46Å; F518-N597 VanDerWaalsContact CD1-CG 3.41Å; F518-N597 WeakPolarHBondContact CD1-ND2 3.42Å; F518-N597 HydrophobicContact CE1-CB 3.73Å; F518-N597 HydrophobicContact CG-CB 4.03Å; F518-N597 HydrophobicContact CZ-CB 4.48Å; F518-N597 PolarHBondContact O-ND2 3.39Å; F518-N597 VanDerWaalsContact O-ND2 3.16Å; F518-P598 HydrophobicContact CD2-CG 4.48Å; F518-Y599 HydrophobicContact CB-CD2 4.26Å
519	L	80.3	Confident	81.6	Confident	71 Å²	71	48.8 Å²	48.8	37%	0.372	25%	0.246	S	C	.	.	H	α-helix	trans	-63.7	-42.3	172.2	-175.3	60.6	0	0	0	111.1	D515 L517 F521 A522 K523 Y599	D515-L519 WeakPolarHBondContact O-CB 3.45Å; D515-L519 PolarHBondContact O-N 3.29Å; L517-L519 VanDerWaalsContact C-N 3.32Å; L519-F521 VanDerWaalsContact C-N 3.34Å; L519-F521 PolarHBondContact O-N 3.41Å; L519-A522 PolarHBondContact O-N 3.34Å; L519-K523 WeakPolarHBondContact O-CB 3.16Å; L519-K523 PolarHBondContact O-N 2.77Å; L519-Y599 HydrophobicContact CB-CD2 3.93Å; L519-Y599 HydrophobicContact CB-CE2 4.33Å; L519-Y599 HydrophobicContact CD1-CD2 4.3Å
520	E	81.4	Confident	81.7	Confident	55 Å²	55	47 Å²	47	26%	0.257	24%	0.243	S	C	.	.	H	α-helix	trans	-66.6	-33	179.9	-162.8	65.2	-154.3	0	0	112.9	Q516 L517 K523 I578	Q516-E520 WeakPolarHBondContact O-CB 3.49Å; Q516-E520 PolarHBondContact O-N 3.08Å; L517-E520 PolarHBondContact O-N 3.08Å; E520-K523 IonicContact OE1-NZ 2.76Å; E520-K523 PolarHBondContact OE1-NZ 3.17Å; E520-K523 WeakPolarHBondContact OE2-CD 3.39Å; E520-K523 IonicContact OE2-NZ 3.1Å; E520-K523 PolarHBondContact OE2-NZ 3.28Å; E520-I578 HydrophobicContact CB-CG2 4.42Å; E520-I578 HydrophobicContact CG-CD1 4.29Å
521	F	84.2	Confident	82.4	Confident	20 Å²	20	46 Å²	46	9%	0.088	23%	0.233	C	C	.	.	H	α-helix	trans	-65.8	-53	169.3	175.5	-93.1	0	0	0	111.3	L517 L519 K523 R524 S525 I575 I578 H579 N597	L517-F521 PolarHBondContact O-N 3.04Å; L519-F521 VanDerWaalsContact C-N 3.34Å; L519-F521 PolarHBondContact O-N 3.41Å; F521-K523 VanDerWaalsContact C-N 3.35Å; F521-K523 PolarHBondContact O-N 3.11Å; F521-R524 PolarHBondContact O-N 3.43Å; F521-R524 VanDerWaalsContact O-N 3.12Å; F521-S525 PolarHBondContact O-N 3.15Å; F521-S525 VanDerWaalsContact O-N 3.07Å; F521-S525 PolarHBondContact O-OG 2.94Å; F521-I575 HydrophobicContact CD2-CG2 4.28Å; F521-I575 HydrophobicContact CE2-CG2 3.77Å; F521-I575 HydrophobicContact CZ-CG2 4.19Å; F521-I578 HydrophobicContact CB-CB 4.09Å; F521-I578 HydrophobicContact CB-CG2 4Å; F521-I578 HydrophobicContact CD2-CB 4.22Å; F521-H579 HydrophobicContact CD2-CB 4.19Å; F521-H579 HydrophobicContact CE2-CB 4.3Å; F521-N597 WeakPolarHBondContact CD1-ND2 3.24Å
522	A	81.8	Confident	82.8	Confident	7 Å²	7	44.6 Å²	44.6	6%	0.058	23%	0.225	C	C	.	.	H	α-helix	trans	-58.6	-44.5	-179	0	0	0	0	0	112.7	F518 L519 R524 S525 A526 Y599	F518-A522 WeakPolarHBondContact O-CB 3.27Å; F518-A522 PolarHBondContact O-N 3.2Å; F518-A522 VanDerWaalsContact O-N 3.08Å; L519-A522 PolarHBondContact O-N 3.34Å; A522-R524 PolarHBondContact O-N 3.18Å; A522-S525 PolarHBondContact O-N 3.5Å; A522-S525 PolarHBondContact O-OG 3.41Å; A522-A526 WeakPolarHBondContact O-CB 3.26Å; A522-A526 PolarHBondContact O-N 3.36Å; A522-Y599 VanDerWaalsContact CB-O 3.29Å; A522-Y599 WeakPolarHBondContact CB-O 3.31Å
523	K	84.7	Confident	83	Confident	120 Å²	120	44.5 Å²	44.5	52%	0.522	23%	0.225	S	C	.	.	H	α-helix	trans	-54.1	-17.1	175.3	172.3	-177	164.1	-157.3	0	114.3	L519 E520 F521 P527	L519-K523 WeakPolarHBondContact O-CB 3.16Å; L519-K523 PolarHBondContact O-N 2.77Å; E520-K523 IonicContact OE1-NZ 2.76Å; E520-K523 PolarHBondContact OE1-NZ 3.17Å; E520-K523 WeakPolarHBondContact OE2-CD 3.39Å; E520-K523 IonicContact OE2-NZ 3.1Å; E520-K523 PolarHBondContact OE2-NZ 3.28Å; F521-K523 VanDerWaalsContact C-N 3.35Å; F521-K523 PolarHBondContact O-N 3.11Å; K523-P527 WeakPolarHBondContact O-CD 3.4Å; K523-P527 WeakPolarHBondContact O-CG 3.46Å
524	R	85.8	Confident	83.2	Confident	77 Å²	77	42.2 Å²	42.2	29%	0.291	22%	0.215	S	C	.	.	H	α-helix	trans	-108	-44.2	176.9	-66.9	-176.5	67	174.2	1	112.3	F521 A522 A526 P527 F528 E571 I575	F521-R524 PolarHBondContact O-N 3.43Å; F521-R524 VanDerWaalsContact O-N 3.12Å; A522-R524 PolarHBondContact O-N 3.18Å; R524-A526 VanDerWaalsContact C-N 3.32Å; R524-A526 PolarHBondContact O-N 3.34Å; R524-P527 WeakPolarHBondContact O-CD 3.4Å; R524-P527 WeakPolarHBondContact O-CG 3.45Å; R524-F528 PolarHBondContact O-N 3.38Å; R524-E571 WeakPolarHBondContact CB-OE1 3.29Å; R524-E571 IonicContact CZ-OE1 2.78Å; R524-E571 VanDerWaalsContact CZ-OE1 3.26Å; R524-E571 IonicContact CZ-OE2 3.81Å; R524-E571 IonicContact NE-OE1 3.71Å; R524-E571 PolarHBondContact NE-OE1 3Å; R524-E571 IonicContact NE-OE2 2.72Å; R524-E571 VanDerWaalsContact NH2-CD 3.27Å; R524-E571 IonicContact NH2-OE1 3.7Å; R524-E571 PolarHBondContact NH2-OE1 3.28Å; R524-E571 IonicContact NH2-OE2 3.7Å; R524-E571 PolarHBondContact NH2-OE2 3.46Å; R524-I575 HydrophobicContact CB-CG1 3.9Å
525	S	84.4	Confident	83.6	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-65.4	-34.7	177.5	62	0	0	0	0	113.4	F521 A522 N529 S600	F521-S525 PolarHBondContact O-N 3.15Å; F521-S525 VanDerWaalsContact O-N 3.07Å; F521-S525 PolarHBondContact O-OG 2.94Å; A522-S525 PolarHBondContact O-N 3.5Å; A522-S525 PolarHBondContact O-OG 3.41Å; S525-N529 VanDerWaalsContact O-CB 3.32Å; S525-N529 WeakPolarHBondContact O-CB 3.42Å; S525-N529 PolarHBondContact O-N 3.46Å; S525-S600 PolarHBondContact OG-OG 3.16Å
526	A	79.3	Confident	84	Confident	34 Å²	34	42.2 Å²	42.2	28%	0.281	21%	0.214	S	C	.	.	H	α-helix	trans	-70.4	-52.8	-179.1	0	0	0	0	0	113.6	A522 R524 F528 N529 N530	A522-A526 WeakPolarHBondContact O-CB 3.26Å; A522-A526 PolarHBondContact O-N 3.36Å; R524-A526 VanDerWaalsContact C-N 3.32Å; R524-A526 PolarHBondContact O-N 3.34Å; A526-F528 PolarHBondContact O-N 3.3Å; A526-N529 CarbonylContact O-C 3.49Å; A526-N529 WeakPolarHBondContact O-CA 3.19Å; A526-N529 WeakPolarHBondContact O-CB 3.29Å; A526-N529 PolarHBondContact O-N 3.07Å; A526-N530 PolarHBondContact O-N 3.09Å; A526-N530 PolarHBondContact O-OD1 3.41Å
527	P	83.9	Confident	84.1	Confident	79 Å²	79	43.6 Å²	43.6	51%	0.513	22%	0.221	S	C	.	.	H	α-helix	trans	-63.9	-28.4	176.8	24.5	-34.4	0	0	0	112.7	K523 R524 W531	K523-P527 WeakPolarHBondContact O-CD 3.4Å; K523-P527 WeakPolarHBondContact O-CG 3.46Å; R524-P527 WeakPolarHBondContact O-CD 3.4Å; R524-P527 WeakPolarHBondContact O-CG 3.45Å; P527-W531 WeakPolarHBondContact O-CB 3.43Å; P527-W531 PolarHBondContact O-N 2.96Å
528	F	87	Confident	84.4	Confident	11 Å²	11	45 Å²	45	5%	0.048	23%	0.229	C	C	.	.	H	α-helix	trans	-66.8	-43.7	168.3	176.6	-105.7	0	0	0	112	R524 A526 N530 W531 M532 A568 R572 I575 L607 W611	R524-F528 PolarHBondContact O-N 3.38Å; A526-F528 PolarHBondContact O-N 3.3Å; F528-N530 PolarHBondContact O-N 2.98Å; F528-W531 HydrophobicContact CD2-CE3 4.42Å; F528-W531 HydrophobicContact CE2-CE3 4.24Å; F528-W531 HydrophobicContact CE2-CZ3 4.29Å; F528-M532 HydrophobicContact CD1-CE 3.66Å; F528-M532 HydrophobicContact CE1-CE 3.19Å; F528-M532 HydrophobicContact CE1-SD 3.82Å; F528-M532 HydrophobicContact CE2-SD 4.4Å; F528-M532 HydrophobicContact CG-CE 4.47Å; F528-M532 HydrophobicContact CZ-CE 3.69Å; F528-M532 HydrophobicContact CZ-CG 4.38Å; F528-M532 HydrophobicContact CZ-SD 3.64Å; F528-M532 PolarHBondContact O-N 2.93Å; F528-A568 HydrophobicContact CE2-CB 4.36Å; F528-A568 WeakPolarHBondContact CE2-O 3.31Å; F528-R572 HydrophobicContact CD1-CB 4.36Å; F528-R572 HydrophobicContact CD1-CG 4.39Å; F528-R572 HydrophobicContact CE1-CB 3.71Å; F528-R572 HydrophobicContact CE1-CG 3.52Å; F528-R572 HydrophobicContact CE2-CB 3.99Å; F528-R572 HydrophobicContact CZ-CB 3.51Å; F528-R572 HydrophobicContact CZ-CG 3.66Å; F528-I575 HydrophobicContact CB-CD1 3.81Å; F528-I575 HydrophobicContact CD1-CD1 4.08Å; F528-I575 HydrophobicContact CG-CD1 4.07Å; F528-L607 HydrophobicContact CD1-CD2 4.13Å; F528-W611 HydrophobicContact CE2-CE3 4.25Å; F528-W611 HydrophobicContact CE2-CZ3 4.07Å; F528-W611 AromaticContact CZ-CE3 3.96Å; F528-W611 HydrophobicContact CZ-CE3 3.96Å; F528-W611 HydrophobicContact CZ-CZ3 4.22Å
529	N	87.8	Confident	84.5	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.016	23%	0.229	C	C	.	.	H	α-helix	trans	-60.6	-43.3	175.2	-174.3	73.6	0	0	0	112.9	S525 A526 M532 E533 I602 L607 K610	S525-N529 VanDerWaalsContact O-CB 3.32Å; S525-N529 WeakPolarHBondContact O-CB 3.42Å; S525-N529 PolarHBondContact O-N 3.46Å; A526-N529 CarbonylContact O-C 3.49Å; A526-N529 WeakPolarHBondContact O-CA 3.19Å; A526-N529 WeakPolarHBondContact O-CB 3.29Å; A526-N529 PolarHBondContact O-N 3.07Å; N529-M532 CarbonylContact O-C 3.58Å; N529-M532 WeakPolarHBondContact O-CA 3.41Å; N529-M532 WeakPolarHBondContact O-CB 3.3Å; N529-M532 PolarHBondContact O-N 2.94Å; N529-M532 VanDerWaalsContact O-N 3.15Å; N529-E533 VanDerWaalsContact ND2-CD 3.34Å; N529-E533 PolarHBondContact ND2-OE1 3.43Å; N529-E533 PolarHBondContact O-N 3.41Å; N529-I602 HydrophobicContact CB-CD1 3.95Å; N529-I602 HydrophobicContact CB-CG2 4.48Å; N529-L607 HydrophobicContact CB-CD2 3.61Å; N529-K610 PolarHBondContact ND2-NZ 3.45Å; N529-K610 WeakPolarHBondContact OD1-CD 3.29Å; N529-K610 WeakPolarHBondContact OD1-CE 3.35Å; N529-K610 PolarHBondContact OD1-NZ 3.12Å
530	N	83.8	Confident	84.8	Confident	82 Å²	82	47.3 Å²	47.3	44%	0.439	24%	0.238	S	C	.	.	H	α-helix	trans	-91.6	-12.4	-174	-75	79.6	0	0	0	113.3	A526 F528 E533 G534	A526-N530 PolarHBondContact O-N 3.09Å; A526-N530 PolarHBondContact O-OD1 3.41Å; F528-N530 PolarHBondContact O-N 2.98Å; N530-E533 PolarHBondContact ND2-OE2 2.87Å; N530-G534 PolarHBondContact O-N 3.33Å
531	W	90.5	Very high	85	Confident	71 Å²	71	48.4 Å²	48.4	27%	0.269	25%	0.245	S	C	.	.	H	α-helix	trans	-64	-41.1	152.1	172.8	75.1	0	0	0	111	P527 F528 A535 M565 A568 W611	P527-W531 WeakPolarHBondContact O-CB 3.43Å; P527-W531 PolarHBondContact O-N 2.96Å; F528-W531 HydrophobicContact CD2-CE3 4.42Å; F528-W531 HydrophobicContact CE2-CE3 4.24Å; F528-W531 HydrophobicContact CE2-CZ3 4.29Å; W531-A535 WeakPolarHBondContact O-CB 3.39Å; W531-A535 PolarHBondContact O-N 3.01Å; W531-M565 HydrophobicContact CH2-CE 3.86Å; W531-M565 HydrophobicContact CH2-SD 3.86Å; W531-M565 HydrophobicContact CZ2-SD 3.95Å; W531-A568 HydrophobicContact CD2-CB 4.47Å; W531-A568 HydrophobicContact CE3-CB 4.03Å; W531-A568 HydrophobicContact CH2-CB 3.65Å; W531-A568 HydrophobicContact CZ2-CB 4.11Å; W531-A568 HydrophobicContact CZ3-CB 3.61Å; W531-W611 HydrophobicContact CH2-CH2 4.36Å; W531-W611 AromaticContact CH2-CZ3 3.89Å; W531-W611 HydrophobicContact CH2-CZ3 3.89Å; W531-W611 AromaticContact CZ3-CE3 3.98Å; W531-W611 HydrophobicContact CZ3-CE3 3.98Å; W531-W611 HydrophobicContact CZ3-CH2 4.45Å; W531-W611 AromaticContact CZ3-CZ3 3.56Å; W531-W611 HydrophobicContact CZ3-CZ3 3.56Å
532	M	86.6	Confident	84.5	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-70.7	-36	176.6	-68.8	-176.4	-67.9	0	0	113.4	F528 N529 A535 M536 L607 K610 W611 V614	F528-M532 HydrophobicContact CD1-CE 3.66Å; F528-M532 HydrophobicContact CE1-CE 3.19Å; F528-M532 HydrophobicContact CE1-SD 3.82Å; F528-M532 HydrophobicContact CE2-SD 4.4Å; F528-M532 HydrophobicContact CG-CE 4.47Å; F528-M532 HydrophobicContact CZ-CE 3.69Å; F528-M532 HydrophobicContact CZ-CG 4.38Å; F528-M532 HydrophobicContact CZ-SD 3.64Å; F528-M532 PolarHBondContact O-N 2.93Å; N529-M532 CarbonylContact O-C 3.58Å; N529-M532 WeakPolarHBondContact O-CA 3.41Å; N529-M532 WeakPolarHBondContact O-CB 3.3Å; N529-M532 PolarHBondContact O-N 2.94Å; N529-M532 VanDerWaalsContact O-N 3.15Å; M532-A535 CarbonylContact O-C 3.57Å; M532-M536 WeakPolarHBondContact O-CE 3.27Å; M532-M536 WeakPolarHBondContact O-CG 3.33Å; M532-M536 PolarHBondContact O-N 3.49Å; M532-L607 HydrophobicContact CE-CD2 4.13Å; M532-K610 HydrophobicContact CB-CB 4.26Å; M532-K610 HydrophobicContact CE-CB 3.84Å; M532-K610 HydrophobicContact SD-CB 3.92Å; M532-W611 HydrophobicContact SD-CB 3.99Å; M532-W611 HydrophobicContact SD-CE3 4.14Å; M532-W611 PolarHBondContact SD-N 2.87Å; M532-W611 VanDerWaalsContact SD-N 3.38Å; M532-V614 HydrophobicContact CB-CG2 4.21Å; M532-V614 HydrophobicContact CG-CG2 4.49Å; M532-V614 WeakPolarHBondContact O-CG2 3.33Å
533	E	84.4	Confident	84.5	Confident	50 Å²	50	57.1 Å²	57.1	23%	0.234	29%	0.287	C	S	.	.	H	α-helix	trans	-71.5	-41	173.7	-69.9	171.1	-171.1	0	0	112	N529 N530 A535 M536 E537 K610	N529-E533 VanDerWaalsContact ND2-CD 3.34Å; N529-E533 PolarHBondContact ND2-OE1 3.43Å; N529-E533 PolarHBondContact O-N 3.41Å; N530-E533 PolarHBondContact ND2-OE2 2.87Å; E533-A535 VanDerWaalsContact C-N 3.34Å; E533-A535 PolarHBondContact O-N 3.26Å; E533-M536 HydrophobicContact CB-CE 4.3Å; E533-M536 HydrophobicContact CG-CE 3.83Å; E533-M536 CarbonylContact O-C 3.57Å; E533-M536 WeakPolarHBondContact O-CA 3.46Å; E533-M536 WeakPolarHBondContact O-CB 3.24Å; E533-M536 PolarHBondContact O-N 3.23Å; E533-E537 PolarHBondContact O-N 3.04Å; E533-K610 WeakPolarHBondContact OE1-CE 3.48Å; E533-K610 IonicContact OE1-NZ 2.87Å; E533-K610 PolarHBondContact OE1-NZ 3.26Å
534	G	82.8	Confident	84.2	Confident	20 Å²	20	58.1 Å²	58.1	21%	0.206	30%	0.296	C	S	.	.	H	α-helix	trans	-55	-50.3	166.8	0	0	0	0	0	110.9	N530 M536 E537 D538	N530-G534 PolarHBondContact O-N 3.33Å; G534-M536 PolarHBondContact O-N 2.99Å; G534-E537 PolarHBondContact O-N 2.93Å; G534-D538 VanDerWaalsContact C-OD2 3.22Å; G534-D538 WeakPolarHBondContact O-CB 3.39Å; G534-D538 PolarHBondContact O-N 3.13Å; G534-D538 VanDerWaalsContact O-OD2 3.06Å
535	A	85.3	Confident	84.1	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63.1	14.4	169.8	0	0	0	0	0	115.5	W531 M532 E533 L539 F561 V614	W531-A535 WeakPolarHBondContact O-CB 3.39Å; W531-A535 PolarHBondContact O-N 3.01Å; M532-A535 CarbonylContact O-C 3.57Å; E533-A535 VanDerWaalsContact C-N 3.34Å; E533-A535 PolarHBondContact O-N 3.26Å; A535-L539 WeakPolarHBondContact O-CD1 3.46Å; A535-F561 HydrophobicContact CB-CE2 3.9Å; A535-F561 HydrophobicContact CB-CZ 3.55Å; A535-V614 HydrophobicContact CB-CB 4.36Å; A535-V614 HydrophobicContact CB-CG1 3.78Å; A535-V614 HydrophobicContact CB-CG2 3.66Å; A535-V614 WeakPolarHBondContact O-CG1 3.39Å; A535-V614 WeakPolarHBondContact O-CG2 3.4Å
536	M	87.3	Confident	83.8	Confident	25 Å²	25	61.1 Å²	61.1	12%	0.123	31%	0.314	C	S	.	.	H	α-helix	trans	-124.7	-40.4	164.4	-68.1	-175.5	-76.2	0	0	110.9	M532 E533 G534 L539 Q540 K613 V614 L617	M532-M536 WeakPolarHBondContact O-CE 3.27Å; M532-M536 WeakPolarHBondContact O-CG 3.33Å; M532-M536 PolarHBondContact O-N 3.49Å; E533-M536 HydrophobicContact CB-CE 4.3Å; E533-M536 HydrophobicContact CG-CE 3.83Å; E533-M536 CarbonylContact O-C 3.57Å; E533-M536 WeakPolarHBondContact O-CA 3.46Å; E533-M536 WeakPolarHBondContact O-CB 3.24Å; E533-M536 PolarHBondContact O-N 3.23Å; G534-M536 PolarHBondContact O-N 2.99Å; M536-L539 CarbonylContact O-C 3.6Å; M536-L539 WeakPolarHBondContact O-CB 3.4Å; M536-L539 PolarHBondContact O-N 3.41Å; M536-Q540 WeakPolarHBondContact O-CB 3.48Å; M536-Q540 VanDerWaalsContact O-CG 3.28Å; M536-Q540 WeakPolarHBondContact O-CG 3.49Å; M536-Q540 PolarHBondContact O-N 2.87Å; M536-K613 HydrophobicContact CE-CD 4.16Å; M536-K613 HydrophobicContact CG-CB 4.31Å; M536-K613 HydrophobicContact SD-CB 3.25Å; M536-K613 WeakPolarHBondContact SD-CB 3.38Å; M536-K613 HydrophobicContact SD-CD 3.61Å; M536-K613 HydrophobicContact SD-CG 4.08Å; M536-V614 HydrophobicContact CG-CG2 4.1Å; M536-L617 HydrophobicContact CB-CD1 3.78Å; M536-L617 HydrophobicContact CG-CD1 3.84Å; M536-L617 HydrophobicContact SD-CD1 4.48Å
537	E	83.7	Confident	84	Confident	132 Å²	132	61.7 Å²	61.7	62%	0.617	31%	0.314	S	S	*	.	H	α-helix	trans	-66.3	-43	173.8	-67.9	179.9	-177.5	0	0	112.2	E533 G534 L539 Q540 D541	E533-E537 PolarHBondContact O-N 3.04Å; G534-E537 PolarHBondContact O-N 2.93Å; E537-L539 PolarHBondContact O-N 3.06Å; E537-Q540 CarbonylContact O-C 3.36Å; E537-Q540 PolarHBondContact O-N 3.33Å; E537-D541 PolarHBondContact O-N 3.25Å
538	D	85.1	Confident	84.1	Confident	86 Å²	86	59.1 Å²	59.1	46%	0.46	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-23.2	169.7	-75.5	-40.9	0	0	0	112.5	G534 R621	G534-D538 VanDerWaalsContact C-OD2 3.22Å; G534-D538 WeakPolarHBondContact O-CB 3.39Å; G534-D538 PolarHBondContact O-N 3.13Å; G534-D538 VanDerWaalsContact O-OD2 3.06Å; D538-R621 VanDerWaalsContact O-CZ 3.22Å; D538-R621 PolarHBondContact O-NE 2.83Å; D538-R621 PolarHBondContact O-NH2 3.36Å
539	L	84.8	Confident	84.2	Confident	5 Å²	5	63.9 Å²	63.9	3%	0.026	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-0.8	-178.2	-48.5	-178.5	0	0	0	112.8	A535 M536 E537 F561 L617 V618	A535-L539 WeakPolarHBondContact O-CD1 3.46Å; M536-L539 CarbonylContact O-C 3.6Å; M536-L539 WeakPolarHBondContact O-CB 3.4Å; M536-L539 PolarHBondContact O-N 3.41Å; E537-L539 PolarHBondContact O-N 3.06Å; L539-F561 HydrophobicContact CD1-CE1 4.34Å; L539-F561 HydrophobicContact CD2-CD1 3.98Å; L539-F561 HydrophobicContact CD2-CE1 3.73Å; L539-F561 HydrophobicContact CD2-CZ 4.45Å; L539-F561 HydrophobicContact CG-CE1 4.41Å; L539-L617 HydrophobicContact CB-CB 3.94Å; L539-L617 HydrophobicContact CD1-CB 3.74Å; L539-V618 HydrophobicContact CD1-CB 4.43Å; L539-V618 HydrophobicContact CD1-CG2 3.55Å; L539-V618 HydrophobicContact CD2-CG2 4.02Å; L539-V618 HydrophobicContact CG-CG2 4.46Å
540	Q	85.5	Confident	84.1	Confident	116 Å²	116	67.5 Å²	67.5	54%	0.542	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.8	-6.6	-173.8	-67.4	-172.5	-58.9	0	0	114.6	M536 E537 L617	M536-Q540 WeakPolarHBondContact O-CB 3.48Å; M536-Q540 VanDerWaalsContact O-CG 3.28Å; M536-Q540 WeakPolarHBondContact O-CG 3.49Å; M536-Q540 PolarHBondContact O-N 2.87Å; E537-Q540 CarbonylContact O-C 3.36Å; E537-Q540 PolarHBondContact O-N 3.33Å; Q540-L617 HydrophobicContact CG-CD1 4.12Å; Q540-L617 HydrophobicContact CG-CD2 4.33Å
541	D	86.3	Confident	84.3	Confident	78 Å²	78	63.6 Å²	63.6	42%	0.417	31%	0.314	S	S	.	.			trans	-57.3	147.4	-178.3	136.4	77.4	0	0	0	114	E537 F543 R621	E537-D541 PolarHBondContact O-N 3.25Å; D541-F543 PolarHBondContact O-N 3.08Å; D541-F543 PolarHBondContact OD1-N 2.81Å; D541-F543 VanDerWaalsContact OD1-N 3.11Å; D541-R621 PolarHBondContact O-NH1 3.13Å; D541-R621 IonicContact OD2-CZ 2.96Å; D541-R621 IonicContact OD2-NH1 3.86Å; D541-R621 PolarHBondContact OD2-NH1 3.1Å; D541-R621 IonicContact OD2-NH2 3.86Å; D541-R621 PolarHBondContact OD2-NH2 3.36Å
542	M	73.8	Confident	84.3	Confident	174 Å²	174	65.1 Å²	65.1	86%	0.857	32%	0.324	S	S	*	.			trans	-100.5	59.5	179.7	-64.4	-172.5	67.8	0	0	111.4
543	F	82.9	Confident	84.4	Confident	37 Å²	37	68.9 Å²	68.9	16%	0.162	35%	0.35	C	S	.	.			trans	-42.6	148.2	176	66.7	-71.8	0	0	0	114.8	D541 V545 L554 L625 E628	D541-F543 PolarHBondContact O-N 3.08Å; D541-F543 PolarHBondContact OD1-N 2.81Å; D541-F543 VanDerWaalsContact OD1-N 3.11Å; F543-V545 HydrophobicContact CD2-CG1 4.38Å; F543-L554 HydrophobicContact CB-CD1 4.05Å; F543-L554 HydrophobicContact CD2-CD1 3.48Å; F543-L554 VanDerWaalsContact CD2-CD1 3.48Å; F543-L554 HydrophobicContact CE2-CD1 4.27Å; F543-L554 HydrophobicContact CG-CD1 4.05Å; F543-L625 HydrophobicContact CD1-CD2 4.22Å; F543-L625 HydrophobicContact CD2-CD2 4.01Å; F543-L625 HydrophobicContact CE1-CD2 3.94Å; F543-L625 HydrophobicContact CE2-CD2 3.67Å; F543-L625 HydrophobicContact CG-CD2 4.28Å; F543-L625 HydrophobicContact CZ-CD2 3.67Å; F543-L625 HydrophobicContact CZ-CG 4.39Å; F543-E628 HydrophobicContact CD2-CG 4.43Å; F543-E628 HydrophobicContact CE2-CB 3.54Å; F543-E628 HydrophobicContact CE2-CG 3.54Å; F543-E628 HydrophobicContact CZ-CB 3.62Å; F543-E628 HydrophobicContact CZ-CG 4.07Å
544	I	78.2	Confident	84.6	Confident	140 Å²	140	69.3 Å²	69.3	72%	0.718	35%	0.354	S	S	*	.			trans	-125.3	137.6	177.7	-59.5	176.7	0	0	0	108.7
545	V	82.9	Confident	85	Confident	7 Å²	7	70.7 Å²	70.7	4%	0.042	36%	0.356	C	S	.	.			trans	-139.9	145.5	-179.2	-71.5	0	0	0	0	110.8	F543 E550 V551 L554 E628 Q632	F543-V545 HydrophobicContact CD2-CG1 4.38Å; V545-E550 WeakPolarHBondContact CA-OE2 3.06Å; V545-E550 HydrophobicContact CB-CB 4.14Å; V545-E550 HydrophobicContact CG1-CB 3.77Å; V545-V551 HydrophobicContact CB-CG2 3.67Å; V545-V551 HydrophobicContact CG1-CG2 3.73Å; V545-V551 HydrophobicContact CG2-CG2 3.25Å; V545-L554 HydrophobicContact CG1-CD1 3.8Å; V545-E628 HydrophobicContact CG2-CG 3.35Å; V545-E628 WeakPolarHBondContact CG2-OE1 2.94Å; V545-Q632 HydrophobicContact CG2-CG 3.86Å; V545-Q632 PolarHBondContact O-NE2 3.19Å
546	H	79.1	Confident	85.2	Confident	133 Å²	133	73.8 Å²	73.8	62%	0.616	38%	0.382	S	S	*	.	S	Bend	trans	-125.2	-7.6	-179.7	-66.5	-5.9	0	0	0	112.7	E550	H546-E550 PolarHBondContact N-OE2 3.2Å
547	T	83	Confident	85.2	Confident	47 Å²	47	75.1 Å²	75.1	29%	0.288	40%	0.397	S	S	.	.	S	Bend	trans	-122.9	159	169.4	67.1	0	0	0	0	111.7	E549 E550	T547-E549 WeakPolarHBondContact CB-OE1 3.26Å; T547-E550 PolarHBondContact N-OE2 3.15Å; T547-E550 WeakPolarHBondContact OG1-CB 3.07Å; T547-E550 WeakPolarHBondContact OG1-CG 3.2Å; T547-E550 PolarHBondContact OG1-N 3.09Å; T547-E550 PolarHBondContact OG1-OE1 2.89Å
548	I	86	Confident	85.6	Confident	25 Å²	25	69.4 Å²	69.4	13%	0.128	37%	0.37	C	S	.	.	H	α-helix	trans	-73.2	-29.2	175	-62.8	158.9	0	0	0	109.1	Q552 M629 Q632 E636	I548-Q552 PolarHBondContact O-NE2 3.47Å; I548-M629 HydrophobicContact CG2-CE 3.44Å; I548-M629 VanDerWaalsContact CG2-CE 3.44Å; I548-M629 HydrophobicContact CG2-SD 3.95Å; I548-Q632 HydrophobicContact CG1-CB 3.72Å; I548-E636 HydrophobicContact CD1-CB 3.93Å; I548-E636 HydrophobicContact CD1-CG 4.25Å
549	E	87.7	Confident	85.8	Confident	110 Å²	110	70.2 Å²	70.2	51%	0.514	37%	0.371	S	S	.	.	H	α-helix	trans	-64.3	-35.4	177.4	-60.3	91.3	-46.7	0	0	112.5	T547 S553	T547-E549 WeakPolarHBondContact CB-OE1 3.26Å; E549-S553 PolarHBondContact O-OG 3.18Å
550	E	86.8	Confident	86	Confident	79 Å²	79	77.2 Å²	77.2	37%	0.369	40%	0.404	S	S	.	.	H	α-helix	trans	-70.2	-43.7	177	-79.3	153	-150.2	0	0	113.5	V545 H546 T547 Q552 S553 L554	V545-E550 WeakPolarHBondContact CA-OE2 3.06Å; V545-E550 HydrophobicContact CB-CB 4.14Å; V545-E550 HydrophobicContact CG1-CB 3.77Å; H546-E550 PolarHBondContact N-OE2 3.2Å; T547-E550 PolarHBondContact N-OE2 3.15Å; T547-E550 WeakPolarHBondContact OG1-CB 3.07Å; T547-E550 WeakPolarHBondContact OG1-CG 3.2Å; T547-E550 PolarHBondContact OG1-N 3.09Å; T547-E550 PolarHBondContact OG1-OE1 2.89Å; E550-Q552 VanDerWaalsContact C-N 3.32Å; E550-Q552 PolarHBondContact O-N 3.29Å; E550-S553 WeakPolarHBondContact O-CB 3.21Å; E550-S553 PolarHBondContact O-N 2.96Å; E550-L554 PolarHBondContact O-N 3.42Å
551	V	88.4	Confident	86.2	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-63.3	-40.1	-178.4	-176	0	0	0	0	111.5	V545 S553 L554 I555 L625 E628 M629 Q632	V545-V551 HydrophobicContact CB-CG2 3.67Å; V545-V551 HydrophobicContact CG1-CG2 3.73Å; V545-V551 HydrophobicContact CG2-CG2 3.25Å; V551-S553 PolarHBondContact O-N 3.35Å; V551-L554 PolarHBondContact O-N 3.34Å; V551-I555 HydrophobicContact CG1-CD1 4.28Å; V551-I555 PolarHBondContact O-N 3.46Å; V551-L625 WeakPolarHBondContact CG1-O 3.46Å; V551-E628 HydrophobicContact CG2-CG 4.21Å; V551-M629 HydrophobicContact CB-SD 3.84Å; V551-M629 HydrophobicContact CG1-CB 3.79Å; V551-M629 HydrophobicContact CG1-CG 4.46Å; V551-M629 HydrophobicContact CG1-SD 4.02Å; V551-Q632 HydrophobicContact CG2-CG 4.02Å
552	Q	89.6	Confident	86.4	Confident	103 Å²	103	72.8 Å²	72.8	48%	0.481	38%	0.379	S	S	.	.	H	α-helix	trans	-60.8	-32	175.8	-69.9	167.7	95.9	0	0	112.3	I548 E550 A556 M629	I548-Q552 PolarHBondContact O-NE2 3.47Å; E550-Q552 VanDerWaalsContact C-N 3.32Å; E550-Q552 PolarHBondContact O-N 3.29Å; Q552-A556 PolarHBondContact O-N 3.18Å; Q552-M629 HydrophobicContact CG-CE 3.49Å; Q552-M629 VanDerWaalsContact CG-CE 3.49Å; Q552-M629 HydrophobicContact CG-SD 4Å
553	S	89.2	Confident	87.2	Confident	79 Å²	79	68.2 Å²	68.2	55%	0.552	37%	0.369	S	S	*	.	H	α-helix	trans	-71.9	-35.7	178.3	-56	0	0	0	0	111.9	E549 E550 V551 A556 A557	E549-S553 PolarHBondContact O-OG 3.18Å; E550-S553 WeakPolarHBondContact O-CB 3.21Å; E550-S553 PolarHBondContact O-N 2.96Å; V551-S553 PolarHBondContact O-N 3.35Å; S553-A556 PolarHBondContact O-N 3.16Å; S553-A557 PolarHBondContact O-N 3.33Å
554	L	88.9	Confident	87.5	Confident	59 Å²	59	69.8 Å²	69.8	31%	0.309	38%	0.382	S	S	.	.	H	α-helix	trans	-68.3	-39	175.9	-66.4	173.8	0	0	0	112.6	F543 V545 E550 V551 A556 A557 H558 L625	F543-L554 HydrophobicContact CB-CD1 4.05Å; F543-L554 HydrophobicContact CD2-CD1 3.48Å; F543-L554 VanDerWaalsContact CD2-CD1 3.48Å; F543-L554 HydrophobicContact CE2-CD1 4.27Å; F543-L554 HydrophobicContact CG-CD1 4.05Å; V545-L554 HydrophobicContact CG1-CD1 3.8Å; E550-L554 PolarHBondContact O-N 3.42Å; V551-L554 PolarHBondContact O-N 3.34Å; L554-A556 VanDerWaalsContact C-N 3.31Å; L554-A556 PolarHBondContact O-N 3.25Å; L554-A557 PolarHBondContact O-N 3.49Å; L554-H558 PolarHBondContact O-N 3.48Å; L554-L625 HydrophobicContact CB-CD2 3.8Å; L554-L625 HydrophobicContact CD1-CD2 4.24Å
555	I	90	Very high	88.1	Confident	49 Å²	49	65 Å²	65	25%	0.251	36%	0.357	S	S	.	.	H	α-helix	trans	-61.6	-40.2	175.2	-66.2	165.8	0	0	0	110.8	V551 L625	V551-I555 HydrophobicContact CG1-CD1 4.28Å; V551-I555 PolarHBondContact O-N 3.46Å; I555-L625 HydrophobicContact CD1-CB 4.49Å; I555-L625 HydrophobicContact CG1-CB 3.83Å; I555-L625 HydrophobicContact CG1-CD1 4.31Å
556	A	90.3	Very high	88.4	Confident	65 Å²	65	69.4 Å²	69.4	54%	0.537	39%	0.385	S	S	.	.	H	α-helix	trans	-67.3	-35.2	177.7	0	0	0	0	0	113.4	Q552 S553 L554	Q552-A556 PolarHBondContact O-N 3.18Å; S553-A556 PolarHBondContact O-N 3.16Å; L554-A556 VanDerWaalsContact C-N 3.31Å; L554-A556 PolarHBondContact O-N 3.25Å
557	A	88	Confident	88.7	Confident	54 Å²	54	71.1 Å²	71.1	45%	0.446	39%	0.394	S	S	.	.	H	α-helix	trans	-69.6	-40.1	-179.9	0	0	0	0	0	112.8	S553 L554 E559 Q560 F561	S553-A557 PolarHBondContact O-N 3.33Å; L554-A557 PolarHBondContact O-N 3.49Å; A557-E559 VanDerWaalsContact C-N 3.29Å; A557-E559 PolarHBondContact O-N 3.29Å; A557-Q560 WeakPolarHBondContact O-CB 3.37Å; A557-Q560 PolarHBondContact O-N 3.33Å; A557-Q560 VanDerWaalsContact O-N 3.11Å; A557-F561 PolarHBondContact O-N 3.08Å; A557-F561 VanDerWaalsContact O-N 3.16Å
558	H	91.6	Very high	88.9	Confident	12 Å²	12	70.1 Å²	70.1	6%	0.056	39%	0.39	C	S	.	.	H	α-helix	trans	-64.1	-33.2	179.8	-179	67.3	0	0	0	112.8	L554 Q560 F561 V618 D622 L625	L554-H558 PolarHBondContact O-N 3.48Å; H558-Q560 PolarHBondContact O-N 3.25Å; H558-F561 PolarHBondContact O-N 3.17Å; H558-V618 PolarHBondContact NE2-O 3.18Å; H558-D622 IonicContact CD2-OD1 3.66Å; H558-D622 PolarHBondContact CD2-OD1 3.28Å; H558-D622 IonicContact NE2-OD1 3.76Å; H558-D622 PolarHBondContact NE2-OD1 2.84Å; H558-D622 VanDerWaalsContact NE2-OD1 3.16Å; H558-D622 IonicContact NE2-OD2 2.8Å; H558-D622 PolarHBondContact NE2-OD2 3.35Å; H558-L625 HydrophobicContact CB-CD1 4.34Å
559	E	89.1	Confident	89	Confident	102 Å²	102	71 Å²	71	48%	0.477	40%	0.395	S	S	.	.	H	α-helix	trans	-63.7	-38.4	172.2	-73.6	-61.7	152.2	0	0	112.9	A557 K562	A557-E559 VanDerWaalsContact C-N 3.29Å; A557-E559 PolarHBondContact O-N 3.29Å; E559-K562 VanDerWaalsContact CD-CE 3.45Å; E559-K562 PolarHBondContact O-N 3.46Å; E559-K562 IonicContact OE1-NZ 2.73Å; E559-K562 PolarHBondContact OE1-NZ 3.46Å; E559-K562 WeakPolarHBondContact OE2-CE 3.41Å; E559-K562 IonicContact OE2-NZ 2.74Å; E559-K562 PolarHBondContact OE2-NZ 3.01Å
560	Q	89.2	Confident	89	Confident	152 Å²	152	69 Å²	69	71%	0.71	40%	0.397	S	S	*	.	H	α-helix	trans	-69.6	-37.3	179.2	-173.1	173.6	-0.1	0	0	112.3	A557 H558 K562 A563	A557-Q560 WeakPolarHBondContact O-CB 3.37Å; A557-Q560 PolarHBondContact O-N 3.33Å; A557-Q560 VanDerWaalsContact O-N 3.11Å; H558-Q560 PolarHBondContact O-N 3.25Å; Q560-K562 VanDerWaalsContact C-N 3.3Å; Q560-K562 PolarHBondContact O-N 3.19Å; Q560-A563 WeakPolarHBondContact O-CB 3.28Å; Q560-A563 PolarHBondContact O-N 3.25Å
561	F	89.9	Confident	89.1	Confident	31 Å²	31	68.1 Å²	68.1	14%	0.136	39%	0.393	C	S	.	.	H	α-helix	trans	-57.3	-42.5	176.5	169.4	-95.4	0	0	0	112.1	A535 L539 A557 H558 A563 T564 M565 V614 V618	A535-F561 HydrophobicContact CB-CE2 3.9Å; A535-F561 HydrophobicContact CB-CZ 3.55Å; L539-F561 HydrophobicContact CD1-CE1 4.34Å; L539-F561 HydrophobicContact CD2-CD1 3.98Å; L539-F561 HydrophobicContact CD2-CE1 3.73Å; L539-F561 HydrophobicContact CD2-CZ 4.45Å; L539-F561 HydrophobicContact CG-CE1 4.41Å; A557-F561 PolarHBondContact O-N 3.08Å; A557-F561 VanDerWaalsContact O-N 3.16Å; H558-F561 PolarHBondContact O-N 3.17Å; F561-A563 PolarHBondContact O-N 3.44Å; F561-T564 WeakPolarHBondContact O-CB 3.26Å; F561-T564 WeakPolarHBondContact O-CG2 3.19Å; F561-T564 PolarHBondContact O-N 3.27Å; F561-T564 PolarHBondContact O-OG1 3.37Å; F561-M565 HydrophobicContact CZ-SD 4.45Å; F561-V614 HydrophobicContact CZ-CG1 4.34Å; F561-V618 HydrophobicContact CE1-CG2 4.25Å
562	K	89.2	Confident	89.1	Confident	71 Å²	71	70.4 Å²	70.4	31%	0.309	40%	0.402	S	S	.	.	H	α-helix	trans	-57.7	-26.2	-179.7	-70.3	-175.4	-66.7	-166.9	0	113.5	E559 Q560 T564 V618	E559-K562 VanDerWaalsContact CD-CE 3.45Å; E559-K562 PolarHBondContact O-N 3.46Å; E559-K562 IonicContact OE1-NZ 2.73Å; E559-K562 PolarHBondContact OE1-NZ 3.46Å; E559-K562 WeakPolarHBondContact OE2-CE 3.41Å; E559-K562 IonicContact OE2-NZ 2.74Å; E559-K562 PolarHBondContact OE2-NZ 3.01Å; Q560-K562 VanDerWaalsContact C-N 3.3Å; Q560-K562 PolarHBondContact O-N 3.19Å; K562-T564 VanDerWaalsContact C-N 3.33Å; K562-T564 PolarHBondContact O-N 3.34Å; K562-V618 HydrophobicContact CD-CG1 3.46Å; K562-V618 VanDerWaalsContact CD-CG1 3.46Å; K562-V618 HydrophobicContact CG-CG1 3.7Å
563	A	90.8	Very high	89	Confident	78 Å²	78	71 Å²	71	65%	0.645	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-17.1	178.4	0	0	0	0	0	114.1	Q560 F561 P566	Q560-A563 WeakPolarHBondContact O-CB 3.28Å; Q560-A563 PolarHBondContact O-N 3.25Å; F561-A563 PolarHBondContact O-N 3.44Å; A563-P566 VanDerWaalsContact O-CD 3.31Å; A563-P566 WeakPolarHBondContact O-CD 3.45Å
564	T	89.3	Confident	88.9	Confident	70 Å²	70	69.5 Å²	69.5	43%	0.429	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-21.4	-172.3	66.6	0	0	0	0	114.8	F561 K562 P566	F561-T564 WeakPolarHBondContact O-CB 3.26Å; F561-T564 WeakPolarHBondContact O-CG2 3.19Å; F561-T564 PolarHBondContact O-N 3.27Å; F561-T564 PolarHBondContact O-OG1 3.37Å; K562-T564 VanDerWaalsContact C-N 3.33Å; K562-T564 PolarHBondContact O-N 3.34Å; T564-P566 WeakPolarHBondContact O-CD 3.42Å
565	M	90.4	Very high	88.7	Confident	40 Å²	40	66.7 Å²	66.7	20%	0.197	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-32.6	-171	-67.5	-58.3	-55.5	0	0	118.2	W531 F561 E567 W611 V614	W531-M565 HydrophobicContact CH2-CE 3.86Å; W531-M565 HydrophobicContact CH2-SD 3.86Å; W531-M565 HydrophobicContact CZ2-SD 3.95Å; F561-M565 HydrophobicContact CZ-SD 4.45Å; M565-E567 PolarHBondContact O-N 2.85Å; M565-W611 HydrophobicContact CE-CZ2 4.4Å; M565-W611 WeakPolarHBondContact O-CH2 3.49Å; M565-V614 HydrophobicContact CE-CB 4.34Å; M565-V614 HydrophobicContact CE-CG1 3.66Å; M565-V614 HydrophobicContact SD-CG1 3.6Å; M565-V614 VanDerWaalsContact SD-CG1 3.6Å
566	P	89.2	Confident	88.4	Confident	99 Å²	99	68.3 Å²	68.3	64%	0.643	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-39.2	-165.1	-27.8	36.4	0	0	0	117.1	A563 T564	A563-P566 VanDerWaalsContact O-CD 3.31Å; A563-P566 WeakPolarHBondContact O-CD 3.45Å; T564-P566 WeakPolarHBondContact O-CD 3.42Å
567	E	87.3	Confident	88.1	Confident	169 Å²	169	67.7 Å²	67.7	79%	0.79	39%	0.391	S	S	*	.	S	Bend	trans	-98.7	-15.7	-162.7	-60.2	-163	105.6	0	0	114.7	M565 D569 A570	M565-E567 PolarHBondContact O-N 2.85Å; E567-D569 PolarHBondContact O-N 3.41Å; E567-D569 VanDerWaalsContact O-N 3.08Å; E567-A570 WeakPolarHBondContact O-CB 3.43Å; E567-A570 PolarHBondContact O-N 3.4Å
568	A	86.2	Confident	87.9	Confident	25 Å²	25	66.9 Å²	66.9	21%	0.207	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-20.3	-177.3	0	0	0	0	0	114	F528 W531 A570 E571 W611	F528-A568 HydrophobicContact CE2-CB 4.36Å; F528-A568 WeakPolarHBondContact CE2-O 3.31Å; W531-A568 HydrophobicContact CD2-CB 4.47Å; W531-A568 HydrophobicContact CE3-CB 4.03Å; W531-A568 HydrophobicContact CH2-CB 3.65Å; W531-A568 HydrophobicContact CZ2-CB 4.11Å; W531-A568 HydrophobicContact CZ3-CB 3.61Å; A568-A570 PolarHBondContact O-N 3.42Å; A568-E571 PolarHBondContact O-N 3.14Å; A568-W611 HydrophobicContact CB-CH2 4.15Å; A568-W611 HydrophobicContact CB-CZ3 3.89Å
569	D	88.8	Confident	87.3	Confident	43 Å²	43	68.9 Å²	68.9	23%	0.23	39%	0.388	C	S	.	.	H	α-helix	trans	-61.6	-25.4	174.2	-166.3	83.6	0	0	0	113	E567 E571 R572 Q573 W611	E567-D569 PolarHBondContact O-N 3.41Å; E567-D569 VanDerWaalsContact O-N 3.08Å; D569-E571 VanDerWaalsContact C-N 3.35Å; D569-E571 PolarHBondContact O-N 3.36Å; D569-R572 VanDerWaalsContact O-CB 3.31Å; D569-R572 WeakPolarHBondContact O-CB 3.42Å; D569-R572 PolarHBondContact O-N 3.3Å; D569-R572 IonicContact OD1-CZ 3.44Å; D569-R572 IonicContact OD1-NE 3.11Å; D569-R572 PolarHBondContact OD1-NE 3.32Å; D569-R572 IonicContact OD1-NH2 2.77Å; D569-R572 PolarHBondContact OD1-NH2 3.46Å; D569-R572 IonicContact OD2-CZ 3.19Å; D569-R572 IonicContact OD2-NE 2.72Å; D569-R572 IonicContact OD2-NH2 2.88Å; D569-R572 PolarHBondContact OD2-NH2 3.24Å; D569-Q573 PolarHBondContact O-N 3.32Å; D569-Q573 PolarHBondContact OD2-NE2 3.24Å; D569-W611 HydrophobicContact CB-CH2 3.97Å; D569-W611 HydrophobicContact CB-CZ2 4.29Å; D569-W611 HydrophobicContact CB-CZ3 4.48Å
570	A	88	Confident	86.9	Confident	69 Å²	69	69.8 Å²	69.8	57%	0.57	40%	0.397	S	S	*	.	H	α-helix	trans	-62.3	-41.1	176.9	0	0	0	0	0	112.1	E567 A568 Q573 A574	E567-A570 WeakPolarHBondContact O-CB 3.43Å; E567-A570 PolarHBondContact O-N 3.4Å; A568-A570 PolarHBondContact O-N 3.42Å; A570-Q573 PolarHBondContact O-N 2.96Å; A570-A574 WeakPolarHBondContact O-CB 3.28Å; A570-A574 PolarHBondContact O-N 3.23Å
571	E	87	Confident	86.6	Confident	61 Å²	61	66.8 Å²	66.8	29%	0.285	38%	0.382	S	S	.	.	H	α-helix	trans	-71.5	-37.6	178.8	-176.3	58.3	-167.3	0	0	111.4	R524 A568 D569 Q573 A574 I575	R524-E571 WeakPolarHBondContact CB-OE1 3.29Å; R524-E571 IonicContact CZ-OE1 2.78Å; R524-E571 VanDerWaalsContact CZ-OE1 3.26Å; R524-E571 IonicContact CZ-OE2 3.81Å; R524-E571 IonicContact NE-OE1 3.71Å; R524-E571 PolarHBondContact NE-OE1 3Å; R524-E571 IonicContact NE-OE2 2.72Å; R524-E571 VanDerWaalsContact NH2-CD 3.27Å; R524-E571 IonicContact NH2-OE1 3.7Å; R524-E571 PolarHBondContact NH2-OE1 3.28Å; R524-E571 IonicContact NH2-OE2 3.7Å; R524-E571 PolarHBondContact NH2-OE2 3.46Å; A568-E571 PolarHBondContact O-N 3.14Å; D569-E571 VanDerWaalsContact C-N 3.35Å; D569-E571 PolarHBondContact O-N 3.36Å; E571-Q573 PolarHBondContact O-N 3.38Å; E571-A574 PolarHBondContact O-N 2.95Å; E571-I575 HydrophobicContact CG-CD1 4.09Å; E571-I575 HydrophobicContact CG-CG1 4.22Å; E571-I575 VanDerWaalsContact O-CD1 3.3Å; E571-I575 WeakPolarHBondContact O-CD1 3.15Å; E571-I575 VanDerWaalsContact O-CG1 3.24Å; E571-I575 WeakPolarHBondContact O-CG1 3.45Å; E571-I575 PolarHBondContact O-N 3.39Å
572	R	89.2	Confident	86	Confident	48 Å²	48	65.4 Å²	65.4	18%	0.181	38%	0.376	C	S	.	.	H	α-helix	trans	-50.2	-32.1	171.3	-166.7	-173.5	57.8	58	5.6	112.7	F528 D569	F528-R572 HydrophobicContact CD1-CB 4.36Å; F528-R572 HydrophobicContact CD1-CG 4.39Å; F528-R572 HydrophobicContact CE1-CB 3.71Å; F528-R572 HydrophobicContact CE1-CG 3.52Å; F528-R572 HydrophobicContact CE2-CB 3.99Å; F528-R572 HydrophobicContact CZ-CB 3.51Å; F528-R572 HydrophobicContact CZ-CG 3.66Å; D569-R572 VanDerWaalsContact O-CB 3.31Å; D569-R572 WeakPolarHBondContact O-CB 3.42Å; D569-R572 PolarHBondContact O-N 3.3Å; D569-R572 IonicContact OD1-CZ 3.44Å; D569-R572 IonicContact OD1-NE 3.11Å; D569-R572 PolarHBondContact OD1-NE 3.32Å; D569-R572 IonicContact OD1-NH2 2.77Å; D569-R572 PolarHBondContact OD1-NH2 3.46Å; D569-R572 IonicContact OD2-CZ 3.19Å; D569-R572 IonicContact OD2-NE 2.72Å; D569-R572 IonicContact OD2-NH2 2.88Å; D569-R572 PolarHBondContact OD2-NH2 3.24Å
573	Q	86.7	Confident	85.3	Confident	114 Å²	114	67.1 Å²	67.1	53%	0.533	39%	0.386	S	S	.	.	H	α-helix	trans	-90.3	-36.6	176.8	-59.6	-173	53.2	0	0	112.4	D569 A570 E571 L576	D569-Q573 PolarHBondContact O-N 3.32Å; D569-Q573 PolarHBondContact OD2-NE2 3.24Å; A570-Q573 PolarHBondContact O-N 2.96Å; E571-Q573 PolarHBondContact O-N 3.38Å; Q573-L576 WeakPolarHBondContact O-CG 3.36Å; Q573-L576 PolarHBondContact O-N 3.17Å
574	A	87.2	Confident	84.9	Confident	49 Å²	49	69.1 Å²	69.1	41%	0.405	38%	0.38	S	S	.	.	H	α-helix	trans	-72.2	-26.1	-178.7	0	0	0	0	0	114.7	A570 E571 L576	A570-A574 WeakPolarHBondContact O-CB 3.28Å; A570-A574 PolarHBondContact O-N 3.23Å; E571-A574 PolarHBondContact O-N 2.95Å; A574-L576 PolarHBondContact O-N 3.24Å
575	I	84.9	Confident	84.3	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-53.7	-37.8	173	-76.5	155.5	0	0	0	112.5	F521 R524 F528 E571 G577	F521-I575 HydrophobicContact CD2-CG2 4.28Å; F521-I575 HydrophobicContact CE2-CG2 3.77Å; F521-I575 HydrophobicContact CZ-CG2 4.19Å; R524-I575 HydrophobicContact CB-CG1 3.9Å; F528-I575 HydrophobicContact CB-CD1 3.81Å; F528-I575 HydrophobicContact CD1-CD1 4.08Å; F528-I575 HydrophobicContact CG-CD1 4.07Å; E571-I575 HydrophobicContact CG-CD1 4.09Å; E571-I575 HydrophobicContact CG-CG1 4.22Å; E571-I575 VanDerWaalsContact O-CD1 3.3Å; E571-I575 WeakPolarHBondContact O-CD1 3.15Å; E571-I575 VanDerWaalsContact O-CG1 3.24Å; E571-I575 WeakPolarHBondContact O-CG1 3.45Å; E571-I575 PolarHBondContact O-N 3.39Å; I575-G577 PolarHBondContact O-N 3.42Å
576	L	83.6	Confident	83.4	Confident	83 Å²	83	65.7 Å²	65.7	44%	0.435	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-66.9	-18.8	-157.7	-55.6	177.3	0	0	0	114.6	Q573 A574 T604	Q573-L576 WeakPolarHBondContact O-CG 3.36Å; Q573-L576 PolarHBondContact O-N 3.17Å; A574-L576 PolarHBondContact O-N 3.24Å; L576-T604 HydrophobicContact CD2-CG2 3.61Å
577	G	83.9	Confident	82.8	Confident	52 Å²	52	67.8 Å²	67.8	54%	0.536	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-74.2	-31.8	-174.4	0	0	0	0	0	115.5	I575 H579 N580	I575-G577 PolarHBondContact O-N 3.42Å; G577-H579 PolarHBondContact O-N 3.2Å; G577-N580 PolarHBondContact O-ND2 3.38Å
578	I	84.3	Confident	82.4	Confident	37 Å²	37	63.6 Å²	63.6	19%	0.19	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-35.3	-157.6	-58.7	175.2	0	0	0	113.4	E520 F521 N580 E581	E520-I578 HydrophobicContact CB-CG2 4.42Å; E520-I578 HydrophobicContact CG-CD1 4.29Å; F521-I578 HydrophobicContact CB-CB 4.09Å; F521-I578 HydrophobicContact CB-CG2 4Å; F521-I578 HydrophobicContact CD2-CB 4.22Å; I578-N580 PolarHBondContact O-N 2.84Å; I578-N580 VanDerWaalsContact O-N 3.09Å; I578-E581 PolarHBondContact O-N 2.76Å
579	H	79.4	Confident	81.8	Confident	54 Å²	54	68.9 Å²	68.9	25%	0.25	37%	0.366	C	S	.	.	H	α-helix	trans	-55.9	-34	-175.1	-166	122.1	0	0	0	113.2	F521 G577 E581 V582 Q583	F521-H579 HydrophobicContact CD2-CB 4.19Å; F521-H579 HydrophobicContact CE2-CB 4.3Å; G577-H579 PolarHBondContact O-N 3.2Å; H579-E581 VanDerWaalsContact C-N 3.26Å; H579-E581 PolarHBondContact O-N 2.71Å; H579-V582 PolarHBondContact O-N 2.8Å; H579-Q583 PolarHBondContact CD2-NE2 3.05Å; H579-Q583 VanDerWaalsContact CD2-NE2 3.31Å; H579-Q583 PolarHBondContact NE2-NE2 2.8Å
580	N	81.3	Confident	80.7	Confident	121 Å²	121	70.7 Å²	70.7	65%	0.647	40%	0.395	S	S	*	.	H	α-helix	trans	-61.4	-29.3	-173.6	-58.1	-80.2	0	0	0	113.7	G577 I578	G577-N580 PolarHBondContact O-ND2 3.38Å; I578-N580 PolarHBondContact O-N 2.84Å; I578-N580 VanDerWaalsContact O-N 3.09Å
581	E	81.1	Confident	79.6	Confident	89 Å²	89	68.7 Å²	68.7	42%	0.416	37%	0.374	S	S	.	.	H	α-helix	trans	-81.3	-20.5	-178.2	-172.5	63.3	-172.7	0	0	112.6	L517 I578 H579 K584	L517-E581 HydrophobicContact CD1-CB 4.48Å; L517-E581 HydrophobicContact CD1-CG 3.97Å; I578-E581 PolarHBondContact O-N 2.76Å; H579-E581 VanDerWaalsContact C-N 3.26Å; H579-E581 PolarHBondContact O-N 2.71Å; E581-K584 VanDerWaalsContact CD-CD 3.5Å; E581-K584 WeakPolarHBondContact O-CB 3.38Å; E581-K584 WeakPolarHBondContact OE1-CD 3.41Å; E581-K584 IonicContact OE1-NZ 2.69Å; E581-K584 PolarHBondContact OE1-NZ 2.78Å; E581-K584 VanDerWaalsContact OE2-CD 3.28Å; E581-K584 WeakPolarHBondContact OE2-CD 3.37Å; E581-K584 IonicContact OE2-NZ 3.47Å; E581-K584 PolarHBondContact OE2-NZ 3.43Å
582	V	77.3	Confident	78.4	Confident	1 Å²	1	70.7 Å²	70.7	1%	0.006	38%	0.382	C	S	.	.	H	α-helix	trans	-78.8	-41.8	-169.7	-157.7	0	0	0	0	112.7	I514 L517 F518 H579 K584 I585	I514-V582 HydrophobicContact CG2-CG1 3.77Å; I514-V582 WeakPolarHBondContact O-CG1 3.33Å; L517-V582 HydrophobicContact CB-CB 4.39Å; L517-V582 HydrophobicContact CB-CG1 4.15Å; L517-V582 HydrophobicContact CB-CG2 3.62Å; F518-V582 HydrophobicContact CD1-CB 3.96Å; F518-V582 HydrophobicContact CD1-CG1 3.81Å; F518-V582 HydrophobicContact CD1-CG2 3.88Å; F518-V582 HydrophobicContact CD2-CG1 3.62Å; F518-V582 HydrophobicContact CE1-CB 3.73Å; F518-V582 HydrophobicContact CE1-CG1 3.81Å; F518-V582 HydrophobicContact CE1-CG2 4.05Å; F518-V582 HydrophobicContact CE2-CB 4.36Å; F518-V582 HydrophobicContact CE2-CG1 3.6Å; F518-V582 HydrophobicContact CG-CB 4.38Å; F518-V582 HydrophobicContact CG-CG1 3.72Å; F518-V582 HydrophobicContact CG-CG2 4.42Å; F518-V582 HydrophobicContact CZ-CB 3.95Å; F518-V582 HydrophobicContact CZ-CG1 3.71Å; H579-V582 PolarHBondContact O-N 2.8Å; V582-K584 PolarHBondContact O-N 2.77Å; V582-K584 VanDerWaalsContact O-N 3.1Å; V582-I585 PolarHBondContact O-N 3.39Å; V582-I585 VanDerWaalsContact O-N 3.11Å
583	Q	76.5	Confident	76.5	Confident	108 Å²	108	72.6 Å²	72.6	51%	0.505	41%	0.408	S	S	.	.	H	α-helix	trans	-61.1	-22.5	-179.6	-58.3	-177.8	7.2	0	0	112.8	H579 Q587	H579-Q583 PolarHBondContact CD2-NE2 3.05Å; H579-Q583 VanDerWaalsContact CD2-NE2 3.31Å; H579-Q583 PolarHBondContact NE2-NE2 2.8Å; Q583-Q587 PolarHBondContact O-NE2 3.35Å
584	K	81.1	Confident	75.1	Confident	120 Å²	120	73.8 Å²	73.8	52%	0.522	42%	0.418	S	S	.	.	H	α-helix	trans	-63.4	-39.2	176	-163.7	-176	-173.5	179.4	0	112.9	E581 V582	E581-K584 VanDerWaalsContact CD-CD 3.5Å; E581-K584 WeakPolarHBondContact O-CB 3.38Å; E581-K584 WeakPolarHBondContact OE1-CD 3.41Å; E581-K584 IonicContact OE1-NZ 2.69Å; E581-K584 PolarHBondContact OE1-NZ 2.78Å; E581-K584 VanDerWaalsContact OE2-CD 3.28Å; E581-K584 WeakPolarHBondContact OE2-CD 3.37Å; E581-K584 IonicContact OE2-NZ 3.47Å; E581-K584 PolarHBondContact OE2-NZ 3.43Å; V582-K584 PolarHBondContact O-N 2.77Å; V582-K584 VanDerWaalsContact O-N 3.1Å
585	I	77.1	Confident	74	Confident	32 Å²	32	74 Å²	74	16%	0.164	41%	0.412	C	S	.	.	H	α-helix	trans	-75.8	-42.2	-167.9	-57.4	-178.1	0	0	0	111.4	T513 I514 L517 V582 Q587 S588	T513-I585 HydrophobicContact CG2-CG2 4.04Å; T513-I585 WeakPolarHBondContact O-CD1 3.5Å; I514-I585 HydrophobicContact CG1-CB 4.33Å; I514-I585 HydrophobicContact CG1-CG2 3.87Å; L517-I585 HydrophobicContact CD1-CD1 3.72Å; V582-I585 PolarHBondContact O-N 3.39Å; V582-I585 VanDerWaalsContact O-N 3.11Å; I585-Q587 PolarHBondContact O-N 3.47Å; I585-Q587 VanDerWaalsContact O-N 3.07Å; I585-S588 WeakPolarHBondContact O-CB 3.24Å; I585-S588 PolarHBondContact O-N 3.44Å; I585-S588 PolarHBondContact O-OG 3.4Å
586	S	71.9	Confident	73.2	Confident	5 Å²	5	80.7 Å²	80.7	4%	0.035	45%	0.446	C	S	.	.	H	α-helix	trans	-43.4	-44.2	177.1	172.7	0	0	0	0	113.4	S588 K592 I595	S586-S588 VanDerWaalsContact C-N 3.26Å; S586-S588 PolarHBondContact O-N 3.33Å; S586-K592 PolarHBondContact OG-O 3.09Å; S586-I595 WeakPolarHBondContact OG-CD1 3.44Å
587	Q	76.9	Confident	72.7	Confident	143 Å²	143	77.3 Å²	77.3	67%	0.668	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-20.6	-173.5	-61.3	168.1	63.9	0	0	113.5	Q583 I585	Q583-Q587 PolarHBondContact O-NE2 3.35Å; I585-Q587 PolarHBondContact O-N 3.47Å; I585-Q587 VanDerWaalsContact O-N 3.07Å
588	S	78	Confident	72.2	Confident	82 Å²	82	78.2 Å²	78.2	57%	0.573	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-21.9	-170.5	65	0	0	0	0	115.4	I585 S586	I585-S588 WeakPolarHBondContact O-CB 3.24Å; I585-S588 PolarHBondContact O-N 3.44Å; I585-S588 PolarHBondContact O-OG 3.4Å; S586-S588 VanDerWaalsContact C-N 3.26Å; S586-S588 PolarHBondContact O-N 3.33Å
589	Y	74.3	Confident	71.8	Confident	135 Å²	135	80.4 Å²	80.4	53%	0.529	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	7	-171.9	-77.7	-74.9	0	0	0	114.6	L510 I591	L510-Y589 HydrophobicContact CD2-CE1 4.2Å; Y589-I591 HydrophobicContact CG-CD1 4.35Å; Y589-I591 PolarHBondContact O-N 3.47Å
590	G	65.3	Low	71.7	Confident	81 Å²	81	78.6 Å²	78.6	84%	0.835	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.9	22.9	-171.2	0	0	0	0	0	113.3
591	I	65.6	Low	71.3	Confident	27 Å²	27	78.9 Å²	78.9	14%	0.138	43%	0.431	C	S	.	.			trans	-82.1	145.8	179.9	-65.5	171.8	0	0	0	109.8	L511 I514 Y589 A593 I595	L511-I591 HydrophobicContact CD2-CD1 4.02Å; L511-I591 HydrophobicContact CD2-CG1 4.47Å; L511-I591 HydrophobicContact CD2-CG2 3.84Å; I514-I591 HydrophobicContact CD1-CD1 4.18Å; I514-I591 HydrophobicContact CD1-CG2 4.21Å; Y589-I591 HydrophobicContact CG-CD1 4.35Å; Y589-I591 PolarHBondContact O-N 3.47Å; I591-A593 WeakPolarHBondContact O-CA 3.46Å; I591-A593 PolarHBondContact O-N 3.27Å; I591-I595 HydrophobicContact CG2-CD1 4.28Å
592	K	59.8	Low	71.1	Confident	104 Å²	104	76.1 Å²	76.1	45%	0.452	42%	0.419	S	S	.	.			trans	-26.9	97.5	174.2	-58.7	-179.8	-175.7	-178.9	0	111.5	T431 T433 E436 S586 N594 I595	T431-K592 WeakPolarHBondContact O-CE 3.47Å; T431-K592 PolarHBondContact O-NZ 3.19Å; T433-K592 HydrophobicContact CG2-CD 4.19Å; E436-K592 IonicContact OE2-NZ 2.65Å; S586-K592 PolarHBondContact OG-O 3.09Å; K592-N594 PolarHBondContact O-N 3.41Å; K592-I595 VanDerWaalsContact O-CG1 3.26Å; K592-I595 WeakPolarHBondContact O-CG1 3.29Å
593	A	51	Low	71.2	Confident	88 Å²	88	78.8 Å²	78.8	73%	0.727	44%	0.435	S	S	*	.	S	Bend	trans	-80.7	35.9	-161.9	0	0	0	0	0	115.1	I591	I591-A593 WeakPolarHBondContact O-CA 3.46Å; I591-A593 PolarHBondContact O-N 3.27Å
594	N	57.3	Low	71.3	Confident	138 Å²	138	76.7 Å²	76.7	74%	0.738	43%	0.43	S	S	*	.			trans	-150.7	110.4	169.8	179.2	9.8	0	0	0	107.3	K592	K592-N594 PolarHBondContact O-N 3.41Å
595	I	63.6	Low	71.2	Confident	54 Å²	54	76 Å²	76	28%	0.277	43%	0.429	S	S	.	.			trans	-136.9	109.9	-174.1	-46.8	-176.4	0	0	0	108.5	I514 F518 S586 I591 K592	I514-I595 HydrophobicContact CD1-CD1 3.74Å; I514-I595 HydrophobicContact CG2-CD1 4.35Å; F518-I595 HydrophobicContact CE2-CB 4.34Å; F518-I595 HydrophobicContact CE2-CG2 3.63Å; F518-I595 HydrophobicContact CZ-CG2 4.33Å; S586-I595 WeakPolarHBondContact OG-CD1 3.44Å; I591-I595 HydrophobicContact CG2-CD1 4.28Å; K592-I595 VanDerWaalsContact O-CG1 3.26Å; K592-I595 WeakPolarHBondContact O-CG1 3.29Å
596	I	67.3	Low	71.5	Confident	141 Å²	141	77.9 Å²	77.9	72%	0.723	44%	0.436	S	S	*	.			trans	-83.1	150.8	171	-59.7	168.1	0	0	0	108	P598	I596-P598 VanDerWaalsContact O-CD 3.3Å; I596-P598 WeakPolarHBondContact O-CD 3.37Å
597	N	73.8	Confident	72	Confident	11 Å²	11	78 Å²	78	6%	0.059	44%	0.436	C	S	.	.			trans	-59.9	118.7	178.6	-172.2	-28.8	0	0	0	110.9	F518 F521 Y599 S600	F518-N597 HydrophobicContact CD1-CB 3.46Å; F518-N597 VanDerWaalsContact CD1-CB 3.46Å; F518-N597 VanDerWaalsContact CD1-CG 3.41Å; F518-N597 WeakPolarHBondContact CD1-ND2 3.42Å; F518-N597 HydrophobicContact CE1-CB 3.73Å; F518-N597 HydrophobicContact CG-CB 4.03Å; F518-N597 HydrophobicContact CZ-CB 4.48Å; F518-N597 PolarHBondContact O-ND2 3.39Å; F518-N597 VanDerWaalsContact O-ND2 3.16Å; F521-N597 WeakPolarHBondContact CD1-ND2 3.24Å; N597-Y599 VanDerWaalsContact C-N 3.32Å; N597-Y599 PolarHBondContact O-N 3.11Å; N597-Y599 WeakPolarHBondContact OD1-CA 3.28Å; N597-Y599 PolarHBondContact OD1-N 3.41Å; N597-S600 PolarHBondContact OD1-N 3.49Å; N597-S600 VanDerWaalsContact OD1-N 3.11Å
598	P	72.6	Confident	72.3	Confident	72 Å²	72	75.5 Å²	75.5	47%	0.468	43%	0.427	S	S	.	.	S	Bend	trans	-82.7	-5.2	-179.1	34.4	-35.9	0	0	0	114.1	F518 I596	F518-P598 HydrophobicContact CD2-CG 4.48Å; I596-P598 VanDerWaalsContact O-CD 3.3Å; I596-P598 WeakPolarHBondContact O-CD 3.37Å
599	Y	76.4	Confident	72.8	Confident	83 Å²	83	76.9 Å²	76.9	33%	0.325	43%	0.428	S	S	.	.	S	Bend	trans	-121.8	-7.2	-170.9	-53.3	-43.8	0	0	0	114.3	D515 F518 L519 A522 N597	D515-Y599 HydrophobicContact CB-CE2 4Å; D515-Y599 WeakPolarHBondContact OD2-CE2 3.41Å; F518-Y599 HydrophobicContact CB-CD2 4.26Å; L519-Y599 HydrophobicContact CB-CD2 3.93Å; L519-Y599 HydrophobicContact CB-CE2 4.33Å; L519-Y599 HydrophobicContact CD1-CD2 4.3Å; A522-Y599 VanDerWaalsContact CB-O 3.29Å; A522-Y599 WeakPolarHBondContact CB-O 3.31Å; N597-Y599 VanDerWaalsContact C-N 3.32Å; N597-Y599 PolarHBondContact O-N 3.11Å; N597-Y599 WeakPolarHBondContact OD1-CA 3.28Å; N597-Y599 PolarHBondContact OD1-N 3.41Å
600	S	77.9	Confident	73.2	Confident	15 Å²	15	71 Å²	71	11%	0.105	41%	0.406	C	S	.	.			trans	-134.9	108.4	167.6	-169.9	0	0	0	0	110.3	S525 N597	S525-S600 PolarHBondContact OG-OG 3.16Å; N597-S600 PolarHBondContact OD1-N 3.49Å; N597-S600 VanDerWaalsContact OD1-N 3.11Å
601	T	72.4	Confident	74.5	Confident	128 Å²	128	69.3 Å²	69.3	79%	0.785	37%	0.374	S	S	*	.			trans	-88.7	-12.7	168.2	52.1	0	0	0	0	112.1	T603	T601-T603 PolarHBondContact O-N 3.49Å
602	I	77.4	Confident	75.5	Confident	31 Å²	31	73 Å²	73	16%	0.159	39%	0.391	C	S	.	.			trans	-72.7	112.9	-173.7	-48.4	168.9	0	0	0	107.9	N529 E606 L607	N529-I602 HydrophobicContact CB-CD1 3.95Å; N529-I602 HydrophobicContact CB-CG2 4.48Å; I602-E606 WeakPolarHBondContact CA-OE2 3.24Å; I602-E606 HydrophobicContact CG2-CB 4.34Å; I602-E606 HydrophobicContact CG2-CG 4.49Å; I602-L607 HydrophobicContact CG2-CD2 3.67Å; I602-L607 HydrophobicContact CG2-CG 3.93Å
603	T	79.4	Confident	76.8	Confident	56 Å²	56	72.4 Å²	72.4	34%	0.344	39%	0.388	S	S	.	.			trans	-76.9	159.7	-172.7	93.6	0	0	0	0	111.9	T601 E605 E606 L607	T601-T603 PolarHBondContact O-N 3.49Å; T603-E605 VanDerWaalsContact CB-OE1 3.24Å; T603-E605 WeakPolarHBondContact CB-OE1 3.47Å; T603-E605 PolarHBondContact O-N 3.41Å; T603-E605 PolarHBondContact OG1-N 2.98Å; T603-E605 PolarHBondContact OG1-OE1 3.45Å; T603-E606 PolarHBondContact N-OE2 3.35Å; T603-E606 WeakPolarHBondContact O-CB 3.42Å; T603-E606 PolarHBondContact O-N 2.76Å; T603-E606 VanDerWaalsContact O-N 3.11Å; T603-E606 PolarHBondContact OG1-N 3.1Å; T603-L607 WeakPolarHBondContact O-CG 3.41Å; T603-L607 PolarHBondContact O-N 3.44Å
604	T	78.6	Confident	78.5	Confident	65 Å²	65	68.3 Å²	68.3	40%	0.399	35%	0.354	S	S	.	.	H	α-helix	trans	-59	-33.2	172.3	22.6	0	0	0	0	112.6	L576 L608	L576-T604 HydrophobicContact CD2-CG2 3.61Å; T604-L608 WeakPolarHBondContact O-CD1 3.41Å; T604-L608 VanDerWaalsContact O-CG 3.23Å; T604-L608 WeakPolarHBondContact O-CG 3.23Å; T604-L608 PolarHBondContact O-N 3.13Å
605	E	79.1	Confident	80.1	Confident	106 Å²	106	68 Å²	68	50%	0.495	35%	0.346	S	S	.	.	H	α-helix	trans	-75.2	-35.4	174.4	-39.5	75.4	66.6	0	0	111.4	T603 L608 N609	T603-E605 VanDerWaalsContact CB-OE1 3.24Å; T603-E605 WeakPolarHBondContact CB-OE1 3.47Å; T603-E605 PolarHBondContact O-N 3.41Å; T603-E605 PolarHBondContact OG1-N 2.98Å; T603-E605 PolarHBondContact OG1-OE1 3.45Å; E605-L608 WeakPolarHBondContact O-CB 3.5Å; E605-L608 PolarHBondContact O-N 3.22Å; E605-N609 WeakPolarHBondContact O-CB 3.48Å; E605-N609 PolarHBondContact O-N 3.01Å; E605-N609 PolarHBondContact O-ND2 3.05Å
606	E	81.9	Confident	81.3	Confident	70 Å²	70	72.4 Å²	72.4	33%	0.327	36%	0.363	S	S	.	.	H	α-helix	trans	-67.1	-42.7	176.8	-161.9	-162.7	148	0	0	111.5	I602 T603 L608 N609 K610	I602-E606 WeakPolarHBondContact CA-OE2 3.24Å; I602-E606 HydrophobicContact CG2-CB 4.34Å; I602-E606 HydrophobicContact CG2-CG 4.49Å; T603-E606 PolarHBondContact N-OE2 3.35Å; T603-E606 WeakPolarHBondContact O-CB 3.42Å; T603-E606 PolarHBondContact O-N 2.76Å; T603-E606 VanDerWaalsContact O-N 3.11Å; T603-E606 PolarHBondContact OG1-N 3.1Å; E606-L608 VanDerWaalsContact C-N 3.27Å; E606-L608 PolarHBondContact O-N 3.22Å; E606-N609 CarbonylContact O-C 3.23Å; E606-N609 WeakPolarHBondContact O-CA 3.45Å; E606-N609 PolarHBondContact O-N 3.25Å; E606-K610 PolarHBondContact O-N 3.41Å; E606-K610 WeakPolarHBondContact OE1-CE 3.46Å; E606-K610 IonicContact OE1-NZ 2.65Å; E606-K610 PolarHBondContact OE1-NZ 2.64Å
607	L	83.6	Confident	82.2	Confident	7 Å²	7	66.4 Å²	66.4	4%	0.037	33%	0.333	C	S	.	.	H	α-helix	trans	-58.3	-40.5	172	-70.7	178.6	0	0	0	111.6	F528 N529 M532 I602 T603 N609 K610	F528-L607 HydrophobicContact CD1-CD2 4.13Å; N529-L607 HydrophobicContact CB-CD2 3.61Å; M532-L607 HydrophobicContact CE-CD2 4.13Å; I602-L607 HydrophobicContact CG2-CD2 3.67Å; I602-L607 HydrophobicContact CG2-CG 3.93Å; T603-L607 WeakPolarHBondContact O-CG 3.41Å; T603-L607 PolarHBondContact O-N 3.44Å; L607-N609 VanDerWaalsContact C-N 3.31Å; L607-N609 PolarHBondContact O-N 3.49Å; L607-K610 PolarHBondContact O-N 2.88Å
608	L	84.1	Confident	83	Confident	91 Å²	91	67 Å²	67	48%	0.476	34%	0.337	S	S	.	.	H	α-helix	trans	-66.9	-34	175.1	-69	166.4	0	0	0	111.9	T604 E605 E606 K610	T604-L608 WeakPolarHBondContact O-CD1 3.41Å; T604-L608 VanDerWaalsContact O-CG 3.23Å; T604-L608 WeakPolarHBondContact O-CG 3.23Å; T604-L608 PolarHBondContact O-N 3.13Å; E605-L608 WeakPolarHBondContact O-CB 3.5Å; E605-L608 PolarHBondContact O-N 3.22Å; E606-L608 VanDerWaalsContact C-N 3.27Å; E606-L608 PolarHBondContact O-N 3.22Å; L608-K610 PolarHBondContact O-N 3.22Å
609	N	86.6	Confident	83.7	Confident	112 Å²	112	68.1 Å²	68.1	60%	0.599	34%	0.344	S	S	*	.	H	α-helix	trans	-82.9	21.6	176.9	-80.2	-91.2	0	0	0	114.2	E605 E606 L607 K613	E605-N609 WeakPolarHBondContact O-CB 3.48Å; E605-N609 PolarHBondContact O-N 3.01Å; E605-N609 PolarHBondContact O-ND2 3.05Å; E606-N609 CarbonylContact O-C 3.23Å; E606-N609 WeakPolarHBondContact O-CA 3.45Å; E606-N609 PolarHBondContact O-N 3.25Å; L607-N609 VanDerWaalsContact C-N 3.31Å; L607-N609 PolarHBondContact O-N 3.49Å; N609-K613 WeakPolarHBondContact O-CE 3.47Å; N609-K613 PolarHBondContact O-NZ 3.04Å
610	K	84.3	Confident	84.2	Confident	12 Å²	12	69.4 Å²	69.4	5%	0.052	35%	0.352	C	S	.	.	H	α-helix	trans	-120.6	-35.1	171.8	-75.9	170.6	-175	-178.6	0	114.1	N529 M532 E533 E606 L607 L608 E612 K613	N529-K610 PolarHBondContact ND2-NZ 3.45Å; N529-K610 WeakPolarHBondContact OD1-CD 3.29Å; N529-K610 WeakPolarHBondContact OD1-CE 3.35Å; N529-K610 PolarHBondContact OD1-NZ 3.12Å; M532-K610 HydrophobicContact CB-CB 4.26Å; M532-K610 HydrophobicContact CE-CB 3.84Å; M532-K610 HydrophobicContact SD-CB 3.92Å; E533-K610 WeakPolarHBondContact OE1-CE 3.48Å; E533-K610 IonicContact OE1-NZ 2.87Å; E533-K610 PolarHBondContact OE1-NZ 3.26Å; E606-K610 PolarHBondContact O-N 3.41Å; E606-K610 WeakPolarHBondContact OE1-CE 3.46Å; E606-K610 IonicContact OE1-NZ 2.65Å; E606-K610 PolarHBondContact OE1-NZ 2.64Å; L607-K610 PolarHBondContact O-N 2.88Å; L608-K610 PolarHBondContact O-N 3.22Å; K610-E612 VanDerWaalsContact C-N 3.3Å; K610-E612 PolarHBondContact O-N 3.41Å; K610-K613 HydrophobicContact CG-CD 4.46Å; K610-K613 WeakPolarHBondContact O-CB 3.38Å; K610-K613 PolarHBondContact O-N 3.37Å
611	W	91.1	Very high	84.7	Confident	45 Å²	45	70.1 Å²	70.1	17%	0.17	35%	0.353	C	S	.	.	H	α-helix	trans	-52.7	-44.1	177.3	-173.8	-92	0	0	0	113.4	F528 W531 M532 M565 A568 D569 K613	F528-W611 HydrophobicContact CE2-CE3 4.25Å; F528-W611 HydrophobicContact CE2-CZ3 4.07Å; F528-W611 AromaticContact CZ-CE3 3.96Å; F528-W611 HydrophobicContact CZ-CE3 3.96Å; F528-W611 HydrophobicContact CZ-CZ3 4.22Å; W531-W611 HydrophobicContact CH2-CH2 4.36Å; W531-W611 AromaticContact CH2-CZ3 3.89Å; W531-W611 HydrophobicContact CH2-CZ3 3.89Å; W531-W611 AromaticContact CZ3-CE3 3.98Å; W531-W611 HydrophobicContact CZ3-CE3 3.98Å; W531-W611 HydrophobicContact CZ3-CH2 4.45Å; W531-W611 AromaticContact CZ3-CZ3 3.56Å; W531-W611 HydrophobicContact CZ3-CZ3 3.56Å; M532-W611 HydrophobicContact SD-CB 3.99Å; M532-W611 HydrophobicContact SD-CE3 4.14Å; M532-W611 PolarHBondContact SD-N 2.87Å; M532-W611 VanDerWaalsContact SD-N 3.38Å; M565-W611 HydrophobicContact CE-CZ2 4.4Å; M565-W611 WeakPolarHBondContact O-CH2 3.49Å; A568-W611 HydrophobicContact CB-CH2 4.15Å; A568-W611 HydrophobicContact CB-CZ3 3.89Å; D569-W611 HydrophobicContact CB-CH2 3.97Å; D569-W611 HydrophobicContact CB-CZ2 4.29Å; D569-W611 HydrophobicContact CB-CZ3 4.48Å; W611-K613 PolarHBondContact O-N 3.3Å; W611-K613 VanDerWaalsContact O-N 3.16Å
612	E	88.4	Confident	85.4	Confident	105 Å²	105	66.6 Å²	66.6	49%	0.491	33%	0.33	S	S	.	.	H	α-helix	trans	-70.7	-6	179.6	-62.6	-64.9	106.6	0	0	114.4	K610 K615	K610-E612 VanDerWaalsContact C-N 3.3Å; K610-E612 PolarHBondContact O-N 3.41Å; E612-K615 WeakPolarHBondContact OE1-CD 3.36Å; E612-K615 IonicContact OE1-NZ 3.97Å; E612-K615 PolarHBondContact OE1-NZ 3.45Å; E612-K615 WeakPolarHBondContact OE2-CD 3.49Å; E612-K615 IonicContact OE2-NZ 3.38Å; E612-K615 PolarHBondContact OE2-NZ 2.85Å
613	K	85.5	Confident	85.9	Confident	91 Å²	91	67 Å²	67	40%	0.396	34%	0.342	S	S	.	.	H	α-helix	trans	-89.8	-45.2	177.5	-59.8	173.4	178.3	143.8	0	112.1	M536 N609 K610 W611 K615 K616 L617	M536-K613 HydrophobicContact CE-CD 4.16Å; M536-K613 HydrophobicContact CG-CB 4.31Å; M536-K613 HydrophobicContact SD-CB 3.25Å; M536-K613 WeakPolarHBondContact SD-CB 3.38Å; M536-K613 HydrophobicContact SD-CD 3.61Å; M536-K613 HydrophobicContact SD-CG 4.08Å; N609-K613 WeakPolarHBondContact O-CE 3.47Å; N609-K613 PolarHBondContact O-NZ 3.04Å; K610-K613 HydrophobicContact CG-CD 4.46Å; K610-K613 WeakPolarHBondContact O-CB 3.38Å; K610-K613 PolarHBondContact O-N 3.37Å; W611-K613 PolarHBondContact O-N 3.3Å; W611-K613 VanDerWaalsContact O-N 3.16Å; K613-K615 PolarHBondContact O-N 3.49Å; K613-K616 WeakPolarHBondContact O-CB 3.24Å; K613-K616 PolarHBondContact O-N 3.18Å; K613-L617 PolarHBondContact O-N 3.27Å
614	V	88	Confident	86.2	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.006	35%	0.346	C	S	.	.	H	α-helix	trans	-49.2	-51.2	170.3	178.1	0	0	0	0	109.7	M532 A535 M536 F561 M565 K616 L617	M532-V614 HydrophobicContact CB-CG2 4.21Å; M532-V614 HydrophobicContact CG-CG2 4.49Å; M532-V614 WeakPolarHBondContact O-CG2 3.33Å; A535-V614 HydrophobicContact CB-CB 4.36Å; A535-V614 HydrophobicContact CB-CG1 3.78Å; A535-V614 HydrophobicContact CB-CG2 3.66Å; A535-V614 WeakPolarHBondContact O-CG1 3.39Å; A535-V614 WeakPolarHBondContact O-CG2 3.4Å; M536-V614 HydrophobicContact CG-CG2 4.1Å; F561-V614 HydrophobicContact CZ-CG1 4.34Å; M565-V614 HydrophobicContact CE-CB 4.34Å; M565-V614 HydrophobicContact CE-CG1 3.66Å; M565-V614 HydrophobicContact SD-CG1 3.6Å; M565-V614 VanDerWaalsContact SD-CG1 3.6Å; V614-K616 PolarHBondContact O-N 3.02Å; V614-L617 PolarHBondContact O-N 3.07Å
615	K	89.6	Confident	86.7	Confident	132 Å²	132	64.5 Å²	64.5	57%	0.574	33%	0.328	S	S	*	.	H	α-helix	trans	-53.5	-13.3	176.1	-165.6	-177.3	-175.7	-176.2	0	115.6	E612 K613	E612-K615 WeakPolarHBondContact OE1-CD 3.36Å; E612-K615 IonicContact OE1-NZ 3.97Å; E612-K615 PolarHBondContact OE1-NZ 3.45Å; E612-K615 WeakPolarHBondContact OE2-CD 3.49Å; E612-K615 IonicContact OE2-NZ 3.38Å; E612-K615 PolarHBondContact OE2-NZ 2.85Å; K613-K615 PolarHBondContact O-N 3.49Å
616	K	88.6	Confident	87.2	Confident	147 Å²	147	64.9 Å²	64.9	64%	0.639	33%	0.33	S	S	*	.	H	α-helix	trans	-106.2	-39.3	-179.8	178.1	-163.9	167.7	-164.1	0	113.2	K613 V614	K613-K616 WeakPolarHBondContact O-CB 3.24Å; K613-K616 PolarHBondContact O-N 3.18Å; V614-K616 PolarHBondContact O-N 3.02Å
617	L	87.4	Confident	87.4	Confident	15 Å²	15	68.6 Å²	68.6	8%	0.079	35%	0.347	C	S	.	.	H	α-helix	trans	-78.5	-29.9	-165.5	-74.5	171.2	0	0	0	114.2	M536 L539 Q540 K613 V614 P619 Q620	M536-L617 HydrophobicContact CB-CD1 3.78Å; M536-L617 HydrophobicContact CG-CD1 3.84Å; M536-L617 HydrophobicContact SD-CD1 4.48Å; L539-L617 HydrophobicContact CB-CB 3.94Å; L539-L617 HydrophobicContact CD1-CB 3.74Å; Q540-L617 HydrophobicContact CG-CD1 4.12Å; Q540-L617 HydrophobicContact CG-CD2 4.33Å; K613-L617 PolarHBondContact O-N 3.27Å; V614-L617 PolarHBondContact O-N 3.07Å; L617-P619 VanDerWaalsContact C-CD 3.47Å; L617-P619 VanDerWaalsContact O-N 3.09Å; L617-Q620 WeakPolarHBondContact O-CB 3.28Å; L617-Q620 PolarHBondContact O-N 3.44Å
618	V	89.3	Confident	87.5	Confident	24 Å²	24	69.2 Å²	69.2	15%	0.145	35%	0.35	C	S	.	.	H	α-helix	trans	-42.9	-48.8	-171.3	169.7	0	0	0	0	114.8	L539 H558 F561 K562 Q620 R621	L539-V618 HydrophobicContact CD1-CB 4.43Å; L539-V618 HydrophobicContact CD1-CG2 3.55Å; L539-V618 HydrophobicContact CD2-CG2 4.02Å; L539-V618 HydrophobicContact CG-CG2 4.46Å; H558-V618 PolarHBondContact NE2-O 3.18Å; F561-V618 HydrophobicContact CE1-CG2 4.25Å; K562-V618 HydrophobicContact CD-CG1 3.46Å; K562-V618 VanDerWaalsContact CD-CG1 3.46Å; K562-V618 HydrophobicContact CG-CG1 3.7Å; V618-Q620 PolarHBondContact O-N 3.04Å; V618-R621 PolarHBondContact O-N 3.32Å
619	P	88.9	Confident	87.8	Confident	94 Å²	94	66.2 Å²	66.2	61%	0.61	33%	0.334	S	S	*	.	H	α-helix	trans	-75.6	-1.9	-175.6	-15.1	32.4	0	0	0	115	L617	L617-P619 VanDerWaalsContact C-CD 3.47Å; L617-P619 VanDerWaalsContact O-N 3.09Å
620	Q	86.6	Confident	87.8	Confident	110 Å²	110	63.8 Å²	63.8	51%	0.514	33%	0.33	S	S	.	.	H	α-helix	trans	-84.9	-40.3	174.2	-62.7	-176.1	-10	0	0	111.4	L617 V618 D622 G623	L617-Q620 WeakPolarHBondContact O-CB 3.28Å; L617-Q620 PolarHBondContact O-N 3.44Å; V618-Q620 PolarHBondContact O-N 3.04Å; Q620-D622 VanDerWaalsContact C-N 3.27Å; Q620-D622 PolarHBondContact O-N 2.72Å; Q620-G623 PolarHBondContact O-N 3.36Å
621	R	88.6	Confident	87.9	Confident	30 Å²	30	70 Å²	70	11%	0.113	35%	0.353	C	S	.	.	H	α-helix	trans	-58.1	-38.7	176.7	-174.1	64.6	138.8	149	4.1	112.5	D538 D541 V618 G623 S624 L625	D538-R621 VanDerWaalsContact O-CZ 3.22Å; D538-R621 PolarHBondContact O-NE 2.83Å; D538-R621 PolarHBondContact O-NH2 3.36Å; D541-R621 PolarHBondContact O-NH1 3.13Å; D541-R621 IonicContact OD2-CZ 2.96Å; D541-R621 IonicContact OD2-NH1 3.86Å; D541-R621 PolarHBondContact OD2-NH1 3.1Å; D541-R621 IonicContact OD2-NH2 3.86Å; D541-R621 PolarHBondContact OD2-NH2 3.36Å; V618-R621 PolarHBondContact O-N 3.32Å; R621-G623 VanDerWaalsContact C-N 3.26Å; R621-G623 PolarHBondContact O-N 3.19Å; R621-S624 PolarHBondContact O-N 2.87Å; R621-L625 HydrophobicContact CG-CD1 4.21Å; R621-L625 PolarHBondContact O-N 2.99Å
622	D	87.6	Confident	87.6	Confident	55 Å²	55	68.3 Å²	68.3	29%	0.294	35%	0.347	S	S	.	.	H	α-helix	trans	-54.9	-39.8	177.4	-76.2	-46.5	0	0	0	112.6	H558 Q620	H558-D622 IonicContact CD2-OD1 3.66Å; H558-D622 PolarHBondContact CD2-OD1 3.28Å; H558-D622 IonicContact NE2-OD1 3.76Å; H558-D622 PolarHBondContact NE2-OD1 2.84Å; H558-D622 VanDerWaalsContact NE2-OD1 3.16Å; H558-D622 IonicContact NE2-OD2 2.8Å; H558-D622 PolarHBondContact NE2-OD2 3.35Å; Q620-D622 VanDerWaalsContact C-N 3.27Å; Q620-D622 PolarHBondContact O-N 2.72Å
623	G	86	Confident	87.6	Confident	40 Å²	40	67.5 Å²	67.5	41%	0.412	34%	0.343	S	S	.	.	H	α-helix	trans	-70.6	-44.6	-179.4	0	0	0	0	0	113.2	Q620 R621 L625 Q626	Q620-G623 PolarHBondContact O-N 3.36Å; R621-G623 VanDerWaalsContact C-N 3.26Å; R621-G623 PolarHBondContact O-N 3.19Å; G623-L625 PolarHBondContact O-N 3.09Å; G623-Q626 PolarHBondContact O-N 3.1Å
624	S	87.6	Confident	87.7	Confident	63 Å²	63	64.8 Å²	64.8	44%	0.441	34%	0.338	S	S	.	.	H	α-helix	trans	-66.4	-36.4	-176.8	-60.4	0	0	0	0	113.5	R621 Q626 E627	R621-S624 PolarHBondContact O-N 2.87Å; S624-Q626 VanDerWaalsContact C-N 3.26Å; S624-Q626 PolarHBondContact O-N 3.12Å; S624-E627 PolarHBondContact O-N 3.36Å
625	L	88.8	Confident	87.7	Confident	4 Å²	4	66.5 Å²	66.5	2%	0.021	35%	0.345	C	S	.	.	H	α-helix	trans	-64.6	-29	178.5	-71.2	169.3	0	0	0	112.7	F543 V551 L554 I555 H558 R621 G623	F543-L625 HydrophobicContact CD1-CD2 4.22Å; F543-L625 HydrophobicContact CD2-CD2 4.01Å; F543-L625 HydrophobicContact CE1-CD2 3.94Å; F543-L625 HydrophobicContact CE2-CD2 3.67Å; F543-L625 HydrophobicContact CG-CD2 4.28Å; F543-L625 HydrophobicContact CZ-CD2 3.67Å; F543-L625 HydrophobicContact CZ-CG 4.39Å; V551-L625 WeakPolarHBondContact CG1-O 3.46Å; L554-L625 HydrophobicContact CB-CD2 3.8Å; L554-L625 HydrophobicContact CD1-CD2 4.24Å; I555-L625 HydrophobicContact CD1-CB 4.49Å; I555-L625 HydrophobicContact CG1-CB 3.83Å; I555-L625 HydrophobicContact CG1-CD1 4.31Å; H558-L625 HydrophobicContact CB-CD1 4.34Å; R621-L625 HydrophobicContact CG-CD1 4.21Å; R621-L625 PolarHBondContact O-N 2.99Å; G623-L625 PolarHBondContact O-N 3.09Å
626	Q	88.6	Confident	87.6	Confident	115 Å²	115	61 Å²	61	54%	0.537	32%	0.321	S	S	.	.	H	α-helix	trans	-74.8	-34.6	178.3	-71	-65.6	-19.2	0	0	113.4	G623 S624 M629	G623-Q626 PolarHBondContact O-N 3.1Å; S624-Q626 VanDerWaalsContact C-N 3.26Å; S624-Q626 PolarHBondContact O-N 3.12Å; Q626-M629 WeakPolarHBondContact O-CB 3.42Å; Q626-M629 PolarHBondContact O-N 3.38Å
627	E	86.4	Confident	87.6	Confident	147 Å²	147	62.2 Å²	62.2	69%	0.687	32%	0.322	S	S	*	.	H	α-helix	trans	-67.4	-40	178.8	-68.5	-177.7	171.1	0	0	112.1	S624 M629 A630 R631	S624-E627 PolarHBondContact O-N 3.36Å; E627-M629 VanDerWaalsContact C-N 3.33Å; E627-M629 PolarHBondContact O-N 3.45Å; E627-A630 PolarHBondContact O-N 3.35Å; E627-R631 PolarHBondContact O-N 3.03Å
628	E	86.4	Confident	87.6	Confident	20 Å²	20	63.3 Å²	63.3	9%	0.093	33%	0.328	C	S	.	.	H	α-helix	trans	-67.7	-33.6	179	-173.4	56.1	-144.7	0	0	112.2	F543 V545 V551 A630 R631 Q632	F543-E628 HydrophobicContact CD2-CG 4.43Å; F543-E628 HydrophobicContact CE2-CB 3.54Å; F543-E628 HydrophobicContact CE2-CG 3.54Å; F543-E628 HydrophobicContact CZ-CB 3.62Å; F543-E628 HydrophobicContact CZ-CG 4.07Å; V545-E628 HydrophobicContact CG2-CG 3.35Å; V545-E628 WeakPolarHBondContact CG2-OE1 2.94Å; V551-E628 HydrophobicContact CG2-CG 4.21Å; E628-A630 VanDerWaalsContact C-N 3.27Å; E628-A630 PolarHBondContact O-N 3.16Å; E628-R631 WeakPolarHBondContact O-CB 3.32Å; E628-R631 PolarHBondContact O-N 3.25Å; E628-R631 VanDerWaalsContact O-N 3.13Å; E628-R631 IonicContact OE1-NH1 2.99Å; E628-R631 IonicContact OE2-CZ 2.71Å; E628-R631 IonicContact OE2-NE 3.66Å; E628-R631 IonicContact OE2-NH1 3.26Å; E628-R631 PolarHBondContact OE2-NH1 3.27Å; E628-R631 IonicContact OE2-NH2 2.61Å; E628-Q632 PolarHBondContact O-N 3.04Å; E628-Q632 PolarHBondContact OE1-NE2 3.12Å
629	M	89.1	Confident	87.5	Confident	28 Å²	28	63.2 Å²	63.2	14%	0.138	33%	0.325	C	S	.	.	H	α-helix	trans	-57.8	-40.3	174.3	-173.2	62.9	176.8	0	0	111.9	I548 V551 Q552 Q626 E627 R631 H633	I548-M629 HydrophobicContact CG2-CE 3.44Å; I548-M629 VanDerWaalsContact CG2-CE 3.44Å; I548-M629 HydrophobicContact CG2-SD 3.95Å; V551-M629 HydrophobicContact CB-SD 3.84Å; V551-M629 HydrophobicContact CG1-CB 3.79Å; V551-M629 HydrophobicContact CG1-CG 4.46Å; V551-M629 HydrophobicContact CG1-SD 4.02Å; Q552-M629 HydrophobicContact CG-CE 3.49Å; Q552-M629 VanDerWaalsContact CG-CE 3.49Å; Q552-M629 HydrophobicContact CG-SD 4Å; Q626-M629 WeakPolarHBondContact O-CB 3.42Å; Q626-M629 PolarHBondContact O-N 3.38Å; E627-M629 VanDerWaalsContact C-N 3.33Å; E627-M629 PolarHBondContact O-N 3.45Å; M629-R631 VanDerWaalsContact C-N 3.35Å; M629-R631 PolarHBondContact O-N 3.41Å; M629-H633 PolarHBondContact O-CD2 3.21Å; M629-H633 VanDerWaalsContact O-CD2 3.26Å; M629-H633 PolarHBondContact O-N 2.92Å
630	A	86.5	Confident	87.6	Confident	62 Å²	62	65.3 Å²	65.3	51%	0.512	32%	0.321	S	S	.	.	H	α-helix	trans	-67.7	-34.1	178.3	0	0	0	0	0	112.7	E627 E628 A634	E627-A630 PolarHBondContact O-N 3.35Å; E628-A630 VanDerWaalsContact C-N 3.27Å; E628-A630 PolarHBondContact O-N 3.16Å; A630-A634 PolarHBondContact O-N 3.12Å
631	R	86.3	Confident	87.7	Confident	141 Å²	141	64.7 Å²	64.7	53%	0.532	32%	0.318	S	S	.	.	H	α-helix	trans	-65.3	-47.4	177.8	-171.5	-176.9	-63.3	165	-1.8	111.7	E627 E628 M629 H633 A634 H635	E627-R631 PolarHBondContact O-N 3.03Å; E628-R631 WeakPolarHBondContact O-CB 3.32Å; E628-R631 PolarHBondContact O-N 3.25Å; E628-R631 VanDerWaalsContact O-N 3.13Å; E628-R631 IonicContact OE1-NH1 2.99Å; E628-R631 IonicContact OE2-CZ 2.71Å; E628-R631 IonicContact OE2-NE 3.66Å; E628-R631 IonicContact OE2-NH1 3.26Å; E628-R631 PolarHBondContact OE2-NH1 3.27Å; E628-R631 IonicContact OE2-NH2 2.61Å; M629-R631 VanDerWaalsContact C-N 3.35Å; M629-R631 PolarHBondContact O-N 3.41Å; R631-H633 VanDerWaalsContact C-N 3.28Å; R631-H633 PolarHBondContact O-N 3.45Å; R631-A634 WeakPolarHBondContact O-CB 3.33Å; R631-A634 PolarHBondContact O-N 3.03Å; R631-H635 PolarHBondContact O-N 3.46Å
632	Q	86.3	Confident	87.7	Confident	10 Å²	10	63.7 Å²	63.7	5%	0.047	31%	0.314	C	S	.	.	H	α-helix	trans	-62.8	-34.1	-180	-62.1	-56.9	-32.7	0	0	112.7	V545 I548 V551 E628 A634 H635 E636	V545-Q632 HydrophobicContact CG2-CG 3.86Å; V545-Q632 PolarHBondContact O-NE2 3.19Å; I548-Q632 HydrophobicContact CG1-CB 3.72Å; V551-Q632 HydrophobicContact CG2-CG 4.02Å; E628-Q632 PolarHBondContact O-N 3.04Å; E628-Q632 PolarHBondContact OE1-NE2 3.12Å; Q632-A634 VanDerWaalsContact C-N 3.3Å; Q632-A634 PolarHBondContact O-N 3Å; Q632-H635 PolarHBondContact O-N 3.2Å; Q632-E636 PolarHBondContact O-N 3.49Å
633	H	87.7	Confident	87.8	Confident	89 Å²	89	61.2 Å²	61.2	41%	0.412	30%	0.302	S	S	.	.	H	α-helix	trans	-63.7	-31.8	171.5	-82.4	-61.1	0	0	0	113.8	M629 R631	M629-H633 PolarHBondContact O-CD2 3.21Å; M629-H633 VanDerWaalsContact O-CD2 3.26Å; M629-H633 PolarHBondContact O-N 2.92Å; R631-H633 VanDerWaalsContact C-N 3.28Å; R631-H633 PolarHBondContact O-N 3.45Å
634	A	86.9	Confident	88.1	Confident	34 Å²	34	62 Å²	62	28%	0.281	30%	0.304	S	S	.	.	H	α-helix	trans	-71.2	-42.1	176.6	0	0	0	0	0	111.9	A630 R631 Q632 E636 R637 L638	A630-A634 PolarHBondContact O-N 3.12Å; R631-A634 WeakPolarHBondContact O-CB 3.33Å; R631-A634 PolarHBondContact O-N 3.03Å; Q632-A634 VanDerWaalsContact C-N 3.3Å; Q632-A634 PolarHBondContact O-N 3Å; A634-E636 VanDerWaalsContact C-N 3.33Å; A634-E636 PolarHBondContact O-N 3.34Å; A634-R637 WeakPolarHBondContact O-CB 3.38Å; A634-R637 PolarHBondContact O-N 3.25Å; A634-R637 VanDerWaalsContact O-N 3.16Å; A634-L638 PolarHBondContact O-N 3.42Å
635	H	88.4	Confident	88.1	Confident	36 Å²	36	61.3 Å²	61.3	17%	0.167	29%	0.294	C	S	.	.	H	α-helix	trans	-58.7	-41.7	176.6	-67.3	173.2	0	0	0	112.6	R631 Q632 R637 L638 R639 V707	R631-H635 PolarHBondContact O-N 3.46Å; Q632-H635 PolarHBondContact O-N 3.2Å; H635-R637 VanDerWaalsContact C-N 3.26Å; H635-R637 PolarHBondContact O-N 2.9Å; H635-L638 PolarHBondContact O-N 3.01Å; H635-R639 PolarHBondContact O-N 3.23Å; H635-V707 HydrophobicContact CB-CG2 3.83Å
636	E	88.2	Confident	88.1	Confident	16 Å²	16	61.1 Å²	61.1	8%	0.075	29%	0.293	C	S	.	.	H	α-helix	trans	-65.9	-27.2	179	-173.9	58.9	-160.8	0	0	113.2	I548 Q632 A634 R639 R640 H712	I548-E636 HydrophobicContact CD1-CB 3.93Å; I548-E636 HydrophobicContact CD1-CG 4.25Å; Q632-E636 PolarHBondContact O-N 3.49Å; A634-E636 VanDerWaalsContact C-N 3.33Å; A634-E636 PolarHBondContact O-N 3.34Å; E636-R639 IonicContact OE2-CZ 3.16Å; E636-R639 IonicContact OE2-NH1 3.74Å; E636-R639 PolarHBondContact OE2-NH1 3.41Å; E636-R640 WeakPolarHBondContact O-CD 3.43Å; E636-R640 WeakPolarHBondContact O-CG 3.25Å; E636-R640 PolarHBondContact O-N 2.9Å; E636-R640 IonicContact OE1-CZ 2.83Å; E636-R640 IonicContact OE1-NE 3.91Å; E636-R640 PolarHBondContact OE1-NE 2.63Å; E636-R640 IonicContact OE1-NH2 3.12Å; E636-R640 PolarHBondContact OE1-NH2 3.05Å; E636-H712 IonicContact OE1-CE1 2.62Å; E636-H712 IonicContact OE1-NE2 3.94Å; E636-H712 PolarHBondContact OE1-NE2 3.32Å
637	R	89.1	Confident	88.3	Confident	173 Å²	173	59 Å²	59	65%	0.653	29%	0.285	S	S	*	.	H	α-helix	trans	-69.8	-42.3	173.1	-70.3	-174.6	-70.2	-136.5	-2.4	111.9	A634 H635 R640 Q641	A634-R637 WeakPolarHBondContact O-CB 3.38Å; A634-R637 PolarHBondContact O-N 3.25Å; A634-R637 VanDerWaalsContact O-N 3.16Å; H635-R637 VanDerWaalsContact C-N 3.26Å; H635-R637 PolarHBondContact O-N 2.9Å; R637-R640 PolarHBondContact O-N 3.22Å; R637-Q641 PolarHBondContact O-N 3.24Å; R637-Q641 VanDerWaalsContact O-N 3.09Å
638	L	87.1	Confident	88.5	Confident	38 Å²	38	57.4 Å²	57.4	20%	0.199	28%	0.28	C	S	.	.	H	α-helix	trans	-62.7	-46.8	179.2	-68	173.7	0	0	0	111.6	A634 H635 R640 Q641 F642 L701 I702 S705	A634-L638 PolarHBondContact O-N 3.42Å; H635-L638 PolarHBondContact O-N 3.01Å; L638-R640 VanDerWaalsContact C-N 3.26Å; L638-R640 PolarHBondContact O-N 3.49Å; L638-Q641 PolarHBondContact O-N 3.49Å; L638-Q641 VanDerWaalsContact O-N 3.12Å; L638-F642 PolarHBondContact O-N 3.13Å; L638-L701 HydrophobicContact CD2-CB 4.5Å; L638-I702 HydrophobicContact CB-CG1 3.82Å; L638-I702 WeakPolarHBondContact O-CD1 3.4Å; L638-S705 WeakPolarHBondContact CD1-OG 3.3Å
639	R	87.3	Confident	88.8	Confident	22 Å²	22	56.5 Å²	56.5	8%	0.083	28%	0.276	C	S	.	.	H	α-helix	trans	-48.7	-49.3	173.1	-70.4	-173.2	176.9	117.6	-0.4	111.5	H635 E636 Q641 A643 V707 D709 N710	H635-R639 PolarHBondContact O-N 3.23Å; E636-R639 IonicContact OE2-CZ 3.16Å; E636-R639 IonicContact OE2-NH1 3.74Å; E636-R639 PolarHBondContact OE2-NH1 3.41Å; R639-Q641 PolarHBondContact O-N 3.09Å; R639-A643 WeakPolarHBondContact O-CB 3.47Å; R639-A643 PolarHBondContact O-N 3.38Å; R639-V707 HydrophobicContact CG-CG1 3.73Å; R639-D709 WeakPolarHBondContact CD-O 3.39Å; R639-D709 IonicContact CZ-OD1 3.37Å; R639-D709 IonicContact CZ-OD2 3.75Å; R639-D709 PolarHBondContact NE-O 3.23Å; R639-D709 IonicContact NE-OD1 2.87Å; R639-D709 IonicContact NE-OD2 3.36Å; R639-D709 PolarHBondContact NE-OD2 2.91Å; R639-D709 IonicContact NH2-OD1 3.76Å; R639-D709 PolarHBondContact NH2-OD1 2.79Å; R639-D709 IonicContact NH2-OD2 2.72Å; R639-D709 PolarHBondContact NH2-OD2 3.42Å; R639-N710 PolarHBondContact O-ND2 3.31Å; R639-N710 PolarHBondContact O-OD1 3.32Å
640	R	89.5	Confident	88.7	Confident	139 Å²	139	55.6 Å²	55.6	53%	0.525	27%	0.274	S	S	.	.	H	α-helix	trans	-69.4	-31	-176	-67.1	171.8	-170.5	-138	1.4	113.1	E636 R637 L638 A644 H712	E636-R640 WeakPolarHBondContact O-CD 3.43Å; E636-R640 WeakPolarHBondContact O-CG 3.25Å; E636-R640 PolarHBondContact O-N 2.9Å; E636-R640 IonicContact OE1-CZ 2.83Å; E636-R640 IonicContact OE1-NE 3.91Å; E636-R640 PolarHBondContact OE1-NE 2.63Å; E636-R640 IonicContact OE1-NH2 3.12Å; E636-R640 PolarHBondContact OE1-NH2 3.05Å; R637-R640 PolarHBondContact O-N 3.22Å; L638-R640 VanDerWaalsContact C-N 3.26Å; L638-R640 PolarHBondContact O-N 3.49Å; R640-A644 PolarHBondContact O-N 2.78Å; R640-H712 WeakPolarHBondContact CG-NE2 3.4Å; R640-H712 PolarHBondContact NE-NE2 3.1Å
641	Q	89.3	Confident	88.9	Confident	97 Å²	97	55.5 Å²	55.5	45%	0.453	27%	0.268	S	S	.	.	H	α-helix	trans	-67.8	-50.2	176.4	-179.2	172.5	-20.2	0	0	112.1	R637 L638 R639 A643 A644 Q645 D698	R637-Q641 PolarHBondContact O-N 3.24Å; R637-Q641 VanDerWaalsContact O-N 3.09Å; L638-Q641 PolarHBondContact O-N 3.49Å; L638-Q641 VanDerWaalsContact O-N 3.12Å; R639-Q641 PolarHBondContact O-N 3.09Å; Q641-A643 VanDerWaalsContact C-N 3.35Å; Q641-A643 PolarHBondContact O-N 3.11Å; Q641-A644 PolarHBondContact O-N 2.94Å; Q641-Q645 PolarHBondContact O-N 2.74Å; Q641-D698 PolarHBondContact NE2-OD1 3.26Å
642	F	89.4	Confident	89.2	Confident	9 Å²	9	51 Å²	51	4%	0.039	25%	0.251	C	S	.	.	H	α-helix	trans	-60.2	-44.5	177.1	174	-87	0	0	0	112	L638 A644 Q645 A646 L695 D698 H699 I702 N710 T713 M717	L638-F642 PolarHBondContact O-N 3.13Å; F642-A644 VanDerWaalsContact C-N 3.31Å; F642-A644 PolarHBondContact O-N 3.14Å; F642-Q645 PolarHBondContact O-N 2.67Å; F642-A646 HydrophobicContact CE1-CB 4.18Å; F642-A646 WeakPolarHBondContact O-CB 3.41Å; F642-A646 PolarHBondContact O-N 3.47Å; F642-L695 HydrophobicContact CD2-CD1 3.62Å; F642-L695 HydrophobicContact CD2-CG 4.37Å; F642-L695 HydrophobicContact CE2-CD1 3.63Å; F642-L695 HydrophobicContact CE2-CG 3.98Å; F642-L695 HydrophobicContact CG-CD1 4.22Å; F642-L695 HydrophobicContact CZ-CD1 4.27Å; F642-D698 HydrophobicContact CB-CB 4.42Å; F642-D698 HydrophobicContact CD2-CB 4.34Å; F642-H699 HydrophobicContact CD2-CB 4.02Å; F642-H699 HydrophobicContact CE2-CB 3.67Å; F642-H699 AromaticContact CE2-CG 3.94Å; F642-H699 AromaticContact CE2-ND1 3.67Å; F642-I702 HydrophobicContact CB-CD1 3.25Å; F642-I702 HydrophobicContact CD2-CD1 4.28Å; F642-I702 HydrophobicContact CG-CD1 3.82Å; F642-N710 WeakPolarHBondContact CD1-ND2 3.21Å; F642-T713 HydrophobicContact CD1-CG2 4.18Å; F642-T713 HydrophobicContact CE1-CG2 4.12Å; F642-M717 HydrophobicContact CE2-SD 4.33Å; F642-M717 HydrophobicContact CZ-CB 4.29Å
643	A	89.5	Confident	89.2	Confident	3 Å²	3	50.9 Å²	50.9	3%	0.025	25%	0.25	C	S	.	.	H	α-helix	trans	-61.2	-38.9	-179.6	0	0	0	0	0	112.9	R639 Q641 Q645 N647 H712 T713	R639-A643 WeakPolarHBondContact O-CB 3.47Å; R639-A643 PolarHBondContact O-N 3.38Å; Q641-A643 VanDerWaalsContact C-N 3.35Å; Q641-A643 PolarHBondContact O-N 3.11Å; A643-Q645 VanDerWaalsContact C-N 3.32Å; A643-Q645 PolarHBondContact O-N 3.25Å; A643-N647 WeakPolarHBondContact O-CB 3.43Å; A643-N647 PolarHBondContact O-N 3.29Å; A643-N647 VanDerWaalsContact O-N 3.14Å; A643-N647 PolarHBondContact O-ND2 2.71Å; A643-H712 HydrophobicContact CB-CB 3.46Å; A643-H712 VanDerWaalsContact CB-CB 3.46Å; A643-T713 HydrophobicContact CB-CG2 3.8Å
644	A	91.4	Very high	89.1	Confident	55 Å²	55	51.7 Å²	51.7	46%	0.455	26%	0.255	S	S	.	.	H	α-helix	trans	-62.7	-37.5	178.2	0	0	0	0	0	112.6	R640 Q641 F642	R640-A644 PolarHBondContact O-N 2.78Å; Q641-A644 PolarHBondContact O-N 2.94Å; F642-A644 VanDerWaalsContact C-N 3.31Å; F642-A644 PolarHBondContact O-N 3.14Å
645	Q	88.8	Confident	89.2	Confident	50 Å²	50	52.2 Å²	52.2	23%	0.234	26%	0.259	C	S	.	.	H	α-helix	trans	-77.8	-45	178.3	-67.3	-63	-59	0	0	112	Q641 F642 A643 N647 L648 I649 L695	Q641-Q645 PolarHBondContact O-N 2.74Å; F642-Q645 PolarHBondContact O-N 2.67Å; A643-Q645 VanDerWaalsContact C-N 3.32Å; A643-Q645 PolarHBondContact O-N 3.25Å; Q645-N647 VanDerWaalsContact C-N 3.3Å; Q645-N647 PolarHBondContact O-N 2.97Å; Q645-L648 PolarHBondContact O-N 2.87Å; Q645-L648 VanDerWaalsContact O-N 3.1Å; Q645-I649 PolarHBondContact O-N 2.9Å; Q645-L695 HydrophobicContact CB-CD1 3.64Å
646	A	88.4	Confident	89.1	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-60.3	-39.3	-179	0	0	0	0	0	112.5	F642 L648 I649 G650 L695 T713	F642-A646 HydrophobicContact CE1-CB 4.18Å; F642-A646 WeakPolarHBondContact O-CB 3.41Å; F642-A646 PolarHBondContact O-N 3.47Å; A646-L648 PolarHBondContact O-N 3.48Å; A646-I649 PolarHBondContact O-N 2.95Å; A646-G650 PolarHBondContact O-N 3.46Å; A646-G650 VanDerWaalsContact O-N 3.1Å; A646-L695 HydrophobicContact CB-CD1 4.05Å; A646-L695 HydrophobicContact CB-CD2 4.21Å; A646-T713 HydrophobicContact CB-CG2 4.49Å
647	N	91.9	Very high	88.9	Confident	69 Å²	69	56 Å²	56	37%	0.369	27%	0.274	S	S	.	.	H	α-helix	trans	-67.9	-16.7	178.7	-71.4	-24.5	0	0	0	114	A643 Q645 P651 H712 T713	A643-N647 WeakPolarHBondContact O-CB 3.43Å; A643-N647 PolarHBondContact O-N 3.29Å; A643-N647 VanDerWaalsContact O-N 3.14Å; A643-N647 PolarHBondContact O-ND2 2.71Å; Q645-N647 VanDerWaalsContact C-N 3.3Å; Q645-N647 PolarHBondContact O-N 2.97Å; N647-P651 WeakPolarHBondContact O-CD 3.39Å; N647-H712 PolarHBondContact ND2-O 3.48Å; N647-T713 WeakPolarHBondContact OD1-CB 3.48Å; N647-T713 PolarHBondContact OD1-OG1 3.18Å
648	L	91.4	Very high	88.6	Confident	114 Å²	114	52.8 Å²	52.8	60%	0.597	27%	0.266	S	S	*	.	H	α-helix	trans	-89.4	-39.8	173.4	-68.1	170.8	0	0	0	111.8	Q645 A646	Q645-L648 PolarHBondContact O-N 2.87Å; Q645-L648 VanDerWaalsContact O-N 3.1Å; A646-L648 PolarHBondContact O-N 3.48Å
649	I	91.8	Very high	88.3	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-74.7	-43.3	-173.1	-69	165.8	0	0	0	111.7	Q645 A646 W652 I653 Y688 I692 L695 I720	Q645-I649 PolarHBondContact O-N 2.9Å; A646-I649 PolarHBondContact O-N 2.95Å; I649-W652 WeakPolarHBondContact O-CB 3.37Å; I649-W652 PolarHBondContact O-N 3.02Å; I649-W652 VanDerWaalsContact O-N 3.17Å; I649-I653 HydrophobicContact CG2-CD1 3.94Å; I649-I653 HydrophobicContact CG2-CG1 4.43Å; I649-I653 PolarHBondContact O-N 3.19Å; I649-Y688 HydrophobicContact CG1-CE1 4.3Å; I649-I692 HydrophobicContact CB-CD1 4.49Å; I649-I692 HydrophobicContact CD1-CD1 4.32Å; I649-I692 HydrophobicContact CG1-CD1 4.47Å; I649-I692 HydrophobicContact CG2-CD1 3.27Å; I649-L695 HydrophobicContact CD1-CB 3.91Å; I649-L695 HydrophobicContact CD1-CD2 3.85Å; I649-L695 HydrophobicContact CD1-CG 4.4Å; I649-I720 HydrophobicContact CG2-CD1 4.26Å; I649-I720 HydrophobicContact CG2-CG2 3.67Å
650	G	87.2	Confident	88	Confident	8 Å²	8	52.8 Å²	52.8	8%	0.082	27%	0.266	C	S	.	.	H	α-helix	trans	-54.1	-55.6	-177.7	0	0	0	0	0	113.7	A646 W652 I653 Q654	A646-G650 PolarHBondContact O-N 3.46Å; A646-G650 VanDerWaalsContact O-N 3.1Å; G650-W652 VanDerWaalsContact C-N 3.28Å; G650-W652 PolarHBondContact O-N 2.92Å; G650-I653 PolarHBondContact O-N 3.44Å; G650-Q654 PolarHBondContact O-N 3.5Å
651	P	90.4	Very high	87.2	Confident	60 Å²	60	48 Å²	48	39%	0.39	26%	0.26	S	S	.	.	H	α-helix	trans	-62.5	-31.4	177.4	-24.8	35.2	0	0	0	114.1	N647 Q654 A655	N647-P651 WeakPolarHBondContact O-CD 3.39Å; P651-Q654 PolarHBondContact O-N 3.08Å; P651-A655 PolarHBondContact O-N 3.41Å; P651-A655 VanDerWaalsContact O-N 3.11Å
652	W	92.4	Very high	86.5	Confident	48 Å²	48	50.5 Å²	50.5	18%	0.182	27%	0.265	C	S	.	.	H	α-helix	trans	-64.7	-41.2	178.7	-178.1	97.3	0	0	0	111.8	I649 G650 A655 R656 I685 Y688 W724 L727	I649-W652 WeakPolarHBondContact O-CB 3.37Å; I649-W652 PolarHBondContact O-N 3.02Å; I649-W652 VanDerWaalsContact O-N 3.17Å; G650-W652 VanDerWaalsContact C-N 3.28Å; G650-W652 PolarHBondContact O-N 2.92Å; W652-A655 PolarHBondContact O-N 2.78Å; W652-R656 HydrophobicContact CD2-CG 4.39Å; W652-R656 HydrophobicContact CE3-CG 4.41Å; W652-R656 HydrophobicContact CH2-CG 4.11Å; W652-R656 HydrophobicContact CZ2-CG 4.12Å; W652-R656 HydrophobicContact CZ3-CG 4.23Å; W652-R656 PolarHBondContact O-N 3.18Å; W652-I685 HydrophobicContact CH2-CG1 4.47Å; W652-Y688 AromaticContact CD2-CD1 3.93Å; W652-Y688 HydrophobicContact CD2-CD1 3.93Å; W652-Y688 HydrophobicContact CD2-CD2 4.36Å; W652-Y688 AromaticContact CD2-CE1 3.76Å; W652-Y688 HydrophobicContact CD2-CE1 3.76Å; W652-Y688 HydrophobicContact CD2-CE2 4.21Å; W652-Y688 HydrophobicContact CD2-CG 4.23Å; W652-Y688 AromaticContact CD2-CZ 3.9Å; W652-Y688 AromaticContact CE2-CD2 3.7Å; W652-Y688 AromaticContact CE2-CE2 3.81Å; W652-Y688 AromaticContact CE2-CG 3.79Å; W652-Y688 AromaticContact CE3-CD1 3.77Å; W652-Y688 HydrophobicContact CE3-CD1 3.77Å; W652-Y688 AromaticContact CE3-CE1 3.86Å; W652-Y688 HydrophobicContact CE3-CE1 3.86Å; W652-Y688 HydrophobicContact CE3-CG 4.31Å; W652-Y688 HydrophobicContact CG-CE1 4.17Å; W652-Y688 HydrophobicContact CG-CE2 4.39Å; W652-Y688 AromaticContact CG-CZ 3.95Å; W652-Y688 VanDerWaalsContact CH2-CB 3.5Å; W652-Y688 AromaticContact CH2-CD1 3.82Å; W652-Y688 HydrophobicContact CH2-CD1 3.82Å; W652-Y688 HydrophobicContact CH2-CD2 4.28Å; W652-Y688 AromaticContact CH2-CG 3.62Å; W652-Y688 HydrophobicContact CH2-CG 3.62Å; W652-Y688 AromaticContact CZ2-CD1 3.94Å; W652-Y688 HydrophobicContact CZ2-CD1 3.94Å; W652-Y688 AromaticContact CZ2-CD2 3.64Å; W652-Y688 HydrophobicContact CZ2-CD2 3.64Å; W652-Y688 HydrophobicContact CZ2-CE2 4.24Å; W652-Y688 AromaticContact CZ2-CG 3.46Å; W652-Y688 HydrophobicContact CZ2-CG 3.46Å; W652-Y688 VanDerWaalsContact CZ2-CG 3.46Å; W652-Y688 AromaticContact CZ3-CD1 3.76Å; W652-Y688 HydrophobicContact CZ3-CD1 3.76Å; W652-Y688 HydrophobicContact CZ3-CE1 4.33Å; W652-Y688 HydrophobicContact CZ3-CG 4.07Å; W652-Y688 AromaticContact NE1-CD2 3.94Å; W652-Y688 AromaticContact NE1-CE2 3.7Å; W652-W724 HydrophobicContact CE3-CZ3 4.41Å; W652-W724 HydrophobicContact CH2-CZ3 4.06Å; W652-W724 HydrophobicContact CZ3-CE3 4.29Å; W652-W724 HydrophobicContact CZ3-CH2 4.4Å; W652-W724 AromaticContact CZ3-CZ3 3.52Å; W652-W724 HydrophobicContact CZ3-CZ3 3.52Å; W652-L727 HydrophobicContact CZ3-CD2 4.1Å
653	I	88.2	Confident	85.4	Confident	6 Å²	6	51 Å²	51	3%	0.031	27%	0.27	C	S	.	.	H	α-helix	trans	-62.9	-45.1	177.4	-68.1	173	0	0	0	110.5	I649 G650 A655 R656 M657 I720 G723 W724 L727	I649-I653 HydrophobicContact CG2-CD1 3.94Å; I649-I653 HydrophobicContact CG2-CG1 4.43Å; I649-I653 PolarHBondContact O-N 3.19Å; G650-I653 PolarHBondContact O-N 3.44Å; I653-A655 PolarHBondContact O-N 2.94Å; I653-R656 PolarHBondContact O-N 3.04Å; I653-M657 HydrophobicContact CG2-CE 3.79Å; I653-M657 PolarHBondContact O-N 3.46Å; I653-M657 VanDerWaalsContact O-N 3.15Å; I653-I720 HydrophobicContact CD1-CG2 4.11Å; I653-G723 VanDerWaalsContact CG2-O 3.3Å; I653-G723 WeakPolarHBondContact CG2-O 3.39Å; I653-W724 HydrophobicContact CD1-CB 4.19Å; I653-W724 HydrophobicContact CD1-CE3 4.22Å; I653-W724 HydrophobicContact CG1-CE3 4.19Å; I653-L727 HydrophobicContact CG2-CB 4.5Å; I653-L727 HydrophobicContact CG2-CD2 4.4Å
654	Q	85.5	Confident	84	Confident	107 Å²	107	53.9 Å²	53.9	50%	0.5	29%	0.29	S	S	.	.	H	α-helix	trans	-61.2	-46.3	179.6	-175.4	178.4	-12.9	0	0	112	G650 P651 R656 M657 E658	G650-Q654 PolarHBondContact O-N 3.5Å; P651-Q654 PolarHBondContact O-N 3.08Å; Q654-R656 VanDerWaalsContact C-N 3.3Å; Q654-R656 PolarHBondContact O-N 2.97Å; Q654-M657 PolarHBondContact O-N 3.14Å; Q654-E658 PolarHBondContact NE2-OE1 2.91Å; Q654-E658 PolarHBondContact O-N 3.18Å
655	A	87.4	Confident	82.4	Confident	44 Å²	44	57.4 Å²	57.4	36%	0.364	30%	0.3	S	S	.	.	H	α-helix	trans	-60	-38.1	179.7	0	0	0	0	0	112.8	P651 W652 I653 E658 E659	P651-A655 PolarHBondContact O-N 3.41Å; P651-A655 VanDerWaalsContact O-N 3.11Å; W652-A655 PolarHBondContact O-N 2.78Å; I653-A655 PolarHBondContact O-N 2.94Å; A655-E658 PolarHBondContact O-N 3.27Å; A655-E659 WeakPolarHBondContact O-CG 3.27Å; A655-E659 PolarHBondContact O-N 3.25Å
656	R	87.2	Confident	80.8	Confident	78 Å²	78	61.1 Å²	61.1	29%	0.294	32%	0.318	S	S	.	.	H	α-helix	trans	-72.3	-35.2	178.1	-66.3	-57.2	-177.4	-173.9	-2	113.4	W652 I653 Q654 E658 E659 I660 L727	W652-R656 HydrophobicContact CD2-CG 4.39Å; W652-R656 HydrophobicContact CE3-CG 4.41Å; W652-R656 HydrophobicContact CH2-CG 4.11Å; W652-R656 HydrophobicContact CZ2-CG 4.12Å; W652-R656 HydrophobicContact CZ3-CG 4.23Å; W652-R656 PolarHBondContact O-N 3.18Å; I653-R656 PolarHBondContact O-N 3.04Å; Q654-R656 VanDerWaalsContact C-N 3.3Å; Q654-R656 PolarHBondContact O-N 2.97Å; R656-E658 VanDerWaalsContact C-N 3.33Å; R656-E658 PolarHBondContact O-N 3.19Å; R656-E659 WeakPolarHBondContact CD-OE2 3.47Å; R656-E659 IonicContact CZ-OE2 2.77Å; R656-E659 IonicContact NE-OE2 2.67Å; R656-E659 IonicContact NH1-OE1 3.05Å; R656-E659 IonicContact NH1-OE2 3.88Å; R656-E659 PolarHBondContact NH1-OE2 2.89Å; R656-E659 PolarHBondContact O-N 3.12Å; R656-I660 WeakPolarHBondContact O-CG1 3.33Å; R656-I660 PolarHBondContact O-N 3.11Å; R656-L727 HydrophobicContact CB-CD1 3.91Å; R656-L727 HydrophobicContact CB-CD2 4.13Å
657	M	82.9	Confident	79.1	Confident	54 Å²	54	69 Å²	69	27%	0.266	36%	0.358	S	S	.	.	H	α-helix	trans	-61.4	-41.7	172.2	-79.8	-161.4	-96.1	0	0	111.9	I653 Q654 E659 I660 G661 L726 L727	I653-M657 HydrophobicContact CG2-CE 3.79Å; I653-M657 PolarHBondContact O-N 3.46Å; I653-M657 VanDerWaalsContact O-N 3.15Å; Q654-M657 PolarHBondContact O-N 3.14Å; M657-E659 VanDerWaalsContact C-N 3.33Å; M657-E659 PolarHBondContact O-N 2.79Å; M657-I660 PolarHBondContact O-N 3.46Å; M657-G661 PolarHBondContact O-N 3.41Å; M657-L726 HydrophobicContact CE-CD2 4.45Å; M657-L726 HydrophobicContact SD-CD2 3.93Å; M657-L726 HydrophobicContact SD-CG 4.04Å; M657-L727 HydrophobicContact CB-CD1 4.35Å; M657-L727 HydrophobicContact CG-CB 4.1Å; M657-L727 HydrophobicContact CG-CD1 3.56Å; M657-L727 HydrophobicContact CG-CG 4.41Å
658	E	83.4	Confident	77.2	Confident	106 Å²	106	69.7 Å²	69.7	50%	0.495	38%	0.382	S	S	.	.	H	α-helix	trans	-68.2	-29.5	178.2	-69	174.4	-168.8	0	0	113.1	Q654 A655 R656 R662	Q654-E658 PolarHBondContact NE2-OE1 2.91Å; Q654-E658 PolarHBondContact O-N 3.18Å; A655-E658 PolarHBondContact O-N 3.27Å; R656-E658 VanDerWaalsContact C-N 3.33Å; R656-E658 PolarHBondContact O-N 3.19Å; E658-R662 PolarHBondContact O-N 3.12Å; E658-R662 PolarHBondContact O-NE 3.41Å
659	E	81.4	Confident	75.7	Confident	58 Å²	58	66.4 Å²	66.4	27%	0.271	38%	0.375	S	S	.	.	H	α-helix	trans	-71	-43.8	174.2	-75.2	175.2	-179.4	0	0	112.8	A655 R656 M657 G661 R662 C663	A655-E659 WeakPolarHBondContact O-CG 3.27Å; A655-E659 PolarHBondContact O-N 3.25Å; R656-E659 WeakPolarHBondContact CD-OE2 3.47Å; R656-E659 IonicContact CZ-OE2 2.77Å; R656-E659 IonicContact NE-OE2 2.67Å; R656-E659 IonicContact NH1-OE1 3.05Å; R656-E659 IonicContact NH1-OE2 3.88Å; R656-E659 PolarHBondContact NH1-OE2 2.89Å; R656-E659 PolarHBondContact O-N 3.12Å; M657-E659 VanDerWaalsContact C-N 3.33Å; M657-E659 PolarHBondContact O-N 2.79Å; E659-G661 VanDerWaalsContact C-N 3.28Å; E659-G661 PolarHBondContact O-N 3.37Å; E659-R662 PolarHBondContact O-N 3.3Å; E659-R662 VanDerWaalsContact O-N 3.08Å; E659-C663 PolarHBondContact O-N 3.08Å
660	I	81.3	Confident	74.7	Confident	2 Å²	2	69.5 Å²	69.5	1%	0.01	39%	0.394	C	S	.	.	H	α-helix	trans	-60.2	-40.6	176.9	-65.9	158	0	0	0	111	R656 M657 R662 C663 M681 I685 L727 T730 I731 T734	R656-I660 WeakPolarHBondContact O-CG1 3.33Å; R656-I660 PolarHBondContact O-N 3.11Å; M657-I660 PolarHBondContact O-N 3.46Å; I660-R662 VanDerWaalsContact C-N 3.27Å; I660-R662 PolarHBondContact O-N 3.17Å; I660-C663 PolarHBondContact O-N 3.39Å; I660-M681 HydrophobicContact CG1-SD 4.36Å; I660-I685 HydrophobicContact CD1-CD1 4.13Å; I660-L727 HydrophobicContact CD1-CD1 3.49Å; I660-L727 VanDerWaalsContact CD1-CD1 3.49Å; I660-T730 HydrophobicContact CG2-CG2 4.15Å; I660-I731 HydrophobicContact CD1-CB 3.89Å; I660-I731 HydrophobicContact CD1-CD1 4.1Å; I660-I731 HydrophobicContact CD1-CG1 4.32Å; I660-I731 HydrophobicContact CG1-CD1 4.26Å; I660-T734 HydrophobicContact CG2-CG2 4.26Å
661	G	71.5	Confident	73.8	Confident	39 Å²	39	70.7 Å²	70.7	40%	0.402	40%	0.398	S	S	.	.	H	α-helix	trans	-61.9	-31.5	176.3	0	0	0	0	0	113.7	M657 E659	M657-G661 PolarHBondContact O-N 3.41Å; E659-G661 VanDerWaalsContact C-N 3.28Å; E659-G661 PolarHBondContact O-N 3.37Å
662	R	74.2	Confident	73.2	Confident	148 Å²	148	71.4 Å²	71.4	56%	0.558	40%	0.397	S	S	*	.	H	α-helix	trans	-76.8	-37.9	178.8	-76.9	-177.1	-75.4	-164.6	-0.1	113.1	E658 E659 I660 S664 L665	E658-R662 PolarHBondContact O-N 3.12Å; E658-R662 PolarHBondContact O-NE 3.41Å; E659-R662 PolarHBondContact O-N 3.3Å; E659-R662 VanDerWaalsContact O-N 3.08Å; I660-R662 VanDerWaalsContact C-N 3.27Å; I660-R662 PolarHBondContact O-N 3.17Å; R662-S664 PolarHBondContact O-N 2.65Å; R662-L665 PolarHBondContact O-N 3.49Å; R662-L665 VanDerWaalsContact O-N 3.13Å
663	C	67.2	Low	72.5	Confident	20 Å²	20	73.3 Å²	73.3	14%	0.135	41%	0.41	C	S	.	.	H	α-helix	trans	-61.3	-26.9	178.3	-76.9	0	0	0	0	113.8	E659 I660 L665 L678 M681	E659-C663 PolarHBondContact O-N 3.08Å; I660-C663 PolarHBondContact O-N 3.39Å; C663-L665 VanDerWaalsContact C-N 3.29Å; C663-L665 PolarHBondContact O-N 3.06Å; C663-L678 HydrophobicContact CB-CD2 4.14Å; C663-M681 WeakPolarHBondContact SG-CE 3.42Å
664	S	59.8	Low	71.7	Confident	63 Å²	63	74.8 Å²	74.8	44%	0.441	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-11.4	179	-56.6	0	0	0	0	113.8	R662	R662-S664 PolarHBondContact O-N 2.65Å
665	L	58.2	Low	71.4	Confident	129 Å²	129	70.4 Å²	70.4	68%	0.675	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	-8	-172.2	-75.9	162.1	0	0	0	114.5	R662 C663 I667	R662-L665 PolarHBondContact O-N 3.49Å; R662-L665 VanDerWaalsContact O-N 3.13Å; C663-L665 VanDerWaalsContact C-N 3.29Å; C663-L665 PolarHBondContact O-N 3.06Å; L665-I667 PolarHBondContact O-N 2.83Å
666	E	56.2	Low	71.2	Confident	129 Å²	129	72.8 Å²	72.8	60%	0.603	41%	0.407	S	S	*	.			trans	-81.3	117.6	-177.8	-75.5	-171.5	162.1	0	0	112.4	G668 Q674	E666-G668 VanDerWaalsContact C-N 3.27Å; E666-G668 PolarHBondContact O-N 2.9Å; E666-Q674 PolarHBondContact O-NE2 3.12Å
667	I	51	Low	70.9	Confident	166 Å²	166	73.7 Å²	73.7	85%	0.851	41%	0.414	S	S	*	.			trans	-79.4	-0.2	-171.6	-61.3	167.3	0	0	0	113	L665	L665-I667 PolarHBondContact O-N 2.83Å
668	G	51.7	Low	70.9	Confident	83 Å²	83	71.2 Å²	71.2	86%	0.856	40%	0.402	S	S	*	.	S	Bend	trans	-105.9	12.6	-160.8	0	0	0	0	0	118.6	E666	E666-G668 VanDerWaalsContact C-N 3.27Å; E666-G668 PolarHBondContact O-N 2.9Å
669	G	60.6	Low	70.9	Confident	44 Å²	44	70.6 Å²	70.6	45%	0.454	40%	0.398	S	S	.	.	S	Bend	trans	-133.4	164.3	-174	0	0	0	0	0	114.2
670	T	70.1	Confident	71.2	Confident	67 Å²	67	73.8 Å²	73.8	41%	0.411	41%	0.413	S	S	.	.			trans	-70.3	153.5	170	66.9	0	0	0	0	110	E672 D673 Q674	T670-E672 WeakPolarHBondContact CB-OE2 3.32Å; T670-E672 PolarHBondContact O-N 3.46Å; T670-D673 PolarHBondContact N-OD2 2.77Å; T670-D673 PolarHBondContact O-N 2.88Å; T670-D673 VanDerWaalsContact O-N 3.09Å; T670-D673 PolarHBondContact OG1-N 3.26Å; T670-D673 PolarHBondContact OG1-OD2 3.46Å; T670-Q674 PolarHBondContact O-N 2.64Å
671	L	68.6	Low	71.3	Confident	33 Å²	33	75.8 Å²	75.8	17%	0.173	42%	0.422	C	S	.	.	H	α-helix	trans	-60.4	-27.9	177.4	-68.3	172.2	0	0	0	110.7	M675 I738 I742	L671-M675 WeakPolarHBondContact O-CB 3.44Å; L671-M675 PolarHBondContact O-N 3.34Å; L671-M675 VanDerWaalsContact O-N 3.13Å; L671-I738 HydrophobicContact CB-CG2 4.4Å; L671-I738 HydrophobicContact CD2-CG2 4.42Å; L671-I742 HydrophobicContact CB-CD1 4.21Å; L671-I742 HydrophobicContact CB-CG1 4.05Å; L671-I742 HydrophobicContact CD1-CG1 4.18Å
672	E	79.3	Confident	72	Confident	76 Å²	76	77.1 Å²	77.1	36%	0.355	42%	0.418	S	S	.	.	H	α-helix	trans	-69.2	-37	176.1	-62.2	81.7	178	0	0	112.8	T670 T676 R745	T670-E672 WeakPolarHBondContact CB-OE2 3.32Å; T670-E672 PolarHBondContact O-N 3.46Å; E672-T676 PolarHBondContact O-N 3.1Å; E672-T676 PolarHBondContact O-OG1 3.43Å; E672-R745 IonicContact OE1-CZ 3.16Å; E672-R745 IonicContact OE1-NH1 2.7Å; E672-R745 PolarHBondContact OE1-NH1 2.81Å; E672-R745 IonicContact OE1-NH2 3.49Å
673	D	76.6	Confident	72.6	Confident	88 Å²	88	76 Å²	76	47%	0.471	42%	0.419	S	S	.	.	H	α-helix	trans	-71.9	-41.4	176.5	-66.6	-43.5	0	0	0	112.1	T670 M675 T676 Q677	T670-D673 PolarHBondContact N-OD2 2.77Å; T670-D673 PolarHBondContact O-N 2.88Å; T670-D673 VanDerWaalsContact O-N 3.09Å; T670-D673 PolarHBondContact OG1-N 3.26Å; T670-D673 PolarHBondContact OG1-OD2 3.46Å; D673-M675 VanDerWaalsContact C-N 3.34Å; D673-T676 PolarHBondContact O-N 2.88Å; D673-Q677 PolarHBondContact O-N 2.99Å; D673-Q677 VanDerWaalsContact O-N 3.11Å
674	Q	72.4	Confident	73.7	Confident	36 Å²	36	77.6 Å²	77.6	17%	0.168	43%	0.428	C	S	.	.	H	α-helix	trans	-63.9	-40.7	177	-68.7	179.8	-19.4	0	0	111.4	E666 T670 T676 Q677 L678 I738	E666-Q674 PolarHBondContact O-NE2 3.12Å; T670-Q674 PolarHBondContact O-N 2.64Å; Q674-T676 VanDerWaalsContact C-N 3.3Å; Q674-T676 PolarHBondContact O-N 3.45Å; Q674-Q677 PolarHBondContact O-N 3.47Å; Q674-L678 PolarHBondContact O-N 3.3Å; Q674-L678 VanDerWaalsContact O-N 3.14Å; Q674-I738 HydrophobicContact CB-CD1 4.05Å
675	M	79	Confident	75	Confident	16 Å²	16	74.7 Å²	74.7	8%	0.079	41%	0.408	C	S	.	.	H	α-helix	trans	-58.2	-42.6	173.1	-177.1	55.6	59.6	0	0	112.2	L671 D673 K679 I735 I738 E739	L671-M675 WeakPolarHBondContact O-CB 3.44Å; L671-M675 PolarHBondContact O-N 3.34Å; L671-M675 VanDerWaalsContact O-N 3.13Å; D673-M675 VanDerWaalsContact C-N 3.34Å; M675-K679 HydrophobicContact CG-CD 4.3Å; M675-K679 WeakPolarHBondContact O-CG 3.2Å; M675-K679 PolarHBondContact O-N 3.05Å; M675-K679 VanDerWaalsContact O-N 3.1Å; M675-K679 HydrophobicContact SD-CD 4.13Å; M675-K679 VanDerWaalsContact SD-CE 3.55Å; M675-K679 HydrophobicContact SD-CG 4.4Å; M675-I735 HydrophobicContact CE-CG2 4.44Å; M675-I735 WeakPolarHBondContact CE-O 3.41Å; M675-I735 HydrophobicContact SD-CG2 3.89Å; M675-I738 HydrophobicContact CB-CG2 4.49Å; M675-I738 HydrophobicContact CE-CB 3.54Å; M675-I738 HydrophobicContact CE-CG2 3.49Å; M675-I738 VanDerWaalsContact CE-CG2 3.49Å; M675-E739 HydrophobicContact CE-CB 4.31Å; M675-E739 HydrophobicContact CE-CG 3.32Å; M675-E739 HydrophobicContact SD-CG 4.06Å
676	T	82.4	Confident	76.4	Confident	93 Å²	93	73.4 Å²	73.4	57%	0.571	40%	0.401	S	S	*	.	H	α-helix	trans	-67.4	-40.4	-178.2	-56.6	0	0	0	0	111.7	E672 D673 Q674 Q680	E672-T676 PolarHBondContact O-N 3.1Å; E672-T676 PolarHBondContact O-OG1 3.43Å; D673-T676 PolarHBondContact O-N 2.88Å; Q674-T676 VanDerWaalsContact C-N 3.3Å; Q674-T676 PolarHBondContact O-N 3.45Å; T676-Q680 PolarHBondContact O-N 3.4Å; T676-Q680 VanDerWaalsContact O-N 3.09Å
677	Q	81.9	Confident	78	Confident	97 Å²	97	70.5 Å²	70.5	45%	0.453	40%	0.398	S	S	.	.	H	α-helix	trans	-65.8	-42.6	177	-69.8	-178.2	3	0	0	112.7	D673 Q674 Q680 M681	D673-Q677 PolarHBondContact O-N 2.99Å; D673-Q677 VanDerWaalsContact O-N 3.11Å; Q674-Q677 PolarHBondContact O-N 3.47Å; Q677-Q680 WeakPolarHBondContact O-CB 3.47Å; Q677-Q680 PolarHBondContact O-N 2.95Å; Q677-M681 WeakPolarHBondContact O-CG 3.4Å; Q677-M681 PolarHBondContact O-N 3.23Å
678	L	82.2	Confident	79.9	Confident	3 Å²	3	64.9 Å²	64.9	2%	0.016	37%	0.367	C	S	.	.	H	α-helix	trans	-65.5	-40	177.6	-70.2	174.6	0	0	0	112.1	C663 Q674 Q680 M681 E682 I735 I738	C663-L678 HydrophobicContact CB-CD2 4.14Å; Q674-L678 PolarHBondContact O-N 3.3Å; Q674-L678 VanDerWaalsContact O-N 3.14Å; L678-Q680 VanDerWaalsContact C-N 3.3Å; L678-Q680 PolarHBondContact O-N 3.46Å; L678-M681 PolarHBondContact O-N 2.75Å; L678-E682 PolarHBondContact O-N 3.15Å; L678-I735 HydrophobicContact CB-CD1 4.28Å; L678-I735 HydrophobicContact CB-CG1 3.75Å; L678-I735 HydrophobicContact CD1-CG1 4.27Å; L678-I738 HydrophobicContact CD1-CD1 3.58Å
679	K	83.1	Confident	81.6	Confident	92 Å²	92	64.9 Å²	64.9	40%	0.4	34%	0.343	S	S	.	.	H	α-helix	trans	-64.1	-33.2	174.1	-75.1	-179.2	174	168	0	112.6	M675 H683 I735 E739	M675-K679 HydrophobicContact CG-CD 4.3Å; M675-K679 WeakPolarHBondContact O-CG 3.2Å; M675-K679 PolarHBondContact O-N 3.05Å; M675-K679 VanDerWaalsContact O-N 3.1Å; M675-K679 HydrophobicContact SD-CD 4.13Å; M675-K679 VanDerWaalsContact SD-CE 3.55Å; M675-K679 HydrophobicContact SD-CG 4.4Å; K679-H683 PolarHBondContact O-N 3.46Å; K679-I735 HydrophobicContact CG-CD1 4.41Å; K679-E739 IonicContact NZ-OE1 3.39Å; K679-E739 PolarHBondContact NZ-OE1 3.11Å
680	Q	86.9	Confident	83	Confident	125 Å²	125	66.7 Å²	66.7	58%	0.584	35%	0.347	S	S	*	.	H	α-helix	trans	-68.7	-40	173.6	-173.3	63.3	33.3	0	0	112.3	T676 Q677 L678 H683 V684	T676-Q680 PolarHBondContact O-N 3.4Å; T676-Q680 VanDerWaalsContact O-N 3.09Å; Q677-Q680 WeakPolarHBondContact O-CB 3.47Å; Q677-Q680 PolarHBondContact O-N 2.95Å; L678-Q680 VanDerWaalsContact C-N 3.3Å; L678-Q680 PolarHBondContact O-N 3.46Å; Q680-H683 PolarHBondContact O-N 3.39Å; Q680-V684 PolarHBondContact O-N 2.77Å
681	M	84.3	Confident	83.9	Confident	44 Å²	44	66.5 Å²	66.5	22%	0.217	34%	0.344	C	S	.	.	H	α-helix	trans	-65.1	-39.5	175.8	-70.4	-177.3	176.1	0	0	111.8	I660 C663 Q677 L678 H683 V684 I685 I731	I660-M681 HydrophobicContact CG1-SD 4.36Å; C663-M681 WeakPolarHBondContact SG-CE 3.42Å; Q677-M681 WeakPolarHBondContact O-CG 3.4Å; Q677-M681 PolarHBondContact O-N 3.23Å; L678-M681 PolarHBondContact O-N 2.75Å; M681-H683 VanDerWaalsContact C-N 3.32Å; M681-H683 PolarHBondContact O-N 2.98Å; M681-V684 PolarHBondContact O-N 3.12Å; M681-I685 WeakPolarHBondContact O-CG1 3.3Å; M681-I685 PolarHBondContact O-N 3.07Å; M681-I731 HydrophobicContact CB-CD1 3.78Å
682	E	85.9	Confident	84.8	Confident	68 Å²	68	65.5 Å²	65.5	32%	0.318	34%	0.338	S	S	.	.	H	α-helix	trans	-57.8	-44.6	174.7	-175.7	-179.8	-153.8	0	0	111.4	L678 V684 I685 I686 I731 I735	L678-E682 PolarHBondContact O-N 3.15Å; E682-V684 VanDerWaalsContact C-N 3.34Å; E682-V684 PolarHBondContact O-N 2.97Å; E682-I685 PolarHBondContact O-N 2.73Å; E682-I686 HydrophobicContact CG-CD1 3.94Å; E682-I686 WeakPolarHBondContact O-CG1 3.43Å; E682-I686 PolarHBondContact O-N 2.87Å; E682-I731 HydrophobicContact CB-CD1 3.86Å; E682-I731 HydrophobicContact CB-CG1 4.43Å; E682-I731 VanDerWaalsContact N-CD1 3.33Å; E682-I735 HydrophobicContact CB-CD1 4.45Å
683	H	87.9	Confident	85.2	Confident	124 Å²	124	65.7 Å²	65.7	57%	0.574	34%	0.342	S	S	*	.	H	α-helix	trans	-61.8	-39.5	176.6	-171.4	-80.5	0	0	0	112.8	K679 Q680 M681 I685 I686 A687	K679-H683 PolarHBondContact O-N 3.46Å; Q680-H683 PolarHBondContact O-N 3.39Å; M681-H683 VanDerWaalsContact C-N 3.32Å; M681-H683 PolarHBondContact O-N 2.98Å; H683-I685 VanDerWaalsContact C-N 3.34Å; H683-I686 PolarHBondContact O-N 3.25Å; H683-A687 WeakPolarHBondContact O-CB 3.47Å; H683-A687 PolarHBondContact O-N 2.99Å
684	V	89.1	Confident	85.8	Confident	53 Å²	53	67.1 Å²	67.1	32%	0.321	34%	0.344	S	S	.	.	H	α-helix	trans	-65.9	-38.1	176.6	173.3	0	0	0	0	111.4	Q680 M681 E682 Y688	Q680-V684 PolarHBondContact O-N 2.77Å; M681-V684 PolarHBondContact O-N 3.12Å; E682-V684 VanDerWaalsContact C-N 3.34Å; E682-V684 PolarHBondContact O-N 2.97Å; V684-Y688 PolarHBondContact O-N 3.36Å
685	I	88	Confident	86.6	Confident	3 Å²	3	65.4 Å²	65.4	2%	0.015	34%	0.336	C	S	.	.	H	α-helix	trans	-66.1	-49.1	176.7	-66.8	163.7	0	0	0	110	W652 I660 M681 E682 H683 A687 Y688 W724 L727 L728 I731	W652-I685 HydrophobicContact CH2-CG1 4.47Å; I660-I685 HydrophobicContact CD1-CD1 4.13Å; M681-I685 WeakPolarHBondContact O-CG1 3.3Å; M681-I685 PolarHBondContact O-N 3.07Å; E682-I685 PolarHBondContact O-N 2.73Å; H683-I685 VanDerWaalsContact C-N 3.34Å; I685-A687 VanDerWaalsContact C-N 3.26Å; I685-A687 PolarHBondContact O-N 3.19Å; I685-Y688 PolarHBondContact O-N 3.2Å; I685-W724 HydrophobicContact CG2-CH2 3.92Å; I685-W724 HydrophobicContact CG2-CZ2 4.14Å; I685-W724 HydrophobicContact CG2-CZ3 4.39Å; I685-W724 WeakPolarHBondContact O-CH2 3.4Å; I685-L727 HydrophobicContact CD1-CD1 4.01Å; I685-L727 HydrophobicContact CD1-CD2 4.17Å; I685-L727 HydrophobicContact CD1-CG 3.96Å; I685-L727 HydrophobicContact CG1-CD2 4.16Å; I685-L727 HydrophobicContact CG1-CG 4.48Å; I685-L727 HydrophobicContact CG2-CD2 4.11Å; I685-L727 HydrophobicContact CG2-CG 4.43Å; I685-L728 HydrophobicContact CG2-CD2 3.73Å; I685-I731 HydrophobicContact CD1-CD1 3.75Å; I685-I731 HydrophobicContact CD1-CG2 4.44Å
686	I	86.8	Confident	87	Confident	102 Å²	102	67.4 Å²	67.4	52%	0.523	35%	0.345	S	S	.	.	H	α-helix	trans	-58.8	-39.7	179	-66	166.4	0	0	0	111.3	E682 H683 Y688 K689	E682-I686 HydrophobicContact CG-CD1 3.94Å; E682-I686 WeakPolarHBondContact O-CG1 3.43Å; E682-I686 PolarHBondContact O-N 2.87Å; H683-I686 PolarHBondContact O-N 3.25Å; I686-Y688 PolarHBondContact O-N 3.07Å; I686-K689 VanDerWaalsContact O-CB 3.26Å; I686-K689 WeakPolarHBondContact O-CB 3.39Å; I686-K689 PolarHBondContact O-N 3.22Å
687	A	90.7	Very high	87.2	Confident	67 Å²	67	64.6 Å²	64.6	55%	0.554	33%	0.334	S	S	*	.	H	α-helix	trans	-64.7	-21.6	178.9	0	0	0	0	0	114.2	H683 I685 P690	H683-A687 WeakPolarHBondContact O-CB 3.47Å; H683-A687 PolarHBondContact O-N 2.99Å; I685-A687 VanDerWaalsContact C-N 3.26Å; I685-A687 PolarHBondContact O-N 3.19Å; A687-P690 WeakPolarHBondContact O-CD 3.41Å
688	Y	90.5	Very high	87.5	Confident	48 Å²	48	60.7 Å²	60.7	19%	0.188	32%	0.316	C	S	.	.	H	α-helix	trans	-86.1	-10.4	-179.3	-156.5	-98.4	0	0	0	113.6	I649 W652 V684 I685 I686 N691 W724	I649-Y688 HydrophobicContact CG1-CE1 4.3Å; W652-Y688 AromaticContact CD2-CD1 3.93Å; W652-Y688 HydrophobicContact CD2-CD1 3.93Å; W652-Y688 HydrophobicContact CD2-CD2 4.36Å; W652-Y688 AromaticContact CD2-CE1 3.76Å; W652-Y688 HydrophobicContact CD2-CE1 3.76Å; W652-Y688 HydrophobicContact CD2-CE2 4.21Å; W652-Y688 HydrophobicContact CD2-CG 4.23Å; W652-Y688 AromaticContact CD2-CZ 3.9Å; W652-Y688 AromaticContact CE2-CD2 3.7Å; W652-Y688 AromaticContact CE2-CE2 3.81Å; W652-Y688 AromaticContact CE2-CG 3.79Å; W652-Y688 AromaticContact CE3-CD1 3.77Å; W652-Y688 HydrophobicContact CE3-CD1 3.77Å; W652-Y688 AromaticContact CE3-CE1 3.86Å; W652-Y688 HydrophobicContact CE3-CE1 3.86Å; W652-Y688 HydrophobicContact CE3-CG 4.31Å; W652-Y688 HydrophobicContact CG-CE1 4.17Å; W652-Y688 HydrophobicContact CG-CE2 4.39Å; W652-Y688 AromaticContact CG-CZ 3.95Å; W652-Y688 VanDerWaalsContact CH2-CB 3.5Å; W652-Y688 AromaticContact CH2-CD1 3.82Å; W652-Y688 HydrophobicContact CH2-CD1 3.82Å; W652-Y688 HydrophobicContact CH2-CD2 4.28Å; W652-Y688 AromaticContact CH2-CG 3.62Å; W652-Y688 HydrophobicContact CH2-CG 3.62Å; W652-Y688 AromaticContact CZ2-CD1 3.94Å; W652-Y688 HydrophobicContact CZ2-CD1 3.94Å; W652-Y688 AromaticContact CZ2-CD2 3.64Å; W652-Y688 HydrophobicContact CZ2-CD2 3.64Å; W652-Y688 HydrophobicContact CZ2-CE2 4.24Å; W652-Y688 AromaticContact CZ2-CG 3.46Å; W652-Y688 HydrophobicContact CZ2-CG 3.46Å; W652-Y688 VanDerWaalsContact CZ2-CG 3.46Å; W652-Y688 AromaticContact CZ3-CD1 3.76Å; W652-Y688 HydrophobicContact CZ3-CD1 3.76Å; W652-Y688 HydrophobicContact CZ3-CE1 4.33Å; W652-Y688 HydrophobicContact CZ3-CG 4.07Å; W652-Y688 AromaticContact NE1-CD2 3.94Å; W652-Y688 AromaticContact NE1-CE2 3.7Å; V684-Y688 PolarHBondContact O-N 3.36Å; I685-Y688 PolarHBondContact O-N 3.2Å; I686-Y688 PolarHBondContact O-N 3.07Å; Y688-N691 HydrophobicContact CD1-CB 4.31Å; Y688-N691 WeakPolarHBondContact CD2-ND2 3.47Å; Y688-N691 HydrophobicContact CE1-CB 4.07Å; Y688-N691 VanDerWaalsContact CE2-ND2 3.34Å; Y688-N691 WeakPolarHBondContact CE2-ND2 3.48Å; Y688-N691 PolarHBondContact O-N 3.18Å; Y688-N691 VanDerWaalsContact O-N 3.11Å; Y688-W724 HydrophobicContact CD1-CZ3 4.13Å
689	K	86.9	Confident	87.6	Confident	83 Å²	83	62.3 Å²	62.3	36%	0.361	32%	0.324	S	S	.	.	H	α-helix	trans	-49.2	-41.2	-179.8	-178.8	61.1	168.6	64.4	0	115.1	I686 N691 I692 D693 W724	I686-K689 VanDerWaalsContact O-CB 3.26Å; I686-K689 WeakPolarHBondContact O-CB 3.39Å; I686-K689 PolarHBondContact O-N 3.22Å; K689-N691 PolarHBondContact O-N 3.39Å; K689-I692 WeakPolarHBondContact O-CB 3.36Å; K689-I692 PolarHBondContact O-N 2.66Å; K689-I692 VanDerWaalsContact O-N 3.07Å; K689-D693 IonicContact NZ-OD1 3.05Å; K689-D693 PolarHBondContact NZ-OD1 3.41Å; K689-D693 IonicContact NZ-OD2 2.7Å; K689-D693 PolarHBondContact NZ-OD2 3.28Å; K689-D693 PolarHBondContact O-N 3.05Å; K689-W724 HydrophobicContact CB-CZ2 4.12Å; K689-W724 HydrophobicContact CD-CZ2 4.09Å
690	P	91.1	Very high	87.8	Confident	83 Å²	83	62 Å²	62	54%	0.539	32%	0.324	S	S	.	.	H	α-helix	trans	-61.8	-26.6	-179.5	-24.6	35.7	0	0	0	114.7	A687 D693 K694	A687-P690 WeakPolarHBondContact O-CD 3.41Å; P690-D693 PolarHBondContact O-N 2.88Å; P690-K694 PolarHBondContact O-N 3.18Å
691	N	88.7	Confident	87.7	Confident	63 Å²	63	60 Å²	60	34%	0.337	32%	0.317	S	S	.	.	H	α-helix	trans	-72.2	-33	177.2	-65.8	-38	0	0	0	111.7	Y688 K689 L695	Y688-N691 HydrophobicContact CD1-CB 4.31Å; Y688-N691 WeakPolarHBondContact CD2-ND2 3.47Å; Y688-N691 HydrophobicContact CE1-CB 4.07Å; Y688-N691 VanDerWaalsContact CE2-ND2 3.34Å; Y688-N691 WeakPolarHBondContact CE2-ND2 3.48Å; Y688-N691 PolarHBondContact O-N 3.18Å; Y688-N691 VanDerWaalsContact O-N 3.11Å; K689-N691 PolarHBondContact O-N 3.39Å; N691-L695 PolarHBondContact O-N 3.09Å
692	I	87.9	Confident	87.7	Confident	12 Å²	12	58.3 Å²	58.3	6%	0.062	31%	0.309	C	S	.	.	H	α-helix	trans	-66.5	-42.6	172.4	-51.6	-58	0	0	0	109.8	I649 K689 K694 L695 E696 M717 I720 W724	I649-I692 HydrophobicContact CB-CD1 4.49Å; I649-I692 HydrophobicContact CD1-CD1 4.32Å; I649-I692 HydrophobicContact CG1-CD1 4.47Å; I649-I692 HydrophobicContact CG2-CD1 3.27Å; K689-I692 WeakPolarHBondContact O-CB 3.36Å; K689-I692 PolarHBondContact O-N 2.66Å; K689-I692 VanDerWaalsContact O-N 3.07Å; I692-K694 VanDerWaalsContact C-N 3.3Å; I692-K694 PolarHBondContact O-N 3.22Å; I692-L695 PolarHBondContact O-N 3.01Å; I692-E696 PolarHBondContact O-N 3.49Å; I692-M717 HydrophobicContact CG2-CE 4.29Å; I692-I720 HydrophobicContact CD1-CG2 4.15Å; I692-W724 HydrophobicContact CD1-CD2 4.49Å; I692-W724 HydrophobicContact CD1-CE3 4Å; I692-W724 HydrophobicContact CD1-CZ3 4.26Å; I692-W724 HydrophobicContact CG1-CD2 4.06Å; I692-W724 HydrophobicContact CG1-CE3 3.91Å; I692-W724 HydrophobicContact CG1-CH2 4.32Å; I692-W724 HydrophobicContact CG1-CZ3 4.02Å
693	D	86.8	Confident	87.4	Confident	80 Å²	80	58.8 Å²	58.8	43%	0.428	31%	0.311	S	S	.	.	H	α-helix	trans	-65.3	-34.6	179.3	-64.4	-27.9	0	0	0	112.3	K689 P690 E696 G697	K689-D693 IonicContact NZ-OD1 3.05Å; K689-D693 PolarHBondContact NZ-OD1 3.41Å; K689-D693 IonicContact NZ-OD2 2.7Å; K689-D693 PolarHBondContact NZ-OD2 3.28Å; K689-D693 PolarHBondContact O-N 3.05Å; P690-D693 PolarHBondContact O-N 2.88Å; D693-E696 WeakPolarHBondContact O-CB 3.48Å; D693-E696 PolarHBondContact O-N 3.03Å; D693-G697 PolarHBondContact O-N 2.7Å
694	K	89.1	Confident	87.1	Confident	117 Å²	117	58.8 Å²	58.8	51%	0.509	31%	0.311	S	S	.	.	H	α-helix	trans	-66	-42.2	173	-171.7	-178.1	177.2	-173.2	0	112.2	P690 I692 E696 G697 D698	P690-K694 PolarHBondContact O-N 3.18Å; I692-K694 VanDerWaalsContact C-N 3.3Å; I692-K694 PolarHBondContact O-N 3.22Å; K694-E696 VanDerWaalsContact C-N 3.31Å; K694-G697 PolarHBondContact O-N 3.31Å; K694-D698 PolarHBondContact O-N 3.03Å
695	L	90.1	Very high	86.8	Confident	0 Å²	0	58 Å²	58	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-64.1	-38	176	-179	68.5	0	0	0	111.5	F642 Q645 A646 I649 N691 I692 G697 D698 H699 M717 I720	F642-L695 HydrophobicContact CD2-CD1 3.62Å; F642-L695 HydrophobicContact CD2-CG 4.37Å; F642-L695 HydrophobicContact CE2-CD1 3.63Å; F642-L695 HydrophobicContact CE2-CG 3.98Å; F642-L695 HydrophobicContact CG-CD1 4.22Å; F642-L695 HydrophobicContact CZ-CD1 4.27Å; Q645-L695 HydrophobicContact CB-CD1 3.64Å; A646-L695 HydrophobicContact CB-CD1 4.05Å; A646-L695 HydrophobicContact CB-CD2 4.21Å; I649-L695 HydrophobicContact CD1-CB 3.91Å; I649-L695 HydrophobicContact CD1-CD2 3.85Å; I649-L695 HydrophobicContact CD1-CG 4.4Å; N691-L695 PolarHBondContact O-N 3.09Å; I692-L695 PolarHBondContact O-N 3.01Å; L695-G697 VanDerWaalsContact C-N 3.32Å; L695-G697 PolarHBondContact O-N 2.85Å; L695-D698 PolarHBondContact O-N 3.47Å; L695-H699 PolarHBondContact O-N 2.69Å; L695-M717 HydrophobicContact CD2-CE 4.35Å; L695-M717 HydrophobicContact CD2-SD 3.74Å; L695-M717 HydrophobicContact CG-CE 4.46Å; L695-M717 HydrophobicContact CG-SD 3.81Å; L695-I720 HydrophobicContact CD2-CB 4.49Å; L695-I720 HydrophobicContact CD2-CG1 4.15Å; L695-I720 HydrophobicContact CD2-CG2 4.17Å
696	E	85.7	Confident	86.4	Confident	59 Å²	59	64.1 Å²	64.1	28%	0.276	34%	0.34	S	S	.	.	H	α-helix	trans	-60.7	-41	173.3	-168.8	71.4	-142.9	0	0	111	I692 D693 K694 H699 Q700 M717 R721	I692-E696 PolarHBondContact O-N 3.49Å; D693-E696 WeakPolarHBondContact O-CB 3.48Å; D693-E696 PolarHBondContact O-N 3.03Å; K694-E696 VanDerWaalsContact C-N 3.31Å; E696-H699 WeakPolarHBondContact O-CB 3.34Å; E696-H699 PolarHBondContact O-N 2.8Å; E696-Q700 PolarHBondContact O-N 2.62Å; E696-M717 HydrophobicContact CB-CE 4.05Å; E696-M717 WeakPolarHBondContact OE2-CE 3.33Å; E696-R721 IonicContact OE1-CZ 3.98Å; E696-R721 IonicContact OE1-NE 2.65Å; E696-R721 IonicContact OE1-NH2 3.78Å; E696-R721 PolarHBondContact OE1-NH2 3.47Å; E696-R721 IonicContact OE2-CZ 3.2Å; E696-R721 IonicContact OE2-NE 3.26Å; E696-R721 PolarHBondContact OE2-NE 3.29Å; E696-R721 IonicContact OE2-NH2 2.72Å; E696-R721 PolarHBondContact OE2-NH2 2.96Å
697	G	86.9	Confident	86.1	Confident	34 Å²	34	59.6 Å²	59.6	35%	0.351	32%	0.317	S	S	.	.	H	α-helix	trans	-63.7	-43	173.3	0	0	0	0	0	113.9	D693 K694 L695 H699 Q700 L701	D693-G697 PolarHBondContact O-N 2.7Å; K694-G697 PolarHBondContact O-N 3.31Å; L695-G697 VanDerWaalsContact C-N 3.32Å; L695-G697 PolarHBondContact O-N 2.85Å; G697-H699 VanDerWaalsContact C-N 3.27Å; G697-H699 PolarHBondContact O-N 3.28Å; G697-Q700 PolarHBondContact O-N 3.06Å; G697-L701 PolarHBondContact O-N 3.47Å; G697-L701 VanDerWaalsContact O-N 3.15Å
698	D	87.9	Confident	85.5	Confident	14 Å²	14	64 Å²	64	8%	0.075	32%	0.324	C	S	.	.	H	α-helix	trans	-63.2	-35.3	174.1	-73.6	-24.3	0	0	0	111.3	Q641 F642 K694 L695 I702	Q641-D698 PolarHBondContact NE2-OD1 3.26Å; F642-D698 HydrophobicContact CB-CB 4.42Å; F642-D698 HydrophobicContact CD2-CB 4.34Å; K694-D698 PolarHBondContact O-N 3.03Å; L695-D698 PolarHBondContact O-N 3.47Å; D698-I702 WeakPolarHBondContact O-CG1 3.37Å; D698-I702 PolarHBondContact O-N 3.03Å
699	H	85.7	Confident	85	Confident	37 Å²	37	65.7 Å²	65.7	17%	0.171	34%	0.337	C	S	.	.	H	α-helix	trans	-65.9	-43.1	174.7	-166.3	53.2	0	0	0	112.2	F642 L695 E696 G697 L701 I702 Q703	F642-H699 HydrophobicContact CD2-CB 4.02Å; F642-H699 HydrophobicContact CE2-CB 3.67Å; F642-H699 AromaticContact CE2-CG 3.94Å; F642-H699 AromaticContact CE2-ND1 3.67Å; L695-H699 PolarHBondContact O-N 2.69Å; E696-H699 WeakPolarHBondContact O-CB 3.34Å; E696-H699 PolarHBondContact O-N 2.8Å; G697-H699 VanDerWaalsContact C-N 3.27Å; G697-H699 PolarHBondContact O-N 3.28Å; H699-L701 PolarHBondContact O-N 2.62Å; H699-I702 WeakPolarHBondContact O-CB 3.25Å; H699-I702 PolarHBondContact O-N 3.11Å; H699-Q703 PolarHBondContact CD2-NE2 3.39Å; H699-Q703 PolarHBondContact NE2-NE2 2.77Å; H699-Q703 WeakPolarHBondContact O-CG 3.4Å; H699-Q703 PolarHBondContact O-N 3.41Å
700	Q	86.1	Confident	84.9	Confident	87 Å²	87	63.5 Å²	63.5	41%	0.407	33%	0.329	S	S	.	.	H	α-helix	trans	-59.7	-45.7	178.5	-175.6	63.9	29.9	0	0	111.4	E696 G697 I702 Q703 E704	E696-Q700 PolarHBondContact O-N 2.62Å; G697-Q700 PolarHBondContact O-N 3.06Å; Q700-I702 VanDerWaalsContact C-N 3.28Å; Q700-I702 PolarHBondContact O-N 2.71Å; Q700-Q703 PolarHBondContact O-N 2.98Å; Q700-E704 WeakPolarHBondContact CG-OE1 3.46Å; Q700-E704 PolarHBondContact NE2-OE1 3.11Å; Q700-E704 WeakPolarHBondContact O-CB 3.34Å; Q700-E704 WeakPolarHBondContact O-CG 3.35Å; Q700-E704 PolarHBondContact O-N 3.45Å
701	L	85.8	Confident	84.7	Confident	81 Å²	81	65.9 Å²	65.9	42%	0.424	33%	0.331	S	S	.	.	H	α-helix	trans	-62.3	-35.9	177.9	-69.5	173.3	0	0	0	112.8	L638 G697 H699 S705	L638-L701 HydrophobicContact CD2-CB 4.5Å; G697-L701 PolarHBondContact O-N 3.47Å; G697-L701 VanDerWaalsContact O-N 3.15Å; H699-L701 PolarHBondContact O-N 2.62Å; L701-S705 WeakPolarHBondContact O-CB 3.33Å; L701-S705 PolarHBondContact O-N 3.36Å; L701-S705 PolarHBondContact O-OG 3.2Å
702	I	84.1	Confident	84.7	Confident	10 Å²	10	65.9 Å²	65.9	5%	0.051	33%	0.328	C	S	.	.	H	α-helix	trans	-67.2	-43.4	175.6	-77.2	173.5	0	0	0	110.8	L638 F642 D698 H699 Q700 S705 L706 V707	L638-I702 HydrophobicContact CB-CG1 3.82Å; L638-I702 WeakPolarHBondContact O-CD1 3.4Å; F642-I702 HydrophobicContact CB-CD1 3.25Å; F642-I702 HydrophobicContact CD2-CD1 4.28Å; F642-I702 HydrophobicContact CG-CD1 3.82Å; D698-I702 WeakPolarHBondContact O-CG1 3.37Å; D698-I702 PolarHBondContact O-N 3.03Å; H699-I702 WeakPolarHBondContact O-CB 3.25Å; H699-I702 PolarHBondContact O-N 3.11Å; Q700-I702 VanDerWaalsContact C-N 3.28Å; Q700-I702 PolarHBondContact O-N 2.71Å; I702-S705 CarbonylContact O-C 3.56Å; I702-S705 PolarHBondContact O-N 3Å; I702-L706 PolarHBondContact O-N 2.9Å; I702-V707 HydrophobicContact CG2-CB 4.05Å; I702-V707 HydrophobicContact CG2-CG1 4.34Å; I702-V707 WeakPolarHBondContact CG2-O 3.47Å; I702-V707 PolarHBondContact O-N 2.87Å
703	Q	78.8	Confident	84.7	Confident	78 Å²	78	66.2 Å²	66.2	36%	0.364	33%	0.331	S	S	.	.	H	α-helix	trans	-66.6	-42.1	176.7	-71.4	-172.4	-14.5	0	0	112.5	H699 Q700 S705 L706	H699-Q703 PolarHBondContact CD2-NE2 3.39Å; H699-Q703 PolarHBondContact NE2-NE2 2.77Å; H699-Q703 WeakPolarHBondContact O-CG 3.4Å; H699-Q703 PolarHBondContact O-N 3.41Å; Q700-Q703 PolarHBondContact O-N 2.98Å; Q703-S705 PolarHBondContact O-N 3.46Å; Q703-L706 WeakPolarHBondContact O-CA 3.45Å; Q703-L706 PolarHBondContact O-N 2.94Å
704	E	82.4	Confident	84.6	Confident	123 Å²	123	69.9 Å²	69.9	58%	0.575	35%	0.35	S	S	*	.	H	α-helix	trans	-64.7	-31.4	175.9	-73.9	174.3	-173.5	0	0	112.1	Q700 L706	Q700-E704 WeakPolarHBondContact CG-OE1 3.46Å; Q700-E704 PolarHBondContact NE2-OE1 3.11Å; Q700-E704 WeakPolarHBondContact O-CB 3.34Å; Q700-E704 WeakPolarHBondContact O-CG 3.35Å; Q700-E704 PolarHBondContact O-N 3.45Å; E704-L706 PolarHBondContact O-N 2.92Å
705	S	81.9	Confident	84.5	Confident	37 Å²	37	67.8 Å²	67.8	26%	0.259	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	5.7	172.2	-52.9	0	0	0	0	113.2	L638 L701 I702 Q703 V707	L638-S705 WeakPolarHBondContact CD1-OG 3.3Å; L701-S705 WeakPolarHBondContact O-CB 3.33Å; L701-S705 PolarHBondContact O-N 3.36Å; L701-S705 PolarHBondContact O-OG 3.2Å; I702-S705 CarbonylContact O-C 3.56Å; I702-S705 PolarHBondContact O-N 3Å; Q703-S705 PolarHBondContact O-N 3.46Å; S705-V707 VanDerWaalsContact C-N 3.25Å; S705-V707 PolarHBondContact O-N 3.26Å
706	L	80.9	Confident	84.3	Confident	131 Å²	131	71.1 Å²	71.1	69%	0.686	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	32.3	179.7	-55.4	175.6	0	0	0	114.4	I702 Q703 E704 F708	I702-L706 PolarHBondContact O-N 2.9Å; Q703-L706 WeakPolarHBondContact O-CA 3.45Å; Q703-L706 PolarHBondContact O-N 2.94Å; E704-L706 PolarHBondContact O-N 2.92Å; L706-F708 HydrophobicContact CB-CE2 4.17Å; L706-F708 HydrophobicContact CB-CZ 4.43Å; L706-F708 HydrophobicContact CD2-CE2 4.47Å; L706-F708 HydrophobicContact CD2-CZ 4.07Å; L706-F708 WeakPolarHBondContact O-CD2 3.39Å; L706-F708 WeakPolarHBondContact O-CE2 3.38Å
707	V	80.1	Confident	84.4	Confident	7 Å²	7	68.5 Å²	68.5	4%	0.042	35%	0.348	C	S	.	.			trans	-100.5	116.8	175.4	179.5	0	0	0	0	108.5	H635 R639 I702 S705	H635-V707 HydrophobicContact CB-CG2 3.83Å; R639-V707 HydrophobicContact CG-CG1 3.73Å; I702-V707 HydrophobicContact CG2-CB 4.05Å; I702-V707 HydrophobicContact CG2-CG1 4.34Å; I702-V707 WeakPolarHBondContact CG2-O 3.47Å; I702-V707 PolarHBondContact O-N 2.87Å; S705-V707 VanDerWaalsContact C-N 3.25Å; S705-V707 PolarHBondContact O-N 3.26Å
708	F	78.9	Confident	84.2	Confident	159 Å²	159	71.9 Å²	71.9	70%	0.697	36%	0.355	S	S	*	.			trans	-111.8	-11	-174.3	-58	-72.3	0	0	0	113.7	L706	L706-F708 HydrophobicContact CB-CE2 4.17Å; L706-F708 HydrophobicContact CB-CZ 4.43Å; L706-F708 HydrophobicContact CD2-CE2 4.47Å; L706-F708 HydrophobicContact CD2-CZ 4.07Å; L706-F708 WeakPolarHBondContact O-CD2 3.39Å; L706-F708 WeakPolarHBondContact O-CE2 3.38Å
709	D	79.5	Confident	84	Confident	85 Å²	85	77 Å²	77	46%	0.455	38%	0.378	S	S	.	.			trans	-109	140.9	179.8	72.1	-62.1	0	0	0	111.1	R639	R639-D709 WeakPolarHBondContact CD-O 3.39Å; R639-D709 IonicContact CZ-OD1 3.37Å; R639-D709 IonicContact CZ-OD2 3.75Å; R639-D709 PolarHBondContact NE-O 3.23Å; R639-D709 IonicContact NE-OD1 2.87Å; R639-D709 IonicContact NE-OD2 3.36Å; R639-D709 PolarHBondContact NE-OD2 2.91Å; R639-D709 IonicContact NH2-OD1 3.76Å; R639-D709 PolarHBondContact NH2-OD1 2.79Å; R639-D709 IonicContact NH2-OD2 2.72Å; R639-D709 PolarHBondContact NH2-OD2 3.42Å
710	N	84.9	Confident	84.1	Confident	36 Å²	36	75.3 Å²	75.3	19%	0.193	37%	0.37	C	S	.	.			trans	-138.6	97.6	174.1	-164	-18.6	0	0	0	111.4	R639 F642 H712	R639-N710 PolarHBondContact O-ND2 3.31Å; R639-N710 PolarHBondContact O-OD1 3.32Å; F642-N710 WeakPolarHBondContact CD1-ND2 3.21Å; N710-H712 PolarHBondContact O-N 3Å; N710-H712 VanDerWaalsContact O-N 3.12Å; N710-H712 WeakPolarHBondContact OD1-CB 3.49Å; N710-H712 PolarHBondContact OD1-N 3.08Å; N710-H712 VanDerWaalsContact OD1-N 3.11Å
711	K	85.6	Confident	84.1	Confident	134 Å²	134	75 Å²	75	58%	0.583	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-4.6	178.3	64.9	-172.4	175.6	-170.3	0	115.2
712	H	89.3	Confident	84.1	Confident	63 Å²	63	74.9 Å²	74.9	29%	0.292	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-3.4	-172.3	-57.1	-70.5	0	0	0	114.1	E636 R640 A643 N647 N710	E636-H712 IonicContact OE1-CE1 2.62Å; E636-H712 IonicContact OE1-NE2 3.94Å; E636-H712 PolarHBondContact OE1-NE2 3.32Å; R640-H712 WeakPolarHBondContact CG-NE2 3.4Å; R640-H712 PolarHBondContact NE-NE2 3.1Å; A643-H712 HydrophobicContact CB-CB 3.46Å; A643-H712 VanDerWaalsContact CB-CB 3.46Å; N647-H712 PolarHBondContact ND2-O 3.48Å; N710-H712 PolarHBondContact O-N 3Å; N710-H712 VanDerWaalsContact O-N 3.12Å; N710-H712 WeakPolarHBondContact OD1-CB 3.49Å; N710-H712 PolarHBondContact OD1-N 3.08Å; N710-H712 VanDerWaalsContact OD1-N 3.11Å
713	T	87.6	Confident	84	Confident	18 Å²	18	75.1 Å²	75.1	11%	0.11	37%	0.372	C	S	.	.			trans	-149.4	148.8	176.1	-177.1	0	0	0	0	111.7	F642 A643 A646 N647 Y715	F642-T713 HydrophobicContact CD1-CG2 4.18Å; F642-T713 HydrophobicContact CE1-CG2 4.12Å; A643-T713 HydrophobicContact CB-CG2 3.8Å; A646-T713 HydrophobicContact CB-CG2 4.49Å; N647-T713 WeakPolarHBondContact OD1-CB 3.48Å; N647-T713 PolarHBondContact OD1-OG1 3.18Å; T713-Y715 PolarHBondContact OG1-N 3.46Å; T713-Y715 VanDerWaalsContact OG1-N 3.08Å
714	N	86.4	Confident	84.4	Confident	157 Å²	157	72.3 Å²	72.3	84%	0.84	36%	0.359	S	S	*	.	S	Bend	trans	-92.2	-9.5	170.9	-64	-23.6	0	0	0	112.4
715	Y	85.5	Confident	84.5	Confident	73 Å²	73	72.4 Å²	72.4	29%	0.286	36%	0.359	S	S	.	.			trans	-86.7	115.4	177.6	-67.3	-76.1	0	0	0	109.6	T713 I720	T713-Y715 PolarHBondContact OG1-N 3.46Å; T713-Y715 VanDerWaalsContact OG1-N 3.08Å; Y715-I720 HydrophobicContact CD1-CD1 4.01Å; Y715-I720 HydrophobicContact CG-CD1 4.26Å
716	T	87.5	Confident	84.6	Confident	70 Å²	70	74.8 Å²	74.8	43%	0.429	37%	0.369	S	S	.	.			trans	-85.1	159.5	167.1	69.8	0	0	0	0	109.7	E718 H719 I720	T716-E718 PolarHBondContact O-N 2.95Å; T716-H719 PolarHBondContact O-N 3.21Å; T716-H719 VanDerWaalsContact O-N 3.15Å; T716-H719 PolarHBondContact OG1-N 3.27Å; T716-H719 PolarHBondContact OG1-ND1 3.42Å; T716-I720 PolarHBondContact O-N 3.49Å
717	M	86.4	Confident	84.8	Confident	4 Å²	4	68.6 Å²	68.6	2%	0.02	34%	0.336	C	S	.	.	H	α-helix	trans	-57.8	-34	178	-166.5	58.2	-159.8	0	0	111.8	F642 I692 L695 E696 I720 R721	F642-M717 HydrophobicContact CE2-SD 4.33Å; F642-M717 HydrophobicContact CZ-CB 4.29Å; I692-M717 HydrophobicContact CG2-CE 4.29Å; L695-M717 HydrophobicContact CD2-CE 4.35Å; L695-M717 HydrophobicContact CD2-SD 3.74Å; L695-M717 HydrophobicContact CG-CE 4.46Å; L695-M717 HydrophobicContact CG-SD 3.81Å; E696-M717 HydrophobicContact CB-CE 4.05Å; E696-M717 WeakPolarHBondContact OE2-CE 3.33Å; M717-I720 PolarHBondContact O-N 2.9Å; M717-R721 HydrophobicContact CE-CG 4.31Å; M717-R721 WeakPolarHBondContact O-CG 3.49Å; M717-R721 PolarHBondContact O-N 3.25Å
718	E	82.3	Confident	84.9	Confident	105 Å²	105	71.4 Å²	71.4	49%	0.491	35%	0.351	S	S	.	.	H	α-helix	trans	-64.8	-41	178.5	-161.9	58.5	-158.5	0	0	113.4	T716 I720 R721 V722	T716-E718 PolarHBondContact O-N 2.95Å; E718-I720 PolarHBondContact O-N 3.43Å; E718-R721 PolarHBondContact O-N 2.95Å; E718-R721 IonicContact OE2-NH1 2.99Å; E718-R721 PolarHBondContact OE2-NH1 3.32Å; E718-V722 WeakPolarHBondContact O-CG2 3.32Å; E718-V722 PolarHBondContact O-N 2.67Å
719	H	84.8	Confident	85	Confident	122 Å²	122	67.9 Å²	67.9	57%	0.565	34%	0.342	S	S	*	.	H	α-helix	trans	-60.1	-38	174.3	-72.2	104.1	0	0	0	111.7	T716 G723	T716-H719 PolarHBondContact O-N 3.21Å; T716-H719 VanDerWaalsContact O-N 3.15Å; T716-H719 PolarHBondContact OG1-N 3.27Å; T716-H719 PolarHBondContact OG1-ND1 3.42Å; H719-G723 PolarHBondContact O-N 3.39Å; H719-G723 VanDerWaalsContact O-N 3.12Å
720	I	88.2	Confident	85.1	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.01	33%	0.329	C	S	.	.	H	α-helix	trans	-70.5	-40.6	178.9	-58.6	-57.7	0	0	0	111.2	I649 I653 I692 L695 Y715 T716 M717 E718 W724	I649-I720 HydrophobicContact CG2-CD1 4.26Å; I649-I720 HydrophobicContact CG2-CG2 3.67Å; I653-I720 HydrophobicContact CD1-CG2 4.11Å; I692-I720 HydrophobicContact CD1-CG2 4.15Å; L695-I720 HydrophobicContact CD2-CB 4.49Å; L695-I720 HydrophobicContact CD2-CG1 4.15Å; L695-I720 HydrophobicContact CD2-CG2 4.17Å; Y715-I720 HydrophobicContact CD1-CD1 4.01Å; Y715-I720 HydrophobicContact CG-CD1 4.26Å; T716-I720 PolarHBondContact O-N 3.49Å; M717-I720 PolarHBondContact O-N 2.9Å; E718-I720 PolarHBondContact O-N 3.43Å; I720-W724 VanDerWaalsContact O-CB 3.28Å; I720-W724 WeakPolarHBondContact O-CB 3.48Å; I720-W724 PolarHBondContact O-N 3.41Å
721	R	85.8	Confident	85	Confident	80 Å²	80	63.5 Å²	63.5	30%	0.302	32%	0.32	S	S	.	.	H	α-helix	trans	-62.4	-53.2	177.2	-71	179.1	-170.2	147.5	-7.2	112.2	E696 M717 E718 G723 W724 E725	E696-R721 IonicContact OE1-CZ 3.98Å; E696-R721 IonicContact OE1-NE 2.65Å; E696-R721 IonicContact OE1-NH2 3.78Å; E696-R721 PolarHBondContact OE1-NH2 3.47Å; E696-R721 IonicContact OE2-CZ 3.2Å; E696-R721 IonicContact OE2-NE 3.26Å; E696-R721 PolarHBondContact OE2-NE 3.29Å; E696-R721 IonicContact OE2-NH2 2.72Å; E696-R721 PolarHBondContact OE2-NH2 2.96Å; M717-R721 HydrophobicContact CE-CG 4.31Å; M717-R721 WeakPolarHBondContact O-CG 3.49Å; M717-R721 PolarHBondContact O-N 3.25Å; E718-R721 PolarHBondContact O-N 2.95Å; E718-R721 IonicContact OE2-NH1 2.99Å; E718-R721 PolarHBondContact OE2-NH1 3.32Å; R721-G723 VanDerWaalsContact C-N 3.33Å; R721-G723 PolarHBondContact O-N 2.92Å; R721-W724 WeakPolarHBondContact O-CB 3.29Å; R721-W724 PolarHBondContact O-N 2.94Å; R721-W724 VanDerWaalsContact O-N 3.15Å; R721-E725 WeakPolarHBondContact O-CG 3.46Å; R721-E725 PolarHBondContact O-N 2.89Å
722	V	84.8	Confident	84.6	Confident	79 Å²	79	59.6 Å²	59.6	48%	0.479	31%	0.312	S	S	.	.	H	α-helix	trans	-61.2	-44.2	-179.5	174.6	0	0	0	0	111	E718 W724 E725 L726	E718-V722 WeakPolarHBondContact O-CG2 3.32Å; E718-V722 PolarHBondContact O-N 2.67Å; V722-W724 VanDerWaalsContact C-N 3.29Å; V722-W724 PolarHBondContact O-N 3.22Å; V722-E725 PolarHBondContact O-N 3.42Å; V722-L726 VanDerWaalsContact O-CB 3.32Å; V722-L726 WeakPolarHBondContact O-CB 3.48Å; V722-L726 PolarHBondContact O-N 3.12Å
723	G	81.9	Confident	84.1	Confident	14 Å²	14	63.6 Å²	63.6	14%	0.144	33%	0.325	C	S	.	.	H	α-helix	trans	-60.4	-39.2	176.9	0	0	0	0	0	112.8	I653 H719 R721 L727	I653-G723 VanDerWaalsContact CG2-O 3.3Å; I653-G723 WeakPolarHBondContact CG2-O 3.39Å; H719-G723 PolarHBondContact O-N 3.39Å; H719-G723 VanDerWaalsContact O-N 3.12Å; R721-G723 VanDerWaalsContact C-N 3.33Å; R721-G723 PolarHBondContact O-N 2.92Å; G723-L727 WeakPolarHBondContact O-CB 3.47Å; G723-L727 PolarHBondContact O-N 3.24Å; G723-L727 VanDerWaalsContact O-N 3.14Å
724	W	87.9	Confident	83.6	Confident	19 Å²	19	63.3 Å²	63.3	7%	0.072	32%	0.323	C	S	.	.	H	α-helix	trans	-69.9	-44.1	178.7	-178	-98.6	0	0	0	113	W652 I653 I685 Y688 K689 I692 I720 R721 V722 L727 L728	W652-W724 HydrophobicContact CE3-CZ3 4.41Å; W652-W724 HydrophobicContact CH2-CZ3 4.06Å; W652-W724 HydrophobicContact CZ3-CE3 4.29Å; W652-W724 HydrophobicContact CZ3-CH2 4.4Å; W652-W724 AromaticContact CZ3-CZ3 3.52Å; W652-W724 HydrophobicContact CZ3-CZ3 3.52Å; I653-W724 HydrophobicContact CD1-CB 4.19Å; I653-W724 HydrophobicContact CD1-CE3 4.22Å; I653-W724 HydrophobicContact CG1-CE3 4.19Å; I685-W724 HydrophobicContact CG2-CH2 3.92Å; I685-W724 HydrophobicContact CG2-CZ2 4.14Å; I685-W724 HydrophobicContact CG2-CZ3 4.39Å; I685-W724 WeakPolarHBondContact O-CH2 3.4Å; Y688-W724 HydrophobicContact CD1-CZ3 4.13Å; K689-W724 HydrophobicContact CB-CZ2 4.12Å; K689-W724 HydrophobicContact CD-CZ2 4.09Å; I692-W724 HydrophobicContact CD1-CD2 4.49Å; I692-W724 HydrophobicContact CD1-CE3 4Å; I692-W724 HydrophobicContact CD1-CZ3 4.26Å; I692-W724 HydrophobicContact CG1-CD2 4.06Å; I692-W724 HydrophobicContact CG1-CE3 3.91Å; I692-W724 HydrophobicContact CG1-CH2 4.32Å; I692-W724 HydrophobicContact CG1-CZ3 4.02Å; I720-W724 VanDerWaalsContact O-CB 3.28Å; I720-W724 WeakPolarHBondContact O-CB 3.48Å; I720-W724 PolarHBondContact O-N 3.41Å; R721-W724 WeakPolarHBondContact O-CB 3.29Å; R721-W724 PolarHBondContact O-N 2.94Å; R721-W724 VanDerWaalsContact O-N 3.15Å; V722-W724 VanDerWaalsContact C-N 3.29Å; V722-W724 PolarHBondContact O-N 3.22Å; W724-L727 WeakPolarHBondContact O-CB 3.33Å; W724-L727 PolarHBondContact O-N 3.47Å; W724-L728 PolarHBondContact O-N 3.48Å; W724-L728 VanDerWaalsContact O-N 3.16Å
725	E	84.5	Confident	83.2	Confident	126 Å²	126	56.5 Å²	56.5	59%	0.589	29%	0.287	S	S	*	.	H	α-helix	trans	-65.6	-40.6	177.3	-71	178	177.8	0	0	112.2	R721 V722 L727 L728 T729	R721-E725 WeakPolarHBondContact O-CG 3.46Å; R721-E725 PolarHBondContact O-N 2.89Å; V722-E725 PolarHBondContact O-N 3.42Å; E725-L727 VanDerWaalsContact C-N 3.31Å; E725-L727 PolarHBondContact O-N 3.31Å; E725-L728 PolarHBondContact O-N 3.44Å; E725-T729 WeakPolarHBondContact O-CG2 3.31Å; E725-T729 PolarHBondContact O-N 3.39Å; E725-T729 PolarHBondContact O-OG1 3.4Å
726	L	82.8	Confident	82.8	Confident	87 Å²	87	57.7 Å²	57.7	46%	0.455	30%	0.298	S	S	.	.	H	α-helix	trans	-63.1	-38.5	175.5	-175.9	61.5	0	0	0	111.8	M657 V722 T729 T730	M657-L726 HydrophobicContact CE-CD2 4.45Å; M657-L726 HydrophobicContact SD-CD2 3.93Å; M657-L726 HydrophobicContact SD-CG 4.04Å; V722-L726 VanDerWaalsContact O-CB 3.32Å; V722-L726 WeakPolarHBondContact O-CB 3.48Å; V722-L726 PolarHBondContact O-N 3.12Å; L726-T729 WeakPolarHBondContact CA-OG1 3.46Å; L726-T729 PolarHBondContact O-OG1 3.34Å; L726-T730 VanDerWaalsContact O-CB 3.27Å; L726-T730 WeakPolarHBondContact O-CB 3.31Å; L726-T730 PolarHBondContact O-N 2.82Å; L726-T730 PolarHBondContact O-OG1 2.95Å
727	L	86	Confident	82.1	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-62.1	-44.7	175.8	177.4	65	0	0	0	111.5	W652 I653 R656 M657 I660 I685 G723 W724 E725 I731	W652-L727 HydrophobicContact CZ3-CD2 4.1Å; I653-L727 HydrophobicContact CG2-CB 4.5Å; I653-L727 HydrophobicContact CG2-CD2 4.4Å; R656-L727 HydrophobicContact CB-CD1 3.91Å; R656-L727 HydrophobicContact CB-CD2 4.13Å; M657-L727 HydrophobicContact CB-CD1 4.35Å; M657-L727 HydrophobicContact CG-CB 4.1Å; M657-L727 HydrophobicContact CG-CD1 3.56Å; M657-L727 HydrophobicContact CG-CG 4.41Å; I660-L727 HydrophobicContact CD1-CD1 3.49Å; I660-L727 VanDerWaalsContact CD1-CD1 3.49Å; I685-L727 HydrophobicContact CD1-CD1 4.01Å; I685-L727 HydrophobicContact CD1-CD2 4.17Å; I685-L727 HydrophobicContact CD1-CG 3.96Å; I685-L727 HydrophobicContact CG1-CD2 4.16Å; I685-L727 HydrophobicContact CG1-CG 4.48Å; I685-L727 HydrophobicContact CG2-CD2 4.11Å; I685-L727 HydrophobicContact CG2-CG 4.43Å; G723-L727 WeakPolarHBondContact O-CB 3.47Å; G723-L727 PolarHBondContact O-N 3.24Å; G723-L727 VanDerWaalsContact O-N 3.14Å; W724-L727 WeakPolarHBondContact O-CB 3.33Å; W724-L727 PolarHBondContact O-N 3.47Å; E725-L727 VanDerWaalsContact C-N 3.31Å; E725-L727 PolarHBondContact O-N 3.31Å; L727-I731 PolarHBondContact O-N 2.99Å
728	L	83.1	Confident	81.5	Confident	67 Å²	67	59.4 Å²	59.4	35%	0.351	30%	0.301	S	S	.	.	H	α-helix	trans	-66	-42.8	178.6	-72.5	173.8	0	0	0	113.1	I685 W724 E725 I731 A732	I685-L728 HydrophobicContact CG2-CD2 3.73Å; W724-L728 PolarHBondContact O-N 3.48Å; W724-L728 VanDerWaalsContact O-N 3.16Å; E725-L728 PolarHBondContact O-N 3.44Å; L728-I731 VanDerWaalsContact O-CG2 3.26Å; L728-I731 WeakPolarHBondContact O-CG2 3.38Å; L728-A732 WeakPolarHBondContact O-CB 3.09Å; L728-A732 PolarHBondContact O-N 3.05Å
729	T	80.6	Confident	80.9	Confident	85 Å²	85	58.1 Å²	58.1	52%	0.521	30%	0.295	S	S	.	.	H	α-helix	trans	-68.7	-37.6	178.6	50	0	0	0	0	111.9	E725 L726 R733	E725-T729 WeakPolarHBondContact O-CG2 3.31Å; E725-T729 PolarHBondContact O-N 3.39Å; E725-T729 PolarHBondContact O-OG1 3.4Å; L726-T729 WeakPolarHBondContact CA-OG1 3.46Å; L726-T729 PolarHBondContact O-OG1 3.34Å; T729-R733 WeakPolarHBondContact O-CB 3.43Å; T729-R733 PolarHBondContact O-N 2.85Å; T729-R733 VanDerWaalsContact O-N 3.08Å
730	T	80.8	Confident	80	Confident	28 Å²	28	55.7 Å²	55.7	17%	0.172	29%	0.289	C	S	.	.	H	α-helix	trans	-63.5	-46.5	178.8	-60.5	0	0	0	0	111.4	I660 L726 T734	I660-T730 HydrophobicContact CG2-CG2 4.15Å; L726-T730 VanDerWaalsContact O-CB 3.27Å; L726-T730 WeakPolarHBondContact O-CB 3.31Å; L726-T730 PolarHBondContact O-N 2.82Å; L726-T730 PolarHBondContact O-OG1 2.95Å; T730-T734 PolarHBondContact O-N 3.49Å; T730-T734 PolarHBondContact O-OG1 3.01Å; T730-T734 VanDerWaalsContact O-OG1 3.1Å
731	I	83	Confident	78.8	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-67	-41	180	-166.4	159.2	0	0	0	112.6	I660 M681 E682 I685 L727 L728 R733 T734 I735	I660-I731 HydrophobicContact CD1-CB 3.89Å; I660-I731 HydrophobicContact CD1-CD1 4.1Å; I660-I731 HydrophobicContact CD1-CG1 4.32Å; I660-I731 HydrophobicContact CG1-CD1 4.26Å; M681-I731 HydrophobicContact CB-CD1 3.78Å; E682-I731 HydrophobicContact CB-CD1 3.86Å; E682-I731 HydrophobicContact CB-CG1 4.43Å; E682-I731 VanDerWaalsContact N-CD1 3.33Å; I685-I731 HydrophobicContact CD1-CD1 3.75Å; I685-I731 HydrophobicContact CD1-CG2 4.44Å; L727-I731 PolarHBondContact O-N 2.99Å; L728-I731 VanDerWaalsContact O-CG2 3.26Å; L728-I731 WeakPolarHBondContact O-CG2 3.38Å; I731-R733 PolarHBondContact O-N 3.19Å; I731-T734 WeakPolarHBondContact CA-OG1 3.49Å; I731-T734 PolarHBondContact O-N 3.34Å; I731-T734 PolarHBondContact O-OG1 3.16Å; I731-I735 HydrophobicContact CG1-CD1 4.12Å; I731-I735 WeakPolarHBondContact O-CG1 3.48Å; I731-I735 PolarHBondContact O-N 3.04Å; I731-I735 VanDerWaalsContact O-N 3.08Å
732	A	77.9	Confident	77.9	Confident	51 Å²	51	56.7 Å²	56.7	42%	0.421	30%	0.298	S	S	.	.	H	α-helix	trans	-62.9	-42.1	178.4	0	0	0	0	0	112.4	L728 I735 N736	L728-A732 WeakPolarHBondContact O-CB 3.09Å; L728-A732 PolarHBondContact O-N 3.05Å; A732-I735 PolarHBondContact O-N 3.44Å; A732-N736 PolarHBondContact O-N 3.29Å; A732-N736 VanDerWaalsContact O-N 3.13Å
733	R	78.4	Confident	76.7	Confident	148 Å²	148	58.7 Å²	58.7	56%	0.558	31%	0.305	S	S	*	.	H	α-helix	trans	-61.9	-47.6	176	177.8	-178.8	55.6	160.9	-1.9	111.7	T729 I731 I735 N736 E737	T729-R733 WeakPolarHBondContact O-CB 3.43Å; T729-R733 PolarHBondContact O-N 2.85Å; T729-R733 VanDerWaalsContact O-N 3.08Å; I731-R733 PolarHBondContact O-N 3.19Å; R733-I735 VanDerWaalsContact C-N 3.28Å; R733-I735 PolarHBondContact O-N 3.13Å; R733-N736 PolarHBondContact O-N 3.07Å; R733-E737 WeakPolarHBondContact CG-OE1 3.42Å; R733-E737 WeakPolarHBondContact O-CG 3.27Å; R733-E737 PolarHBondContact O-N 3.49Å
734	T	76.4	Confident	75.6	Confident	12 Å²	12	59.3 Å²	59.3	7%	0.074	31%	0.306	C	S	.	.	H	α-helix	trans	-63.5	-33.3	-179.9	46.3	0	0	0	0	112.8	I660 T730 I731 I738	I660-T734 HydrophobicContact CG2-CG2 4.26Å; T730-T734 PolarHBondContact O-N 3.49Å; T730-T734 PolarHBondContact O-OG1 3.01Å; T730-T734 VanDerWaalsContact O-OG1 3.1Å; I731-T734 WeakPolarHBondContact CA-OG1 3.49Å; I731-T734 PolarHBondContact O-N 3.34Å; I731-T734 PolarHBondContact O-OG1 3.16Å; T734-I738 PolarHBondContact O-N 3.31Å
735	I	79.3	Confident	74.4	Confident	14 Å²	14	60.5 Å²	60.5	7%	0.072	31%	0.311	C	S	.	.	H	α-helix	trans	-66.2	-49.8	174.1	-71.8	169.7	0	0	0	110.4	M675 L678 K679 E682 I731 A732 R733 E737 I738 E739	M675-I735 HydrophobicContact CE-CG2 4.44Å; M675-I735 WeakPolarHBondContact CE-O 3.41Å; M675-I735 HydrophobicContact SD-CG2 3.89Å; L678-I735 HydrophobicContact CB-CD1 4.28Å; L678-I735 HydrophobicContact CB-CG1 3.75Å; L678-I735 HydrophobicContact CD1-CG1 4.27Å; K679-I735 HydrophobicContact CG-CD1 4.41Å; E682-I735 HydrophobicContact CB-CD1 4.45Å; I731-I735 HydrophobicContact CG1-CD1 4.12Å; I731-I735 WeakPolarHBondContact O-CG1 3.48Å; I731-I735 PolarHBondContact O-N 3.04Å; I731-I735 VanDerWaalsContact O-N 3.08Å; A732-I735 PolarHBondContact O-N 3.44Å; R733-I735 VanDerWaalsContact C-N 3.28Å; R733-I735 PolarHBondContact O-N 3.13Å; I735-E737 VanDerWaalsContact C-N 3.31Å; I735-E737 PolarHBondContact O-N 3.41Å; I735-I738 PolarHBondContact O-N 2.83Å; I735-I738 VanDerWaalsContact O-N 3.16Å; I735-E739 PolarHBondContact O-N 2.96Å; I735-E739 VanDerWaalsContact O-N 3.11Å
736	N	75.7	Confident	73.1	Confident	97 Å²	97	59.5 Å²	59.5	52%	0.519	31%	0.309	S	S	.	.	H	α-helix	trans	-62.3	-35.7	-178	-175.4	67	0	0	0	113.4	A732 R733 I738 E739 T740	A732-N736 PolarHBondContact O-N 3.29Å; A732-N736 VanDerWaalsContact O-N 3.13Å; R733-N736 PolarHBondContact O-N 3.07Å; N736-I738 VanDerWaalsContact C-N 3.34Å; N736-I738 PolarHBondContact O-N 3.33Å; N736-E739 PolarHBondContact O-N 3.47Å; N736-T740 PolarHBondContact O-N 3.31Å; N736-T740 VanDerWaalsContact O-N 3.09Å; N736-T740 PolarHBondContact O-OG1 3.32Å
737	E	73.6	Confident	71.6	Confident	95 Å²	95	59.5 Å²	59.5	44%	0.444	32%	0.322	S	S	.	.	H	α-helix	trans	-62	-39.7	175.7	-76.3	171.9	-169.4	0	0	112.3	R733 I735 Q741	R733-E737 WeakPolarHBondContact CG-OE1 3.42Å; R733-E737 WeakPolarHBondContact O-CG 3.27Å; R733-E737 PolarHBondContact O-N 3.49Å; I735-E737 VanDerWaalsContact C-N 3.31Å; I735-E737 PolarHBondContact O-N 3.41Å; E737-Q741 WeakPolarHBondContact O-CG 3.15Å; E737-Q741 PolarHBondContact O-N 3.16Å; E737-Q741 PolarHBondContact O-NE2 2.95Å
738	I	73	Confident	70.2	Confident	16 Å²	16	63.1 Å²	63.1	8%	0.082	34%	0.338	C	S	.	.	H	α-helix	trans	-74	-37	177.7	-60.9	-179.3	0	0	0	111.1	L671 Q674 M675 L678 T734 I735 N736 T740 Q741 I742	L671-I738 HydrophobicContact CB-CG2 4.4Å; L671-I738 HydrophobicContact CD2-CG2 4.42Å; Q674-I738 HydrophobicContact CB-CD1 4.05Å; M675-I738 HydrophobicContact CB-CG2 4.49Å; M675-I738 HydrophobicContact CE-CB 3.54Å; M675-I738 HydrophobicContact CE-CG2 3.49Å; M675-I738 VanDerWaalsContact CE-CG2 3.49Å; L678-I738 HydrophobicContact CD1-CD1 3.58Å; T734-I738 PolarHBondContact O-N 3.31Å; I735-I738 PolarHBondContact O-N 2.83Å; I735-I738 VanDerWaalsContact O-N 3.16Å; N736-I738 VanDerWaalsContact C-N 3.34Å; N736-I738 PolarHBondContact O-N 3.33Å; I738-T740 PolarHBondContact O-N 2.98Å; I738-Q741 PolarHBondContact O-N 3.04Å; I738-I742 HydrophobicContact CG2-CD1 4.46Å; I738-I742 WeakPolarHBondContact O-CG1 3.41Å; I738-I742 PolarHBondContact O-N 3.44Å
739	E	69.9	Low	68.9	Low	78 Å²	78	63.3 Å²	63.3	36%	0.364	36%	0.356	S	S	.	.	H	α-helix	trans	-62.5	-41.4	176.6	-68.9	-171.8	163.7	0	0	112.3	M675 K679 I735 N736 Q741 I742 L743	M675-E739 HydrophobicContact CE-CB 4.31Å; M675-E739 HydrophobicContact CE-CG 3.32Å; M675-E739 HydrophobicContact SD-CG 4.06Å; K679-E739 IonicContact NZ-OE1 3.39Å; K679-E739 PolarHBondContact NZ-OE1 3.11Å; I735-E739 PolarHBondContact O-N 2.96Å; I735-E739 VanDerWaalsContact O-N 3.11Å; N736-E739 PolarHBondContact O-N 3.47Å; E739-Q741 VanDerWaalsContact C-N 3.3Å; E739-Q741 PolarHBondContact O-N 2.81Å; E739-I742 PolarHBondContact O-N 3.43Å; E739-L743 PolarHBondContact O-N 2.86Å
740	T	66.3	Low	68	Low	71 Å²	71	60.6 Å²	60.6	44%	0.436	34%	0.338	S	S	.	.	H	α-helix	trans	-63.6	-36.2	178.9	-55.7	0	0	0	0	112.1	N736 I738 I742 L743 T744	N736-T740 PolarHBondContact O-N 3.31Å; N736-T740 VanDerWaalsContact O-N 3.09Å; N736-T740 PolarHBondContact O-OG1 3.32Å; I738-T740 PolarHBondContact O-N 2.98Å; T740-I742 VanDerWaalsContact C-N 3.32Å; T740-I742 PolarHBondContact O-N 3.15Å; T740-L743 PolarHBondContact O-N 3.48Å; T740-T744 PolarHBondContact O-N 3.45Å
741	Q	63.5	Low	67	Low	66 Å²	66	61.8 Å²	61.8	31%	0.308	35%	0.347	S	S	.	.	H	α-helix	trans	-68	-31.2	179.2	-70.4	173.7	36.8	0	0	113	E737 I738 E739	E737-Q741 WeakPolarHBondContact O-CG 3.15Å; E737-Q741 PolarHBondContact O-N 3.16Å; E737-Q741 PolarHBondContact O-NE2 2.95Å; I738-Q741 PolarHBondContact O-N 3.04Å; E739-Q741 VanDerWaalsContact C-N 3.3Å; E739-Q741 PolarHBondContact O-N 2.81Å
742	I	65.6	Low	65.8	Low	36 Å²	36	67.3 Å²	67.3	19%	0.185	37%	0.373	C	S	.	.	H	α-helix	trans	-70.1	-38.3	177.3	-65.1	169.5	0	0	0	110.3	L671 I738 E739 T740 D746	L671-I742 HydrophobicContact CB-CD1 4.21Å; L671-I742 HydrophobicContact CB-CG1 4.05Å; L671-I742 HydrophobicContact CD1-CG1 4.18Å; I738-I742 HydrophobicContact CG2-CD1 4.46Å; I738-I742 WeakPolarHBondContact O-CG1 3.41Å; I738-I742 PolarHBondContact O-N 3.44Å; E739-I742 PolarHBondContact O-N 3.43Å; T740-I742 VanDerWaalsContact C-N 3.32Å; T740-I742 PolarHBondContact O-N 3.15Å; I742-D746 PolarHBondContact O-N 2.89Å
743	L	60.8	Low	65	Low	121 Å²	121	71.7 Å²	71.7	63%	0.634	39%	0.385	S	S	*	.	H	α-helix	trans	-66.8	-42.6	-179.3	-80.5	153.6	0	0	0	114.1	E739 T740 R745 D746 A747	E739-L743 PolarHBondContact O-N 2.86Å; T740-L743 PolarHBondContact O-N 3.48Å; L743-R745 VanDerWaalsContact C-N 3.32Å; L743-R745 PolarHBondContact O-N 2.9Å; L743-D746 PolarHBondContact O-N 3.35Å; L743-A747 PolarHBondContact O-N 3.1Å; L743-A747 VanDerWaalsContact O-N 3.12Å
744	T	59.4	Low	64.2	Low	28 Å²	28	69 Å²	69	17%	0.172	38%	0.379	C	S	.	.	H	α-helix	trans	-64.7	-36	-179.7	-61.6	0	0	0	0	112.5	T740 D746 M755 Q812	T740-T744 PolarHBondContact O-N 3.45Å; T744-D746 VanDerWaalsContact C-N 3.32Å; T744-D746 PolarHBondContact O-N 3.21Å; T744-M755 HydrophobicContact CG2-CE 4.32Å; T744-Q812 PolarHBondContact OG1-OE1 3.19Å
745	R	60.8	Low	63.7	Low	44 Å²	44	69.2 Å²	69.2	17%	0.166	38%	0.379	C	S	.	.	H	α-helix	trans	-58.4	-46	174.8	-178.5	-165.9	70.4	-167.2	-2.6	110.9	E672 L743	E672-R745 IonicContact OE1-CZ 3.16Å; E672-R745 IonicContact OE1-NH1 2.7Å; E672-R745 PolarHBondContact OE1-NH1 2.81Å; E672-R745 IonicContact OE1-NH2 3.49Å; L743-R745 VanDerWaalsContact C-N 3.32Å; L743-R745 PolarHBondContact O-N 2.9Å
746	D	57.4	Low	62.9	Low	104 Å²	104	73.1 Å²	73.1	56%	0.556	40%	0.4	S	S	*	.	H	α-helix	trans	-79.7	-28.6	-171.6	-64	-10.1	0	0	0	112.7	I742 L743 T744	I742-D746 PolarHBondContact O-N 2.89Å; L743-D746 PolarHBondContact O-N 3.35Å; T744-D746 VanDerWaalsContact C-N 3.32Å; T744-D746 PolarHBondContact O-N 3.21Å
747	A	52.3	Low	62.6	Low	88 Å²	88	73.5 Å²	73.5	73%	0.727	40%	0.399	S	S	*	.	H	α-helix	trans	-79.4	-29.8	-175.9	0	0	0	0	0	115.2	L743	L743-A747 PolarHBondContact O-N 3.1Å; L743-A747 VanDerWaalsContact O-N 3.12Å
748	K	56.9	Low	62.4	Low	75 Å²	75	71 Å²	71	33%	0.326	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	3.9	-173.5	-70.3	-174.3	168.9	-171.2	0	114.3	I750 I815 D816	K748-I750 HydrophobicContact CB-CD1 3.69Å; K748-I750 HydrophobicContact CB-CG1 3.77Å; K748-I750 HydrophobicContact CD-CD1 4.23Å; K748-I750 PolarHBondContact O-N 3.29Å; K748-I750 VanDerWaalsContact O-N 3.12Å; K748-I815 HydrophobicContact CD-CG2 3.69Å; K748-I815 PolarHBondContact NZ-O 3.43Å; K748-D816 IonicContact NZ-OD1 2.98Å; K748-D816 PolarHBondContact NZ-OD1 3.07Å; K748-D816 IonicContact NZ-OD2 3.27Å; K748-D816 PolarHBondContact NZ-OD2 3.22Å
749	G	55	Low	62.2	Low	71 Å²	71	74 Å²	74	73%	0.732	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	18.8	-179.6	0	0	0	0	0	113.9
750	I	61.7	Low	62.2	Low	29 Å²	29	74.3 Å²	74.3	15%	0.149	41%	0.407	C	S	.	.			trans	-77.4	124.7	-179.7	-57.7	171.5	0	0	0	107.1	K748 Q754 M755 F758 I815	K748-I750 HydrophobicContact CB-CD1 3.69Å; K748-I750 HydrophobicContact CB-CG1 3.77Å; K748-I750 HydrophobicContact CD-CD1 4.23Å; K748-I750 PolarHBondContact O-N 3.29Å; K748-I750 VanDerWaalsContact O-N 3.12Å; I750-Q754 HydrophobicContact CG2-CB 3.65Å; I750-M755 HydrophobicContact CG2-CB 4.04Å; I750-F758 HydrophobicContact CG2-CD2 4.29Å; I750-F758 HydrophobicContact CG2-CE2 4.11Å; I750-I815 HydrophobicContact CD1-CG2 3.61Å
751	S	60.8	Low	62.4	Low	52 Å²	52	72.8 Å²	72.8	36%	0.364	40%	0.4	S	S	.	.			trans	-61.4	150.1	178.3	65.8	0	0	0	0	111.1	Q753 Q754 M755	S751-Q753 PolarHBondContact O-N 3.43Å; S751-Q754 PolarHBondContact O-N 2.98Å; S751-Q754 WeakPolarHBondContact OG-CB 3.3Å; S751-Q754 VanDerWaalsContact OG-CG 3.32Å; S751-Q754 WeakPolarHBondContact OG-CG 3.5Å; S751-Q754 PolarHBondContact OG-N 3.5Å; S751-Q754 VanDerWaalsContact OG-N 3.16Å; S751-Q754 PolarHBondContact OG-OE1 3.36Å; S751-M755 PolarHBondContact O-N 3.48Å
752	Q	57.8	Low	62.7	Low	117 Å²	117	69.9 Å²	69.9	55%	0.547	39%	0.386	S	S	.	.	H	α-helix	trans	-55.8	-28.6	177.8	-166.6	168.7	26.6	0	0	112	N756	Q752-N756 VanDerWaalsContact O-CB 3.24Å; Q752-N756 WeakPolarHBondContact O-CB 3.26Å; Q752-N756 PolarHBondContact O-N 3.31Å; Q752-N756 PolarHBondContact O-ND2 3.37Å
753	Q	60.1	Low	62.9	Low	143 Å²	143	72.7 Å²	72.7	67%	0.668	40%	0.401	S	S	*	.	H	α-helix	trans	-72.7	-47.1	175.8	-151.8	167	3.2	0	0	112.1	S751 M755 N756 E757	S751-Q753 PolarHBondContact O-N 3.43Å; Q753-M755 PolarHBondContact O-N 3.02Å; Q753-N756 PolarHBondContact O-N 3.09Å; Q753-E757 WeakPolarHBondContact O-CB 3.41Å; Q753-E757 VanDerWaalsContact O-CG 3.28Å; Q753-E757 WeakPolarHBondContact O-CG 3.42Å; Q753-E757 PolarHBondContact O-N 3.45Å
754	Q	62.3	Low	63.5	Low	93 Å²	93	73.8 Å²	73.8	44%	0.435	40%	0.403	S	S	.	.	H	α-helix	trans	-65.1	-37	174.7	-77.2	170.4	-46.6	0	0	112.7	I750 S751 E757 F758	I750-Q754 HydrophobicContact CG2-CB 3.65Å; S751-Q754 PolarHBondContact O-N 2.98Å; S751-Q754 WeakPolarHBondContact OG-CB 3.3Å; S751-Q754 VanDerWaalsContact OG-CG 3.32Å; S751-Q754 WeakPolarHBondContact OG-CG 3.5Å; S751-Q754 PolarHBondContact OG-N 3.5Å; S751-Q754 VanDerWaalsContact OG-N 3.16Å; S751-Q754 PolarHBondContact OG-OE1 3.36Å; Q754-E757 PolarHBondContact O-N 3.25Å; Q754-F758 HydrophobicContact CB-CE2 4.24Å; Q754-F758 WeakPolarHBondContact O-CD2 3.24Å; Q754-F758 WeakPolarHBondContact O-CG 3.45Å; Q754-F758 PolarHBondContact O-N 2.88Å
755	M	64.9	Low	64.1	Low	16 Å²	16	74.1 Å²	74.1	8%	0.079	40%	0.402	C	S	.	.	H	α-helix	trans	-67.8	-39.2	175.8	-168.4	63.6	160.9	0	0	111.3	T744 I750 S751 Q753 R759 F811	T744-M755 HydrophobicContact CG2-CE 4.32Å; I750-M755 HydrophobicContact CG2-CB 4.04Å; S751-M755 PolarHBondContact O-N 3.48Å; Q753-M755 PolarHBondContact O-N 3.02Å; M755-R759 WeakPolarHBondContact O-CB 3.3Å; M755-R759 PolarHBondContact O-N 3.42Å; M755-F811 HydrophobicContact CE-CE1 3.73Å; M755-F811 HydrophobicContact CE-CZ 4.36Å; M755-F811 HydrophobicContact SD-CE1 4.15Å; M755-F811 HydrophobicContact SD-CZ 4.19Å
756	N	64.1	Low	64.6	Low	96 Å²	96	72.5 Å²	72.5	51%	0.513	40%	0.397	S	S	.	.	H	α-helix	trans	-67.4	-34.6	172.7	-75.7	-13.2	0	0	0	112.1	Q752 Q753 R759 S760	Q752-N756 VanDerWaalsContact O-CB 3.24Å; Q752-N756 WeakPolarHBondContact O-CB 3.26Å; Q752-N756 PolarHBondContact O-N 3.31Å; Q752-N756 PolarHBondContact O-ND2 3.37Å; Q753-N756 PolarHBondContact O-N 3.09Å; N756-R759 PolarHBondContact O-N 3.46Å; N756-S760 WeakPolarHBondContact O-CB 3.48Å; N756-S760 PolarHBondContact O-N 3.35Å
757	E	68.4	Low	65	Low	105 Å²	105	77.3 Å²	77.3	49%	0.491	41%	0.407	S	S	.	.	H	α-helix	trans	-67.5	-45.5	174.3	-76.8	168.4	-169	0	0	111.6	Q753 Q754 R759 S761	Q753-E757 WeakPolarHBondContact O-CB 3.41Å; Q753-E757 VanDerWaalsContact O-CG 3.28Å; Q753-E757 WeakPolarHBondContact O-CG 3.42Å; Q753-E757 PolarHBondContact O-N 3.45Å; Q754-E757 PolarHBondContact O-N 3.25Å; E757-R759 VanDerWaalsContact C-N 3.33Å; E757-R759 PolarHBondContact O-N 3.44Å; E757-S761 VanDerWaalsContact O-CB 3.28Å; E757-S761 WeakPolarHBondContact O-CB 3.5Å; E757-S761 PolarHBondContact O-N 3.5Å; E757-S761 PolarHBondContact O-OG 3.25Å
758	F	70.4	Confident	65.6	Low	42 Å²	42	79.9 Å²	79.9	18%	0.184	40%	0.402	C	S	.	.	H	α-helix	trans	-63.7	-38.6	173.9	-62.8	-39.4	0	0	0	111.7	I750 Q754 S761 F762 M785 F811 F814 I815	I750-F758 HydrophobicContact CG2-CD2 4.29Å; I750-F758 HydrophobicContact CG2-CE2 4.11Å; Q754-F758 HydrophobicContact CB-CE2 4.24Å; Q754-F758 WeakPolarHBondContact O-CD2 3.24Å; Q754-F758 WeakPolarHBondContact O-CG 3.45Å; Q754-F758 PolarHBondContact O-N 2.88Å; F758-S761 PolarHBondContact O-N 3.36Å; F758-F762 VanDerWaalsContact O-CB 3.29Å; F758-F762 WeakPolarHBondContact O-CB 3.34Å; F758-F762 PolarHBondContact O-N 2.77Å; F758-M785 HydrophobicContact CD1-CE 4.31Å; F758-M785 HydrophobicContact CE1-CE 3.98Å; F758-F811 HydrophobicContact CB-CE2 4.15Å; F758-F811 HydrophobicContact CB-CZ 4.2Å; F758-F814 HydrophobicContact CB-CE1 4.35Å; F758-F814 AromaticContact CD1-CE1 3.98Å; F758-F814 HydrophobicContact CD1-CE1 3.98Å; F758-F814 HydrophobicContact CG-CE1 4.34Å; F758-I815 HydrophobicContact CB-CD1 3.92Å; F758-I815 HydrophobicContact CD2-CD1 3.39Å; F758-I815 HydrophobicContact CE2-CD1 4.03Å; F758-I815 HydrophobicContact CG-CD1 3.76Å
759	R	68.6	Low	65.8	Low	80 Å²	80	84.2 Å²	84.2	30%	0.302	42%	0.421	S	S	.	.	H	α-helix	trans	-72.9	-39.8	178.6	-168.3	172.2	-176.4	133.9	-1	113	M755 N756 E757 S761 F762 N763 F811	M755-R759 WeakPolarHBondContact O-CB 3.3Å; M755-R759 PolarHBondContact O-N 3.42Å; N756-R759 PolarHBondContact O-N 3.46Å; E757-R759 VanDerWaalsContact C-N 3.33Å; E757-R759 PolarHBondContact O-N 3.44Å; R759-S761 VanDerWaalsContact C-N 3.31Å; R759-F762 PolarHBondContact O-N 3.41Å; R759-N763 VanDerWaalsContact O-CB 3.29Å; R759-N763 WeakPolarHBondContact O-CB 3.42Å; R759-N763 PolarHBondContact O-N 3.13Å; R759-F811 HydrophobicContact CB-CZ 4.12Å
760	S	68.8	Low	66.3	Low	83 Å²	83	85.5 Å²	85.5	58%	0.58	41%	0.411	S	S	*	.	H	α-helix	trans	-63.4	-40.7	172.2	-174.7	0	0	0	0	110.8	N756 H764	N756-S760 WeakPolarHBondContact O-CB 3.48Å; N756-S760 PolarHBondContact O-N 3.35Å; S760-H764 VanDerWaalsContact O-CB 3.26Å; S760-H764 WeakPolarHBondContact O-CB 3.47Å; S760-H764 PolarHBondContact O-N 3.35Å
761	S	70.3	Confident	66.4	Low	39 Å²	39	86.5 Å²	86.5	27%	0.273	43%	0.428	S	S	.	.	H	α-helix	trans	-65.4	-47.6	176.1	-57.3	0	0	0	0	110.6	E757 F758 R759 N763 H764 F765	E757-S761 VanDerWaalsContact O-CB 3.28Å; E757-S761 WeakPolarHBondContact O-CB 3.5Å; E757-S761 PolarHBondContact O-N 3.5Å; E757-S761 PolarHBondContact O-OG 3.25Å; F758-S761 PolarHBondContact O-N 3.36Å; R759-S761 VanDerWaalsContact C-N 3.31Å; S761-N763 PolarHBondContact O-N 3.37Å; S761-H764 PolarHBondContact O-N 3.17Å; S761-F765 WeakPolarHBondContact O-CD2 3.24Å; S761-F765 PolarHBondContact O-N 2.95Å
762	F	71.1	Confident	66.6	Low	6 Å²	6	85 Å²	85	3%	0.026	42%	0.419	C	S	.	.	H	α-helix	trans	-61.9	-46.3	178.2	-169.2	-86.9	0	0	0	112.7	F758 R759 H764 F765 D766 M773 F811	F758-F762 VanDerWaalsContact O-CB 3.29Å; F758-F762 WeakPolarHBondContact O-CB 3.34Å; F758-F762 PolarHBondContact O-N 2.77Å; R759-F762 PolarHBondContact O-N 3.41Å; F762-H764 VanDerWaalsContact C-N 3.31Å; F762-H764 PolarHBondContact O-N 3.36Å; F762-F765 PolarHBondContact O-N 2.86Å; F762-D766 PolarHBondContact O-N 3.48Å; F762-M773 HydrophobicContact CB-SD 4.41Å; F762-M773 HydrophobicContact CD1-CG 4.43Å; F762-M773 HydrophobicContact CD2-CE 3.3Å; F762-M773 HydrophobicContact CD2-CG 3.77Å; F762-M773 HydrophobicContact CD2-SD 3.44Å; F762-M773 WeakPolarHBondContact CD2-SD 3.02Å; F762-M773 HydrophobicContact CE1-CG 4.22Å; F762-M773 HydrophobicContact CE2-CB 4.25Å; F762-M773 HydrophobicContact CE2-CE 3.49Å; F762-M773 VanDerWaalsContact CE2-CE 3.49Å; F762-M773 HydrophobicContact CE2-CG 3.55Å; F762-M773 HydrophobicContact CE2-SD 3.83Å; F762-M773 HydrophobicContact CG-CE 4.34Å; F762-M773 HydrophobicContact CG-CG 4.22Å; F762-M773 HydrophobicContact CG-SD 3.93Å; F762-M773 HydrophobicContact CZ-CB 4.49Å; F762-M773 HydrophobicContact CZ-CG 3.79Å; F762-F811 HydrophobicContact CB-CD2 3.73Å; F762-F811 HydrophobicContact CB-CE2 3.86Å; F762-F811 HydrophobicContact CD1-CB 4.5Å; F762-F811 HydrophobicContact CD1-CD2 4.12Å; F762-F811 HydrophobicContact CD2-CB 4.17Å; F762-F811 AromaticContact CD2-CD2 3.49Å; F762-F811 HydrophobicContact CD2-CD2 3.49Å; F762-F811 VanDerWaalsContact CD2-CD2 3.49Å; F762-F811 HydrophobicContact CD2-CE2 4.37Å; F762-F811 HydrophobicContact CD2-CG 4.31Å; F762-F811 HydrophobicContact CE1-CB 4.21Å; F762-F811 HydrophobicContact CE2-CB 3.82Å; F762-F811 HydrophobicContact CE2-CD2 4.04Å; F762-F811 HydrophobicContact CE2-CG 4.45Å; F762-F811 HydrophobicContact CG-CB 4.48Å; F762-F811 AromaticContact CG-CD2 3.52Å; F762-F811 HydrophobicContact CG-CD2 3.52Å; F762-F811 HydrophobicContact CG-CE2 4.18Å; F762-F811 HydrophobicContact CG-CG 4.38Å; F762-F811 HydrophobicContact CZ-CB 3.86Å
763	N	69.7	Low	67.5	Low	95 Å²	95	79.4 Å²	79.4	51%	0.508	39%	0.393	S	S	.	.	H	α-helix	trans	-69.9	-25.4	178.9	-75.6	-10.1	0	0	0	113.7	R759 S761 F765	R759-N763 VanDerWaalsContact O-CB 3.29Å; R759-N763 WeakPolarHBondContact O-CB 3.42Å; R759-N763 PolarHBondContact O-N 3.13Å; S761-N763 PolarHBondContact O-N 3.37Å; N763-F765 VanDerWaalsContact C-N 3.28Å
764	H	73.2	Confident	68.5	Low	143 Å²	143	76.2 Å²	76.2	66%	0.662	38%	0.378	S	S	*	.	H	α-helix	trans	-66.8	-35	173.9	-175.7	75.9	0	0	0	111.4	S760 S761 F762	S760-H764 VanDerWaalsContact O-CB 3.26Å; S760-H764 WeakPolarHBondContact O-CB 3.47Å; S760-H764 PolarHBondContact O-N 3.35Å; S761-H764 PolarHBondContact O-N 3.17Å; F762-H764 VanDerWaalsContact C-N 3.31Å; F762-H764 PolarHBondContact O-N 3.36Å
765	F	71.4	Confident	69.1	Low	36 Å²	36	74.2 Å²	74.2	16%	0.158	37%	0.372	C	S	.	.	H	α-helix	trans	-97	-16.4	-178.5	-67.1	-74.2	0	0	0	113.6	S761 F762 N763 R767 M773 D777 A780 C781	S761-F765 WeakPolarHBondContact O-CD2 3.24Å; S761-F765 PolarHBondContact O-N 2.95Å; F762-F765 PolarHBondContact O-N 2.86Å; N763-F765 VanDerWaalsContact C-N 3.28Å; F765-R767 PolarHBondContact O-N 3.21Å; F765-M773 HydrophobicContact CB-SD 4.06Å; F765-D777 HydrophobicContact CB-CB 4.39Å; F765-A780 HydrophobicContact CD1-CB 4.3Å; F765-A780 HydrophobicContact CE1-CB 4.07Å; F765-C781 HydrophobicContact CD2-CB 3.93Å; F765-C781 HydrophobicContact CE2-CB 4.25Å; F765-C781 HydrophobicContact CG-CB 4.37Å
766	D	72.7	Confident	69.7	Low	10 Å²	10	79.4 Å²	79.4	5%	0.053	40%	0.4	C	S	.	.			trans	-75.6	81.9	168.3	-178.9	3.1	0	0	0	111.9	F762 K768 K769 N770 G771	F762-D766 PolarHBondContact O-N 3.48Å; D766-K768 PolarHBondContact O-N 3.11Å; D766-K768 PolarHBondContact OD1-N 3.42Å; D766-K769 PolarHBondContact O-N 3.4Å; D766-K769 PolarHBondContact OD1-N 2.88Å; D766-K769 WeakPolarHBondContact OD2-CA 3.48Å; D766-N770 PolarHBondContact OD1-N 3.49Å; D766-N770 PolarHBondContact OD1-OD1 2.91Å; D766-N770 PolarHBondContact OD2-N 3.33Å; D766-G771 WeakPolarHBondContact OD2-CA 3.35Å; D766-G771 PolarHBondContact OD2-N 2.89Å
767	R	65.5	Low	70.3	Confident	204 Å²	204	75.9 Å²	75.9	77%	0.77	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-24.1	-179.3	-67.2	-179.9	178	178.1	3.6	114	F765	F765-R767 PolarHBondContact O-N 3.21Å
768	K	64.1	Low	70.8	Confident	142 Å²	142	71 Å²	71	62%	0.617	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-8.4	-175.5	-70.4	177.6	-177.9	166.6	0	112.9	D766 N770 E774	D766-K768 PolarHBondContact O-N 3.11Å; D766-K768 PolarHBondContact OD1-N 3.42Å; K768-N770 PolarHBondContact O-N 3.16Å; K768-E774 IonicContact NZ-OE1 2.73Å; K768-E774 PolarHBondContact NZ-OE1 3.28Å; K768-E774 IonicContact NZ-OE2 2.83Å
769	K	61.5	Low	71.2	Confident	167 Å²	167	72.8 Å²	72.8	73%	0.726	36%	0.364	S	S	*	.			trans	52.4	37.1	-178	-60.7	-171.1	176.3	-172.6	0	112.7	D766	D766-K769 PolarHBondContact O-N 3.4Å; D766-K769 PolarHBondContact OD1-N 2.88Å; D766-K769 WeakPolarHBondContact OD2-CA 3.48Å
770	N	65.2	Low	71.6	Confident	98 Å²	98	70.8 Å²	70.8	52%	0.524	37%	0.365	S	S	.	.	S	Bend	trans	-104.4	2.8	-179.7	67.3	-4.5	0	0	0	112.4	D766 K768 A772	D766-N770 PolarHBondContact OD1-N 3.49Å; D766-N770 PolarHBondContact OD1-OD1 2.91Å; D766-N770 PolarHBondContact OD2-N 3.33Å; K768-N770 PolarHBondContact O-N 3.16Å; N770-A772 PolarHBondContact OD1-N 3.5Å; N770-A772 PolarHBondContact OD1-O 3.42Å
771	G	62.9	Low	72	Confident	49 Å²	49	66.9 Å²	66.9	51%	0.505	34%	0.337	S	S	.	.	S	Bend	trans	84.1	21.2	177.4	0	0	0	0	0	114.2	D766	D766-G771 WeakPolarHBondContact OD2-CA 3.35Å; D766-G771 PolarHBondContact OD2-N 2.89Å
772	A	66.6	Low	72.2	Confident	21 Å²	21	65.1 Å²	65.1	17%	0.174	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	134.4	-170.8	0	0	0	0	0	111.7	N770 I808	N770-A772 PolarHBondContact OD1-N 3.5Å; N770-A772 PolarHBondContact OD1-O 3.42Å; A772-I808 HydrophobicContact CB-CG2 3.24Å
773	M	76.9	Confident	72.5	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	131.6	174.9	-68	-171.8	-48.5	0	0	111	F762 F765 F778 I808 V809 F814	F762-M773 HydrophobicContact CB-SD 4.41Å; F762-M773 HydrophobicContact CD1-CG 4.43Å; F762-M773 HydrophobicContact CD2-CE 3.3Å; F762-M773 HydrophobicContact CD2-CG 3.77Å; F762-M773 HydrophobicContact CD2-SD 3.44Å; F762-M773 WeakPolarHBondContact CD2-SD 3.02Å; F762-M773 HydrophobicContact CE1-CG 4.22Å; F762-M773 HydrophobicContact CE2-CB 4.25Å; F762-M773 HydrophobicContact CE2-CE 3.49Å; F762-M773 VanDerWaalsContact CE2-CE 3.49Å; F762-M773 HydrophobicContact CE2-CG 3.55Å; F762-M773 HydrophobicContact CE2-SD 3.83Å; F762-M773 HydrophobicContact CG-CE 4.34Å; F762-M773 HydrophobicContact CG-CG 4.22Å; F762-M773 HydrophobicContact CG-SD 3.93Å; F762-M773 HydrophobicContact CZ-CB 4.49Å; F762-M773 HydrophobicContact CZ-CG 3.79Å; F765-M773 HydrophobicContact CB-SD 4.06Å; M773-F778 HydrophobicContact CE-CB 4.48Å; M773-F778 HydrophobicContact CE-CD2 3.8Å; M773-I808 CarbonylContact O-C 3.09Å; M773-I808 WeakPolarHBondContact O-CA 3.48Å; M773-V809 PolarHBondContact N-O 2.98Å; M773-V809 PolarHBondContact O-N 2.92Å; M773-F814 HydrophobicContact CE-CD2 3.62Å; M773-F814 HydrophobicContact CE-CE2 3.92Å
774	E	79.1	Confident	72.5	Confident	76 Å²	76	68.9 Å²	68.9	36%	0.355	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	163.8	173.6	-65.8	178.6	-174.6	0	0	110.7	K768 D776 D777 F778	K768-E774 IonicContact NZ-OE1 2.73Å; K768-E774 PolarHBondContact NZ-OE1 3.28Å; K768-E774 IonicContact NZ-OE2 2.83Å; E774-D776 PolarHBondContact O-N 3.46Å; E774-D777 PolarHBondContact O-N 2.89Å; E774-D777 VanDerWaalsContact O-N 3.08Å; E774-F778 PolarHBondContact O-N 3.36Å
775	T	76.3	Confident	72.2	Confident	51 Å²	51	65.4 Å²	65.4	31%	0.313	34%	0.336	S	S	.	.	H	α-helix	trans	-53.5	-40	-175.3	57.8	0	0	0	0	113.8	R779 M798 G807	T775-R779 WeakPolarHBondContact O-CB 3.38Å; T775-R779 PolarHBondContact O-N 3.39Å; T775-M798 HydrophobicContact CG2-CE 3.53Å; T775-G807 VanDerWaalsContact CG2-O 3.27Å; T775-G807 WeakPolarHBondContact CG2-O 3.35Å; T775-G807 PolarHBondContact N-O 3.48Å
776	D	76	Confident	71.9	Confident	124 Å²	124	66.9 Å²	66.9	66%	0.663	36%	0.362	S	S	*	.	H	α-helix	trans	-74.1	-35.5	-178.2	-65.8	-11.7	0	0	0	111.3	E774 R779 A780	E774-D776 PolarHBondContact O-N 3.46Å; D776-R779 PolarHBondContact O-N 3.01Å; D776-A780 WeakPolarHBondContact O-CB 3.47Å; D776-A780 PolarHBondContact O-N 3.37Å
777	D	77.4	Confident	71.7	Confident	23 Å²	23	71.7 Å²	71.7	12%	0.123	38%	0.38	C	S	.	.	H	α-helix	trans	-72.5	-37.4	176.7	-68.3	-35.9	0	0	0	111.3	F765 E774 A780 C781	F765-D777 HydrophobicContact CB-CB 4.39Å; E774-D777 PolarHBondContact O-N 2.89Å; E774-D777 VanDerWaalsContact O-N 3.08Å; D777-A780 PolarHBondContact O-N 2.64Å; D777-C781 WeakPolarHBondContact O-CB 3.26Å; D777-C781 PolarHBondContact O-N 3.07Å
778	F	79.5	Confident	71.6	Confident	2 Å²	2	69.1 Å²	69.1	1%	0.009	38%	0.382	C	S	.	.	H	α-helix	trans	-66.1	-39.1	172.8	-179.4	-122.6	0	0	0	112	M773 E774 C781 L782 F794 I797 M798 V801 V809 F814	M773-F778 HydrophobicContact CE-CB 4.48Å; M773-F778 HydrophobicContact CE-CD2 3.8Å; E774-F778 PolarHBondContact O-N 3.36Å; F778-C781 WeakPolarHBondContact O-CB 3.23Å; F778-C781 PolarHBondContact O-N 2.91Å; F778-L782 HydrophobicContact CD1-CD1 4.29Å; F778-L782 HydrophobicContact CE1-CD1 3.75Å; F778-L782 HydrophobicContact CE1-CG 4.44Å; F778-L782 HydrophobicContact CE2-CD1 4.27Å; F778-L782 HydrophobicContact CE2-CD2 4.27Å; F778-L782 HydrophobicContact CE2-CG 4.11Å; F778-L782 HydrophobicContact CZ-CD1 3.74Å; F778-L782 HydrophobicContact CZ-CD2 4.27Å; F778-L782 HydrophobicContact CZ-CG 4.08Å; F778-L782 PolarHBondContact O-N 3.14Å; F778-F794 HydrophobicContact CD1-CE2 4.12Å; F778-F794 HydrophobicContact CD1-CZ 4.26Å; F778-F794 HydrophobicContact CE1-CE2 4.49Å; F778-I797 HydrophobicContact CE1-CG2 4.49Å; F778-M798 HydrophobicContact CD1-SD 4.22Å; F778-V801 HydrophobicContact CE1-CG1 4.38Å; F778-V801 HydrophobicContact CZ-CG1 4.11Å; F778-V801 HydrophobicContact CZ-CG2 4.32Å; F778-V809 HydrophobicContact CB-CB 4.45Å; F778-V809 HydrophobicContact CB-CG2 4.14Å; F778-V809 HydrophobicContact CD1-CG2 3.79Å; F778-V809 HydrophobicContact CD2-CB 4.37Å; F778-V809 HydrophobicContact CD2-CG1 4.05Å; F778-V809 HydrophobicContact CD2-CG2 4.33Å; F778-V809 HydrophobicContact CE1-CG2 4.23Å; F778-V809 HydrophobicContact CE2-CG1 4.14Å; F778-V809 HydrophobicContact CG-CB 4.25Å; F778-V809 HydrophobicContact CG-CG1 4.39Å; F778-V809 HydrophobicContact CG-CG2 3.83Å; F778-F814 AromaticContact CD2-CD2 3.98Å; F778-F814 HydrophobicContact CD2-CD2 3.98Å; F778-F814 HydrophobicContact CD2-CE2 4.29Å; F778-F814 AromaticContact CE2-CD2 3.6Å; F778-F814 HydrophobicContact CE2-CD2 3.6Å; F778-F814 HydrophobicContact CE2-CE2 4.04Å
779	R	77.8	Confident	71.7	Confident	79 Å²	79	63.7 Å²	63.7	30%	0.298	36%	0.359	S	S	.	.	H	α-helix	trans	-61.8	-46.9	173.8	-167.9	171	-172.6	146.8	2	111.7	T775 D776 C781 L782 I783 F794	T775-R779 WeakPolarHBondContact O-CB 3.38Å; T775-R779 PolarHBondContact O-N 3.39Å; D776-R779 PolarHBondContact O-N 3.01Å; R779-C781 PolarHBondContact O-N 3.04Å; R779-L782 PolarHBondContact O-N 2.89Å; R779-I783 HydrophobicContact CG-CD1 4.12Å; R779-I783 VanDerWaalsContact O-CG1 3.31Å; R779-I783 WeakPolarHBondContact O-CG1 3.23Å; R779-I783 PolarHBondContact O-N 3.1Å; R779-I783 VanDerWaalsContact O-N 3.14Å; R779-F794 HydrophobicContact CB-CD2 4.46Å; R779-F794 HydrophobicContact CB-CE1 4.25Å; R779-F794 HydrophobicContact CB-CE2 3.64Å; R779-F794 HydrophobicContact CB-CZ 3.52Å; R779-F794 HydrophobicContact CG-CD2 4.09Å; R779-F794 HydrophobicContact CG-CE1 4.35Å; R779-F794 HydrophobicContact CG-CE2 3.76Å; R779-F794 HydrophobicContact CG-CZ 3.91Å
780	A	76.9	Confident	72.2	Confident	39 Å²	39	58 Å²	58	32%	0.322	35%	0.348	S	S	.	.	H	α-helix	trans	-60.7	-37	175.9	0	0	0	0	0	111.9	F765 D776 D777 S784	F765-A780 HydrophobicContact CD1-CB 4.3Å; F765-A780 HydrophobicContact CE1-CB 4.07Å; D776-A780 WeakPolarHBondContact O-CB 3.47Å; D776-A780 PolarHBondContact O-N 3.37Å; D777-A780 PolarHBondContact O-N 2.64Å; A780-S784 WeakPolarHBondContact O-CB 3.41Å; A780-S784 PolarHBondContact O-N 3.18Å
781	C	78.6	Confident	72.6	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.007	36%	0.356	C	S	.	.	H	α-helix	trans	-64.4	-47.7	176.4	-168.6	0	0	0	0	112.5	F765 D777 F778 R779 I783 S784 M785	F765-C781 HydrophobicContact CD2-CB 3.93Å; F765-C781 HydrophobicContact CE2-CB 4.25Å; F765-C781 HydrophobicContact CG-CB 4.37Å; D777-C781 WeakPolarHBondContact O-CB 3.26Å; D777-C781 PolarHBondContact O-N 3.07Å; F778-C781 WeakPolarHBondContact O-CB 3.23Å; F778-C781 PolarHBondContact O-N 2.91Å; R779-C781 PolarHBondContact O-N 3.04Å; C781-I783 PolarHBondContact O-N 3.07Å; C781-S784 WeakPolarHBondContact O-CB 3.29Å; C781-S784 PolarHBondContact O-N 3.48Å; C781-M785 WeakPolarHBondContact O-CG 3.03Å; C781-M785 PolarHBondContact O-N 2.84Å
782	L	73.3	Confident	72.9	Confident	2 Å²	2	63.7 Å²	63.7	1%	0.01	37%	0.366	C	S	.	.	H	α-helix	trans	-63.1	-39.2	178.5	-72	177.7	0	0	0	112.9	F778 R779 S784 M785 G786 Y787 L789 F794 I797 M818	F778-L782 HydrophobicContact CD1-CD1 4.29Å; F778-L782 HydrophobicContact CE1-CD1 3.75Å; F778-L782 HydrophobicContact CE1-CG 4.44Å; F778-L782 HydrophobicContact CE2-CD1 4.27Å; F778-L782 HydrophobicContact CE2-CD2 4.27Å; F778-L782 HydrophobicContact CE2-CG 4.11Å; F778-L782 HydrophobicContact CZ-CD1 3.74Å; F778-L782 HydrophobicContact CZ-CD2 4.27Å; F778-L782 HydrophobicContact CZ-CG 4.08Å; F778-L782 PolarHBondContact O-N 3.14Å; R779-L782 PolarHBondContact O-N 2.89Å; L782-S784 VanDerWaalsContact C-N 3.35Å; L782-M785 PolarHBondContact O-N 2.69Å; L782-G786 PolarHBondContact O-N 3.05Å; L782-Y787 PolarHBondContact O-N 2.94Å; L782-L789 HydrophobicContact CD1-CD1 4.46Å; L782-F794 HydrophobicContact CD1-CD2 4.24Å; L782-F794 HydrophobicContact CD1-CE2 4.05Å; L782-I797 HydrophobicContact CD1-CG2 4.42Å; L782-M818 HydrophobicContact CD2-CE 4.47Å
783	I	77.1	Confident	73	Confident	92 Å²	92	66.8 Å²	66.8	47%	0.472	38%	0.377	S	S	.	.	H	α-helix	trans	-63.3	-43.6	174.5	-65.8	166.6	0	0	0	110.1	R779 C781 M785 G786	R779-I783 HydrophobicContact CG-CD1 4.12Å; R779-I783 VanDerWaalsContact O-CG1 3.31Å; R779-I783 WeakPolarHBondContact O-CG1 3.23Å; R779-I783 PolarHBondContact O-N 3.1Å; R779-I783 VanDerWaalsContact O-N 3.14Å; C781-I783 PolarHBondContact O-N 3.07Å; I783-M785 PolarHBondContact O-N 3.21Å; I783-G786 PolarHBondContact O-N 3.09Å; I783-G786 VanDerWaalsContact O-N 3.07Å
784	S	70.4	Confident	73.1	Confident	88 Å²	88	67.9 Å²	67.9	62%	0.615	38%	0.381	S	S	*	.	H	α-helix	trans	-64.6	-23	176.6	-172.3	0	0	0	0	113.4	A780 C781 L782	A780-S784 WeakPolarHBondContact O-CB 3.41Å; A780-S784 PolarHBondContact O-N 3.18Å; C781-S784 WeakPolarHBondContact O-CB 3.29Å; C781-S784 PolarHBondContact O-N 3.48Å; L782-S784 VanDerWaalsContact C-N 3.35Å
785	M	67.3	Low	72.9	Confident	69 Å²	69	66.9 Å²	66.9	34%	0.34	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	0.3	175.8	-67.1	178.8	76.4	0	0	113.3	F758 C781 L782 I783 Y787 F814 M818	F758-M785 HydrophobicContact CD1-CE 4.31Å; F758-M785 HydrophobicContact CE1-CE 3.98Å; C781-M785 WeakPolarHBondContact O-CG 3.03Å; C781-M785 PolarHBondContact O-N 2.84Å; L782-M785 PolarHBondContact O-N 2.69Å; I783-M785 PolarHBondContact O-N 3.21Å; M785-Y787 HydrophobicContact CB-CD2 4.32Å; M785-F814 HydrophobicContact CE-CZ 4.37Å; M785-F814 HydrophobicContact SD-CE1 4.5Å; M785-F814 HydrophobicContact SD-CE2 4.46Å; M785-F814 HydrophobicContact SD-CZ 3.68Å; M785-M818 HydrophobicContact CE-CE 4.23Å
786	G	65.9	Low	72.7	Confident	68 Å²	68	72 Å²	72	70%	0.701	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.1	7.1	174.5	0	0	0	0	0	115.7	L782 I783	L782-G786 PolarHBondContact O-N 3.05Å; I783-G786 PolarHBondContact O-N 3.09Å; I783-G786 VanDerWaalsContact O-N 3.07Å
787	Y	66.9	Low	72.4	Confident	111 Å²	111	67 Å²	67	44%	0.435	37%	0.373	S	S	.	.			trans	-93.3	100.1	175.7	-66.4	-88.9	0	0	0	110.2	L782 M785 L789 M818	L782-Y787 PolarHBondContact O-N 2.94Å; M785-Y787 HydrophobicContact CB-CD2 4.32Å; Y787-L789 PolarHBondContact O-N 3.48Å; Y787-M818 HydrophobicContact CD2-CE 4.41Å; Y787-M818 HydrophobicContact CE2-CE 3.61Å
788	D	63.4	Low	72.4	Confident	150 Å²	150	67.2 Å²	67.2	80%	0.802	37%	0.373	S	S	*	.			trans	-91.8	88.7	171.4	-164.9	11.3	0	0	0	109.7
789	L	66	Low	72	Confident	27 Å²	27	74.3 Å²	74.3	14%	0.141	41%	0.408	C	S	.	.			trans	-103.2	129.5	-171.9	-62.2	159.3	0	0	0	110	L782 Y787 E793 I797	L782-L789 HydrophobicContact CD1-CD1 4.46Å; Y787-L789 PolarHBondContact O-N 3.48Å; L789-E793 HydrophobicContact CB-CB 4.4Å; L789-E793 HydrophobicContact CD2-CB 4.45Å; L789-E793 HydrophobicContact CD2-CG 3.84Å; L789-I797 HydrophobicContact CD1-CD1 3.44Å; L789-I797 VanDerWaalsContact CD1-CD1 3.44Å; L789-I797 HydrophobicContact CD2-CD1 4.22Å; L789-I797 HydrophobicContact CG-CD1 4.4Å
790	G	73.1	Confident	71.6	Confident	48 Å²	48	73.2 Å²	73.2	50%	0.495	41%	0.408	S	S	.	.			trans	-62.5	160.9	172.4	0	0	0	0	0	112.4	V792 E793 F794	G790-V792 VanDerWaalsContact C-N 3.26Å; G790-V792 PolarHBondContact O-N 2.76Å; G790-V792 VanDerWaalsContact O-N 3.14Å; G790-E793 PolarHBondContact O-N 2.78Å; G790-F794 PolarHBondContact O-N 3.35Å
791	E	72.4	Confident	71.1	Confident	149 Å²	149	71.6 Å²	71.6	70%	0.696	39%	0.394	S	S	*	.	H	α-helix	trans	-55	-37.6	-174.5	-74.9	-161.7	149.8	0	0	114.4	E793 A795	E791-E793 VanDerWaalsContact C-N 3.3Å; E791-E793 PolarHBondContact O-N 2.75Å; E791-A795 WeakPolarHBondContact O-CB 3.4Å; E791-A795 PolarHBondContact O-N 2.78Å
792	V	71	Confident	71	Confident	117 Å²	117	72.1 Å²	72.1	71%	0.709	40%	0.397	S	S	*	.	H	α-helix	trans	-69.6	-31.6	-179.3	-176.5	0	0	0	0	111.6	G790 R796	G790-V792 VanDerWaalsContact C-N 3.26Å; G790-V792 PolarHBondContact O-N 2.76Å; G790-V792 VanDerWaalsContact O-N 3.14Å; V792-R796 PolarHBondContact O-N 3.03Å
793	E	68.8	Low	70.6	Confident	86 Å²	86	77 Å²	77	40%	0.402	43%	0.429	S	S	.	.	H	α-helix	trans	-82.6	-38.5	-179.2	-160.6	165.3	-156.8	0	0	111.2	L789 G790 E791 R796 I797	L789-E793 HydrophobicContact CB-CB 4.4Å; L789-E793 HydrophobicContact CD2-CB 4.45Å; L789-E793 HydrophobicContact CD2-CG 3.84Å; G790-E793 PolarHBondContact O-N 2.78Å; E791-E793 VanDerWaalsContact C-N 3.3Å; E791-E793 PolarHBondContact O-N 2.75Å; E793-R796 WeakPolarHBondContact O-CB 3.31Å; E793-R796 PolarHBondContact O-N 3.43Å; E793-I797 HydrophobicContact CG-CD1 4.49Å; E793-I797 WeakPolarHBondContact O-CG1 3.28Å; E793-I797 PolarHBondContact O-N 3.26Å
794	F	79.1	Confident	70.4	Confident	23 Å²	23	79.2 Å²	79.2	10%	0.101	44%	0.442	C	S	.	.	H	α-helix	trans	-61.7	-42.5	171.1	-177.5	-101.5	0	0	0	112.2	F778 R779 L782 G790 R796 I797 M798	F778-F794 HydrophobicContact CD1-CE2 4.12Å; F778-F794 HydrophobicContact CD1-CZ 4.26Å; F778-F794 HydrophobicContact CE1-CE2 4.49Å; R779-F794 HydrophobicContact CB-CD2 4.46Å; R779-F794 HydrophobicContact CB-CE1 4.25Å; R779-F794 HydrophobicContact CB-CE2 3.64Å; R779-F794 HydrophobicContact CB-CZ 3.52Å; R779-F794 HydrophobicContact CG-CD2 4.09Å; R779-F794 HydrophobicContact CG-CE1 4.35Å; R779-F794 HydrophobicContact CG-CE2 3.76Å; R779-F794 HydrophobicContact CG-CZ 3.91Å; L782-F794 HydrophobicContact CD1-CD2 4.24Å; L782-F794 HydrophobicContact CD1-CE2 4.05Å; G790-F794 PolarHBondContact O-N 3.35Å; F794-R796 VanDerWaalsContact C-N 3.28Å; F794-R796 PolarHBondContact O-N 2.91Å; F794-I797 PolarHBondContact O-N 3.5Å; F794-M798 WeakPolarHBondContact O-CB 3.5Å; F794-M798 PolarHBondContact O-N 2.79Å
795	A	73.6	Confident	70.3	Confident	55 Å²	55	79.2 Å²	79.2	46%	0.455	45%	0.447	S	S	.	.	H	α-helix	trans	-61.1	-37.2	176.4	0	0	0	0	0	112.5	E791 M799	E791-A795 WeakPolarHBondContact O-CB 3.4Å; E791-A795 PolarHBondContact O-N 2.78Å; A795-M799 PolarHBondContact O-N 3.34Å
796	R	71.8	Confident	70.4	Confident	160 Å²	160	80 Å²	80	60%	0.604	46%	0.456	S	S	*	.	H	α-helix	trans	-66.8	-42.4	176.2	-163.5	-167.2	-50.7	154.6	7.3	111.9	V792 E793 F794 M799 L800	V792-R796 PolarHBondContact O-N 3.03Å; E793-R796 WeakPolarHBondContact O-CB 3.31Å; E793-R796 PolarHBondContact O-N 3.43Å; F794-R796 VanDerWaalsContact C-N 3.28Å; F794-R796 PolarHBondContact O-N 2.91Å; R796-M799 PolarHBondContact O-N 3.1Å; R796-L800 PolarHBondContact O-N 3.27Å
797	I	71.1	Confident	70.7	Confident	19 Å²	19	78.1 Å²	78.1	10%	0.097	44%	0.436	C	S	.	.	H	α-helix	trans	-68.7	-38.2	177.8	-69.2	162.6	0	0	0	110.8	F778 L782 L789 E793 F794 M799 L800 V801 F817	F778-I797 HydrophobicContact CE1-CG2 4.49Å; L782-I797 HydrophobicContact CD1-CG2 4.42Å; L789-I797 HydrophobicContact CD1-CD1 3.44Å; L789-I797 VanDerWaalsContact CD1-CD1 3.44Å; L789-I797 HydrophobicContact CD2-CD1 4.22Å; L789-I797 HydrophobicContact CG-CD1 4.4Å; E793-I797 HydrophobicContact CG-CD1 4.49Å; E793-I797 WeakPolarHBondContact O-CG1 3.28Å; E793-I797 PolarHBondContact O-N 3.26Å; F794-I797 PolarHBondContact O-N 3.5Å; I797-M799 VanDerWaalsContact C-N 3.32Å; I797-M799 PolarHBondContact O-N 3.05Å; I797-L800 VanDerWaalsContact O-CB 3.29Å; I797-L800 WeakPolarHBondContact O-CB 3.45Å; I797-L800 PolarHBondContact O-N 2.77Å; I797-V801 HydrophobicContact CG2-CG2 4.27Å; I797-V801 WeakPolarHBondContact O-CG2 3.42Å; I797-V801 PolarHBondContact O-N 3.4Å; I797-V801 VanDerWaalsContact O-N 3.1Å; I797-F817 HydrophobicContact CB-CZ 4.43Å; I797-F817 HydrophobicContact CD1-CE1 4.23Å; I797-F817 HydrophobicContact CD1-CZ 3.87Å; I797-F817 HydrophobicContact CG1-CE1 4.24Å; I797-F817 HydrophobicContact CG1-CE2 4.37Å; I797-F817 HydrophobicContact CG1-CZ 3.75Å; I797-F817 HydrophobicContact CG2-CD1 3.91Å; I797-F817 HydrophobicContact CG2-CE1 3.48Å; I797-F817 VanDerWaalsContact CG2-CE1 3.48Å; I797-F817 HydrophobicContact CG2-CE2 4.49Å; I797-F817 HydrophobicContact CG2-CZ 3.82Å
798	M	76.2	Confident	71	Confident	26 Å²	26	76.3 Å²	76.3	13%	0.128	43%	0.433	C	S	.	.	H	α-helix	trans	-61.4	-40.4	176.2	-169.9	65.3	-173.2	0	0	111.9	T775 F778 F794 L800 V801 D802 V809	T775-M798 HydrophobicContact CG2-CE 3.53Å; F778-M798 HydrophobicContact CD1-SD 4.22Å; F794-M798 WeakPolarHBondContact O-CB 3.5Å; F794-M798 PolarHBondContact O-N 2.79Å; M798-L800 PolarHBondContact O-N 2.73Å; M798-V801 PolarHBondContact O-N 3.42Å; M798-D802 HydrophobicContact CE-CB 3.82Å; M798-D802 PolarHBondContact O-N 3.25Å; M798-V809 HydrophobicContact CE-CG2 4Å; M798-V809 HydrophobicContact SD-CG2 4.01Å
799	M	72.4	Confident	71.6	Confident	151 Å²	151	69.2 Å²	69.2	74%	0.744	40%	0.395	S	S	*	.	H	α-helix	trans	-64.7	-26	174.5	-76	-174.3	65.3	0	0	113.6	A795 R796 I797	A795-M799 PolarHBondContact O-N 3.34Å; R796-M799 PolarHBondContact O-N 3.1Å; I797-M799 VanDerWaalsContact C-N 3.32Å; I797-M799 PolarHBondContact O-N 3.05Å
800	L	67.8	Low	71.9	Confident	56 Å²	56	70.3 Å²	70.3	29%	0.293	41%	0.405	S	S	.	.	H	α-helix	trans	-78.2	-34.2	178.2	-159.2	81.4	0	0	0	112	R796 I797 M798 F817 R820	R796-L800 PolarHBondContact O-N 3.27Å; I797-L800 VanDerWaalsContact O-CB 3.29Å; I797-L800 WeakPolarHBondContact O-CB 3.45Å; I797-L800 PolarHBondContact O-N 2.77Å; M798-L800 PolarHBondContact O-N 2.73Å; L800-F817 HydrophobicContact CD2-CD2 3.47Å; L800-F817 VanDerWaalsContact CD2-CD2 3.47Å; L800-F817 HydrophobicContact CD2-CE2 3.91Å; L800-F817 HydrophobicContact CD2-CG 4.35Å; L800-R820 VanDerWaalsContact CD1-NH2 3.31Å
801	V	68.1	Low	71.7	Confident	5 Å²	5	70 Å²	70	3%	0.03	39%	0.39	C	S	.	.	H	α-helix	trans	-96.3	-27.7	-172.1	178.5	0	0	0	0	112	F778 I797 M798 V809 S813 F817	F778-V801 HydrophobicContact CE1-CG1 4.38Å; F778-V801 HydrophobicContact CZ-CG1 4.11Å; F778-V801 HydrophobicContact CZ-CG2 4.32Å; I797-V801 HydrophobicContact CG2-CG2 4.27Å; I797-V801 WeakPolarHBondContact O-CG2 3.42Å; I797-V801 PolarHBondContact O-N 3.4Å; I797-V801 VanDerWaalsContact O-N 3.1Å; M798-V801 PolarHBondContact O-N 3.42Å; V801-V809 HydrophobicContact CG1-CB 4.35Å; V801-V809 HydrophobicContact CG1-CG1 3.5Å; V801-V809 HydrophobicContact CG1-CG2 3.97Å; V801-S813 WeakPolarHBondContact O-CB 3.42Å; V801-S813 PolarHBondContact O-OG 2.91Å; V801-S813 VanDerWaalsContact O-OG 3.09Å; V801-F817 HydrophobicContact CG2-CB 3.9Å; V801-F817 HydrophobicContact CG2-CD1 4.37Å; V801-F817 HydrophobicContact CG2-CG 4.2Å
802	D	74.7	Confident	71.3	Confident	13 Å²	13	66.4 Å²	66.4	7%	0.07	37%	0.373	C	S	.	.			trans	-128.3	75.9	174.5	179.9	22.5	0	0	0	110.9	M798 N804 A805 T806 G807	M798-D802 HydrophobicContact CE-CB 3.82Å; M798-D802 PolarHBondContact O-N 3.25Å; D802-N804 PolarHBondContact O-N 3.14Å; D802-N804 VanDerWaalsContact O-N 3.13Å; D802-A805 PolarHBondContact O-N 3.46Å; D802-A805 PolarHBondContact OD1-N 2.98Å; D802-A805 WeakPolarHBondContact OD2-CA 3.47Å; D802-T806 PolarHBondContact OD1-N 3.08Å; D802-T806 VanDerWaalsContact OD1-N 3.09Å; D802-T806 PolarHBondContact OD1-OG1 3.4Å; D802-T806 PolarHBondContact OD2-N 3.15Å; D802-T806 PolarHBondContact OD2-OG1 2.88Å; D802-G807 PolarHBondContact OD2-N 3.27Å
803	P	65.4	Low	71.2	Confident	104 Å²	104	62.2 Å²	62.2	68%	0.675	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-20.4	-179.3	-20	31.9	0	0	0	113.5
804	N	72.3	Confident	71.3	Confident	138 Å²	138	58.2 Å²	58.2	74%	0.738	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-0.9	-176.8	-65.3	-20.6	0	0	0	112.8	D802 T806	D802-N804 PolarHBondContact O-N 3.14Å; D802-N804 VanDerWaalsContact O-N 3.13Å; N804-T806 HydrophobicContact CB-CG2 3.84Å; N804-T806 PolarHBondContact O-N 3.05Å
805	A	68.6	Low	70.7	Confident	88 Å²	88	58.1 Å²	58.1	73%	0.727	33%	0.331	S	S	*	.			trans	51.2	37.3	-178.2	0	0	0	0	0	113.4	D802 G807	D802-A805 PolarHBondContact O-N 3.46Å; D802-A805 PolarHBondContact OD1-N 2.98Å; D802-A805 WeakPolarHBondContact OD2-CA 3.47Å; A805-G807 PolarHBondContact O-N 2.97Å
806	T	70.8	Confident	70.3	Confident	87 Å²	87	59 Å²	59	53%	0.534	33%	0.328	S	S	.	.			trans	-72.8	-14.5	178.7	57.5	0	0	0	0	112.6	D802 N804 I808	D802-T806 PolarHBondContact OD1-N 3.08Å; D802-T806 VanDerWaalsContact OD1-N 3.09Å; D802-T806 PolarHBondContact OD1-OG1 3.4Å; D802-T806 PolarHBondContact OD2-N 3.15Å; D802-T806 PolarHBondContact OD2-OG1 2.88Å; N804-T806 HydrophobicContact CB-CG2 3.84Å; N804-T806 PolarHBondContact O-N 3.05Å; T806-I808 PolarHBondContact O-N 3.45Å; T806-I808 PolarHBondContact OG1-O 3.27Å
807	G	70.8	Confident	70.2	Confident	27 Å²	27	52.9 Å²	52.9	28%	0.278	31%	0.306	S	S	.	.	S	Bend	trans	75.6	9.2	-176.9	0	0	0	0	0	112.9	T775 D802 A805	T775-G807 VanDerWaalsContact CG2-O 3.27Å; T775-G807 WeakPolarHBondContact CG2-O 3.35Å; T775-G807 PolarHBondContact N-O 3.48Å; D802-G807 PolarHBondContact OD2-N 3.27Å; A805-G807 PolarHBondContact O-N 2.97Å
808	I	74.8	Confident	69.8	Low	74 Å²	74	55 Å²	55	38%	0.379	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	123.9	-174	-59.9	176.6	0	0	0	109	A772 M773 T806	A772-I808 HydrophobicContact CB-CG2 3.24Å; M773-I808 CarbonylContact O-C 3.09Å; M773-I808 WeakPolarHBondContact O-CA 3.48Å; T806-I808 PolarHBondContact O-N 3.45Å; T806-I808 PolarHBondContact OG1-O 3.27Å
809	V	74.3	Confident	69	Low	0 Å²	0	59.8 Å²	59.8	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	113.7	176.8	176.2	0	0	0	0	109.1	M773 F778 M798 V801 F814	M773-V809 PolarHBondContact N-O 2.98Å; M773-V809 PolarHBondContact O-N 2.92Å; F778-V809 HydrophobicContact CB-CB 4.45Å; F778-V809 HydrophobicContact CB-CG2 4.14Å; F778-V809 HydrophobicContact CD1-CG2 3.79Å; F778-V809 HydrophobicContact CD2-CB 4.37Å; F778-V809 HydrophobicContact CD2-CG1 4.05Å; F778-V809 HydrophobicContact CD2-CG2 4.33Å; F778-V809 HydrophobicContact CE1-CG2 4.23Å; F778-V809 HydrophobicContact CE2-CG1 4.14Å; F778-V809 HydrophobicContact CG-CB 4.25Å; F778-V809 HydrophobicContact CG-CG1 4.39Å; F778-V809 HydrophobicContact CG-CG2 3.83Å; M798-V809 HydrophobicContact CE-CG2 4Å; M798-V809 HydrophobicContact SD-CG2 4.01Å; V801-V809 HydrophobicContact CG1-CB 4.35Å; V801-V809 HydrophobicContact CG1-CG1 3.5Å; V801-V809 HydrophobicContact CG1-CG2 3.97Å; V809-F814 HydrophobicContact CG1-CB 4.38Å
810	S	72.9	Confident	68.3	Low	50 Å²	50	57.9 Å²	57.9	35%	0.35	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	153.3	171.6	81.2	0	0	0	0	110.7	Q812 S813 F814	S810-Q812 PolarHBondContact O-N 3.49Å; S810-S813 WeakPolarHBondContact O-CB 3.43Å; S810-S813 PolarHBondContact O-N 2.81Å; S810-S813 VanDerWaalsContact O-N 3.15Å; S810-S813 PolarHBondContact OG-N 3.03Å; S810-S813 PolarHBondContact OG-OG 3.19Å; S810-F814 PolarHBondContact O-N 3.4Å
811	F	68.3	Low	67.7	Low	43 Å²	43	60.9 Å²	60.9	19%	0.189	34%	0.344	C	S	.	.	H	α-helix	trans	-58.9	-29.9	177.1	-174	-117.4	0	0	0	112.7	M755 F758 R759 F762 F814 I815	M755-F811 HydrophobicContact CE-CE1 3.73Å; M755-F811 HydrophobicContact CE-CZ 4.36Å; M755-F811 HydrophobicContact SD-CE1 4.15Å; M755-F811 HydrophobicContact SD-CZ 4.19Å; F758-F811 HydrophobicContact CB-CE2 4.15Å; F758-F811 HydrophobicContact CB-CZ 4.2Å; R759-F811 HydrophobicContact CB-CZ 4.12Å; F762-F811 HydrophobicContact CB-CD2 3.73Å; F762-F811 HydrophobicContact CB-CE2 3.86Å; F762-F811 HydrophobicContact CD1-CB 4.5Å; F762-F811 HydrophobicContact CD1-CD2 4.12Å; F762-F811 HydrophobicContact CD2-CB 4.17Å; F762-F811 AromaticContact CD2-CD2 3.49Å; F762-F811 HydrophobicContact CD2-CD2 3.49Å; F762-F811 VanDerWaalsContact CD2-CD2 3.49Å; F762-F811 HydrophobicContact CD2-CE2 4.37Å; F762-F811 HydrophobicContact CD2-CG 4.31Å; F762-F811 HydrophobicContact CE1-CB 4.21Å; F762-F811 HydrophobicContact CE2-CB 3.82Å; F762-F811 HydrophobicContact CE2-CD2 4.04Å; F762-F811 HydrophobicContact CE2-CG 4.45Å; F762-F811 HydrophobicContact CG-CB 4.48Å; F762-F811 AromaticContact CG-CD2 3.52Å; F762-F811 HydrophobicContact CG-CD2 3.52Å; F762-F811 HydrophobicContact CG-CE2 4.18Å; F762-F811 HydrophobicContact CG-CG 4.38Å; F762-F811 HydrophobicContact CZ-CB 3.86Å; F811-F814 WeakPolarHBondContact O-CB 3.44Å; F811-I815 HydrophobicContact CE2-CG1 4.49Å; F811-I815 HydrophobicContact CZ-CG1 4.38Å; F811-I815 VanDerWaalsContact O-CG1 3.26Å; F811-I815 WeakPolarHBondContact O-CG1 3.19Å; F811-I815 PolarHBondContact O-N 3.32Å
812	Q	64.4	Low	66.7	Low	72 Å²	72	67.1 Å²	67.1	34%	0.336	38%	0.383	S	S	.	.	H	α-helix	trans	-70.9	-43.4	177.1	-173.2	63	42.7	0	0	111.8	T744 S810 F814 I815 D816	T744-Q812 PolarHBondContact OG1-OE1 3.19Å; S810-Q812 PolarHBondContact O-N 3.49Å; Q812-F814 VanDerWaalsContact C-N 3.28Å; Q812-F814 PolarHBondContact O-N 3.25Å; Q812-I815 CarbonylContact O-C 3.34Å; Q812-I815 WeakPolarHBondContact O-CA 3.41Å; Q812-I815 PolarHBondContact O-N 3.32Å; Q812-D816 PolarHBondContact NE2-OD2 3.12Å; Q812-D816 PolarHBondContact O-N 3.18Å; Q812-D816 VanDerWaalsContact O-N 3.16Å
813	S	68.4	Low	64.9	Low	30 Å²	30	71.5 Å²	71.5	21%	0.21	42%	0.42	C	S	.	.	H	α-helix	trans	-56.1	-44	176.8	-56.9	0	0	0	0	111.9	V801 S810 I815 D816	V801-S813 WeakPolarHBondContact O-CB 3.42Å; V801-S813 PolarHBondContact O-OG 2.91Å; V801-S813 VanDerWaalsContact O-OG 3.09Å; S810-S813 WeakPolarHBondContact O-CB 3.43Å; S810-S813 PolarHBondContact O-N 2.81Å; S810-S813 VanDerWaalsContact O-N 3.15Å; S810-S813 PolarHBondContact OG-N 3.03Å; S810-S813 PolarHBondContact OG-OG 3.19Å; S813-I815 PolarHBondContact O-N 3.31Å; S813-D816 PolarHBondContact O-N 3.33Å; S813-D816 VanDerWaalsContact O-N 3.09Å
814	F	71.4	Confident	63.4	Low	2 Å²	2	74.2 Å²	74.2	1%	0.009	43%	0.429	C	S	.	.	H	α-helix	trans	-55.1	-38.2	174.1	-172.5	-80.5	0	0	0	112.2	F758 M773 F778 M785 V809 S810 F811 Q812 D816	F758-F814 HydrophobicContact CB-CE1 4.35Å; F758-F814 AromaticContact CD1-CE1 3.98Å; F758-F814 HydrophobicContact CD1-CE1 3.98Å; F758-F814 HydrophobicContact CG-CE1 4.34Å; M773-F814 HydrophobicContact CE-CD2 3.62Å; M773-F814 HydrophobicContact CE-CE2 3.92Å; F778-F814 AromaticContact CD2-CD2 3.98Å; F778-F814 HydrophobicContact CD2-CD2 3.98Å; F778-F814 HydrophobicContact CD2-CE2 4.29Å; F778-F814 AromaticContact CE2-CD2 3.6Å; F778-F814 HydrophobicContact CE2-CD2 3.6Å; F778-F814 HydrophobicContact CE2-CE2 4.04Å; M785-F814 HydrophobicContact CE-CZ 4.37Å; M785-F814 HydrophobicContact SD-CE1 4.5Å; M785-F814 HydrophobicContact SD-CE2 4.46Å; M785-F814 HydrophobicContact SD-CZ 3.68Å; V809-F814 HydrophobicContact CG1-CB 4.38Å; S810-F814 PolarHBondContact O-N 3.4Å; F811-F814 WeakPolarHBondContact O-CB 3.44Å; Q812-F814 VanDerWaalsContact C-N 3.28Å; Q812-F814 PolarHBondContact O-N 3.25Å; F814-D816 VanDerWaalsContact C-N 3.33Å
815	I	67.3	Low	61.5	Low	20 Å²	20	74.1 Å²	74.1	10%	0.103	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	6	-177.6	-61	-68.2	0	0	0	112.4	K748 I750 F758 F811 Q812 S813	K748-I815 HydrophobicContact CD-CG2 3.69Å; K748-I815 PolarHBondContact NZ-O 3.43Å; I750-I815 HydrophobicContact CD1-CG2 3.61Å; F758-I815 HydrophobicContact CB-CD1 3.92Å; F758-I815 HydrophobicContact CD2-CD1 3.39Å; F758-I815 HydrophobicContact CE2-CD1 4.03Å; F758-I815 HydrophobicContact CG-CD1 3.76Å; F811-I815 HydrophobicContact CE2-CG1 4.49Å; F811-I815 HydrophobicContact CZ-CG1 4.38Å; F811-I815 VanDerWaalsContact O-CG1 3.26Å; F811-I815 WeakPolarHBondContact O-CG1 3.19Å; F811-I815 PolarHBondContact O-N 3.32Å; Q812-I815 CarbonylContact O-C 3.34Å; Q812-I815 WeakPolarHBondContact O-CA 3.41Å; Q812-I815 PolarHBondContact O-N 3.32Å; S813-I815 PolarHBondContact O-N 3.31Å
816	D	65.4	Low	60.1	Low	75 Å²	75	75.5 Å²	75.5	40%	0.401	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.9	4.2	176.4	-84.3	-61.8	0	0	0	114.3	K748 Q812 S813 F814 R820	K748-D816 IonicContact NZ-OD1 2.98Å; K748-D816 PolarHBondContact NZ-OD1 3.07Å; K748-D816 IonicContact NZ-OD2 3.27Å; K748-D816 PolarHBondContact NZ-OD2 3.22Å; Q812-D816 PolarHBondContact NE2-OD2 3.12Å; Q812-D816 PolarHBondContact O-N 3.18Å; Q812-D816 VanDerWaalsContact O-N 3.16Å; S813-D816 PolarHBondContact O-N 3.33Å; S813-D816 VanDerWaalsContact O-N 3.09Å; F814-D816 VanDerWaalsContact C-N 3.33Å; D816-R820 PolarHBondContact O-NH1 3.43Å
817	F	68.5	Low	59.2	Low	31 Å²	31	75.3 Å²	75.3	14%	0.136	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-47.6	175.9	172.4	-142.9	0	0	0	114.5	I797 L800 V801 T819 R820	I797-F817 HydrophobicContact CB-CZ 4.43Å; I797-F817 HydrophobicContact CD1-CE1 4.23Å; I797-F817 HydrophobicContact CD1-CZ 3.87Å; I797-F817 HydrophobicContact CG1-CE1 4.24Å; I797-F817 HydrophobicContact CG1-CE2 4.37Å; I797-F817 HydrophobicContact CG1-CZ 3.75Å; I797-F817 HydrophobicContact CG2-CD1 3.91Å; I797-F817 HydrophobicContact CG2-CE1 3.48Å; I797-F817 VanDerWaalsContact CG2-CE1 3.48Å; I797-F817 HydrophobicContact CG2-CE2 4.49Å; I797-F817 HydrophobicContact CG2-CZ 3.82Å; L800-F817 HydrophobicContact CD2-CD2 3.47Å; L800-F817 VanDerWaalsContact CD2-CD2 3.47Å; L800-F817 HydrophobicContact CD2-CE2 3.91Å; L800-F817 HydrophobicContact CD2-CG 4.35Å; V801-F817 HydrophobicContact CG2-CB 3.9Å; V801-F817 HydrophobicContact CG2-CD1 4.37Å; V801-F817 HydrophobicContact CG2-CG 4.2Å; F817-T819 VanDerWaalsContact C-N 3.3Å; F817-T819 PolarHBondContact O-N 3.16Å; F817-R820 WeakPolarHBondContact O-CB 3.41Å; F817-R820 WeakPolarHBondContact O-CD 3.47Å
818	M	64.1	Low	58.1	Low	62 Å²	62	74.8 Å²	74.8	31%	0.305	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	47.2	-151.2	-50.4	-64	-80.9	0	0	117	L782 M785 Y787	L782-M818 HydrophobicContact CD2-CE 4.47Å; M785-M818 HydrophobicContact CE-CE 4.23Å; Y787-M818 HydrophobicContact CD2-CE 4.41Å; Y787-M818 HydrophobicContact CE2-CE 3.61Å
819	T	58.1	Low	57.5	Low	128 Å²	128	76.3 Å²	76.3	79%	0.785	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.8	-2	-164.9	54.7	0	0	0	0	117.6	F817	F817-T819 VanDerWaalsContact C-N 3.3Å; F817-T819 PolarHBondContact O-N 3.16Å
820	R	58.2	Low	56.9	Low	110 Å²	110	79.8 Å²	79.8	42%	0.415	45%	0.446	S	S	.	.				-127.2	-90.8	-116.3	-165.8	178.1	157.9	144	-3	118.3	L800 D816 F817 T822	L800-R820 VanDerWaalsContact CD1-NH2 3.31Å; D816-R820 PolarHBondContact O-NH1 3.43Å; F817-R820 WeakPolarHBondContact O-CB 3.41Å; F817-R820 WeakPolarHBondContact O-CD 3.47Å; R820-T822 WeakPolarHBondContact O-CB 3.07Å; R820-T822 VanDerWaalsContact O-CG2 3.27Å; R820-T822 WeakPolarHBondContact O-CG2 3.2Å; R820-T822 PolarHBondContact O-N 3.42Å; R820-T822 PolarHBondContact O-OG1 3.02Å
821	E	54.7	Low	56.5	Low	119 Å²	119	78 Å²	78	56%	0.556	43%	0.433	S	S	*	.			trans	-66.9	124.8	-169.6	-78.7	65.4	-150.2	0	0	113.3
822	T	47.4	Very low	56.9	Low	137 Å²	137	78.2 Å²	78.2	84%	0.84	44%	0.438	S	S	*	.			trans	-151.7	14	-154.1	35.4	0	0	0	0	118.4	R820	R820-T822 WeakPolarHBondContact O-CB 3.07Å; R820-T822 VanDerWaalsContact O-CG2 3.27Å; R820-T822 WeakPolarHBondContact O-CG2 3.2Å; R820-T822 PolarHBondContact O-N 3.42Å; R820-T822 PolarHBondContact O-OG1 3.02Å
823	A	36.3	Very low	57.1	Low	104 Å²	104	77.4 Å²	77.4	86%	0.86	44%	0.443	S	S	*	.			trans	-136	161.6	-167.2	0	0	0	0	0	117.2
824	D	34.3	Very low	57.3	Low	161 Å²	161	76.1 Å²	76.1	86%	0.861	43%	0.434	S	S	*	.			trans	-145.8	-176.6	-178.7	-161.4	-7	0	0	0	110.5
825	T	32.2	Very low	57.5	Low	137 Å²	137	76.1 Å²	76.1	84%	0.84	44%	0.435	S	S	*	.			trans	-143.5	-110.8	-177.5	-47.5	0	0	0	0	117.4
826	D	38.5	Very low	58.1	Low	116 Å²	116	81.5 Å²	81.5	62%	0.62	45%	0.454	S	S	*	.			trans	-161.6	172.2	-157.8	-162.2	1.3	0	0	0	112.3	Q830	D826-Q830 PolarHBondContact OD1-NE2 3.29Å
827	T	52.4	Low	58.5	Low	83 Å²	83	81.4 Å²	81.4	51%	0.509	45%	0.452	S	S	.	.			trans	-107.2	-161.2	-176.6	76.9	0	0	0	0	114.7	D829 Q830	T827-D829 WeakPolarHBondContact CB-OD1 3.49Å; T827-D829 PolarHBondContact OG1-OD1 3.05Å; T827-D829 PolarHBondContact OG1-OD2 2.7Å; T827-Q830 WeakPolarHBondContact OG1-CG 3.27Å; T827-Q830 PolarHBondContact OG1-NE2 2.87Å
828	A	48	Very low	58.7	Low	16 Å²	16	80.6 Å²	80.6	13%	0.132	45%	0.449	C	S	.	.	S	Bend	trans	-142.6	-41.8	-168.8	0	0	0	0	0	116.1	Q830 V831 Y889	A828-Q830 PolarHBondContact O-N 3.48Å; A828-V831 WeakPolarHBondContact O-CG2 3.19Å; A828-V831 PolarHBondContact O-N 3.36Å; A828-Y889 HydrophobicContact CB-CD1 3.72Å; A828-Y889 HydrophobicContact CB-CE1 3.62Å; A828-Y889 HydrophobicContact CB-CG 4.33Å
829	D	61.7	Low	59.3	Low	107 Å²	107	77.7 Å²	77.7	57%	0.572	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-29.8	-41.3	161.4	39.8	-76	0	0	0	114.8	T827 V831 V832	T827-D829 WeakPolarHBondContact CB-OD1 3.49Å; T827-D829 PolarHBondContact OG1-OD1 3.05Å; T827-D829 PolarHBondContact OG1-OD2 2.7Å; D829-V831 PolarHBondContact O-N 3.18Å; D829-V832 PolarHBondContact O-N 3.46Å
830	Q	63.1	Low	59.9	Low	72 Å²	72	75 Å²	75	34%	0.336	43%	0.426	S	S	.	.	H	α-helix	trans	-43.8	-25.8	171.6	-54.8	-178.4	6.9	0	0	115.6	D826 T827 A828 S834	D826-Q830 PolarHBondContact OD1-NE2 3.29Å; T827-Q830 WeakPolarHBondContact OG1-CG 3.27Å; T827-Q830 PolarHBondContact OG1-NE2 2.87Å; A828-Q830 PolarHBondContact O-N 3.48Å; Q830-S834 PolarHBondContact O-OG 3.25Å; Q830-S834 VanDerWaalsContact O-OG 3.12Å
831	V	64.8	Low	60.6	Low	13 Å²	13	76 Å²	76	8%	0.079	44%	0.439	C	S	.	.	H	α-helix	trans	-73.9	-38.2	176.8	178.9	0	0	0	0	112.4	V272 A828 D829 A833 S834 F835 Y889	V272-V831 HydrophobicContact CG1-CG1 4.26Å; V272-V831 HydrophobicContact CG2-CG1 4.4Å; V272-V831 HydrophobicContact CG2-CG2 3.74Å; A828-V831 WeakPolarHBondContact O-CG2 3.19Å; A828-V831 PolarHBondContact O-N 3.36Å; D829-V831 PolarHBondContact O-N 3.18Å; V831-A833 PolarHBondContact O-N 3.46Å; V831-S834 WeakPolarHBondContact O-CB 3.44Å; V831-S834 PolarHBondContact O-N 2.8Å; V831-F835 HydrophobicContact CG1-CE2 4.44Å; V831-F835 PolarHBondContact O-N 2.96Å; V831-Y889 HydrophobicContact CB-CE2 4.08Å; V831-Y889 HydrophobicContact CG1-CE2 4.37Å; V831-Y889 HydrophobicContact CG2-CE2 3.89Å; V831-Y889 WeakPolarHBondContact CG2-OH 3.24Å
832	V	75	Confident	61.8	Low	47 Å²	47	73.5 Å²	73.5	29%	0.285	43%	0.426	S	S	.	.	H	α-helix	trans	-63.2	-36.3	-179.6	-167.7	0	0	0	0	110.5	D829 S834	D829-V832 PolarHBondContact O-N 3.46Å; V832-S834 VanDerWaalsContact C-N 3.29Å; V832-S834 PolarHBondContact O-N 3.39Å
833	A	68.3	Low	63.2	Low	55 Å²	55	70.1 Å²	70.1	46%	0.455	41%	0.407	S	S	.	.	H	α-helix	trans	-65.4	-30.5	174.2	0	0	0	0	0	112.9	V831 I837	V831-A833 PolarHBondContact O-N 3.46Å; A833-I837 WeakPolarHBondContact O-CG1 3.19Å
834	S	73.4	Confident	65.3	Low	3 Å²	3	67.6 Å²	67.6	2%	0.021	38%	0.376	C	S	.	.	H	α-helix	trans	-71.1	-39.9	-179.4	-57.6	0	0	0	0	111.8	A265 Q830 V831 V832 R836 I837	A265-S834 VanDerWaalsContact CB-O 3.31Å; A265-S834 WeakPolarHBondContact CB-O 3.45Å; Q830-S834 PolarHBondContact O-OG 3.25Å; Q830-S834 VanDerWaalsContact O-OG 3.12Å; V831-S834 WeakPolarHBondContact O-CB 3.44Å; V831-S834 PolarHBondContact O-N 2.8Å; V832-S834 VanDerWaalsContact C-N 3.29Å; V832-S834 PolarHBondContact O-N 3.39Å; S834-R836 PolarHBondContact O-N 2.85Å; S834-I837 PolarHBondContact O-N 3.13Å
835	F	76.5	Confident	67.7	Low	3 Å²	3	60 Å²	60	1%	0.013	34%	0.335	C	S	.	.	H	α-helix	trans	-69.9	-31.1	178.1	-84.1	-73.1	0	0	0	113.5	I269 V831 I837 L838 A839 M866 Y881 F884 S885	I269-F835 HydrophobicContact CB-CE1 4.44Å; I269-F835 HydrophobicContact CB-CE2 4.43Å; I269-F835 HydrophobicContact CB-CZ 4.14Å; I269-F835 HydrophobicContact CD1-CB 4.18Å; I269-F835 HydrophobicContact CD1-CD1 3.42Å; I269-F835 VanDerWaalsContact CD1-CD1 3.42Å; I269-F835 HydrophobicContact CD1-CD2 3.71Å; I269-F835 HydrophobicContact CD1-CE1 3.62Å; I269-F835 HydrophobicContact CD1-CE2 3.91Å; I269-F835 HydrophobicContact CD1-CG 3.47Å; I269-F835 VanDerWaalsContact CD1-CG 3.47Å; I269-F835 HydrophobicContact CD1-CZ 3.87Å; I269-F835 HydrophobicContact CG1-CD1 4.22Å; I269-F835 HydrophobicContact CG1-CD2 3.83Å; I269-F835 HydrophobicContact CG1-CE1 4.03Å; I269-F835 HydrophobicContact CG1-CE2 3.64Å; I269-F835 HydrophobicContact CG1-CG 4.12Å; I269-F835 HydrophobicContact CG1-CZ 3.75Å; I269-F835 HydrophobicContact CG2-CE1 3.61Å; I269-F835 HydrophobicContact CG2-CE2 4.01Å; I269-F835 HydrophobicContact CG2-CZ 3.3Å; V831-F835 HydrophobicContact CG1-CE2 4.44Å; V831-F835 PolarHBondContact O-N 2.96Å; F835-I837 VanDerWaalsContact C-N 3.28Å; F835-I837 PolarHBondContact O-N 3.05Å; F835-L838 PolarHBondContact O-N 3.09Å; F835-A839 PolarHBondContact O-N 3.01Å; F835-A839 VanDerWaalsContact O-N 3.17Å; F835-M866 HydrophobicContact CD1-CE 4.21Å; F835-M866 HydrophobicContact CE1-CE 3.59Å; F835-M866 HydrophobicContact CZ-CE 3.86Å; F835-Y881 HydrophobicContact CB-CD2 3.35Å; F835-Y881 HydrophobicContact CB-CE2 3.98Å; F835-Y881 HydrophobicContact CB-CG 3.67Å; F835-Y881 HydrophobicContact CG-CD2 4.27Å; F835-Y881 HydrophobicContact CG-CG 4.3Å; F835-F884 HydrophobicContact CE2-CD1 4.14Å; F835-F884 HydrophobicContact CE2-CE1 4.18Å; F835-F884 HydrophobicContact CZ-CD1 4.12Å; F835-F884 AromaticContact CZ-CE1 3.97Å; F835-F884 HydrophobicContact CZ-CE1 3.97Å; F835-S885 WeakPolarHBondContact CD2-OG 3.36Å
836	R	78.3	Confident	70.1	Confident	133 Å²	133	55.5 Å²	55.5	50%	0.502	31%	0.305	S	S	.	.	H	α-helix	trans	-62.5	-36.8	176.4	-176.6	177.4	-72.6	169.3	-1.9	112.2	S834 A839 A840 D841 Y881	S834-R836 PolarHBondContact O-N 2.85Å; R836-A839 PolarHBondContact O-N 3.19Å; R836-A840 PolarHBondContact O-N 3.46Å; R836-D841 WeakPolarHBondContact CG-OD1 3.16Å; R836-D841 PolarHBondContact O-N 3.11Å; R836-D841 VanDerWaalsContact O-N 3.09Å; R836-Y881 HydrophobicContact CB-CE2 4.27Å
837	I	74.7	Confident	72.1	Confident	73 Å²	73	51.7 Å²	51.7	37%	0.374	29%	0.286	S	S	.	.	H	α-helix	trans	-64	-43.4	177.3	-64	165.9	0	0	0	110.6	Q261 A265 A833 S834 F835 A839 A840	Q261-I837 HydrophobicContact CB-CG2 4.06Å; Q261-I837 WeakPolarHBondContact O-CG2 3.37Å; A265-I837 HydrophobicContact CB-CB 3.92Å; A265-I837 HydrophobicContact CB-CD1 4.25Å; A265-I837 HydrophobicContact CB-CG2 3.98Å; A833-I837 WeakPolarHBondContact O-CG1 3.19Å; S834-I837 PolarHBondContact O-N 3.13Å; F835-I837 VanDerWaalsContact C-N 3.28Å; F835-I837 PolarHBondContact O-N 3.05Å; I837-A839 VanDerWaalsContact C-N 3.32Å; I837-A839 PolarHBondContact O-N 2.83Å; I837-A840 PolarHBondContact O-N 3.43Å
838	L	73.6	Confident	73.3	Confident	14 Å²	14	53.6 Å²	53.6	7%	0.073	29%	0.293	C	S	.	.	H	α-helix	trans	-65.9	-31.9	178.1	-77.7	147.9	0	0	0	113.7	A265 A266 I269 F835 A840 I845 E853	A265-L838 HydrophobicContact CB-CD1 4.23Å; A265-L838 HydrophobicContact CB-CG 4.28Å; A266-L838 HydrophobicContact CB-CD2 4.2Å; I269-L838 HydrophobicContact CD1-CD1 3.13Å; F835-L838 PolarHBondContact O-N 3.09Å; L838-A840 PolarHBondContact O-N 2.98Å; L838-I845 HydrophobicContact CB-CD1 4.12Å; L838-E853 HydrophobicContact CD2-CB 3.35Å; L838-E853 HydrophobicContact CD2-CG 3.81Å
839	A	75.9	Confident	74.6	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	4	177.3	0	0	0	0	0	113.5	F835 R836 I837 D841 K842 I845 Y881	F835-A839 PolarHBondContact O-N 3.01Å; F835-A839 VanDerWaalsContact O-N 3.17Å; R836-A839 PolarHBondContact O-N 3.19Å; I837-A839 VanDerWaalsContact C-N 3.32Å; I837-A839 PolarHBondContact O-N 2.83Å; A839-D841 VanDerWaalsContact C-N 3.33Å; A839-D841 PolarHBondContact O-N 3.18Å; A839-K842 HydrophobicContact CB-CB 4.32Å; A839-K842 WeakPolarHBondContact CB-O 3.4Å; A839-K842 VanDerWaalsContact O-CB 3.23Å; A839-K842 WeakPolarHBondContact O-CB 3.48Å; A839-K842 WeakPolarHBondContact O-CD 3.46Å; A839-K842 WeakPolarHBondContact O-CG 3.28Å; A839-K842 PolarHBondContact O-N 3.08Å; A839-K842 VanDerWaalsContact O-N 3.11Å; A839-I845 HydrophobicContact CB-CB 4.33Å; A839-I845 HydrophobicContact CB-CG1 4.49Å; A839-Y881 HydrophobicContact CB-CD1 4.44Å; A839-Y881 HydrophobicContact CB-CE1 3.74Å
840	A	71.3	Confident	75.4	Confident	72 Å²	72	49.1 Å²	49.1	60%	0.595	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	51.2	-172.4	0	0	0	0	0	112	R836 I837 L838 K842	R836-A840 PolarHBondContact O-N 3.46Å; I837-A840 PolarHBondContact O-N 3.43Å; L838-A840 PolarHBondContact O-N 2.98Å; A840-K842 PolarHBondContact O-N 2.83Å; A840-K842 VanDerWaalsContact O-N 3.07Å
841	D	71.6	Confident	76.1	Confident	130 Å²	130	52 Å²	52	70%	0.695	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	9.4	-177.5	-71	-44.4	0	0	0	115.9	R836 A839	R836-D841 WeakPolarHBondContact CG-OD1 3.16Å; R836-D841 PolarHBondContact O-N 3.11Å; R836-D841 VanDerWaalsContact O-N 3.09Å; A839-D841 VanDerWaalsContact C-N 3.33Å; A839-D841 PolarHBondContact O-N 3.18Å
842	K	80.1	Confident	76.6	Confident	67 Å²	67	60 Å²	60	29%	0.291	30%	0.303	S	S	.	.			trans	-72.1	146.6	170.9	-59.7	171	-158.3	165.3	0	110.1	A839 A840 Y844 E849 Y881	A839-K842 HydrophobicContact CB-CB 4.32Å; A839-K842 WeakPolarHBondContact CB-O 3.4Å; A839-K842 VanDerWaalsContact O-CB 3.23Å; A839-K842 WeakPolarHBondContact O-CB 3.48Å; A839-K842 WeakPolarHBondContact O-CD 3.46Å; A839-K842 WeakPolarHBondContact O-CG 3.28Å; A839-K842 PolarHBondContact O-N 3.08Å; A839-K842 VanDerWaalsContact O-N 3.11Å; A840-K842 PolarHBondContact O-N 2.83Å; A840-K842 VanDerWaalsContact O-N 3.07Å; K842-Y844 HydrophobicContact CB-CE1 4.5Å; K842-Y844 WeakPolarHBondContact CB-O 3.45Å; K842-Y844 HydrophobicContact CD-CE2 4.03Å; K842-Y844 PolarHBondContact O-N 3.24Å; K842-E849 IonicContact NZ-OE1 3.55Å; K842-E849 PolarHBondContact NZ-OE1 3.34Å; K842-Y881 WeakPolarHBondContact O-CE1 3.32Å; K842-Y881 PolarHBondContact O-OH 3.1Å
843	P	78.1	Confident	76.6	Confident	67 Å²	67	60.6 Å²	60.6	44%	0.435	30%	0.303	S	S	.	.	S	Bend	trans	-75.1	0.9	174.8	31.5	-34.4	0	0	0	113.2	Y869	P843-Y869 HydrophobicContact CB-CE2 4.39Å; P843-Y869 WeakPolarHBondContact O-CE2 3.35Å
844	Y	80.6	Confident	76.8	Confident	50 Å²	50	58.4 Å²	58.4	20%	0.196	28%	0.283	C	S	.	.	S	Bend	trans	-138.6	156.2	178.8	59.7	-95.6	0	0	0	110.1	K842 Y869 P875 A878 L879	K842-Y844 HydrophobicContact CB-CE1 4.5Å; K842-Y844 WeakPolarHBondContact CB-O 3.45Å; K842-Y844 HydrophobicContact CD-CE2 4.03Å; K842-Y844 PolarHBondContact O-N 3.24Å; Y844-Y869 HydrophobicContact CD1-CD1 4.05Å; Y844-Y869 AromaticContact CD1-CE1 3.97Å; Y844-Y869 HydrophobicContact CD1-CE1 3.97Å; Y844-Y869 HydrophobicContact CG-CD1 4.24Å; Y844-P875 HydrophobicContact CE2-CG 3.79Å; Y844-A878 HydrophobicContact CD2-CB 3.82Å; Y844-A878 HydrophobicContact CG-CB 4.02Å; Y844-L879 WeakPolarHBondContact CA-O 3.46Å
845	I	83.1	Confident	76.9	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.01	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	142.5	174.6	-163.9	161.7	0	0	0	110.5	L838 A839 E849 L850 M866 L879 Y881	L838-I845 HydrophobicContact CB-CD1 4.12Å; A839-I845 HydrophobicContact CB-CB 4.33Å; A839-I845 HydrophobicContact CB-CG1 4.49Å; I845-E849 HydrophobicContact CG1-CB 4.08Å; I845-L850 HydrophobicContact CD1-CD2 3.58Å; I845-L850 HydrophobicContact CD1-CG 3.95Å; I845-L850 HydrophobicContact CG1-CD2 4.22Å; I845-L850 HydrophobicContact CG1-CG 4.05Å; I845-L850 HydrophobicContact CG2-CD1 4.1Å; I845-L850 HydrophobicContact CG2-CD2 4.3Å; I845-L850 HydrophobicContact CG2-CG 4.16Å; I845-M866 HydrophobicContact CG2-SD 4.19Å; I845-L879 HydrophobicContact CG2-CB 4.06Å; I845-L879 PolarHBondContact N-O 3.43Å; I845-L879 PolarHBondContact O-N 3.11Å; I845-Y881 HydrophobicContact CB-CD1 4.18Å; I845-Y881 HydrophobicContact CG2-CD1 4.26Å
846	L	83.8	Confident	76.7	Confident	42 Å²	42	66.3 Å²	66.3	22%	0.22	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	154	178.1	-68.2	170.9	0	0	0	112	D848 E849 L850 P875 A878	L846-D848 VanDerWaalsContact C-N 3.28Å; L846-D848 PolarHBondContact O-N 2.9Å; L846-E849 HydrophobicContact CB-CB 4.3Å; L846-E849 HydrophobicContact CB-CG 3.97Å; L846-E849 PolarHBondContact N-OE2 2.88Å; L846-E849 WeakPolarHBondContact O-CB 3.42Å; L846-E849 PolarHBondContact O-N 3.45Å; L846-E849 VanDerWaalsContact O-N 3.09Å; L846-L850 PolarHBondContact O-N 3.19Å; L846-P875 HydrophobicContact CD2-CG 4.01Å; L846-A878 HydrophobicContact CD2-CB 4.5Å
847	V	80.3	Confident	76.3	Confident	36 Å²	36	67.3 Å²	67.3	22%	0.218	35%	0.345	C	S	.	.	H	α-helix	trans	-56.9	-41.6	176.3	174.1	0	0	0	0	112	E849 L850 R851 I863 L879	V847-E849 VanDerWaalsContact C-N 3.32Å; V847-E849 PolarHBondContact O-N 2.89Å; V847-L850 PolarHBondContact O-N 3.45Å; V847-R851 WeakPolarHBondContact O-CG 2.98Å; V847-R851 PolarHBondContact O-N 3.17Å; V847-I863 HydrophobicContact CG1-CD1 3.74Å; V847-I863 HydrophobicContact CG1-CG1 4.24Å; V847-I863 HydrophobicContact CG2-CG1 4.46Å; V847-L879 HydrophobicContact CG2-CD1 4.1Å
848	D	76.4	Confident	76.4	Confident	123 Å²	123	66.1 Å²	66.1	66%	0.658	34%	0.338	S	S	*	.	H	α-helix	trans	-70.7	-29	178.8	-63.7	-31	0	0	0	112.3	L846 R852	L846-D848 VanDerWaalsContact C-N 3.28Å; L846-D848 PolarHBondContact O-N 2.9Å; D848-R852 VanDerWaalsContact O-CB 3.29Å; D848-R852 WeakPolarHBondContact O-CB 3.34Å; D848-R852 PolarHBondContact O-N 3.38Å; D848-R852 VanDerWaalsContact O-N 3.14Å
849	E	76.2	Confident	76.5	Confident	28 Å²	28	65.4 Å²	65.4	13%	0.131	33%	0.334	C	S	.	.	H	α-helix	trans	-70.7	-44	175	-67.6	169.7	162.4	0	0	110.1	K842 I845 L846 V847 R851 R852 E853	K842-E849 IonicContact NZ-OE1 3.55Å; K842-E849 PolarHBondContact NZ-OE1 3.34Å; I845-E849 HydrophobicContact CG1-CB 4.08Å; L846-E849 HydrophobicContact CB-CB 4.3Å; L846-E849 HydrophobicContact CB-CG 3.97Å; L846-E849 PolarHBondContact N-OE2 2.88Å; L846-E849 WeakPolarHBondContact O-CB 3.42Å; L846-E849 PolarHBondContact O-N 3.45Å; L846-E849 VanDerWaalsContact O-N 3.09Å; V847-E849 VanDerWaalsContact C-N 3.32Å; V847-E849 PolarHBondContact O-N 2.89Å; E849-R851 PolarHBondContact O-N 2.86Å; E849-R852 PolarHBondContact O-N 3.39Å; E849-E853 WeakPolarHBondContact O-CG 3.47Å; E849-E853 PolarHBondContact O-N 2.93Å; E849-E853 VanDerWaalsContact O-N 3.08Å
850	L	77.6	Confident	76.8	Confident	2 Å²	2	69.7 Å²	69.7	1%	0.01	35%	0.354	C	S	.	.	H	α-helix	trans	-61.6	-44	174.8	-73	170.3	0	0	0	112.5	I845 L846 V847 R852 L854 C862 I863 M866 L879	I845-L850 HydrophobicContact CD1-CD2 3.58Å; I845-L850 HydrophobicContact CD1-CG 3.95Å; I845-L850 HydrophobicContact CG1-CD2 4.22Å; I845-L850 HydrophobicContact CG1-CG 4.05Å; I845-L850 HydrophobicContact CG2-CD1 4.1Å; I845-L850 HydrophobicContact CG2-CD2 4.3Å; I845-L850 HydrophobicContact CG2-CG 4.16Å; L846-L850 PolarHBondContact O-N 3.19Å; V847-L850 PolarHBondContact O-N 3.45Å; L850-R852 VanDerWaalsContact C-N 3.26Å; L850-R852 PolarHBondContact O-N 3.42Å; L850-L854 HydrophobicContact CD2-CD1 3.73Å; L850-L854 WeakPolarHBondContact O-CB 3.32Å; L850-L854 PolarHBondContact O-N 2.91Å; L850-C862 HydrophobicContact CD1-CB 4.2Å; L850-C862 HydrophobicContact CD2-CB 4.42Å; L850-I863 HydrophobicContact CD1-CG1 4.05Å; L850-M866 HydrophobicContact CD1-SD 4.12Å; L850-L879 HydrophobicContact CD1-CD1 3.69Å
851	R	79.3	Confident	77	Confident	133 Å²	133	67.2 Å²	67.2	50%	0.502	33%	0.33	S	S	.	.	H	α-helix	trans	-69.5	-22.3	179	-74.8	179.6	173.2	158.5	0	113.7	V847 E849 A859 E860 I863	V847-R851 WeakPolarHBondContact O-CG 2.98Å; V847-R851 PolarHBondContact O-N 3.17Å; E849-R851 PolarHBondContact O-N 2.86Å; R851-A859 HydrophobicContact CG-CB 4.15Å; R851-E860 IonicContact CZ-OE1 2.7Å; R851-E860 IonicContact NE-OE1 3.84Å; R851-E860 PolarHBondContact NE-OE1 2.92Å; R851-E860 IonicContact NH2-OE1 2.99Å; R851-E860 PolarHBondContact NH2-OE1 3.29Å; R851-E860 IonicContact NH2-OE2 2.74Å; R851-I863 HydrophobicContact CG-CD1 4.17Å
852	R	75.6	Confident	77.3	Confident	180 Å²	180	61 Å²	61	68%	0.679	30%	0.297	S	S	*	.	H	α-helix	trans	-82.7	-40.3	177.6	-169.9	-179.6	75.1	-165.6	0.6	112	D848 E849 L850	D848-R852 VanDerWaalsContact O-CB 3.29Å; D848-R852 WeakPolarHBondContact O-CB 3.34Å; D848-R852 PolarHBondContact O-N 3.38Å; D848-R852 VanDerWaalsContact O-N 3.14Å; E849-R852 PolarHBondContact O-N 3.39Å; L850-R852 VanDerWaalsContact C-N 3.26Å; L850-R852 PolarHBondContact O-N 3.42Å
853	E	73.7	Confident	77.4	Confident	60 Å²	60	59.6 Å²	59.6	28%	0.28	29%	0.292	S	S	.	.	H	α-helix	trans	-99.3	-20.2	-170.5	-54.6	-62.2	157.3	0	0	114	L838 E849	L838-E853 HydrophobicContact CD2-CB 3.35Å; L838-E853 HydrophobicContact CD2-CG 3.81Å; E849-E853 WeakPolarHBondContact O-CG 3.47Å; E849-E853 PolarHBondContact O-N 2.93Å; E849-E853 VanDerWaalsContact O-N 3.08Å
854	L	73.8	Confident	77.4	Confident	9 Å²	9	63 Å²	63	5%	0.047	30%	0.304	C	S	.	.	S	Bend	trans	-113	151.7	178.3	-60.9	174.8	0	0	0	112	A266 I269 L850 A859	A266-L854 HydrophobicContact CB-CD2 4.12Å; I269-L854 HydrophobicContact CG2-CD1 4.35Å; I269-L854 HydrophobicContact CG2-CD2 4.12Å; L850-L854 HydrophobicContact CD2-CD1 3.73Å; L850-L854 WeakPolarHBondContact O-CB 3.32Å; L850-L854 PolarHBondContact O-N 2.91Å; L854-A859 HydrophobicContact CB-CB 4.29Å
855	P	73.7	Confident	77.2	Confident	63 Å²	63	66.5 Å²	66.5	41%	0.409	32%	0.316	S	S	.	.			trans	-52.8	146.9	168.8	-28.9	36.3	0	0	0	113	E857 Q858 A859	P855-E857 VanDerWaalsContact C-N 3.32Å; P855-E857 PolarHBondContact O-N 2.66Å; P855-E857 VanDerWaalsContact O-N 3.15Å; P855-Q858 PolarHBondContact O-N 2.99Å; P855-A859 PolarHBondContact O-N 3.16Å
856	P	73.1	Confident	77.2	Confident	108 Å²	108	66.8 Å²	66.8	70%	0.701	32%	0.318	S	S	*	.	H	α-helix	trans	-54.5	-41.3	-170.4	-26.9	33.3	0	0	0	114.6	E860	P856-E860 WeakPolarHBondContact O-CG 3.42Å; P856-E860 PolarHBondContact O-N 2.92Å; P856-E860 VanDerWaalsContact O-N 3.1Å
857	E	70.6	Confident	77.1	Confident	155 Å²	155	67.4 Å²	67.4	72%	0.724	32%	0.324	S	S	*	.	H	α-helix	trans	-67.7	-37.3	-179.8	-65.4	-175.4	171.4	0	0	112.8	P855 Y861	P855-E857 VanDerWaalsContact C-N 3.32Å; P855-E857 PolarHBondContact O-N 2.66Å; P855-E857 VanDerWaalsContact O-N 3.15Å; E857-Y861 WeakPolarHBondContact O-CB 3.45Å; E857-Y861 PolarHBondContact O-N 2.72Å; E857-Y861 VanDerWaalsContact O-N 3.09Å
858	Q	75.8	Confident	77.1	Confident	47 Å²	47	69.9 Å²	69.9	22%	0.22	34%	0.341	C	S	.	.	H	α-helix	trans	-78.9	-34.9	-179.2	-70.2	155	-7.2	0	0	111.2	C270 L273 P855 Y861 C862	C270-Q858 PolarHBondContact SG-OE1 2.97Å; L273-Q858 HydrophobicContact CD1-CB 4.1Å; P855-Q858 PolarHBondContact O-N 2.99Å; Q858-Y861 PolarHBondContact O-N 3.04Å; Q858-C862 PolarHBondContact O-N 3.36Å; Q858-C862 PolarHBondContact O-SG 2.67Å
859	A	77.3	Confident	77.3	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-60	-50.6	171.4	0	0	0	0	0	111	R851 L854 P855 Y861 C862 I863	R851-A859 HydrophobicContact CG-CB 4.15Å; L854-A859 HydrophobicContact CB-CB 4.29Å; P855-A859 PolarHBondContact O-N 3.16Å; A859-Y861 VanDerWaalsContact C-N 3.34Å; A859-Y861 PolarHBondContact O-N 3.1Å; A859-C862 PolarHBondContact O-N 3.37Å; A859-I863 VanDerWaalsContact O-CD1 3.29Å; A859-I863 WeakPolarHBondContact O-CD1 3.43Å; A859-I863 WeakPolarHBondContact O-CG1 3.43Å; A859-I863 PolarHBondContact O-N 2.71Å
860	E	80.2	Confident	77.1	Confident	90 Å²	90	75 Å²	75	42%	0.421	36%	0.356	S	S	.	.	H	α-helix	trans	-64.3	-37	178.3	-67.8	-58.9	144	0	0	112.5	R851 P856 I863 M864	R851-E860 IonicContact CZ-OE1 2.7Å; R851-E860 IonicContact NE-OE1 3.84Å; R851-E860 PolarHBondContact NE-OE1 2.92Å; R851-E860 IonicContact NH2-OE1 2.99Å; R851-E860 PolarHBondContact NH2-OE1 3.29Å; R851-E860 IonicContact NH2-OE2 2.74Å; P856-E860 WeakPolarHBondContact O-CG 3.42Å; P856-E860 PolarHBondContact O-N 2.92Å; P856-E860 VanDerWaalsContact O-N 3.1Å; E860-I863 PolarHBondContact O-N 3.34Å; E860-M864 PolarHBondContact O-N 3.27Å
861	Y	77.1	Confident	76.8	Confident	19 Å²	19	75.8 Å²	75.8	8%	0.075	37%	0.365	C	S	.	.	H	α-helix	trans	-61.3	-46.4	173.5	-179.4	-93.7	0	0	0	112.2	L273 N276 E280 E857 Q858 A859 M864 R865 F884	L273-Y861 HydrophobicContact CD2-CD1 3.95Å; L273-Y861 HydrophobicContact CD2-CE1 3.94Å; N276-Y861 PolarHBondContact ND2-OH 3.46Å; E280-Y861 PolarHBondContact OE1-OH 3.33Å; E857-Y861 WeakPolarHBondContact O-CB 3.45Å; E857-Y861 PolarHBondContact O-N 2.72Å; E857-Y861 VanDerWaalsContact O-N 3.09Å; Q858-Y861 PolarHBondContact O-N 3.04Å; A859-Y861 VanDerWaalsContact C-N 3.34Å; A859-Y861 PolarHBondContact O-N 3.1Å; Y861-M864 PolarHBondContact O-N 3.18Å; Y861-R865 HydrophobicContact CE1-CG 4.37Å; Y861-R865 HydrophobicContact CE2-CG 4.21Å; Y861-R865 WeakPolarHBondContact O-CB 3.33Å; Y861-R865 WeakPolarHBondContact O-CG 3.37Å; Y861-R865 PolarHBondContact O-N 3.01Å; Y861-F884 HydrophobicContact CE1-CZ 4.31Å
862	C	77.8	Confident	75.9	Confident	0 Å²	0	76 Å²	76	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-62.3	-42.5	174.5	-75.2	0	0	0	0	112.1	L273 L850 Q858 A859 M864 R865 M866	L273-C862 WeakPolarHBondContact CD1-SG 3.38Å; L850-C862 HydrophobicContact CD1-CB 4.2Å; L850-C862 HydrophobicContact CD2-CB 4.42Å; Q858-C862 PolarHBondContact O-N 3.36Å; Q858-C862 PolarHBondContact O-SG 2.67Å; A859-C862 PolarHBondContact O-N 3.37Å; C862-M864 VanDerWaalsContact C-N 3.32Å; C862-M864 PolarHBondContact O-N 3.1Å; C862-R865 PolarHBondContact O-N 3.19Å; C862-M866 HydrophobicContact CB-CE 3.93Å; C862-M866 HydrophobicContact CB-SD 4.06Å; C862-M866 WeakPolarHBondContact O-CB 3.38Å; C862-M866 WeakPolarHBondContact O-CG 3.48Å; C862-M866 PolarHBondContact O-N 3.4Å
863	I	81.9	Confident	75.3	Confident	38 Å²	38	71.2 Å²	71.2	20%	0.195	39%	0.39	C	S	.	.	H	α-helix	trans	-62.4	-39	180	-67.4	157.8	0	0	0	111.6	V847 L850 R851 A859 E860 L879	V847-I863 HydrophobicContact CG1-CD1 3.74Å; V847-I863 HydrophobicContact CG1-CG1 4.24Å; V847-I863 HydrophobicContact CG2-CG1 4.46Å; L850-I863 HydrophobicContact CD1-CG1 4.05Å; R851-I863 HydrophobicContact CG-CD1 4.17Å; A859-I863 VanDerWaalsContact O-CD1 3.29Å; A859-I863 WeakPolarHBondContact O-CD1 3.43Å; A859-I863 WeakPolarHBondContact O-CG1 3.43Å; A859-I863 PolarHBondContact O-N 2.71Å; E860-I863 PolarHBondContact O-N 3.34Å; I863-L879 HydrophobicContact CG1-CD1 4.23Å
864	M	78.6	Confident	74.8	Confident	139 Å²	139	70.1 Å²	70.1	69%	0.685	39%	0.391	S	S	*	.	H	α-helix	trans	-73.1	-31.8	179.6	-168.6	178.8	73	0	0	112.9	E860 Y861 C862	E860-M864 PolarHBondContact O-N 3.27Å; Y861-M864 PolarHBondContact O-N 3.18Å; C862-M864 VanDerWaalsContact C-N 3.32Å; C862-M864 PolarHBondContact O-N 3.1Å
865	R	76.5	Confident	74.6	Confident	122 Å²	122	71.9 Å²	71.9	46%	0.46	40%	0.403	S	S	.	.	H	α-helix	trans	-101.1	-22.5	-171.5	-67.2	-68	-161.9	-172.4	-1.1	114.3	E280 Y861 C862 F884	E280-R865 IonicContact OE1-CZ 2.78Å; E280-R865 IonicContact OE1-NE 2.83Å; E280-R865 PolarHBondContact OE1-NE 3.4Å; E280-R865 IonicContact OE1-NH2 2.72Å; E280-R865 PolarHBondContact OE1-NH2 3.31Å; E280-R865 VanDerWaalsContact OE1-NH2 3.17Å; E280-R865 IonicContact OE2-CZ 2.97Å; E280-R865 IonicContact OE2-NE 3.08Å; E280-R865 IonicContact OE2-NH2 2.67Å; E280-R865 PolarHBondContact OE2-NH2 3.27Å; Y861-R865 HydrophobicContact CE1-CG 4.37Å; Y861-R865 HydrophobicContact CE2-CG 4.21Å; Y861-R865 WeakPolarHBondContact O-CB 3.33Å; Y861-R865 WeakPolarHBondContact O-CG 3.37Å; Y861-R865 PolarHBondContact O-N 3.01Å; C862-R865 PolarHBondContact O-N 3.19Å; R865-F884 HydrophobicContact CB-CD2 4.32Å; R865-F884 HydrophobicContact CB-CE2 3.89Å
866	M	82.3	Confident	74.4	Confident	9 Å²	9	75.4 Å²	75.4	4%	0.044	43%	0.426	C	S	.	.	S	Bend	trans	-77.5	129.8	178.2	-72.8	178.2	174.2	0	0	110.9	F835 I845 L850 C862 L879 F884	F835-M866 HydrophobicContact CD1-CE 4.21Å; F835-M866 HydrophobicContact CE1-CE 3.59Å; F835-M866 HydrophobicContact CZ-CE 3.86Å; I845-M866 HydrophobicContact CG2-SD 4.19Å; L850-M866 HydrophobicContact CD1-SD 4.12Å; C862-M866 HydrophobicContact CB-CE 3.93Å; C862-M866 HydrophobicContact CB-SD 4.06Å; C862-M866 WeakPolarHBondContact O-CB 3.38Å; C862-M866 WeakPolarHBondContact O-CG 3.48Å; C862-M866 PolarHBondContact O-N 3.4Å; M866-L879 HydrophobicContact CB-CB 4Å; M866-L879 HydrophobicContact CB-CD1 4.33Å; M866-L879 HydrophobicContact CB-CD2 4.29Å; M866-L879 HydrophobicContact CB-CG 4.44Å; M866-L879 HydrophobicContact SD-CB 4.24Å; M866-L879 HydrophobicContact SD-CD1 4.49Å; M866-F884 HydrophobicContact CE-CB 4.31Å; M866-F884 HydrophobicContact CE-CD1 3.61Å; M866-F884 HydrophobicContact CE-CE1 4.08Å; M866-F884 HydrophobicContact CE-CG 3.95Å; M866-F884 HydrophobicContact CG-CB 3.87Å; M866-F884 HydrophobicContact CG-CD1 4.42Å; M866-F884 HydrophobicContact CG-CD2 3.94Å; M866-F884 HydrophobicContact CG-CG 3.81Å
867	P	81.4	Confident	74.3	Confident	54 Å²	54	72.4 Å²	72.4	35%	0.351	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-71.4	152.7	174.8	27.3	-29.9	0	0	0	111.3	D880 A883	P867-D880 HydrophobicContact CG-CB 4.3Å; P867-D880 PolarHBondContact O-N 3.49Å; P867-A883 HydrophobicContact CG-CB 3.93Å
868	P	80.6	Confident	74.9	Confident	88 Å²	88	65.3 Å²	65.3	57%	0.571	38%	0.383	S	S	*	.	B	Isolated β-bridge	trans	-67.7	135.5	175.8	27.6	-33.6	0	0	0	110.8	K870 A878	P868-K870 PolarHBondContact O-N 3.47Å; P868-A878 WeakPolarHBondContact CA-O 3.32Å
869	Y	80.2	Confident	75.3	Confident	59 Å²	59	63.9 Å²	63.9	23%	0.231	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-72.1	125	-178.8	-174.6	-105.4	0	0	0	111.2	P843 Y844 A874 A878 D880	P843-Y869 HydrophobicContact CB-CE2 4.39Å; P843-Y869 WeakPolarHBondContact O-CE2 3.35Å; Y844-Y869 HydrophobicContact CD1-CD1 4.05Å; Y844-Y869 AromaticContact CD1-CE1 3.97Å; Y844-Y869 HydrophobicContact CD1-CE1 3.97Å; Y844-Y869 HydrophobicContact CG-CD1 4.24Å; Y869-A874 HydrophobicContact CD1-CB 3.97Å; Y869-A878 PolarHBondContact N-O 2.83Å; Y869-D880 HydrophobicContact CD2-CB 4.08Å
870	K	71.8	Confident	75.6	Confident	200 Å²	200	65.3 Å²	65.3	87%	0.87	38%	0.384	S	S	*	.			trans	-103.2	14.1	-176.2	-64.5	-177.6	-178	174.1	0	114.2	P868	P868-K870 PolarHBondContact O-N 3.47Å
871	G	71.4	Confident	75.7	Confident	19 Å²	19	61.1 Å²	61.1	20%	0.196	37%	0.365	C	S	.	.	S	Bend	trans	-73.3	163	178.8	0	0	0	0	0	114.1	G873	G871-G873 PolarHBondContact O-N 3.39Å
872	P	60	Low	75.8	Confident	136 Å²	136	62.7 Å²	62.7	88%	0.883	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	131.7	-174.4	27.9	-34.8	0	0	0	112.2
873	G	62.8	Low	75.8	Confident	81 Å²	81	64.7 Å²	64.7	84%	0.835	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	80	11.9	175.4	0	0	0	0	0	115.7	G871	G871-G873 PolarHBondContact O-N 3.39Å
874	A	63.8	Low	75.6	Confident	36 Å²	36	63.5 Å²	63.5	30%	0.298	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-60.7	131.8	178.9	0	0	0	0	0	112.6	Y869 A878	Y869-A874 HydrophobicContact CD1-CB 3.97Å; A874-A878 HydrophobicContact CB-CB 4.21Å
875	P	70.8	Confident	75.3	Confident	47 Å²	47	57 Å²	57	31%	0.305	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-66.9	153.7	169.7	26.6	-32.8	0	0	0	111.6	Y844 L846 G877 A878	Y844-P875 HydrophobicContact CE2-CG 3.79Å; L846-P875 HydrophobicContact CD2-CG 4.01Å; P875-G877 PolarHBondContact O-N 3.32Å; P875-A878 PolarHBondContact O-N 3.44Å
876	P	68.9	Low	75	Confident	136 Å²	136	54.5 Å²	54.5	88%	0.883	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	123.5	176.6	22.7	-30.8	0	0	0	110.7
877	G	71.4	Confident	74.3	Confident	45 Å²	45	57.5 Å²	57.5	46%	0.464	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.1	13.3	-178.8	0	0	0	0	0	116.1	P875	P875-G877 PolarHBondContact O-N 3.32Å
878	A	81.6	Confident	73.5	Confident	6 Å²	6	55.5 Å²	55.5	5%	0.05	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	133.1	175.1	0	0	0	0	0	113	Y844 L846 P868 Y869 A874 P875	Y844-A878 HydrophobicContact CD2-CB 3.82Å; Y844-A878 HydrophobicContact CG-CB 4.02Å; L846-A878 HydrophobicContact CD2-CB 4.5Å; P868-A878 WeakPolarHBondContact CA-O 3.32Å; Y869-A878 PolarHBondContact N-O 2.83Å; A874-A878 HydrophobicContact CB-CB 4.21Å; P875-A878 PolarHBondContact O-N 3.44Å
879	L	84	Confident	72.6	Confident	17 Å²	17	53.7 Å²	53.7	9%	0.089	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	149.4	-179.1	-62.2	173.3	0	0	0	111.7	Y844 I845 V847 L850 I863 M866	Y844-L879 WeakPolarHBondContact CA-O 3.46Å; I845-L879 HydrophobicContact CG2-CB 4.06Å; I845-L879 PolarHBondContact N-O 3.43Å; I845-L879 PolarHBondContact O-N 3.11Å; V847-L879 HydrophobicContact CG2-CD1 4.1Å; L850-L879 HydrophobicContact CD1-CD1 3.69Å; I863-L879 HydrophobicContact CG1-CD1 4.23Å; M866-L879 HydrophobicContact CB-CB 4Å; M866-L879 HydrophobicContact CB-CD1 4.33Å; M866-L879 HydrophobicContact CB-CD2 4.29Å; M866-L879 HydrophobicContact CB-CG 4.44Å; M866-L879 HydrophobicContact SD-CB 4.24Å; M866-L879 HydrophobicContact SD-CD1 4.49Å
880	D	84.8	Confident	71.2	Confident	30 Å²	30	51.4 Å²	51.4	16%	0.16	34%	0.342	C	S	.	.			trans	-101.5	104.5	-177.9	-171.3	-18.5	0	0	0	112.1	P867 Y869 T882 A883	P867-D880 HydrophobicContact CG-CB 4.3Å; P867-D880 PolarHBondContact O-N 3.49Å; Y869-D880 HydrophobicContact CD2-CB 4.08Å; D880-T882 PolarHBondContact OD1-N 3.39Å; D880-T882 PolarHBondContact OD1-OG1 2.94Å; D880-A883 HydrophobicContact CB-CB 4.36Å; D880-A883 PolarHBondContact OD1-N 3.31Å; D880-A883 VanDerWaalsContact OD1-N 3.08Å
881	Y	81.8	Confident	69.6	Low	3 Å²	3	49.9 Å²	49.9	1%	0.012	34%	0.338	C	S	.	.	H	α-helix	trans	-81.5	-15.8	178.9	62.9	-100	0	0	0	113.8	F835 R836 A839 K842 I845 S885	F835-Y881 HydrophobicContact CB-CD2 3.35Å; F835-Y881 HydrophobicContact CB-CE2 3.98Å; F835-Y881 HydrophobicContact CB-CG 3.67Å; F835-Y881 HydrophobicContact CG-CD2 4.27Å; F835-Y881 HydrophobicContact CG-CG 4.3Å; R836-Y881 HydrophobicContact CB-CE2 4.27Å; A839-Y881 HydrophobicContact CB-CD1 4.44Å; A839-Y881 HydrophobicContact CB-CE1 3.74Å; K842-Y881 WeakPolarHBondContact O-CE1 3.32Å; K842-Y881 PolarHBondContact O-OH 3.1Å; I845-Y881 HydrophobicContact CB-CD1 4.18Å; I845-Y881 HydrophobicContact CG2-CD1 4.26Å; Y881-S885 WeakPolarHBondContact O-CB 3.32Å; Y881-S885 PolarHBondContact O-N 3.05Å; Y881-S885 PolarHBondContact O-OG 3.44Å
882	T	79.4	Confident	67.9	Low	51 Å²	51	53.7 Å²	53.7	31%	0.313	36%	0.362	S	S	.	.	H	α-helix	trans	-76.9	-48.8	179.2	60.2	0	0	0	0	110.4	D880 F884 S885 T886	D880-T882 PolarHBondContact OD1-N 3.39Å; D880-T882 PolarHBondContact OD1-OG1 2.94Å; T882-F884 PolarHBondContact O-N 3.4Å; T882-S885 PolarHBondContact O-N 2.95Å; T882-T886 PolarHBondContact O-N 2.81Å; T882-T886 PolarHBondContact O-OG1 3.27Å
883	A	76.9	Confident	66.4	Low	42 Å²	42	54.2 Å²	54.2	35%	0.347	36%	0.357	S	S	.	.	H	α-helix	trans	-57.4	-37.6	172.1	0	0	0	0	0	111.7	P867 D880 A887	P867-A883 HydrophobicContact CG-CB 3.93Å; D880-A883 HydrophobicContact CB-CB 4.36Å; D880-A883 PolarHBondContact OD1-N 3.31Å; D880-A883 VanDerWaalsContact OD1-N 3.08Å; A883-A887 VanDerWaalsContact O-CB 3.23Å; A883-A887 WeakPolarHBondContact O-CB 3.11Å; A883-A887 PolarHBondContact O-N 3.34Å
884	F	78.5	Confident	64.9	Low	14 Å²	14	61.3 Å²	61.3	6%	0.061	38%	0.375	C	S	.	.	H	α-helix	trans	-66.9	-44.5	176.7	178.1	-101.8	0	0	0	113.5	L273 F835 Y861 R865 M866 T882 A887 L888	L273-F884 HydrophobicContact CD2-CE1 3.65Å; L273-F884 HydrophobicContact CD2-CZ 3.44Å; L273-F884 VanDerWaalsContact CD2-CZ 3.44Å; F835-F884 HydrophobicContact CE2-CD1 4.14Å; F835-F884 HydrophobicContact CE2-CE1 4.18Å; F835-F884 HydrophobicContact CZ-CD1 4.12Å; F835-F884 AromaticContact CZ-CE1 3.97Å; F835-F884 HydrophobicContact CZ-CE1 3.97Å; Y861-F884 HydrophobicContact CE1-CZ 4.31Å; R865-F884 HydrophobicContact CB-CD2 4.32Å; R865-F884 HydrophobicContact CB-CE2 3.89Å; M866-F884 HydrophobicContact CE-CB 4.31Å; M866-F884 HydrophobicContact CE-CD1 3.61Å; M866-F884 HydrophobicContact CE-CE1 4.08Å; M866-F884 HydrophobicContact CE-CG 3.95Å; M866-F884 HydrophobicContact CG-CB 3.87Å; M866-F884 HydrophobicContact CG-CD1 4.42Å; M866-F884 HydrophobicContact CG-CD2 3.94Å; M866-F884 HydrophobicContact CG-CG 3.81Å; T882-F884 PolarHBondContact O-N 3.4Å; F884-A887 PolarHBondContact O-N 2.63Å; F884-L888 HydrophobicContact CE1-CD1 3.89Å; F884-L888 HydrophobicContact CE2-CD1 4.03Å; F884-L888 HydrophobicContact CZ-CD1 3.61Å; F884-L888 PolarHBondContact O-N 2.78Å; F884-L888 VanDerWaalsContact O-N 3.13Å
885	S	72	Confident	64.9	Low	2 Å²	2	62.6 Å²	62.6	1%	0.014	38%	0.378	C	S	.	.	H	α-helix	trans	-71.9	-37.3	-177.9	-56.6	0	0	0	0	112.4	F835 Y881 T882 L888 Y889	F835-S885 WeakPolarHBondContact CD2-OG 3.36Å; Y881-S885 WeakPolarHBondContact O-CB 3.32Å; Y881-S885 PolarHBondContact O-N 3.05Å; Y881-S885 PolarHBondContact O-OG 3.44Å; T882-S885 PolarHBondContact O-N 2.95Å; S885-L888 WeakPolarHBondContact O-CB 3.47Å; S885-L888 PolarHBondContact O-N 3.19Å; S885-Y889 PolarHBondContact O-N 3.39Å
886	T	71.4	Confident	64.6	Low	69 Å²	69	63.4 Å²	63.4	42%	0.423	38%	0.382	S	S	.	.	H	α-helix	trans	-68.7	-38.7	173.9	-54.1	0	0	0	0	111.5	T882 L888 Y889 G890	T882-T886 PolarHBondContact O-N 2.81Å; T882-T886 PolarHBondContact O-OG1 3.27Å; T886-L888 PolarHBondContact O-N 3.41Å; T886-Y889 PolarHBondContact O-N 2.8Å; T886-G890 CarbonylContact O-C 3.6Å; T886-G890 VanDerWaalsContact O-C 3.22Å; T886-G890 WeakPolarHBondContact O-CA 2.74Å; T886-G890 PolarHBondContact O-N 3.34Å; T886-G890 VanDerWaalsContact O-O 3.12Å
887	A	67.5	Low	64.4	Low	73 Å²	73	59.4 Å²	59.4	60%	0.603	35%	0.354	S	S	*	.	H	α-helix	trans	-62.6	-27.8	172.1	0	0	0	0	0	112.7	A883 F884	A883-A887 VanDerWaalsContact O-CB 3.23Å; A883-A887 WeakPolarHBondContact O-CB 3.11Å; A883-A887 PolarHBondContact O-N 3.34Å; F884-A887 PolarHBondContact O-N 2.63Å
888	L	63.7	Low	64	Low	12 Å²	12	60.2 Å²	60.2	6%	0.063	35%	0.348	C	S	.	.	H	α-helix	trans	-74.8	-35.1	-178.3	-133.6	102.1	0	0	0	113.7	V272 R357 F884 S885 T886	V272-L888 HydrophobicContact CG1-CD2 3.2Å; R357-L888 WeakPolarHBondContact CD-O 3.36Å; R357-L888 WeakPolarHBondContact CG-O 3.49Å; R357-L888 PolarHBondContact NE-O 3.49Å; R357-L888 VanDerWaalsContact NH2-CD2 3.31Å; F884-L888 HydrophobicContact CE1-CD1 3.89Å; F884-L888 HydrophobicContact CE2-CD1 4.03Å; F884-L888 HydrophobicContact CZ-CD1 3.61Å; F884-L888 PolarHBondContact O-N 2.78Å; F884-L888 VanDerWaalsContact O-N 3.13Å; S885-L888 WeakPolarHBondContact O-CB 3.47Å; S885-L888 PolarHBondContact O-N 3.19Å; T886-L888 PolarHBondContact O-N 3.41Å
889	Y	62.1	Low	62.9	Low	49 Å²	49	63.6 Å²	63.6	19%	0.192	37%	0.367	C	S	.	.	H	α-helix	trans	-105.8	8	-180	-71.4	-83.7	0	0	0	113	V272 S355 N356 A828 V831 S885 T886	V272-Y889 HydrophobicContact CG1-CE2 4.35Å; S355-Y889 VanDerWaalsContact O-CD1 3.26Å; S355-Y889 WeakPolarHBondContact O-CD1 3.49Å; S355-Y889 VanDerWaalsContact O-CE1 3.24Å; S355-Y889 WeakPolarHBondContact O-CE1 3.32Å; N356-Y889 HydrophobicContact CB-CD1 4.21Å; N356-Y889 CarbonylContact O-C 3.41Å; N356-Y889 VanDerWaalsContact O-C 3.23Å; N356-Y889 VanDerWaalsContact O-CA 3.22Å; N356-Y889 WeakPolarHBondContact O-CA 3.16Å; A828-Y889 HydrophobicContact CB-CD1 3.72Å; A828-Y889 HydrophobicContact CB-CE1 3.62Å; A828-Y889 HydrophobicContact CB-CG 4.33Å; V831-Y889 HydrophobicContact CB-CE2 4.08Å; V831-Y889 HydrophobicContact CG1-CE2 4.37Å; V831-Y889 HydrophobicContact CG2-CE2 3.89Å; V831-Y889 WeakPolarHBondContact CG2-OH 3.24Å; S885-Y889 PolarHBondContact O-N 3.39Å; T886-Y889 PolarHBondContact O-N 2.8Å
890	G	50.1	Low	61.5	Low	11 Å²	11	66.7 Å²	66.7	11%	0.113	39%	0.385	C	S	.	.			trans	73.6	157	-173.9	0	0	0	0	0	112.1	T886 S892	T886-G890 CarbonylContact O-C 3.6Å; T886-G890 VanDerWaalsContact O-C 3.22Å; T886-G890 WeakPolarHBondContact O-CA 2.74Å; T886-G890 PolarHBondContact O-N 3.34Å; T886-G890 VanDerWaalsContact O-O 3.12Å; G890-S892 VanDerWaalsContact C-N 3.34Å; G890-S892 PolarHBondContact O-N 2.98Å
891	E	38.8	Very low	59.8	Low	168 Å²	168	69.4 Å²	69.4	79%	0.785	40%	0.401	S	S	*	.			trans	-53	106.2	164.8	-77.2	-179.9	158.6	0	0	107.4	D893	E891-D893 PolarHBondContact O-N 3.25Å
892	S	35.5	Very low	58.1	Low	100 Å²	100	74.5 Å²	74.5	70%	0.699	43%	0.431	S	S	*	.			trans	-67.8	83.6	159	-56.5	0	0	0	0	105.1	G890 L894	G890-S892 VanDerWaalsContact C-N 3.34Å; G890-S892 PolarHBondContact O-N 2.98Å; S892-L894 PolarHBondContact O-N 3.37Å
893	D	27.8	Very low	56.3	Low	147 Å²	147	76.4 Å²	76.4	79%	0.786	44%	0.441	S	S	*	.			trans	-61.4	91.4	151.5	-87.4	-17.2	0	0	0	105.4	E891	E891-D893 PolarHBondContact O-N 3.25Å
894	L	31.6	Very low	54.5	Low	230 Å²	230	79.5 Å²	79.5	100%	1.204	45%	0.45	S	S	*	.			trans	-51.7	0	158.4	-109.9	158.4	0	0	0	110.3	S892	S892-L894 PolarHBondContact O-N 3.37Å

Retrieved 894 of 894 residues in 2595.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).