A0A087Y3I3_POEFO Loading...

N-acetylneuraminate (7)9-O-acetyltransferase

AlphaFold DB , UniProt , Accession A0A087Y3I3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 829 aa.

						>A0A087Y3I3_POEFO|A0A087Y3I3
METEEEAVPHESKRTGGAALPLLDYTAACCHGGAKMAVLAYSLGKREINQHFTIKNAKLISLAAVLLLLLFHTALRHYGGGDSCEWLLSKGRYLGENVWQPYGCMMHKYKSNDAITCLSEKRVVFAGDSRIRQLFYSFVKIIKPEMTEDGNKHEDIFFQDQKSSLNVDFLWYPEANNSMKDRVMSWTHEAAAKPDVVILGAATWSIKLHSGSSETLQQYRANLTAIAVHLDKLAEHAEIYWVLQDPVYEDTLSENRKMITNQQLDLYNQAATEVLNSSKYSGRSRVKLLAAARQAALETIVNSDDGLHLPEGTRNVGAMVLMNSLCNKLLRPIDGSCCQTISPPNLIQKLSACFFLGAVVVFVVLHALGCNRHRWHATPDVESLEEKKPTTAAAPLGPKAPFQALCRMGVIMLYFYLCDRADVFMKEQKFYTHSAFFIPLIYILVLGVFYSENTKEAKLLNREQTDEWKGWMQLVILIYHVSGASAFVPVYMHVRVLVAAYLFQTGYGHFSFFWLKGDFGLYRVCQVLFRLNFLVVVLCIVMDRPYQFYYFVPLVTFWFVLIYATMAIWPQILQKKTNSSGIWYFGILAKLLGLLLIICFFAFSKSLFMSVFSVWPVSKLFELNGSVHEWWFRWQLDRFAVIHGMVFAFIYLVLQKRQVLSEGKGEALFPAKISNLLLFSSVVSFITYSIWASSCKTKTECNEMHPYISVVQILAFILIRNIPGYARSVYSSFFSWFGKISLELFICQYHIWLAADTKGILVLIPGNPSLNILVSTFIFVCVAHEVSVITNDLAQVVIPKDNMALLKRLGAMGFVSLLVLMSQLLTPGT
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.5	Very low	31	Very low	217 Å²	217	151.7 Å²	151.7	100%	1.069	79%	0.79	S	S	*	*				0	156.4	0	-154.6	154	154.4	0	0	106
2	E	32.1	Very low	30.5	Very low	150 Å²	150	147.8 Å²	147.8	70%	0.701	79%	0.785	S	S	*	*			trans	-1.9	137.3	160.2	-73.7	150.8	146.8	0	0	117.6
3	T	32	Very low	30.2	Very low	119 Å²	119	149.8 Å²	149.8	73%	0.73	78%	0.783	S	S	*	*			trans	8.8	126.4	142.8	44.7	0	0	0	0	115.7
4	E	28.2	Very low	30	Very low	179 Å²	179	154.9 Å²	154.9	84%	0.836	79%	0.786	S	S	*	*				170.7	144.1	122.8	-96.1	165.1	165.3	0	0	111.3
5	E	35.4	Very low	29.7	Very low	166 Å²	166	153.4 Å²	153.4	78%	0.776	79%	0.788	S	S	*	*			trans	18.1	151.8	138.2	-105.5	175.6	157.4	0	0	124
6	E	26.9	Very low	29.4	Very low	168 Å²	168	149.1 Å²	149.1	79%	0.785	79%	0.794	S	S	*	*			trans	75.7	101	149.7	-72.7	-167.1	146.5	0	0	121.1
7	A	31	Very low	29.1	Very low	85 Å²	85	144.9 Å²	144.9	70%	0.702	79%	0.794	S	S	*	*				62.3	144	109.7	0	0	0	0	0	122.5
8	V	25.2	Very low	28.9	Very low	136 Å²	136	142.8 Å²	142.8	82%	0.824	80%	0.799	S	S	*	*			trans	88.1	143.7	157.5	-167.1	0	0	0	0	115.3
9	P	46.3	Very low	28.7	Very low	97 Å²	97	140.8 Å²	140.8	63%	0.63	80%	0.803	S	S	*	*			cis	-146.6	-173.1	-44.9	44.5	-26	0	0	0	115.7
10	H	28.2	Very low	28.7	Very low	179 Å²	179	142.2 Å²	142.2	83%	0.829	81%	0.807	S	S	*	*			trans	64.7	149.1	150.6	-79.5	-68.9	0	0	0	120.2
11	E	25.9	Very low	29	Very low	173 Å²	173	141 Å²	141	81%	0.808	81%	0.805	S	S	*	*			cis	-170.1	154.8	39.2	-149.2	-179.1	172.8	0	0	114.4
12	S	24.8	Very low	29.2	Very low	104 Å²	104	138.7 Å²	138.7	73%	0.727	80%	0.796	S	S	*	*			trans	67.3	148.8	142.9	138.1	0	0	0	0	121.6
13	K	26.3	Very low	29.1	Very low	175 Å²	175	138.7 Å²	138.7	76%	0.761	80%	0.8	S	S	*	*			cis	-179.9	139.6	-19.1	-133.6	176.3	-172.8	168.8	0	106.7
14	R	27	Very low	29.1	Very low	220 Å²	220	139.8 Å²	139.8	83%	0.83	80%	0.801	S	S	*	*			trans	47	147.2	149.4	-72.4	-172.2	174.6	173.5	-2.4	120.4
15	T	26	Very low	29.1	Very low	133 Å²	133	142.2 Å²	142.2	82%	0.816	80%	0.804	S	S	*	*			cis	-175.4	148.9	8.1	18.2	0	0	0	0	108.3
16	G	24.5	Very low	28.8	Very low	85 Å²	85	139.3 Å²	139.3	88%	0.876	80%	0.798	S	S	*	*			trans	117.6	116.6	143.6	0	0	0	0	0	118.8
17	G	23.7	Very low	29.1	Very low	78 Å²	78	135 Å²	135	80%	0.804	79%	0.79	S	S	*	*			trans	108.9	86.6	141.7	0	0	0	0	0	120.1
18	A	26.1	Very low	29.1	Very low	106 Å²	106	135.1 Å²	135.1	88%	0.876	79%	0.792	S	S	*	*			trans	63	128.7	138.5	0	0	0	0	0	123.9
19	A	25.3	Very low	29.5	Very low	105 Å²	105	133.9 Å²	133.9	87%	0.868	79%	0.788	S	S	*	*			trans	83.6	104.8	148.1	0	0	0	0	0	120.2
20	L	28.8	Very low	29	Very low	169 Å²	169	134 Å²	134	89%	0.885	79%	0.79	S	S	*	*			trans	-101.1	146	160.3	-110.9	144.2	0	0	0	109
21	P	35	Very low	29.6	Very low	118 Å²	118	132.3 Å²	132.3	77%	0.766	78%	0.782	S	S	*	*			trans	-116.7	131	147.6	18.2	0.1	0	0	0	112.4
22	L	34.8	Very low	30.2	Very low	167 Å²	167	126 Å²	126	87%	0.874	76%	0.763	S	S	*	*			trans	-50	133.1	160.7	-111.3	83.4	0	0	0	112.1
23	L	29.9	Very low	30.8	Very low	150 Å²	150	123.2 Å²	123.2	79%	0.785	75%	0.752	S	S	*	*			trans	-171.3	99.5	150	-111.8	143.3	0	0	0	110.4
24	D	32.3	Very low	31.5	Very low	142 Å²	142	117.6 Å²	117.6	76%	0.759	74%	0.738	S	S	*	*			trans	-174.5	77.1	146	-110.8	-16.1	0	0	0	113
25	Y	27.6	Very low	32.1	Very low	231 Å²	231	114.5 Å²	114.5	91%	0.906	73%	0.73	S	S	*	*	S	Bend	trans	-144.8	2.7	164.7	-113.1	-84.1	0	0	0	114.7
26	T	29.3	Very low	32.8	Very low	105 Å²	105	114.3 Å²	114.3	64%	0.644	72%	0.722	S	S	*	*	S	Bend	trans	-103.7	-9.5	-173.2	45.3	0	0	0	0	115.2
27	A	32.3	Very low	33.8	Very low	76 Å²	76	113.2 Å²	113.2	63%	0.628	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-22.2	-174.9	0	0	0	0	0	114.9
28	A	31.7	Very low	35	Very low	89 Å²	89	114.2 Å²	114.2	74%	0.736	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-23.5	-175.1	0	0	0	0	0	114.4
29	C	33.7	Very low	35.6	Very low	109 Å²	109	113.7 Å²	113.7	74%	0.736	68%	0.676	S	S	*	*	H	α-helix	trans	-81.4	-25.1	-177.4	-78.7	0	0	0	0	114
30	C	36.5	Very low	36.5	Very low	101 Å²	101	111.6 Å²	111.6	68%	0.682	66%	0.659	S	S	*	*	H	α-helix	trans	-76.9	-22.6	-176.7	-67.8	0	0	0	0	113.9
31	H	39.4	Very low	37.4	Very low	143 Å²	143	110 Å²	110	66%	0.662	64%	0.643	S	S	*	*	H	α-helix	trans	-81.1	-26.8	-177.8	-117.2	-45.7	0	0	0	113.8
32	G	38.3	Very low	38	Very low	39 Å²	39	107.1 Å²	107.1	40%	0.402	63%	0.625	S	S	.	*	H	α-helix	trans	-74.2	-41.6	177	0	0	0	0	0	112.9	A34 K35 M36	G32-A34 PolarHBondContact O-N 2.9Å; G32-K35 PolarHBondContact O-N 3.44Å; G32-M36 WeakPolarHBondContact O-CB 3.39Å; G32-M36 VanDerWaalsContact O-CG 3.3Å; G32-M36 WeakPolarHBondContact O-CG 3.35Å; G32-M36 PolarHBondContact O-N 3.48Å
33	G	38.3	Very low	38.3	Very low	47 Å²	47	103.6 Å²	103.6	49%	0.485	61%	0.606	S	S	.	*	H	α-helix	trans	-62.8	-40.9	178.9	0	0	0	0	0	113.5	M36 A37	G33-M36 PolarHBondContact O-N 3.33Å; G33-A37 VanDerWaalsContact O-CB 3.28Å; G33-A37 WeakPolarHBondContact O-CB 3.3Å; G33-A37 PolarHBondContact O-N 3.16Å
34	A	41.2	Very low	39.1	Very low	57 Å²	57	97.6 Å²	97.6	47%	0.471	58%	0.581	S	S	.	*	H	α-helix	trans	-65.8	-39.8	176.8	0	0	0	0	0	112.5	G32 V38	G32-A34 PolarHBondContact O-N 2.9Å; A34-V38 WeakPolarHBondContact O-CB 3.47Å; A34-V38 WeakPolarHBondContact O-CG2 3.32Å; A34-V38 PolarHBondContact O-N 3.04Å
35	K	40.4	Very low	39.7	Very low	154 Å²	154	95.5 Å²	95.5	67%	0.67	57%	0.565	S	S	*	*	H	α-helix	trans	-68.3	-40.7	175.5	-77.6	-175.8	177.4	179	0	112.1	G32 V38 L39	G32-K35 PolarHBondContact O-N 3.44Å; K35-V38 PolarHBondContact O-N 2.96Å; K35-L39 WeakPolarHBondContact O-CB 3.45Å; K35-L39 PolarHBondContact O-N 3.42Å
36	M	40.5	Very low	40.6	Very low	130 Å²	130	93.1 Å²	93.1	64%	0.64	56%	0.555	S	S	*	*	H	α-helix	trans	-68.7	-36.8	177.1	-69.8	-64.8	-75.9	0	0	112.2	G32 G33 L39 A40	G32-M36 WeakPolarHBondContact O-CB 3.39Å; G32-M36 VanDerWaalsContact O-CG 3.3Å; G32-M36 WeakPolarHBondContact O-CG 3.35Å; G32-M36 PolarHBondContact O-N 3.48Å; G33-M36 PolarHBondContact O-N 3.33Å; M36-L39 PolarHBondContact O-N 2.95Å; M36-A40 VanDerWaalsContact O-CB 3.25Å; M36-A40 WeakPolarHBondContact O-CB 3.43Å; M36-A40 PolarHBondContact O-N 3.05Å
37	A	44.9	Very low	41.3	Very low	61 Å²	61	94.3 Å²	94.3	50%	0.504	55%	0.553	S	S	.	*	H	α-helix	trans	-66.9	-40.9	173.6	0	0	0	0	0	112.2	G33 Y41	G33-A37 VanDerWaalsContact O-CB 3.28Å; G33-A37 WeakPolarHBondContact O-CB 3.3Å; G33-A37 PolarHBondContact O-N 3.16Å; A37-Y41 WeakPolarHBondContact O-CB 3.4Å; A37-Y41 PolarHBondContact O-N 3.45Å
38	V	48.3	Very low	42.1	Very low	99 Å²	99	95.9 Å²	95.9	60%	0.6	55%	0.549	S	S	*	.	H	α-helix	trans	-65.2	-39.6	173.6	170	0	0	0	0	111.1	A34 K35 S42	A34-V38 WeakPolarHBondContact O-CB 3.47Å; A34-V38 WeakPolarHBondContact O-CG2 3.32Å; A34-V38 PolarHBondContact O-N 3.04Å; K35-V38 PolarHBondContact O-N 2.96Å; V38-S42 VanDerWaalsContact O-CB 3.31Å; V38-S42 WeakPolarHBondContact O-CB 3.42Å; V38-S42 PolarHBondContact O-N 2.83Å; V38-S42 PolarHBondContact O-OG 2.84Å
39	L	39	Very low	43	Very low	95 Å²	95	94.7 Å²	94.7	50%	0.497	53%	0.531	S	S	.	.	H	α-helix	trans	-67.4	-46.6	176.9	-162.2	80.8	0	0	0	111.4	K35 M36 Y41 S42 L43	K35-L39 WeakPolarHBondContact O-CB 3.45Å; K35-L39 PolarHBondContact O-N 3.42Å; M36-L39 PolarHBondContact O-N 2.95Å; L39-Y41 PolarHBondContact O-N 3.14Å; L39-S42 WeakPolarHBondContact CA-OG 3.47Å; L39-S42 PolarHBondContact O-N 2.85Å; L39-S42 VanDerWaalsContact O-N 3.16Å; L39-S42 PolarHBondContact O-OG 3.42Å; L39-L43 HydrophobicContact CD2-CD1 4.32Å; L39-L43 HydrophobicContact CG-CD1 4.07Å; L39-L43 WeakPolarHBondContact O-CB 3.31Å; L39-L43 WeakPolarHBondContact O-CG 3.25Å; L39-L43 PolarHBondContact O-N 3.16Å
40	A	45.3	Very low	43.6	Very low	62 Å²	62	95.8 Å²	95.8	51%	0.512	53%	0.525	S	S	.	.	H	α-helix	trans	-63.1	-39.6	175.7	0	0	0	0	0	112.1	M36 L43 G44	M36-A40 VanDerWaalsContact O-CB 3.25Å; M36-A40 WeakPolarHBondContact O-CB 3.43Å; M36-A40 PolarHBondContact O-N 3.05Å; A40-L43 PolarHBondContact O-N 2.86Å; A40-G44 PolarHBondContact O-N 2.72Å
41	Y	47.8	Very low	44	Very low	136 Å²	136	98 Å²	98	53%	0.533	53%	0.525	S	S	.	.	H	α-helix	trans	-62.5	-42.6	171.2	177.4	-105.2	0	0	0	111.7	A37 L39 K45	A37-Y41 WeakPolarHBondContact O-CB 3.4Å; A37-Y41 PolarHBondContact O-N 3.45Å; L39-Y41 PolarHBondContact O-N 3.14Å; Y41-K45 WeakPolarHBondContact O-CB 3.46Å; Y41-K45 PolarHBondContact O-N 3.4Å
42	S	46.6	Very low	44.8	Very low	56 Å²	56	96.6 Å²	96.6	39%	0.392	52%	0.517	S	S	.	.	H	α-helix	trans	-69	-36.1	178.6	76.1	0	0	0	0	113.2	V38 L39 R46	V38-S42 VanDerWaalsContact O-CB 3.31Å; V38-S42 WeakPolarHBondContact O-CB 3.42Å; V38-S42 PolarHBondContact O-N 2.83Å; V38-S42 PolarHBondContact O-OG 2.84Å; L39-S42 WeakPolarHBondContact CA-OG 3.47Å; L39-S42 PolarHBondContact O-N 2.85Å; L39-S42 VanDerWaalsContact O-N 3.16Å; L39-S42 PolarHBondContact O-OG 3.42Å; S42-R46 WeakPolarHBondContact O-CB 3.28Å; S42-R46 PolarHBondContact O-N 3.47Å; S42-R46 VanDerWaalsContact O-N 3.14Å
43	L	40.4	Very low	46.8	Very low	93 Å²	93	97 Å²	97	49%	0.487	51%	0.512	S	S	.	.	H	α-helix	trans	-72.1	-47	176.3	-76.5	162.7	0	0	0	110.9	L39 A40 K45 R46 E47	L39-L43 HydrophobicContact CD2-CD1 4.32Å; L39-L43 HydrophobicContact CG-CD1 4.07Å; L39-L43 WeakPolarHBondContact O-CB 3.31Å; L39-L43 WeakPolarHBondContact O-CG 3.25Å; L39-L43 PolarHBondContact O-N 3.16Å; A40-L43 PolarHBondContact O-N 2.86Å; L43-K45 PolarHBondContact O-N 3.49Å; L43-R46 WeakPolarHBondContact O-CB 3.19Å; L43-R46 PolarHBondContact O-N 2.84Å; L43-E47 PolarHBondContact O-N 3.02Å
44	G	46.7	Very low	48.8	Very low	25 Å²	25	98.2 Å²	98.2	26%	0.258	51%	0.507	S	S	.	.	H	α-helix	trans	-61.3	-40.7	174.2	0	0	0	0	0	112.7	A40 R46 E47 I48	A40-G44 PolarHBondContact O-N 2.72Å; G44-R46 VanDerWaalsContact C-N 3.26Å; G44-R46 PolarHBondContact O-N 2.82Å; G44-E47 PolarHBondContact O-N 2.87Å; G44-I48 WeakPolarHBondContact O-CB 3.28Å; G44-I48 WeakPolarHBondContact O-CD1 3.22Å; G44-I48 WeakPolarHBondContact O-CG1 3.32Å; G44-I48 PolarHBondContact O-N 3.3Å
45	K	46.4	Very low	50.8	Low	97 Å²	97	100.4 Å²	100.4	42%	0.422	51%	0.506	S	S	.	.	H	α-helix	trans	-60.2	-35.8	172.2	-174.6	174.4	-177.3	174.4	0	112	Y41 L43 N49	Y41-K45 WeakPolarHBondContact O-CB 3.46Å; Y41-K45 PolarHBondContact O-N 3.4Å; L43-K45 PolarHBondContact O-N 3.49Å; K45-N49 WeakPolarHBondContact O-CB 3.14Å; K45-N49 PolarHBondContact O-N 3.19Å; K45-N49 PolarHBondContact O-OD1 3.02Å
46	R	46.2	Very low	53.1	Low	182 Å²	182	96.4 Å²	96.4	69%	0.687	49%	0.491	S	S	*	.	H	α-helix	trans	-75.5	-39.8	-179.7	-156.7	174.2	-176.1	176.3	-0.5	112.3	S42 L43 G44 Q50	S42-R46 WeakPolarHBondContact O-CB 3.28Å; S42-R46 PolarHBondContact O-N 3.47Å; S42-R46 VanDerWaalsContact O-N 3.14Å; L43-R46 WeakPolarHBondContact O-CB 3.19Å; L43-R46 PolarHBondContact O-N 2.84Å; G44-R46 VanDerWaalsContact C-N 3.26Å; G44-R46 PolarHBondContact O-N 2.82Å; R46-Q50 WeakPolarHBondContact O-CB 3.47Å; R46-Q50 WeakPolarHBondContact O-CG 3.15Å; R46-Q50 PolarHBondContact O-N 3.39Å
47	E	42.8	Very low	55.4	Low	129 Å²	129	90.6 Å²	90.6	60%	0.603	46%	0.464	S	S	*	.	H	α-helix	trans	-70.9	-40	175.9	-74.7	-175.8	162.1	0	0	112.7	L43 G44 Q50 H51	L43-E47 PolarHBondContact O-N 3.02Å; G44-E47 PolarHBondContact O-N 2.87Å; E47-Q50 PolarHBondContact O-N 2.68Å; E47-H51 PolarHBondContact O-N 3.44Å; E47-H51 PolarHBondContact O-ND1 3.21Å
48	I	49.8	Very low	57.5	Low	109 Å²	109	89.9 Å²	89.9	56%	0.559	45%	0.45	S	S	*	.	H	α-helix	trans	-65.5	-44.8	174.3	-67.3	167.5	0	0	0	110.2	G44 Q50 H51 F52	G44-I48 WeakPolarHBondContact O-CB 3.28Å; G44-I48 WeakPolarHBondContact O-CD1 3.22Å; G44-I48 WeakPolarHBondContact O-CG1 3.32Å; G44-I48 PolarHBondContact O-N 3.3Å; I48-Q50 VanDerWaalsContact C-N 3.27Å; I48-Q50 PolarHBondContact O-N 3Å; I48-H51 PolarHBondContact O-N 3.28Å; I48-F52 HydrophobicContact CG2-CB 4.25Å; I48-F52 WeakPolarHBondContact O-CA 3.43Å; I48-F52 VanDerWaalsContact O-CB 3.28Å; I48-F52 WeakPolarHBondContact O-CB 3.19Å; I48-F52 PolarHBondContact O-N 3.35Å
49	N	51.1	Low	59.5	Low	64 Å²	64	90.7 Å²	90.7	34%	0.342	45%	0.45	S	S	.	.	H	α-helix	trans	-68.3	-24.6	177.2	-74.4	13.9	0	0	0	113.1	K45 E382	K45-N49 WeakPolarHBondContact O-CB 3.14Å; K45-N49 PolarHBondContact O-N 3.19Å; K45-N49 PolarHBondContact O-OD1 3.02Å; N49-E382 PolarHBondContact ND2-OE1 3.02Å
50	Q	45.2	Very low	62.1	Low	133 Å²	133	90.3 Å²	90.3	62%	0.621	45%	0.448	S	S	*	.	H	α-helix	trans	-67.4	-33.7	174.1	-88.7	177	-22.6	0	0	113.1	R46 E47 I48	R46-Q50 WeakPolarHBondContact O-CB 3.47Å; R46-Q50 WeakPolarHBondContact O-CG 3.15Å; R46-Q50 PolarHBondContact O-N 3.39Å; E47-Q50 PolarHBondContact O-N 2.68Å; I48-Q50 VanDerWaalsContact C-N 3.27Å; I48-Q50 PolarHBondContact O-N 3Å
51	H	45.2	Very low	64.3	Low	146 Å²	146	87.7 Å²	87.7	68%	0.676	43%	0.426	S	S	*	.	H	α-helix	trans	-105.3	-32.9	-176.9	-66.3	83.5	0	0	0	113.2	E47 I48 T53 N56	E47-H51 PolarHBondContact O-N 3.44Å; E47-H51 PolarHBondContact O-ND1 3.21Å; I48-H51 PolarHBondContact O-N 3.28Å; H51-T53 PolarHBondContact O-N 2.87Å; H51-N56 PolarHBondContact O-ND2 3.49Å
52	F	56.7	Low	66.5	Low	114 Å²	114	85 Å²	85	50%	0.5	42%	0.42	S	S	.	.			trans	-104.3	65.2	-175.3	-147.2	-92.5	0	0	0	111.4	I48 A57 F777	I48-F52 HydrophobicContact CG2-CB 4.25Å; I48-F52 WeakPolarHBondContact O-CA 3.43Å; I48-F52 VanDerWaalsContact O-CB 3.28Å; I48-F52 WeakPolarHBondContact O-CB 3.19Å; I48-F52 PolarHBondContact O-N 3.35Å; F52-A57 HydrophobicContact CE1-CB 4.05Å; F52-A57 HydrophobicContact CZ-CB 4.31Å; F52-F777 HydrophobicContact CZ-CE2 4.22Å
53	T	79.9	Confident	68.7	Low	49 Å²	49	84.5 Å²	84.5	30%	0.301	42%	0.42	S	S	.	.			trans	-74.7	150.9	170.3	68.5	0	0	0	0	110.5	H51 K55 N56 A57	H51-T53 PolarHBondContact O-N 2.87Å; T53-K55 PolarHBondContact O-N 3.35Å; T53-K55 VanDerWaalsContact O-N 3.09Å; T53-N56 PolarHBondContact O-N 3.28Å; T53-N56 VanDerWaalsContact OG1-CG 3.25Å; T53-N56 PolarHBondContact OG1-N 3.02Å; T53-N56 PolarHBondContact OG1-ND2 2.84Å; T53-A57 PolarHBondContact O-N 2.93Å
54	I	81.2	Confident	71.3	Confident	71 Å²	71	81.2 Å²	81.2	36%	0.364	41%	0.406	S	S	.	.	H	α-helix	trans	-54.2	-31.5	173.8	-65.5	172.5	0	0	0	111.3	K58	I54-K58 HydrophobicContact CG2-CD 4.24Å; I54-K58 VanDerWaalsContact O-CG 3.31Å; I54-K58 WeakPolarHBondContact O-CG 3.32Å; I54-K58 PolarHBondContact O-N 2.94Å; I54-K58 VanDerWaalsContact O-N 3.11Å
55	K	83.2	Confident	73.5	Confident	104 Å²	104	81 Å²	81	45%	0.452	40%	0.399	S	S	.	.	H	α-helix	trans	-65.7	-45.4	176.1	-68.9	175.3	-179.4	162.8	0	111.7	T53 K58 L59	T53-K55 PolarHBondContact O-N 3.35Å; T53-K55 VanDerWaalsContact O-N 3.09Å; K55-K58 PolarHBondContact O-N 3.36Å; K55-L59 PolarHBondContact O-N 3.05Å; K55-L59 VanDerWaalsContact O-N 3.08Å
56	N	87.1	Confident	75.7	Confident	69 Å²	69	80.8 Å²	80.8	37%	0.369	40%	0.403	S	S	.	.	H	α-helix	trans	-64.1	-42.9	176.4	-66.6	-12.9	0	0	0	111	H51 T53 K58 L59 I60	H51-N56 PolarHBondContact O-ND2 3.49Å; T53-N56 PolarHBondContact O-N 3.28Å; T53-N56 VanDerWaalsContact OG1-CG 3.25Å; T53-N56 PolarHBondContact OG1-N 3.02Å; T53-N56 PolarHBondContact OG1-ND2 2.84Å; N56-K58 VanDerWaalsContact C-N 3.31Å; N56-K58 PolarHBondContact O-N 2.78Å; N56-L59 WeakPolarHBondContact O-CB 3.32Å; N56-L59 PolarHBondContact O-N 3.03Å; N56-L59 VanDerWaalsContact O-N 3.11Å; N56-I60 VanDerWaalsContact O-CG1 3.28Å; N56-I60 WeakPolarHBondContact O-CG1 3.3Å; N56-I60 PolarHBondContact O-N 3.44Å
57	A	88.8	Confident	78	Confident	9 Å²	9	77.8 Å²	77.8	7%	0.074	40%	0.399	C	S	.	.	H	α-helix	trans	-57.6	-43.1	176.7	0	0	0	0	0	112.4	F52 T53 I60 S61 F777	F52-A57 HydrophobicContact CE1-CB 4.05Å; F52-A57 HydrophobicContact CZ-CB 4.31Å; T53-A57 PolarHBondContact O-N 2.93Å; A57-I60 PolarHBondContact O-N 3.16Å; A57-S61 WeakPolarHBondContact O-CB 3.48Å; A57-S61 PolarHBondContact O-N 2.83Å; A57-F777 HydrophobicContact CB-CE2 4.27Å; A57-F777 HydrophobicContact CB-CZ 4.06Å; A57-F777 WeakPolarHBondContact O-CZ 3.41Å
58	K	90.5	Very high	80.4	Confident	45 Å²	45	72.8 Å²	72.8	20%	0.196	38%	0.377	C	S	.	.	H	α-helix	trans	-64.6	-38.8	175.2	-70.9	169.7	-178.8	177.8	0	112.9	I54 K55 N56 S61 L62 C781 H784 E785	I54-K58 HydrophobicContact CG2-CD 4.24Å; I54-K58 VanDerWaalsContact O-CG 3.31Å; I54-K58 WeakPolarHBondContact O-CG 3.32Å; I54-K58 PolarHBondContact O-N 2.94Å; I54-K58 VanDerWaalsContact O-N 3.11Å; K55-K58 PolarHBondContact O-N 3.36Å; N56-K58 VanDerWaalsContact C-N 3.31Å; N56-K58 PolarHBondContact O-N 2.78Å; K58-S61 WeakPolarHBondContact O-CB 3.35Å; K58-S61 PolarHBondContact O-N 2.71Å; K58-L62 PolarHBondContact O-N 3.24Å; K58-C781 HydrophobicContact CG-CB 4.35Å; K58-H784 WeakPolarHBondContact CE-ND1 3.4Å; K58-H784 PolarHBondContact NZ-CE1 2.88Å; K58-H784 PolarHBondContact NZ-ND1 3.36Å; K58-H784 VanDerWaalsContact NZ-ND1 3.12Å; K58-E785 WeakPolarHBondContact CD-OE2 3Å; K58-E785 WeakPolarHBondContact CE-OE2 3.41Å; K58-E785 IonicContact NZ-OE2 2.77Å; K58-E785 PolarHBondContact NZ-OE2 3.3Å
59	L	89.8	Confident	82.4	Confident	116 Å²	116	69.7 Å²	69.7	61%	0.607	36%	0.361	S	S	*	.	H	α-helix	trans	-65.7	-42.7	176.3	-173.4	67.9	0	0	0	111.4	K55 N56 S61 L62 A63	K55-L59 PolarHBondContact O-N 3.05Å; K55-L59 VanDerWaalsContact O-N 3.08Å; N56-L59 WeakPolarHBondContact O-CB 3.32Å; N56-L59 PolarHBondContact O-N 3.03Å; N56-L59 VanDerWaalsContact O-N 3.11Å; L59-S61 VanDerWaalsContact C-N 3.32Å; L59-S61 PolarHBondContact O-N 3.27Å; L59-L62 PolarHBondContact O-N 3.23Å; L59-A63 WeakPolarHBondContact O-CB 3.48Å; L59-A63 PolarHBondContact O-N 3.09Å
60	I	92.6	Very high	84.3	Confident	88 Å²	88	72.3 Å²	72.3	45%	0.451	37%	0.374	S	S	.	.	H	α-helix	trans	-61.4	-43.7	174.4	-64	167.7	0	0	0	110.1	N56 A57 L62 A63 A64 F777	N56-I60 VanDerWaalsContact O-CG1 3.28Å; N56-I60 WeakPolarHBondContact O-CG1 3.3Å; N56-I60 PolarHBondContact O-N 3.44Å; A57-I60 PolarHBondContact O-N 3.16Å; I60-L62 VanDerWaalsContact C-N 3.34Å; I60-L62 PolarHBondContact O-N 2.98Å; I60-A63 PolarHBondContact O-N 2.89Å; I60-A64 WeakPolarHBondContact O-CB 3.42Å; I60-A64 PolarHBondContact O-N 3.03Å; I60-F777 HydrophobicContact CB-CE1 4.29Å; I60-F777 HydrophobicContact CB-CZ 4.4Å; I60-F777 HydrophobicContact CG2-CE1 3.94Å; I60-F777 HydrophobicContact CG2-CZ 4.3Å
61	S	93.2	Very high	86.5	Confident	6 Å²	6	71.4 Å²	71.4	4%	0.042	37%	0.368	C	S	.	.	H	α-helix	trans	-59.9	-42.5	175.5	175.9	0	0	0	0	112.1	A57 K58 L59 A64 V65 I778	A57-S61 WeakPolarHBondContact O-CB 3.48Å; A57-S61 PolarHBondContact O-N 2.83Å; K58-S61 WeakPolarHBondContact O-CB 3.35Å; K58-S61 PolarHBondContact O-N 2.71Å; L59-S61 VanDerWaalsContact C-N 3.32Å; L59-S61 PolarHBondContact O-N 3.27Å; S61-A64 PolarHBondContact O-N 3.48Å; S61-V65 WeakPolarHBondContact O-CG2 3.38Å; S61-V65 PolarHBondContact O-N 3.33Å; S61-I778 WeakPolarHBondContact OG-CA 3.47Å
62	L	93.1	Very high	88.5	Confident	79 Å²	79	64.8 Å²	64.8	41%	0.414	34%	0.338	S	S	.	.	H	α-helix	trans	-64.9	-45.5	177	-179.8	64.3	0	0	0	111.4	K58 L59 I60 A64 V65 L66 V410	K58-L62 PolarHBondContact O-N 3.24Å; L59-L62 PolarHBondContact O-N 3.23Å; I60-L62 VanDerWaalsContact C-N 3.34Å; I60-L62 PolarHBondContact O-N 2.98Å; L62-A64 VanDerWaalsContact C-N 3.33Å; L62-A64 PolarHBondContact O-N 3.41Å; L62-V65 PolarHBondContact O-N 2.82Å; L62-L66 HydrophobicContact CG-CD1 4.39Å; L62-L66 WeakPolarHBondContact O-CG 3.33Å; L62-L66 PolarHBondContact O-N 2.78Å; L62-V410 HydrophobicContact CD1-CG1 4.19Å
63	A	93.7	Very high	90	Very high	47 Å²	47	63 Å²	63	39%	0.388	34%	0.337	S	S	.	.	H	α-helix	trans	-60.7	-42.7	176.5	0	0	0	0	0	111.6	L59 I60 V65 L66 L67	L59-A63 WeakPolarHBondContact O-CB 3.48Å; L59-A63 PolarHBondContact O-N 3.09Å; I60-A63 PolarHBondContact O-N 2.89Å; A63-V65 PolarHBondContact O-N 3.34Å; A63-L66 PolarHBondContact O-N 3.38Å; A63-L67 WeakPolarHBondContact O-CB 3.4Å; A63-L67 VanDerWaalsContact O-CG 3.32Å; A63-L67 WeakPolarHBondContact O-CG 3.38Å; A63-L67 PolarHBondContact O-N 3.46Å
64	A	93.6	Very high	90.3	Very high	24 Å²	24	62.6 Å²	62.6	20%	0.198	34%	0.338	C	S	.	.	H	α-helix	trans	-60.4	-45.3	176	0	0	0	0	0	111.9	I60 S61 L62 L66 L67 L68 I778	I60-A64 WeakPolarHBondContact O-CB 3.42Å; I60-A64 PolarHBondContact O-N 3.03Å; S61-A64 PolarHBondContact O-N 3.48Å; L62-A64 VanDerWaalsContact C-N 3.33Å; L62-A64 PolarHBondContact O-N 3.41Å; A64-L66 PolarHBondContact O-N 2.89Å; A64-L67 PolarHBondContact O-N 3.49Å; A64-L68 WeakPolarHBondContact O-CB 3.43Å; A64-L68 WeakPolarHBondContact O-CG 3.45Å; A64-L68 PolarHBondContact O-N 2.73Å; A64-I778 HydrophobicContact CB-CD1 4.38Å
65	V	93.3	Very high	90.4	Very high	20 Å²	20	62.2 Å²	62.2	12%	0.121	34%	0.337	C	S	.	.	H	α-helix	trans	-60.4	-44	176.5	169.3	0	0	0	0	111.5	S61 L62 A63 L68 L69 Y414 I778	S61-V65 WeakPolarHBondContact O-CG2 3.38Å; S61-V65 PolarHBondContact O-N 3.33Å; L62-V65 PolarHBondContact O-N 2.82Å; A63-V65 PolarHBondContact O-N 3.34Å; V65-L68 PolarHBondContact O-N 3.36Å; V65-L69 VanDerWaalsContact O-CB 3.31Å; V65-L69 WeakPolarHBondContact O-CB 3.46Å; V65-L69 PolarHBondContact O-N 3.3Å; V65-Y414 HydrophobicContact CB-CE2 4.43Å; V65-Y414 HydrophobicContact CG1-CD2 3.47Å; V65-Y414 VanDerWaalsContact CG1-CD2 3.47Å; V65-Y414 HydrophobicContact CG1-CE2 3.68Å; V65-Y414 HydrophobicContact CG1-CG 4.28Å; V65-Y414 HydrophobicContact CG2-CD2 4.25Å; V65-Y414 HydrophobicContact CG2-CE2 3.84Å; V65-I778 HydrophobicContact CG2-CD1 3.95Å; V65-I778 HydrophobicContact CG2-CG1 4.32Å; V65-I778 HydrophobicContact CG2-CG2 3.8Å
66	L	93.2	Very high	90.2	Very high	93 Å²	93	61.4 Å²	61.4	49%	0.487	33%	0.331	S	S	.	.	H	α-helix	trans	-64.9	-42.8	178.4	-69	173.1	0	0	0	112	L62 A63 A64 L69 L70	L62-L66 HydrophobicContact CG-CD1 4.39Å; L62-L66 WeakPolarHBondContact O-CG 3.33Å; L62-L66 PolarHBondContact O-N 2.78Å; A63-L66 PolarHBondContact O-N 3.38Å; A64-L66 PolarHBondContact O-N 2.89Å; L66-L69 PolarHBondContact O-N 3.3Å; L66-L70 VanDerWaalsContact O-CG 3.3Å; L66-L70 WeakPolarHBondContact O-CG 3.27Å; L66-L70 PolarHBondContact O-N 2.85Å
67	L	94	Very high	89.9	Confident	118 Å²	118	65.3 Å²	65.3	62%	0.618	35%	0.346	S	S	*	.	H	α-helix	trans	-63	-44.3	176.2	-72.8	171.4	0	0	0	111.8	A63 A64 L70 F71	A63-L67 WeakPolarHBondContact O-CB 3.4Å; A63-L67 VanDerWaalsContact O-CG 3.32Å; A63-L67 WeakPolarHBondContact O-CG 3.38Å; A63-L67 PolarHBondContact O-N 3.46Å; A64-L67 PolarHBondContact O-N 3.49Å; L67-L70 PolarHBondContact O-N 3.31Å; L67-F71 WeakPolarHBondContact O-CB 3.23Å; L67-F71 PolarHBondContact O-N 3.44Å
68	L	93.1	Very high	89.4	Confident	24 Å²	24	74.3 Å²	74.3	13%	0.126	38%	0.38	C	S	.	.	H	α-helix	trans	-62.6	-44.2	176.2	-71.6	167.4	0	0	0	111.1	A64 V65 L70 F71 H72 F424 L763 I764 V774 I778	A64-L68 WeakPolarHBondContact O-CB 3.43Å; A64-L68 WeakPolarHBondContact O-CG 3.45Å; A64-L68 PolarHBondContact O-N 2.73Å; V65-L68 PolarHBondContact O-N 3.36Å; L68-L70 PolarHBondContact O-N 2.82Å; L68-F71 PolarHBondContact O-N 3.38Å; L68-H72 PolarHBondContact O-CD2 2.86Å; L68-H72 VanDerWaalsContact O-CD2 3.23Å; L68-H72 PolarHBondContact O-N 2.88Å; L68-F424 HydrophobicContact CB-CE1 4.14Å; L68-L763 HydrophobicContact CD1-CB 4.2Å; L68-L763 HydrophobicContact CD1-CD1 4.22Å; L68-I764 HydrophobicContact CD2-CG1 4.05Å; L68-V774 HydrophobicContact CD1-CG1 4.36Å; L68-I778 HydrophobicContact CD1-CD1 4.08Å
69	L	92.1	Very high	88.1	Confident	44 Å²	44	74.6 Å²	74.6	23%	0.23	40%	0.396	C	S	.	.	H	α-helix	trans	-58.6	-47.8	176.3	177.4	61.7	0	0	0	111.4	V65 L66 T73 L417 V423	V65-L69 VanDerWaalsContact O-CB 3.31Å; V65-L69 WeakPolarHBondContact O-CB 3.46Å; V65-L69 PolarHBondContact O-N 3.3Å; L66-L69 PolarHBondContact O-N 3.3Å; L69-T73 VanDerWaalsContact O-CB 3.26Å; L69-T73 WeakPolarHBondContact O-CB 3.42Å; L69-T73 PolarHBondContact O-N 3.4Å; L69-T73 PolarHBondContact O-OG1 3.24Å; L69-L417 HydrophobicContact CD1-CD1 4.21Å; L69-L417 HydrophobicContact CD2-CD1 4.18Å; L69-V423 HydrophobicContact CD1-CG1 3.61Å
70	L	91.3	Very high	86.6	Confident	119 Å²	119	70.6 Å²	70.6	62%	0.623	38%	0.382	S	S	*	.	H	α-helix	trans	-62.2	-45.1	177.2	-71.5	171.6	0	0	0	111.5	L66 L67 L68 T73 A74	L66-L70 VanDerWaalsContact O-CG 3.3Å; L66-L70 WeakPolarHBondContact O-CG 3.27Å; L66-L70 PolarHBondContact O-N 2.85Å; L67-L70 PolarHBondContact O-N 3.31Å; L68-L70 PolarHBondContact O-N 2.82Å; L70-T73 PolarHBondContact O-N 3.22Å; L70-A74 VanDerWaalsContact O-CB 3.3Å; L70-A74 WeakPolarHBondContact O-CB 3.33Å; L70-A74 PolarHBondContact O-N 2.98Å
71	F	90.5	Very high	85.2	Confident	114 Å²	114	66.6 Å²	66.6	50%	0.5	36%	0.363	S	S	.	.	H	α-helix	trans	-61.3	-49.4	179.3	177.5	-98.3	0	0	0	112.2	L67 L68 A74 L75	L67-F71 WeakPolarHBondContact O-CB 3.23Å; L67-F71 PolarHBondContact O-N 3.44Å; L68-F71 PolarHBondContact O-N 3.38Å; F71-A74 PolarHBondContact O-N 2.88Å; F71-L75 HydrophobicContact CE1-CD2 4.33Å; F71-L75 VanDerWaalsContact O-CB 3.31Å; F71-L75 WeakPolarHBondContact O-CB 3.42Å; F71-L75 PolarHBondContact O-N 2.99Å
72	H	88.6	Confident	84.5	Confident	7 Å²	7	70.4 Å²	70.4	3%	0.032	38%	0.383	C	S	.	.	H	α-helix	trans	-67.1	-37.7	179.1	-82.4	-84.2	0	0	0	112.4	L68 L75 R76 V423 F424 L763	L68-H72 PolarHBondContact O-CD2 2.86Å; L68-H72 VanDerWaalsContact O-CD2 3.23Å; L68-H72 PolarHBondContact O-N 2.88Å; H72-L75 PolarHBondContact O-N 2.96Å; H72-R76 WeakPolarHBondContact O-CB 3.46Å; H72-R76 PolarHBondContact O-N 3.39Å; H72-V423 HydrophobicContact CB-CG1 4.31Å; H72-F424 AromaticContact CD2-CD1 3.66Å; H72-F424 AromaticContact CD2-CE1 3.75Å; H72-F424 AromaticContact CG-CD1 3.97Å; H72-F424 AromaticContact NE2-CD1 3.96Å; H72-L763 PolarHBondContact NE2-O 3.46Å
73	T	86.6	Confident	84.1	Confident	77 Å²	77	66.9 Å²	66.9	47%	0.472	37%	0.365	S	S	.	.	H	α-helix	trans	-63.9	-43.8	175.1	-54.6	0	0	0	0	110.9	L69 L70 R76 H77	L69-T73 VanDerWaalsContact O-CB 3.26Å; L69-T73 WeakPolarHBondContact O-CB 3.42Å; L69-T73 PolarHBondContact O-N 3.4Å; L69-T73 PolarHBondContact O-OG1 3.24Å; L70-T73 PolarHBondContact O-N 3.22Å; T73-R76 PolarHBondContact O-N 2.97Å; T73-H77 WeakPolarHBondContact O-CB 3.32Å; T73-H77 PolarHBondContact O-N 3.37Å
74	A	87.1	Confident	83.9	Confident	41 Å²	41	65.5 Å²	65.5	34%	0.339	35%	0.352	S	S	.	.	H	α-helix	trans	-64.7	-45	175.1	0	0	0	0	0	111.7	L70 F71 R76 H77 Y78	L70-A74 VanDerWaalsContact O-CB 3.3Å; L70-A74 WeakPolarHBondContact O-CB 3.33Å; L70-A74 PolarHBondContact O-N 2.98Å; F71-A74 PolarHBondContact O-N 2.88Å; A74-R76 VanDerWaalsContact C-N 3.27Å; A74-R76 PolarHBondContact O-N 3.12Å; A74-H77 PolarHBondContact O-N 3.44Å; A74-H77 VanDerWaalsContact O-N 3.17Å; A74-Y78 HydrophobicContact CB-CD2 4.31Å; A74-Y78 HydrophobicContact CB-CE2 4.47Å; A74-Y78 VanDerWaalsContact O-CD2 3.23Å; A74-Y78 WeakPolarHBondContact O-CD2 3.08Å; A74-Y78 PolarHBondContact O-N 2.77Å
75	L	83.1	Confident	83.6	Confident	63 Å²	63	68.8 Å²	68.8	33%	0.33	36%	0.363	S	S	.	.	H	α-helix	trans	-58.2	-40.7	177.6	-176.7	66	0	0	0	111.5	F71 H72 G79 M425	F71-L75 HydrophobicContact CE1-CD2 4.33Å; F71-L75 VanDerWaalsContact O-CB 3.31Å; F71-L75 WeakPolarHBondContact O-CB 3.42Å; F71-L75 PolarHBondContact O-N 2.99Å; H72-L75 PolarHBondContact O-N 2.96Å; L75-G79 VanDerWaalsContact O-CA 3.22Å; L75-G79 WeakPolarHBondContact O-CA 3.47Å; L75-G79 PolarHBondContact O-N 3.37Å; L75-M425 HydrophobicContact CD2-CE 3.87Å
76	R	79	Confident	83.4	Confident	86 Å²	86	69.5 Å²	69.5	33%	0.325	36%	0.364	S	S	.	.	H	α-helix	trans	-72	-38.6	177.2	-166.3	171.8	-176.8	128.5	1.1	112.3	H72 T73 A74 G80 D422	H72-R76 WeakPolarHBondContact O-CB 3.46Å; H72-R76 PolarHBondContact O-N 3.39Å; T73-R76 PolarHBondContact O-N 2.97Å; A74-R76 VanDerWaalsContact C-N 3.27Å; A74-R76 PolarHBondContact O-N 3.12Å; R76-G80 PolarHBondContact O-N 3.35Å; R76-D422 IonicContact CZ-OD2 3.84Å; R76-D422 VanDerWaalsContact CZ-OD2 3.29Å; R76-D422 VanDerWaalsContact NH1-CG 3.26Å; R76-D422 PolarHBondContact NH1-O 3.33Å; R76-D422 IonicContact NH1-OD2 3.42Å; R76-D422 PolarHBondContact NH1-OD2 3.37Å; R76-D422 IonicContact NH2-OD2 3.11Å; R76-D422 PolarHBondContact NH2-OD2 3.45Å
77	H	80.3	Confident	83.4	Confident	151 Å²	151	65 Å²	65	70%	0.699	34%	0.34	S	S	*	.	H	α-helix	trans	-67.2	-44.7	178.6	-170.3	69.9	0	0	0	112.4	T73 A74	T73-H77 WeakPolarHBondContact O-CB 3.32Å; T73-H77 PolarHBondContact O-N 3.37Å; A74-H77 PolarHBondContact O-N 3.44Å; A74-H77 VanDerWaalsContact O-N 3.17Å
78	Y	78.9	Confident	83.4	Confident	199 Å²	199	59.9 Å²	59.9	78%	0.78	31%	0.313	S	S	*	.	H	α-helix	trans	-86.3	-30.6	-179.5	-69.5	-69.5	0	0	0	113.8	A74 G80	A74-Y78 HydrophobicContact CB-CD2 4.31Å; A74-Y78 HydrophobicContact CB-CE2 4.47Å; A74-Y78 VanDerWaalsContact O-CD2 3.23Å; A74-Y78 WeakPolarHBondContact O-CD2 3.08Å; A74-Y78 PolarHBondContact O-N 2.77Å; Y78-G80 VanDerWaalsContact C-N 3.32Å; Y78-G80 PolarHBondContact O-N 2.9Å
79	G	64.1	Low	83.3	Confident	51 Å²	51	60.5 Å²	60.5	53%	0.526	32%	0.32	S	S	.	.	H	α-helix	trans	-78.2	-12.5	-178.2	0	0	0	0	0	114.5	L75 G81	L75-G79 VanDerWaalsContact O-CA 3.22Å; L75-G79 WeakPolarHBondContact O-CA 3.47Å; L75-G79 PolarHBondContact O-N 3.37Å; G79-G81 PolarHBondContact O-N 3.11Å
80	G	56.3	Low	83.2	Confident	32 Å²	32	62 Å²	62	33%	0.33	32%	0.324	S	S	.	.			trans	70.2	-18	166	0	0	0	0	0	117.6	R76 Y78 R283	R76-G80 PolarHBondContact O-N 3.35Å; Y78-G80 VanDerWaalsContact C-N 3.32Å; Y78-G80 PolarHBondContact O-N 2.9Å; G80-R283 PolarHBondContact O-NH2 3.44Å
81	G	63.3	Low	83.2	Confident	4 Å²	4	57.2 Å²	57.2	4%	0.041	30%	0.304	C	S	.	.			trans	-93.2	142.2	-173.5	0	0	0	0	0	115.1	G79 E85	G79-G81 PolarHBondContact O-N 3.11Å; G81-E85 WeakPolarHBondContact CA-OE2 3.48Å
82	D	78.5	Confident	83.3	Confident	86 Å²	86	56.5 Å²	56.5	46%	0.46	30%	0.298	S	S	.	.			trans	-86.5	175	166.7	70	18	0	0	0	111.3	C84 E85 W86	D82-C84 PolarHBondContact O-N 3.08Å; D82-C84 VanDerWaalsContact O-N 3.07Å; D82-C84 VanDerWaalsContact OD1-CA 3.28Å; D82-C84 WeakPolarHBondContact OD1-CA 3.49Å; D82-C84 WeakPolarHBondContact OD1-CB 3.31Å; D82-C84 PolarHBondContact OD1-N 3.31Å; D82-E85 PolarHBondContact O-N 3.36Å; D82-E85 PolarHBondContact OD1-N 3.3Å; D82-W86 PolarHBondContact O-N 2.66Å; D82-W86 VanDerWaalsContact O-N 3.14Å
83	S	86.5	Confident	83.3	Confident	5 Å²	5	57.5 Å²	57.5	4%	0.035	30%	0.302	C	S	.	.	H	α-helix	trans	-62.7	-15.4	178.9	64.8	0	0	0	0	113.3	L87 C104 C338	S83-L87 WeakPolarHBondContact O-CB 3.47Å; S83-L87 PolarHBondContact O-N 3.5Å; S83-C104 PolarHBondContact O-SG 3.12Å; S83-C104 VanDerWaalsContact O-SG 3.4Å; S83-C338 PolarHBondContact OG-N 3.11Å
84	C	88.6	Confident	83.2	Confident	17 Å²	17	54.6 Å²	54.6	12%	0.115	28%	0.283	C	S	.	.	H	α-helix	trans	-84.6	-40.1	177.2	-147.7	0	0	0	0	112.3	D82 W86 L87 L88 C338	D82-C84 PolarHBondContact O-N 3.08Å; D82-C84 VanDerWaalsContact O-N 3.07Å; D82-C84 VanDerWaalsContact OD1-CA 3.28Å; D82-C84 WeakPolarHBondContact OD1-CA 3.49Å; D82-C84 WeakPolarHBondContact OD1-CB 3.31Å; D82-C84 PolarHBondContact OD1-N 3.31Å; C84-W86 VanDerWaalsContact C-N 3.3Å; C84-W86 PolarHBondContact O-N 2.89Å; C84-L87 WeakPolarHBondContact O-CB 3.45Å; C84-L87 PolarHBondContact O-N 3.21Å; C84-L88 WeakPolarHBondContact O-CG 3.34Å; C84-L88 PolarHBondContact O-N 2.95Å; C84-L88 VanDerWaalsContact O-N 3.13Å; C84-C338 WeakPolarHBondContact CA-SG 3.28Å; C84-C338 HydrophobicContact CB-CB 3.8Å; C84-C338 WeakPolarHBondContact CB-SG 3.21Å; C84-C338 WeakPolarHBondContact SG-CB 3.35Å; C84-C338 CovalentContact SG-SG 2.05Å; C84-C338 PolarHBondContact SG-SG 3.09Å
85	E	88	Confident	82.8	Confident	94 Å²	94	54.9 Å²	54.9	44%	0.439	29%	0.29	S	S	.	.	H	α-helix	trans	-61.3	-40.6	170.5	-168.5	178.3	154.2	0	0	111.1	G81 D82 L88 S89	G81-E85 WeakPolarHBondContact CA-OE2 3.48Å; D82-E85 PolarHBondContact O-N 3.36Å; D82-E85 PolarHBondContact OD1-N 3.3Å; E85-L88 PolarHBondContact O-N 3.43Å; E85-S89 WeakPolarHBondContact O-CB 3.47Å; E85-S89 PolarHBondContact O-N 2.93Å; E85-S89 PolarHBondContact O-OG 3.1Å
86	W	88.4	Confident	82.3	Confident	34 Å²	34	59.9 Å²	59.9	13%	0.129	31%	0.312	C	S	.	.	H	α-helix	trans	-65.2	-40.9	175.5	-60.6	-18.5	0	0	0	113	D82 C84 L88 S89 K90 Y102 M425	D82-W86 PolarHBondContact O-N 2.66Å; D82-W86 VanDerWaalsContact O-N 3.14Å; C84-W86 VanDerWaalsContact C-N 3.3Å; C84-W86 PolarHBondContact O-N 2.89Å; W86-L88 VanDerWaalsContact C-N 3.27Å; W86-L88 PolarHBondContact O-N 3.29Å; W86-S89 WeakPolarHBondContact CA-OG 3.48Å; W86-S89 PolarHBondContact O-N 3.39Å; W86-S89 PolarHBondContact O-OG 2.64Å; W86-K90 PolarHBondContact O-N 3.3Å; W86-Y102 VanDerWaalsContact CB-O 3.27Å; W86-Y102 WeakPolarHBondContact CB-O 3.49Å; W86-Y102 HydrophobicContact CD2-CD1 4.32Å; W86-Y102 HydrophobicContact CG-CD1 4.21Å; W86-M425 HydrophobicContact CH2-CE 4.15Å; W86-M425 HydrophobicContact CZ3-CE 4.42Å
87	L	93.5	Very high	82.1	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-56.3	-42.8	175.4	172.6	66.7	0	0	0	112	S83 C84 P101 M106 A291 V320 N323 C337 C338	S83-L87 WeakPolarHBondContact O-CB 3.47Å; S83-L87 PolarHBondContact O-N 3.5Å; C84-L87 WeakPolarHBondContact O-CB 3.45Å; C84-L87 PolarHBondContact O-N 3.21Å; L87-P101 HydrophobicContact CD1-CB 4.07Å; L87-P101 HydrophobicContact CD1-CG 3.58Å; L87-M106 HydrophobicContact CD1-CG 3.79Å; L87-M106 HydrophobicContact CD1-SD 3.81Å; L87-A291 WeakPolarHBondContact O-CB 3.48Å; L87-V320 HydrophobicContact CD1-CG1 4.25Å; L87-V320 HydrophobicContact CD1-CG2 4.19Å; L87-V320 HydrophobicContact CG-CG1 4.06Å; L87-N323 HydrophobicContact CD1-CB 4.49Å; L87-N323 HydrophobicContact CD2-CB 3.66Å; L87-C337 HydrophobicContact CB-CB 4.03Å; L87-C337 HydrophobicContact CD1-CB 4.2Å; L87-C337 HydrophobicContact CD2-CB 3.97Å; L87-C337 HydrophobicContact CG-CB 4.27Å; L87-C338 WeakPolarHBondContact CD2-SG 3.41Å
88	L	93.6	Very high	82.4	Confident	9 Å²	9	57.3 Å²	57.3	5%	0.047	31%	0.311	C	S	.	.	H	α-helix	trans	-84	-22.9	-175.3	-65.4	171.6	0	0	0	113.4	C84 E85 W86 Y240 K287 L289 A290 A291 V320	C84-L88 WeakPolarHBondContact O-CG 3.34Å; C84-L88 PolarHBondContact O-N 2.95Å; C84-L88 VanDerWaalsContact O-N 3.13Å; E85-L88 PolarHBondContact O-N 3.43Å; W86-L88 VanDerWaalsContact C-N 3.27Å; W86-L88 PolarHBondContact O-N 3.29Å; L88-Y240 HydrophobicContact CD1-CE1 4.14Å; L88-Y240 HydrophobicContact CD2-CD1 4.31Å; L88-Y240 HydrophobicContact CD2-CE1 4.02Å; L88-K287 HydrophobicContact CD1-CB 3.99Å; L88-K287 HydrophobicContact CD1-CD 4.05Å; L88-K287 HydrophobicContact CD1-CG 4.3Å; L88-L289 HydrophobicContact CD2-CD1 3.74Å; L88-A290 CarbonylContact O-C 3.58Å; L88-A290 WeakPolarHBondContact O-CA 3.36Å; L88-A290 PolarHBondContact O-N 3.34Å; L88-A291 WeakPolarHBondContact O-CB 3.28Å; L88-A291 PolarHBondContact O-N 2.99Å; L88-V320 HydrophobicContact CD2-CG1 3.83Å
89	S	90.8	Very high	83.1	Confident	38 Å²	38	48.1 Å²	48.1	27%	0.266	28%	0.275	S	S	.	.	H	α-helix	trans	-91.2	-50.8	-172.6	53.5	0	0	0	0	113.6	E85 W86 Q294	E85-S89 WeakPolarHBondContact O-CB 3.47Å; E85-S89 PolarHBondContact O-N 2.93Å; E85-S89 PolarHBondContact O-OG 3.1Å; W86-S89 WeakPolarHBondContact CA-OG 3.48Å; W86-S89 PolarHBondContact O-N 3.39Å; W86-S89 PolarHBondContact O-OG 2.64Å; S89-Q294 PolarHBondContact O-NE2 3.33Å
90	K	90.1	Very high	84.5	Confident	75 Å²	75	45.8 Å²	45.8	33%	0.326	25%	0.251	S	S	.	.			trans	-150.2	154.5	-168.6	54.1	167.8	174.4	173.6	0	116	W86 Y102 Q294	W86-K90 PolarHBondContact O-N 3.3Å; K90-Y102 HydrophobicContact CD-CD1 4.29Å; K90-Y102 HydrophobicContact CD-CD2 4.24Å; K90-Y102 HydrophobicContact CD-CG 3.89Å; K90-Y102 HydrophobicContact CG-CG 4.23Å; K90-Y102 VanDerWaalsContact NZ-CE1 3.32Å; K90-Y102 PolarHBondContact O-N 2.98Å; K90-Q294 VanDerWaalsContact CB-OE1 3.24Å
91	G	91.8	Very high	86.2	Confident	19 Å²	19	44.3 Å²	44.3	20%	0.196	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.5	-169.2	175.1	0	0	0	0	0	112.4	W99 Q100 Q294	G91-W99 VanDerWaalsContact C-CZ2 3.47Å; G91-W99 WeakPolarHBondContact O-CH2 3.45Å; G91-Q100 CarbonylContact C-O 3.5Å; G91-Q100 WeakPolarHBondContact CA-O 3.31Å; G91-Q294 PolarHBondContact O-OE1 3.46Å
92	R	91.8	Very high	87.5	Confident	99 Å²	99	47.4 Å²	47.4	37%	0.374	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	158.1	175.7	63.7	-175.9	176.6	112.8	-0.7	110.4	Q100 E427	R92-Q100 PolarHBondContact N-O 3.45Å; R92-Q100 PolarHBondContact O-N 3.43Å; R92-E427 IonicContact CZ-OE1 3.54Å; R92-E427 IonicContact NE-OE1 3.42Å; R92-E427 IonicContact NH2-OE1 2.66Å; R92-E427 PolarHBondContact NH2-OE1 2.94Å; R92-E427 IonicContact NH2-OE2 2.73Å; R92-E427 PolarHBondContact NH2-OE2 3.3Å
93	Y	90.1	Very high	87.8	Confident	27 Å²	27	43.6 Å²	43.6	11%	0.106	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	136.4	167.4	-77.1	-81.2	0	0	0	112.2	V98 W99 A295 E298 T299 V316	Y93-V98 CarbonylContact C-O 3.59Å; Y93-V98 WeakPolarHBondContact CA-O 3.34Å; Y93-W99 HydrophobicContact CD1-CE3 4.32Å; Y93-W99 AromaticContact CD2-CE3 3.81Å; Y93-W99 HydrophobicContact CD2-CE3 3.81Å; Y93-W99 AromaticContact CD2-CZ3 3.89Å; Y93-W99 HydrophobicContact CD2-CZ3 3.89Å; Y93-W99 HydrophobicContact CE1-CB 4.48Å; Y93-W99 HydrophobicContact CE1-CE3 4.33Å; Y93-W99 AromaticContact CE2-CE3 3.81Å; Y93-W99 HydrophobicContact CE2-CE3 3.81Å; Y93-W99 AromaticContact CE2-CZ3 3.96Å; Y93-W99 HydrophobicContact CE2-CZ3 3.96Å; Y93-W99 HydrophobicContact CG-CE3 4.09Å; Y93-A295 HydrophobicContact CE2-CB 3.98Å; Y93-A295 WeakPolarHBondContact CE2-O 3.26Å; Y93-E298 HydrophobicContact CD2-CB 4.11Å; Y93-E298 HydrophobicContact CD2-CG 4.47Å; Y93-E298 WeakPolarHBondContact CD2-OE2 3.46Å; Y93-E298 HydrophobicContact CE2-CB 4.26Å; Y93-T299 HydrophobicContact CE2-CG2 3.83Å; Y93-V316 HydrophobicContact CE1-CG2 4.25Å
94	L	84.5	Confident	88	Confident	16 Å²	16	43.4 Å²	43.4	8%	0.084	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	106.7	163.4	-59.5	179.3	0	0	0	107.5	V98 Q100 F430	L94-V98 HydrophobicContact CB-CB 4.31Å; L94-V98 PolarHBondContact N-O 3.44Å; L94-Q100 HydrophobicContact CD1-CB 3.63Å; L94-Q100 HydrophobicContact CD1-CG 3.96Å; L94-Q100 HydrophobicContact CD2-CB 4.2Å; L94-Q100 HydrophobicContact CD2-CG 4.49Å; L94-Q100 HydrophobicContact CG-CB 3.59Å; L94-Q100 HydrophobicContact CG-CG 4.24Å; L94-F430 HydrophobicContact CB-CB 3.95Å; L94-F430 HydrophobicContact CB-CD1 4.04Å; L94-F430 HydrophobicContact CB-CD2 4.07Å; L94-F430 HydrophobicContact CB-CG 3.75Å; L94-F430 HydrophobicContact CD1-CB 3.9Å; L94-F430 VanDerWaalsContact O-CE2 3.3Å; L94-F430 WeakPolarHBondContact O-CE2 3.21Å; L94-F430 WeakPolarHBondContact O-CZ 3.27Å
95	G	78.4	Confident	88.2	Confident	47 Å²	47	42.6 Å²	42.6	49%	0.485	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	65	-143.3	-169	0	0	0	0	0	111.4
96	E	71.2	Confident	88.4	Confident	169 Å²	169	39 Å²	39	79%	0.79	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-23.3	-171.8	-64.4	-179.5	171	0	0	114.5
97	N	76.2	Confident	88.7	Confident	135 Å²	135	38.4 Å²	38.4	72%	0.722	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-134.7	-2.5	-162.9	-68.7	-42.1	0	0	0	115.7
98	V	86.8	Confident	88.6	Confident	48 Å²	48	46.2 Å²	46.2	29%	0.291	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	110.6	-174.5	-178.5	0	0	0	0	110.1	Y93 L94 F430	Y93-V98 CarbonylContact C-O 3.59Å; Y93-V98 WeakPolarHBondContact CA-O 3.34Å; L94-V98 HydrophobicContact CB-CB 4.31Å; L94-V98 PolarHBondContact N-O 3.44Å; V98-F430 HydrophobicContact CB-CD2 4.28Å; V98-F430 HydrophobicContact CB-CE2 4.45Å; V98-F430 HydrophobicContact CG2-CD2 4.03Å; V98-F430 HydrophobicContact CG2-CE2 4Å
99	W	92.3	Very high	88.6	Confident	6 Å²	6	46.2 Å²	46.2	2%	0.023	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	130.2	173.2	-175.4	-110.1	0	0	0	111.2	G91 Y93 M106 A291 Q294 A295 V316 Q428	G91-W99 VanDerWaalsContact C-CZ2 3.47Å; G91-W99 WeakPolarHBondContact O-CH2 3.45Å; Y93-W99 HydrophobicContact CD1-CE3 4.32Å; Y93-W99 AromaticContact CD2-CE3 3.81Å; Y93-W99 HydrophobicContact CD2-CE3 3.81Å; Y93-W99 AromaticContact CD2-CZ3 3.89Å; Y93-W99 HydrophobicContact CD2-CZ3 3.89Å; Y93-W99 HydrophobicContact CE1-CB 4.48Å; Y93-W99 HydrophobicContact CE1-CE3 4.33Å; Y93-W99 AromaticContact CE2-CE3 3.81Å; Y93-W99 HydrophobicContact CE2-CE3 3.81Å; Y93-W99 AromaticContact CE2-CZ3 3.96Å; Y93-W99 HydrophobicContact CE2-CZ3 3.96Å; Y93-W99 HydrophobicContact CG-CE3 4.09Å; W99-M106 HydrophobicContact CB-CE 4.04Å; W99-M106 HydrophobicContact CG-CE 4.3Å; W99-M106 WeakPolarHBondContact O-CE 3.4Å; W99-A291 HydrophobicContact CZ2-CB 4.3Å; W99-Q294 HydrophobicContact CH2-CB 3.75Å; W99-Q294 HydrophobicContact CZ2-CB 4.21Å; W99-A295 HydrophobicContact CD2-CB 4.24Å; W99-A295 HydrophobicContact CE3-CB 3.84Å; W99-A295 HydrophobicContact CH2-CB 4.03Å; W99-A295 HydrophobicContact CZ2-CB 4.38Å; W99-A295 HydrophobicContact CZ3-CB 3.75Å; W99-V316 HydrophobicContact CB-CB 4.33Å; W99-V316 HydrophobicContact CB-CG1 3.61Å; W99-V316 HydrophobicContact CB-CG2 3.73Å; W99-V316 VanDerWaalsContact CD1-CG1 3.43Å; W99-V316 HydrophobicContact CD2-CG1 3.81Å; W99-V316 HydrophobicContact CG-CB 4.49Å; W99-V316 HydrophobicContact CG-CG1 3.33Å; W99-V316 HydrophobicContact CG-CG2 4.33Å; W99-Q428 PolarHBondContact O-NE2 3.29Å
100	Q	92.9	Very high	88.7	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.009	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	107.8	175.6	175.1	54.5	48.6	0	0	109.4	G91 R92 L94 C104 E427 Q428	G91-Q100 CarbonylContact C-O 3.5Å; G91-Q100 WeakPolarHBondContact CA-O 3.31Å; R92-Q100 PolarHBondContact N-O 3.45Å; R92-Q100 PolarHBondContact O-N 3.43Å; L94-Q100 HydrophobicContact CD1-CB 3.63Å; L94-Q100 HydrophobicContact CD1-CG 3.96Å; L94-Q100 HydrophobicContact CD2-CB 4.2Å; L94-Q100 HydrophobicContact CD2-CG 4.49Å; L94-Q100 HydrophobicContact CG-CB 3.59Å; L94-Q100 HydrophobicContact CG-CG 4.24Å; Q100-C104 PolarHBondContact NE2-O 3.45Å; Q100-E427 HydrophobicContact CG-CG 4.12Å; Q100-Q428 VanDerWaalsContact OE1-CG 3.24Å; Q100-Q428 VanDerWaalsContact OE1-NE2 3.11Å
101	P	92.9	Very high	88.8	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	158.4	172.1	-19	30.5	0	0	0	111.7	L87 G103 M106	L87-P101 HydrophobicContact CD1-CB 4.07Å; L87-P101 HydrophobicContact CD1-CG 3.58Å; P101-G103 PolarHBondContact O-N 3.47Å; P101-M106 HydrophobicContact CG-CE 4.34Å; P101-M106 HydrophobicContact CG-CG 3.35Å; P101-M106 HydrophobicContact CG-SD 3.7Å
102	Y	89.7	Confident	88.8	Confident	69 Å²	69	54.2 Å²	54.2	27%	0.271	27%	0.27	S	S	.	.	S	Bend	trans	-69.2	128.3	175.1	-174.3	-97.7	0	0	0	111	W86 K90 C104 M425	W86-Y102 VanDerWaalsContact CB-O 3.27Å; W86-Y102 WeakPolarHBondContact CB-O 3.49Å; W86-Y102 HydrophobicContact CD2-CD1 4.32Å; W86-Y102 HydrophobicContact CG-CD1 4.21Å; K90-Y102 HydrophobicContact CD-CD1 4.29Å; K90-Y102 HydrophobicContact CD-CD2 4.24Å; K90-Y102 HydrophobicContact CD-CG 3.89Å; K90-Y102 HydrophobicContact CG-CG 4.23Å; K90-Y102 VanDerWaalsContact NZ-CE1 3.32Å; K90-Y102 PolarHBondContact O-N 2.98Å; Y102-C104 PolarHBondContact O-N 2.89Å; Y102-C104 VanDerWaalsContact O-N 3.07Å; Y102-M425 HydrophobicContact CE1-CE 3.63Å; Y102-M425 HydrophobicContact CE1-SD 4.04Å
103	G	86.6	Confident	88.8	Confident	6 Å²	6	52.2 Å²	52.2	6%	0.062	27%	0.267	C	S	.	.	S	Bend	trans	76.5	-10.8	166.8	0	0	0	0	0	117.2	P101 M425 K426	P101-G103 PolarHBondContact O-N 3.47Å; G103-M425 WeakPolarHBondContact O-CA 3.34Å; G103-K426 CarbonylContact C-O 3.51Å; G103-K426 PolarHBondContact O-N 2.78Å
104	C	90.6	Very high	88.9	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.007	26%	0.262	C	S	.	.	S	Bend	trans	-145.3	167.9	-178.6	69.4	0	0	0	0	112.8	S83 Q100 Y102 C337 K426	S83-C104 PolarHBondContact O-SG 3.12Å; S83-C104 VanDerWaalsContact O-SG 3.4Å; Q100-C104 PolarHBondContact NE2-O 3.45Å; Y102-C104 PolarHBondContact O-N 2.89Å; Y102-C104 VanDerWaalsContact O-N 3.07Å; C104-C337 HydrophobicContact CB-CB 3.93Å; C104-C337 WeakPolarHBondContact CB-SG 3.45Å; C104-C337 VanDerWaalsContact SG-CA 3.56Å; C104-C337 WeakPolarHBondContact SG-CB 3.25Å; C104-C337 CovalentContact SG-SG 2.03Å; C104-C337 PolarHBondContact SG-SG 3.5Å; C104-K426 CarbonylContact C-O 3.48Å; C104-K426 VanDerWaalsContact CA-O 3.27Å; C104-K426 WeakPolarHBondContact CA-O 3.15Å; C104-K426 PolarHBondContact N-O 3.4Å
105	M	91.8	Very high	89.2	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	27%	0.269	C	S	.	.			trans	-108.8	137.7	-179.1	-58.7	-176	-68.4	0	0	112.3	G335 S336 C337 K426 E427 Q428 A755 G759	M105-G335 WeakPolarHBondContact O-CA 3.16Å; M105-S336 WeakPolarHBondContact CB-OG 3.31Å; M105-S336 PolarHBondContact N-OG 2.9Å; M105-S336 PolarHBondContact O-N 3.25Å; M105-C337 PolarHBondContact N-SG 2.82Å; M105-C337 VanDerWaalsContact N-SG 3.44Å; M105-C337 PolarHBondContact O-N 3.22Å; M105-C337 VanDerWaalsContact O-N 3.12Å; M105-C337 PolarHBondContact O-SG 3.38Å; M105-K426 HydrophobicContact CE-CB 3.89Å; M105-K426 HydrophobicContact CE-CD 4.28Å; M105-K426 HydrophobicContact CG-CB 4.02Å; M105-K426 HydrophobicContact SD-CB 4.26Å; M105-E427 VanDerWaalsContact CG-C 3.48Å; M105-Q428 HydrophobicContact CB-CG 4.02Å; M105-Q428 HydrophobicContact CG-CG 4.1Å; M105-A755 HydrophobicContact CE-CB 3.24Å; M105-G759 WeakPolarHBondContact SD-CA 3.44Å
106	M	92.7	Very high	89.9	Confident	19 Å²	19	54.3 Å²	54.3	9%	0.094	27%	0.272	C	S	.	.			trans	-83.1	142.2	171.7	-60.9	-165.9	-61.2	0	0	111.1	L87 W99 P101 V320 N323	L87-M106 HydrophobicContact CD1-CG 3.79Å; L87-M106 HydrophobicContact CD1-SD 3.81Å; W99-M106 HydrophobicContact CB-CE 4.04Å; W99-M106 HydrophobicContact CG-CE 4.3Å; W99-M106 WeakPolarHBondContact O-CE 3.4Å; P101-M106 HydrophobicContact CG-CE 4.34Å; P101-M106 HydrophobicContact CG-CG 3.35Å; P101-M106 HydrophobicContact CG-SD 3.7Å; M106-V320 HydrophobicContact SD-CG2 3.86Å; M106-N323 WeakPolarHBondContact CA-OD1 3.33Å
107	H	93.4	Very high	91	Very high	21 Å²	21	46.4 Å²	46.4	10%	0.097	24%	0.235	C	C	.	.			trans	-80.4	139.1	161.2	175.4	59.2	0	0	0	110	Y109 D113 N323 P332 D334	H107-Y109 HydrophobicContact CB-CE2 4.14Å; H107-Y109 AromaticContact CD2-CD2 3.64Å; H107-Y109 AromaticContact CD2-CE1 3.97Å; H107-Y109 AromaticContact CD2-CE2 3.55Å; H107-Y109 AromaticContact CD2-CG 3.85Å; H107-Y109 AromaticContact CD2-CZ 3.69Å; H107-Y109 PolarHBondContact O-N 3.35Å; H107-D113 IonicContact NE2-OD2 2.91Å; H107-N323 PolarHBondContact N-OD1 2.73Å; H107-N323 PolarHBondContact O-ND2 2.95Å; H107-P332 HydrophobicContact CB-CB 3.87Å; H107-P332 HydrophobicContact CB-CG 3.52Å; H107-D334 IonicContact CE1-OD1 2.62Å; H107-D334 PolarHBondContact CE1-OD1 2.99Å; H107-D334 IonicContact CE1-OD2 3.87Å; H107-D334 IonicContact CG-OD1 3.64Å; H107-D334 IonicContact ND1-OD1 3.34Å; H107-D334 PolarHBondContact ND1-OD1 3.27Å; H107-D334 IonicContact ND1-OD2 3.65Å; H107-D334 PolarHBondContact ND1-OD2 3.48Å
108	K	92.1	Very high	91.8	Very high	164 Å²	164	40 Å²	40	71%	0.713	20%	0.201	S	C	*	.			trans	-89.9	95.4	175.2	-173.2	176.2	-177.5	173.8	0	109.9
109	Y	93.6	Very high	92	Very high	8 Å²	8	40.2 Å²	40.2	3%	0.031	20%	0.204	C	C	.	.			trans	-62.7	137.2	-179.3	-81.8	-91.6	0	0	0	112.9	H107 D113 M322 C326 N327 L330	H107-Y109 HydrophobicContact CB-CE2 4.14Å; H107-Y109 AromaticContact CD2-CD2 3.64Å; H107-Y109 AromaticContact CD2-CE1 3.97Å; H107-Y109 AromaticContact CD2-CE2 3.55Å; H107-Y109 AromaticContact CD2-CG 3.85Å; H107-Y109 AromaticContact CD2-CZ 3.69Å; H107-Y109 PolarHBondContact O-N 3.35Å; Y109-D113 HydrophobicContact CD1-CB 3.99Å; Y109-D113 HydrophobicContact CE1-CB 4.39Å; Y109-M322 HydrophobicContact CD1-CG 3.54Å; Y109-M322 HydrophobicContact CD1-SD 4.47Å; Y109-M322 HydrophobicContact CD2-CB 3.85Å; Y109-M322 HydrophobicContact CD2-CG 3.43Å; Y109-M322 VanDerWaalsContact CD2-CG 3.43Å; Y109-M322 HydrophobicContact CE1-CG 3.97Å; Y109-M322 HydrophobicContact CE2-CB 4.3Å; Y109-M322 HydrophobicContact CE2-CG 3.89Å; Y109-M322 HydrophobicContact CG-CB 4.14Å; Y109-M322 HydrophobicContact CG-CG 3.26Å; Y109-C326 HydrophobicContact CE1-CB 3.51Å; Y109-C326 HydrophobicContact CE2-CB 4.36Å; Y109-C326 WeakPolarHBondContact OH-CB 3.29Å; Y109-N327 PolarHBondContact OH-N 2.89Å; Y109-N327 PolarHBondContact OH-OD1 3.38Å; Y109-L330 HydrophobicContact CE1-CD1 3.76Å
110	K	93.1	Very high	91.8	Very high	148 Å²	148	47.5 Å²	47.5	64%	0.643	24%	0.239	S	C	*	.			trans	-110.4	166.1	167.6	-61.6	-179.7	-177.5	177.2	0	110	N112 D113 A114	K110-N112 PolarHBondContact O-N 3.48Å; K110-D113 PolarHBondContact O-N 3.11Å; K110-D113 VanDerWaalsContact O-N 3.08Å; K110-A114 WeakPolarHBondContact O-CB 3.37Å; K110-A114 PolarHBondContact O-N 3.22Å
111	S	92.7	Very high	91.7	Very high	32 Å²	32	50.1 Å²	50.1	22%	0.224	25%	0.25	C	S	.	.	H	α-helix	trans	-47.2	-52.1	179.7	173.4	0	0	0	0	113.2	D113 A114 I115 I141 I142	S111-D113 VanDerWaalsContact C-N 3.35Å; S111-D113 PolarHBondContact O-N 2.88Å; S111-A114 PolarHBondContact O-N 3.36Å; S111-I115 WeakPolarHBondContact O-CB 3.49Å; S111-I115 VanDerWaalsContact O-CG1 3.25Å; S111-I115 WeakPolarHBondContact O-CG1 3.17Å; S111-I115 PolarHBondContact O-N 3.28Å; S111-I141 VanDerWaalsContact CA-O 3.25Å; S111-I141 WeakPolarHBondContact CA-O 3.5Å; S111-I141 PolarHBondContact N-O 2.89Å; S111-I142 VanDerWaalsContact CB-O 3.25Å; S111-I142 WeakPolarHBondContact CB-O 3.14Å; S111-I142 PolarHBondContact OG-O 2.79Å
112	N	91	Very high	91.8	Very high	121 Å²	121	53.2 Å²	53.2	65%	0.647	26%	0.262	S	S	*	.	H	α-helix	trans	-59.9	-42.8	-179.8	-67.4	-2.7	0	0	0	113	K110 T116	K110-N112 PolarHBondContact O-N 3.48Å; N112-T116 WeakPolarHBondContact O-CB 3.1Å; N112-T116 PolarHBondContact O-N 3.33Å; N112-T116 PolarHBondContact O-OG1 3.49Å
113	D	91.7	Very high	92.1	Very high	56 Å²	56	50 Å²	50	30%	0.299	25%	0.249	S	C	.	.	H	α-helix	trans	-68.8	-42.1	-178.8	-52.4	-40.3	0	0	0	110.4	H107 Y109 K110 S111 T116 C117 L330	H107-D113 IonicContact NE2-OD2 2.91Å; Y109-D113 HydrophobicContact CD1-CB 3.99Å; Y109-D113 HydrophobicContact CE1-CB 4.39Å; K110-D113 PolarHBondContact O-N 3.11Å; K110-D113 VanDerWaalsContact O-N 3.08Å; S111-D113 VanDerWaalsContact C-N 3.35Å; S111-D113 PolarHBondContact O-N 2.88Å; D113-T116 PolarHBondContact O-N 2.92Å; D113-C117 PolarHBondContact O-N 2.73Å; D113-L330 HydrophobicContact CB-CD1 4.15Å; D113-L330 WeakPolarHBondContact O-CD1 3.22Å
114	A	92.5	Very high	92.6	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.9	-46.7	177.6	0	0	0	0	0	111.8	K110 S111 T116 C117 L118 I141 I142 M322	K110-A114 WeakPolarHBondContact O-CB 3.37Å; K110-A114 PolarHBondContact O-N 3.22Å; S111-A114 PolarHBondContact O-N 3.36Å; A114-T116 VanDerWaalsContact C-N 3.35Å; A114-T116 PolarHBondContact O-N 2.79Å; A114-C117 PolarHBondContact O-N 3.14Å; A114-L118 WeakPolarHBondContact O-CB 3.37Å; A114-L118 WeakPolarHBondContact O-CG 3.22Å; A114-L118 PolarHBondContact O-N 3.12Å; A114-I141 HydrophobicContact CB-CG2 4.04Å; A114-I142 HydrophobicContact CB-CG1 4.1Å; A114-M322 HydrophobicContact CB-CE 4.03Å; A114-M322 HydrophobicContact CB-SD 4.18Å
115	I	92	Very high	93	Very high	45 Å²	45	49.6 Å²	49.6	23%	0.231	25%	0.246	C	C	.	.	H	α-helix	trans	-60.4	-45.7	176.5	-69	167.3	0	0	0	110.4	S111 C117 L118 S119 I142 S163	S111-I115 WeakPolarHBondContact O-CB 3.49Å; S111-I115 VanDerWaalsContact O-CG1 3.25Å; S111-I115 WeakPolarHBondContact O-CG1 3.17Å; S111-I115 PolarHBondContact O-N 3.28Å; I115-C117 VanDerWaalsContact C-N 3.29Å; I115-C117 PolarHBondContact O-N 3.46Å; I115-L118 PolarHBondContact O-N 3.2Å; I115-S119 PolarHBondContact O-N 3.12Å; I115-I142 HydrophobicContact CD1-CG2 4.42Å; I115-I142 HydrophobicContact CG1-CG2 3.85Å; I115-S163 VanDerWaalsContact CG2-CB 3.49Å
116	T	92.4	Very high	93.2	Very high	90 Å²	90	49.7 Å²	49.7	55%	0.552	25%	0.246	S	C	*	.	H	α-helix	trans	-60.6	-39.7	179	-55.9	0	0	0	0	111.6	N112 D113 A114 L330	N112-T116 WeakPolarHBondContact O-CB 3.1Å; N112-T116 PolarHBondContact O-N 3.33Å; N112-T116 PolarHBondContact O-OG1 3.49Å; D113-T116 PolarHBondContact O-N 2.92Å; A114-T116 VanDerWaalsContact C-N 3.35Å; A114-T116 PolarHBondContact O-N 2.79Å; T116-L330 HydrophobicContact CG2-CD2 4.14Å
117	C	93.3	Very high	93.4	Very high	3 Å²	3	48.8 Å²	48.8	2%	0.02	24%	0.242	C	C	.	.	H	α-helix	trans	-70.9	-38.3	178.2	168.7	0	0	0	0	114	D113 A114 I115 K121 C326 L330	D113-C117 PolarHBondContact O-N 2.73Å; A114-C117 PolarHBondContact O-N 3.14Å; I115-C117 VanDerWaalsContact C-N 3.29Å; I115-C117 PolarHBondContact O-N 3.46Å; C117-K121 WeakPolarHBondContact O-CE 3.49Å; C117-K121 PolarHBondContact O-NZ 3.28Å; C117-C326 HydrophobicContact CB-CB 3.65Å; C117-C326 WeakPolarHBondContact CB-SG 3.47Å; C117-C326 WeakPolarHBondContact SG-CA 3.25Å; C117-C326 WeakPolarHBondContact SG-CB 3.4Å; C117-C326 CovalentContact SG-SG 2.01Å; C117-C326 PolarHBondContact SG-SG 3.09Å; C117-L330 HydrophobicContact CB-CD1 4.11Å; C117-L330 HydrophobicContact CB-CG 4.28Å
118	L	93.6	Very high	93.5	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-98	0.2	-171	-61.2	175.1	0	0	0	113.1	A114 I115 E120 K121 V123 F138 I142 L165 M322	A114-L118 WeakPolarHBondContact O-CB 3.37Å; A114-L118 WeakPolarHBondContact O-CG 3.22Å; A114-L118 PolarHBondContact O-N 3.12Å; I115-L118 PolarHBondContact O-N 3.2Å; L118-E120 PolarHBondContact O-N 2.94Å; L118-K121 HydrophobicContact CD2-CD 4.42Å; L118-K121 VanDerWaalsContact O-CB 3.32Å; L118-K121 WeakPolarHBondContact O-CB 3.38Å; L118-K121 PolarHBondContact O-N 3.31Å; L118-V123 HydrophobicContact CD2-CG2 4.32Å; L118-F138 HydrophobicContact CD1-CE1 3.83Å; L118-F138 HydrophobicContact CD1-CZ 3.65Å; L118-I142 HydrophobicContact CD1-CD1 3.93Å; L118-I142 HydrophobicContact CD1-CG1 4.34Å; L118-L165 HydrophobicContact CB-CD1 3.77Å; L118-L165 HydrophobicContact CB-CD2 3.96Å; L118-L165 HydrophobicContact CB-CG 4.48Å; L118-L165 HydrophobicContact CD1-CD2 4.43Å; L118-L165 WeakPolarHBondContact O-CD1 3.46Å; L118-M322 HydrophobicContact CD1-CE 4.08Å; L118-M322 HydrophobicContact CD1-SD 4.02Å
119	S	90.6	Very high	93.6	Very high	52 Å²	52	40.4 Å²	40.4	36%	0.364	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.6	133	177.3	-167.5	0	0	0	0	111.2	I115 K121 S163	I115-S119 PolarHBondContact O-N 3.12Å; S119-K121 PolarHBondContact O-N 2.77Å; S119-K121 VanDerWaalsContact O-N 3.15Å; S119-S163 PolarHBondContact OG-O 3.23Å
120	E	88.9	Confident	93.7	Very high	160 Å²	160	40.7 Å²	40.7	75%	0.748	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.3	12.3	-179.4	-52.1	179.9	169.9	0	0	115.6	L118 S163	L118-E120 PolarHBondContact O-N 2.94Å; E120-S163 PolarHBondContact N-O 2.63Å
121	K	91.1	Very high	93.9	Very high	56 Å²	56	33.8 Å²	33.8	24%	0.243	18%	0.178	C	C	.	.			trans	-97.6	149.1	176.7	-61.7	-175.6	-176.3	158	0	112.4	C117 L118 S119 L165 N166 D195	C117-K121 WeakPolarHBondContact O-CE 3.49Å; C117-K121 PolarHBondContact O-NZ 3.28Å; L118-K121 HydrophobicContact CD2-CD 4.42Å; L118-K121 VanDerWaalsContact O-CB 3.32Å; L118-K121 WeakPolarHBondContact O-CB 3.38Å; L118-K121 PolarHBondContact O-N 3.31Å; S119-K121 PolarHBondContact O-N 2.77Å; S119-K121 VanDerWaalsContact O-N 3.15Å; K121-L165 WeakPolarHBondContact O-CD1 3.29Å; K121-N166 PolarHBondContact O-N 3.05Å; K121-D195 VanDerWaalsContact CA-OD2 3.29Å; K121-D195 WeakPolarHBondContact CA-OD2 3.44Å; K121-D195 HydrophobicContact CB-CB 4.18Å; K121-D195 HydrophobicContact CG-CB 4.36Å
122	R	93.6	Very high	94.1	Very high	66 Å²	66	33.8 Å²	33.8	25%	0.249	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	114.9	167.1	-173.4	179.5	-177	-166.8	2.4	110.6	V124 N166 D168 A192 D195 V196	R122-V124 HydrophobicContact CG-CG2 4.28Å; R122-N166 WeakPolarHBondContact CA-O 3.35Å; R122-N166 HydrophobicContact CG-CB 4.43Å; R122-D168 IonicContact CZ-OD2 3.5Å; R122-D168 IonicContact NE-OD2 3.48Å; R122-D168 PolarHBondContact NE-OD2 3.16Å; R122-D168 IonicContact NH2-OD2 3.6Å; R122-D168 PolarHBondContact NH2-OD2 3.24Å; R122-A192 PolarHBondContact NH1-O 3.5Å; R122-D195 PolarHBondContact N-OD2 3.2Å; R122-D195 PolarHBondContact O-N 3.3Å; R122-V196 PolarHBondContact O-N 3.41Å
123	V	96.6	Very high	94.2	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	128.8	177.2	-178	0	0	0	0	109	L118 F125 F138 N166 V167 D168 V196 I198	L118-V123 HydrophobicContact CD2-CG2 4.32Å; V123-F125 HydrophobicContact CG1-CD2 4.17Å; V123-F125 HydrophobicContact CG1-CE2 3.67Å; V123-F138 HydrophobicContact CG1-CE1 4.3Å; V123-F138 HydrophobicContact CG1-CZ 4.5Å; V123-N166 PolarHBondContact N-O 3.45Å; V123-V167 HydrophobicContact CB-CG1 4.15Å; V123-V167 HydrophobicContact CB-CG2 4.31Å; V123-V167 HydrophobicContact CG1-CG1 4.23Å; V123-V167 CarbonylContact O-C 3.55Å; V123-V167 VanDerWaalsContact O-CA 3.29Å; V123-V167 WeakPolarHBondContact O-CA 3.33Å; V123-D168 PolarHBondContact O-N 3.25Å; V123-V196 HydrophobicContact CB-CB 4.42Å; V123-V196 HydrophobicContact CG1-CB 4.14Å; V123-V196 HydrophobicContact CG1-CG1 4.31Å; V123-V196 HydrophobicContact CG2-CB 4.16Å; V123-V196 HydrophobicContact CG2-CG2 4.23Å; V123-I198 HydrophobicContact CG1-CD1 3.67Å
124	V	97.3	Very high	94.5	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	124.6	-179.5	179.7	0	0	0	0	110.4	R122 D168 L170 W186 P194 V196 V197 I198	R122-V124 HydrophobicContact CG-CG2 4.28Å; V124-D168 CarbonylContact C-O 3.6Å; V124-D168 WeakPolarHBondContact CA-O 3.36Å; V124-D168 HydrophobicContact CG2-CB 4.33Å; V124-L170 HydrophobicContact CG1-CD1 3.66Å; V124-L170 HydrophobicContact CG1-CG 3.97Å; V124-W186 HydrophobicContact CG1-CH2 3.71Å; V124-W186 HydrophobicContact CG1-CZ2 3.83Å; V124-P194 HydrophobicContact CB-CB 4.31Å; V124-P194 HydrophobicContact CG2-CB 3.68Å; V124-P194 HydrophobicContact CG2-CG 4.45Å; V124-V196 PolarHBondContact N-O 3.4Å; V124-V197 CarbonylContact O-C 3.47Å; V124-V197 WeakPolarHBondContact O-CA 3.29Å; V124-I198 PolarHBondContact O-N 2.95Å
125	F	98.1	Very high	94.7	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	129.6	167.3	-71.6	-99.4	0	0	0	108.5	V123 I131 L134 F135 F138 V167 D168 F169 L170 I198 L321	V123-F125 HydrophobicContact CG1-CD2 4.17Å; V123-F125 HydrophobicContact CG1-CE2 3.67Å; F125-I131 HydrophobicContact CB-CG2 3.97Å; F125-I131 HydrophobicContact CD1-CG2 4.19Å; F125-L134 HydrophobicContact CE1-CD2 4.3Å; F125-L134 HydrophobicContact CE1-CG 4.03Å; F125-F135 HydrophobicContact CB-CB 4.06Å; F125-F135 HydrophobicContact CB-CD2 4.44Å; F125-F135 HydrophobicContact CD1-CB 4.1Å; F125-F135 HydrophobicContact CD2-CB 4.12Å; F125-F135 AromaticContact CD2-CD2 3.79Å; F125-F135 HydrophobicContact CD2-CD2 3.79Å; F125-F135 HydrophobicContact CD2-CG 4.47Å; F125-F135 HydrophobicContact CE2-CD2 4.35Å; F125-F135 HydrophobicContact CG-CB 3.83Å; F125-F135 HydrophobicContact CG-CD2 4.25Å; F125-F138 HydrophobicContact CE2-CB 4.28Å; F125-F138 AromaticContact CE2-CD1 3.88Å; F125-F138 HydrophobicContact CE2-CD1 3.88Å; F125-F138 HydrophobicContact CE2-CE1 4.36Å; F125-F138 HydrophobicContact CE2-CG 4.04Å; F125-F138 HydrophobicContact CZ-CB 3.74Å; F125-F138 AromaticContact CZ-CD1 3.97Å; F125-F138 HydrophobicContact CZ-CD1 3.97Å; F125-F138 AromaticContact CZ-CD2 4Å; F125-F138 HydrophobicContact CZ-CD2 4Å; F125-F138 AromaticContact CZ-CG 3.64Å; F125-F138 HydrophobicContact CZ-CG 3.64Å; F125-V167 HydrophobicContact CD2-CG1 3.98Å; F125-V167 HydrophobicContact CE2-CG1 3.84Å; F125-D168 PolarHBondContact N-O 3.41Å; F125-F169 HydrophobicContact CB-CD2 4.06Å; F125-F169 CarbonylContact O-C 3.51Å; F125-F169 VanDerWaalsContact O-CA 3.28Å; F125-F169 WeakPolarHBondContact O-CA 3.37Å; F125-L170 PolarHBondContact O-N 2.99Å; F125-I198 CarbonylContact C-O 3.58Å; F125-I198 WeakPolarHBondContact CA-O 3.22Å; F125-I198 HydrophobicContact CD1-CB 3.73Å; F125-I198 HydrophobicContact CD1-CD1 4.25Å; F125-I198 HydrophobicContact CD1-CG1 4.28Å; F125-I198 HydrophobicContact CD1-CG2 3.86Å; F125-I198 HydrophobicContact CD2-CD1 4.17Å; F125-I198 HydrophobicContact CE1-CB 3.88Å; F125-I198 HydrophobicContact CE1-CD1 3.93Å; F125-I198 HydrophobicContact CE1-CG1 3.95Å; F125-I198 HydrophobicContact CE1-CG2 3.91Å; F125-I198 HydrophobicContact CE2-CD1 3.86Å; F125-I198 HydrophobicContact CG-CB 4.28Å; F125-I198 HydrophobicContact CG-CD1 4.36Å; F125-I198 HydrophobicContact CZ-CD1 3.73Å; F125-I198 HydrophobicContact CZ-CG1 4.21Å; F125-L321 HydrophobicContact CE1-CD1 4.06Å; F125-L321 HydrophobicContact CZ-CD1 4.34Å
126	A	97.7	Very high	94.9	Very high	2 Å²	2	25.1 Å²	25.1	2%	0.017	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	124.5	179.6	0	0	0	0	0	111.4	L170 I198 L199 G200	A126-L170 WeakPolarHBondContact CA-O 3.39Å; A126-L170 HydrophobicContact CB-CB 4.25Å; A126-I198 PolarHBondContact N-O 2.93Å; A126-L199 HydrophobicContact CB-CD2 3.61Å; A126-L199 VanDerWaalsContact O-CA 3.32Å; A126-L199 WeakPolarHBondContact O-CA 3.22Å; A126-G200 PolarHBondContact O-N 3.3Å; A126-G200 VanDerWaalsContact O-N 3.14Å
127	G	96.9	Very high	95	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.6	-153.6	-174.7	0	0	0	0	0	114.5	L170 Y172 G200	G127-L170 PolarHBondContact N-O 3.27Å; G127-L170 VanDerWaalsContact N-O 3.16Å; G127-Y172 CarbonylContact C-O 3.54Å; G127-Y172 VanDerWaalsContact CA-O 3.25Å; G127-Y172 WeakPolarHBondContact CA-O 3.29Å; G127-Y172 CarbonylContact O-C 3.52Å; G127-Y172 PolarHBondContact O-N 3.48Å; G127-Y172 VanDerWaalsContact O-N 3.11Å; G127-G200 WeakPolarHBondContact CA-O 2.93Å
128	D	95.3	Very high	95.2	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.099	C	C	.	.	S	Bend	trans	-91	-164.7	176.9	68.2	21.5	0	0	0	113	R130 I131 R132 P173 T203	D128-R130 PolarHBondContact O-N 3.44Å; D128-R130 VanDerWaalsContact OD1-CB 3.26Å; D128-R130 WeakPolarHBondContact OD1-CB 3.38Å; D128-R130 PolarHBondContact OD1-N 3.33Å; D128-I131 PolarHBondContact O-N 2.93Å; D128-R132 PolarHBondContact O-N 3.35Å; D128-R132 VanDerWaalsContact O-N 3.09Å; D128-P173 HydrophobicContact CB-CB 3.94Å; D128-T203 PolarHBondContact OD2-OG1 3.03Å
129	S	94.7	Very high	95.3	Very high	9 Å²	9	20.7 Å²	20.7	6%	0.063	10%	0.099	C	C	.	.	H	α-helix	trans	-63.1	-22.6	-179	59.2	0	0	0	0	114.1	R132 Q133 H308	S129-R132 WeakPolarHBondContact O-CB 3.34Å; S129-Q133 WeakPolarHBondContact O-CG 3.33Å; S129-Q133 PolarHBondContact O-N 3.2Å; S129-Q133 VanDerWaalsContact O-N 3.11Å; S129-H308 WeakPolarHBondContact CB-NE2 3.44Å; S129-H308 PolarHBondContact OG-NE2 2.96Å
130	R	94.9	Very high	95.5	Very high	14 Å²	14	20.3 Å²	20.3	5%	0.053	9%	0.09	C	C	.	.	H	α-helix	trans	-76.5	-41.3	178.3	-53.3	174.4	69	147.2	27.2	110.8	D128 R132 Q133 L134 D245 P246	D128-R130 PolarHBondContact O-N 3.44Å; D128-R130 VanDerWaalsContact OD1-CB 3.26Å; D128-R130 WeakPolarHBondContact OD1-CB 3.38Å; D128-R130 PolarHBondContact OD1-N 3.33Å; R130-R132 VanDerWaalsContact C-N 3.27Å; R130-R132 PolarHBondContact O-N 3.08Å; R130-Q133 WeakPolarHBondContact O-CB 3.29Å; R130-Q133 PolarHBondContact O-N 3.15Å; R130-L134 PolarHBondContact O-N 3.26Å; R130-D245 VanDerWaalsContact CZ-O 3.23Å; R130-D245 IonicContact CZ-OD2 2.66Å; R130-D245 VanDerWaalsContact CZ-OD2 3.28Å; R130-D245 IonicContact NE-OD2 3.92Å; R130-D245 PolarHBondContact NE-OD2 3.09Å; R130-D245 PolarHBondContact NH1-O 3.35Å; R130-D245 VanDerWaalsContact NH2-CG 3.35Å; R130-D245 PolarHBondContact NH2-O 3.17Å; R130-D245 IonicContact NH2-OD2 3.78Å; R130-D245 PolarHBondContact NH2-OD2 3.09Å; R130-P246 PolarHBondContact NH2-O 3.49Å
131	I	97.1	Very high	95.8	Very high	4 Å²	4	13.4 Å²	13.4	2%	0.021	6%	0.058	C	C	.	.	H	α-helix	trans	-64.8	-36.3	172.4	-59.5	-54.2	0	0	0	110.8	F125 D128 Q133 L134 F135 F169 G200 V242	F125-I131 HydrophobicContact CB-CG2 3.97Å; F125-I131 HydrophobicContact CD1-CG2 4.19Å; D128-I131 PolarHBondContact O-N 2.93Å; I131-Q133 VanDerWaalsContact C-N 3.33Å; I131-Q133 PolarHBondContact O-N 3.27Å; I131-L134 WeakPolarHBondContact O-CB 3.37Å; I131-L134 PolarHBondContact O-N 2.98Å; I131-F135 PolarHBondContact O-N 3.17Å; I131-F169 HydrophobicContact CB-CE2 4.34Å; I131-F169 HydrophobicContact CG2-CD2 4.47Å; I131-F169 HydrophobicContact CG2-CE2 4.22Å; I131-G200 WeakPolarHBondContact CG1-O 3.23Å; I131-V242 HydrophobicContact CD1-CB 3.69Å; I131-V242 HydrophobicContact CD1-CG1 4.01Å; I131-V242 HydrophobicContact CD1-CG2 3.79Å
132	R	96	Very high	95.9	Very high	31 Å²	31	10.9 Å²	10.9	12%	0.117	5%	0.048	C	C	.	.	H	α-helix	trans	-60.8	-40.5	172	-167.7	175.7	56	161.4	2.2	112.9	D128 S129 R130 L134 F135 Y136 N151 I156 F169	D128-R132 PolarHBondContact O-N 3.35Å; D128-R132 VanDerWaalsContact O-N 3.09Å; S129-R132 WeakPolarHBondContact O-CB 3.34Å; R130-R132 VanDerWaalsContact C-N 3.27Å; R130-R132 PolarHBondContact O-N 3.08Å; R132-L134 VanDerWaalsContact C-N 3.34Å; R132-F135 WeakPolarHBondContact O-CB 3.15Å; R132-F135 PolarHBondContact O-N 3.4Å; R132-Y136 HydrophobicContact CG-CD2 4.15Å; R132-Y136 HydrophobicContact CG-CE2 3.73Å; R132-Y136 WeakPolarHBondContact O-CD2 3.32Å; R132-Y136 PolarHBondContact O-N 3.48Å; R132-N151 PolarHBondContact NH1-O 2.91Å; R132-I156 HydrophobicContact CG-CD1 4.16Å; R132-F169 HydrophobicContact CB-CD1 4.34Å; R132-F169 HydrophobicContact CB-CD2 4.01Å; R132-F169 HydrophobicContact CB-CE1 3.94Å; R132-F169 HydrophobicContact CB-CE2 3.58Å; R132-F169 HydrophobicContact CB-CG 4.38Å; R132-F169 HydrophobicContact CB-CZ 3.55Å; R132-F169 HydrophobicContact CG-CD1 3.93Å; R132-F169 HydrophobicContact CG-CD2 4.29Å; R132-F169 HydrophobicContact CG-CE1 3.85Å; R132-F169 HydrophobicContact CG-CE2 4.21Å; R132-F169 HydrophobicContact CG-CG 4.16Å; R132-F169 HydrophobicContact CG-CZ 4.01Å
133	Q	94.6	Very high	95.8	Very high	21 Å²	21	12.6 Å²	12.6	10%	0.098	6%	0.057	C	C	.	.	H	α-helix	trans	-65.2	-39.2	176	-79.6	-177.9	-13.1	0	0	112.4	S129 R130 I131 Y136 S137 H308 R314	S129-Q133 WeakPolarHBondContact O-CG 3.33Å; S129-Q133 PolarHBondContact O-N 3.2Å; S129-Q133 VanDerWaalsContact O-N 3.11Å; R130-Q133 WeakPolarHBondContact O-CB 3.29Å; R130-Q133 PolarHBondContact O-N 3.15Å; I131-Q133 VanDerWaalsContact C-N 3.33Å; I131-Q133 PolarHBondContact O-N 3.27Å; Q133-Y136 PolarHBondContact O-N 3.2Å; Q133-S137 PolarHBondContact O-N 3.23Å; Q133-S137 VanDerWaalsContact O-N 3.09Å; Q133-H308 VanDerWaalsContact NE2-CB 3.29Å; Q133-H308 PolarHBondContact NE2-CD2 2.98Å; Q133-H308 PolarHBondContact OE1-CD2 3.47Å; Q133-H308 VanDerWaalsContact OE1-CD2 3.23Å; Q133-R314 VanDerWaalsContact OE1-CZ 3.25Å
134	L	96.5	Very high	95.6	Very high	14 Å²	14	17.1 Å²	17.1	7%	0.073	9%	0.086	C	C	.	.	H	α-helix	trans	-63.9	-40.5	172.8	-176.5	60.1	0	0	0	111.8	F125 R130 I131 R132 S137 F138 I198 V242 L289 A318 L321	F125-L134 HydrophobicContact CE1-CD2 4.3Å; F125-L134 HydrophobicContact CE1-CG 4.03Å; R130-L134 PolarHBondContact O-N 3.26Å; I131-L134 WeakPolarHBondContact O-CB 3.37Å; I131-L134 PolarHBondContact O-N 2.98Å; R132-L134 VanDerWaalsContact C-N 3.34Å; L134-S137 PolarHBondContact O-N 3.23Å; L134-F138 WeakPolarHBondContact O-CB 3.24Å; L134-F138 PolarHBondContact O-N 2.93Å; L134-I198 HydrophobicContact CD2-CG2 4.35Å; L134-V242 HydrophobicContact CD2-CG2 4.05Å; L134-L289 HydrophobicContact CD2-CD2 4.25Å; L134-A318 HydrophobicContact CD1-CB 4.3Å; L134-L321 HydrophobicContact CD1-CD1 4.32Å; L134-L321 HydrophobicContact CD2-CD1 3.89Å; L134-L321 HydrophobicContact CG-CD1 4.19Å
135	F	96.8	Very high	95.2	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-55.9	-49.7	172.6	159.6	-94.8	0	0	0	111.6	F125 I131 R132 S137 F138 V139 I156 F158 V167 F169	F125-F135 HydrophobicContact CB-CB 4.06Å; F125-F135 HydrophobicContact CB-CD2 4.44Å; F125-F135 HydrophobicContact CD1-CB 4.1Å; F125-F135 HydrophobicContact CD2-CB 4.12Å; F125-F135 AromaticContact CD2-CD2 3.79Å; F125-F135 HydrophobicContact CD2-CD2 3.79Å; F125-F135 HydrophobicContact CD2-CG 4.47Å; F125-F135 HydrophobicContact CE2-CD2 4.35Å; F125-F135 HydrophobicContact CG-CB 3.83Å; F125-F135 HydrophobicContact CG-CD2 4.25Å; I131-F135 PolarHBondContact O-N 3.17Å; R132-F135 WeakPolarHBondContact O-CB 3.15Å; R132-F135 PolarHBondContact O-N 3.4Å; F135-S137 PolarHBondContact O-N 3.24Å; F135-F138 WeakPolarHBondContact O-CB 3.37Å; F135-F138 PolarHBondContact O-N 2.96Å; F135-F138 VanDerWaalsContact O-N 3.15Å; F135-V139 HydrophobicContact CD2-CG2 4Å; F135-V139 HydrophobicContact CE1-CG2 4.34Å; F135-V139 HydrophobicContact CE2-CG2 3.64Å; F135-V139 HydrophobicContact CZ-CG2 3.83Å; F135-V139 WeakPolarHBondContact O-CG2 3.48Å; F135-V139 PolarHBondContact O-N 3.46Å; F135-I156 HydrophobicContact CE1-CB 4.4Å; F135-I156 HydrophobicContact CE1-CG2 3.98Å; F135-I156 HydrophobicContact CZ-CG2 4.16Å; F135-F158 HydrophobicContact CE2-CB 4.47Å; F135-F158 HydrophobicContact CZ-CB 4.12Å; F135-V167 HydrophobicContact CD2-CG1 3.82Å; F135-V167 HydrophobicContact CE2-CB 4.19Å; F135-V167 HydrophobicContact CE2-CG1 3.65Å; F135-V167 WeakPolarHBondContact CE2-O 3.35Å; F135-F169 HydrophobicContact CB-CB 4.33Å; F135-F169 HydrophobicContact CB-CD2 4.42Å; F135-F169 HydrophobicContact CD1-CB 3.98Å; F135-F169 HydrophobicContact CD2-CB 3.88Å; F135-F169 HydrophobicContact CE1-CB 4.23Å; F135-F169 HydrophobicContact CE2-CB 4.11Å; F135-F169 HydrophobicContact CG-CB 3.8Å; F135-F169 HydrophobicContact CZ-CB 4.28Å
136	Y	96	Very high	94.7	Very high	6 Å²	6	27.3 Å²	27.3	2%	0.024	13%	0.134	C	C	.	.	H	α-helix	trans	-62.8	-43.2	178.6	-74.5	-64.5	0	0	0	112.4	R132 Q133 F138 V139 K140 E148 D149 I156	R132-Y136 HydrophobicContact CG-CD2 4.15Å; R132-Y136 HydrophobicContact CG-CE2 3.73Å; R132-Y136 WeakPolarHBondContact O-CD2 3.32Å; R132-Y136 PolarHBondContact O-N 3.48Å; Q133-Y136 PolarHBondContact O-N 3.2Å; Y136-F138 VanDerWaalsContact C-N 3.27Å; Y136-F138 PolarHBondContact O-N 3.3Å; Y136-V139 PolarHBondContact O-N 2.98Å; Y136-K140 WeakPolarHBondContact O-CB 3.27Å; Y136-K140 VanDerWaalsContact O-CG 3.29Å; Y136-K140 WeakPolarHBondContact O-CG 3.01Å; Y136-K140 PolarHBondContact O-N 2.92Å; Y136-E148 HydrophobicContact CD1-CB 4.33Å; Y136-E148 HydrophobicContact CD1-CG 4.08Å; Y136-E148 HydrophobicContact CD2-CB 4.18Å; Y136-E148 HydrophobicContact CD2-CG 3.94Å; Y136-E148 HydrophobicContact CE1-CB 4.28Å; Y136-E148 HydrophobicContact CE2-CB 4.11Å; Y136-E148 HydrophobicContact CE2-CG 4.39Å; Y136-E148 HydrophobicContact CG-CB 4.29Å; Y136-E148 HydrophobicContact CG-CG 3.77Å; Y136-D149 PolarHBondContact OH-O 3.5Å; Y136-I156 HydrophobicContact CE2-CD1 4.49Å; Y136-I156 VanDerWaalsContact OH-CD1 3.3Å; Y136-I156 WeakPolarHBondContact OH-CD1 3.41Å
137	S	95.9	Very high	94.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.9	-36.7	174.4	-81.2	0	0	0	0	112.4	Q133 L134 F135 I141 R314 N315	Q133-S137 PolarHBondContact O-N 3.23Å; Q133-S137 VanDerWaalsContact O-N 3.09Å; L134-S137 PolarHBondContact O-N 3.23Å; F135-S137 PolarHBondContact O-N 3.24Å; S137-I141 WeakPolarHBondContact O-CG1 3.35Å; S137-I141 PolarHBondContact O-N 3.12Å; S137-R314 WeakPolarHBondContact OG-CB 3.38Å; S137-N315 WeakPolarHBondContact CB-OD1 3.47Å; S137-N315 PolarHBondContact OG-OD1 3.36Å
138	F	96.6	Very high	93.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-67.6	-47.1	175.4	-174	-89.7	0	0	0	112	L118 V123 F125 L134 F135 Y136 K140 I141 I142 V167 A318 L321 M322 L325	L118-F138 HydrophobicContact CD1-CE1 3.83Å; L118-F138 HydrophobicContact CD1-CZ 3.65Å; V123-F138 HydrophobicContact CG1-CE1 4.3Å; V123-F138 HydrophobicContact CG1-CZ 4.5Å; F125-F138 HydrophobicContact CE2-CB 4.28Å; F125-F138 AromaticContact CE2-CD1 3.88Å; F125-F138 HydrophobicContact CE2-CD1 3.88Å; F125-F138 HydrophobicContact CE2-CE1 4.36Å; F125-F138 HydrophobicContact CE2-CG 4.04Å; F125-F138 HydrophobicContact CZ-CB 3.74Å; F125-F138 AromaticContact CZ-CD1 3.97Å; F125-F138 HydrophobicContact CZ-CD1 3.97Å; F125-F138 AromaticContact CZ-CD2 4Å; F125-F138 HydrophobicContact CZ-CD2 4Å; F125-F138 AromaticContact CZ-CG 3.64Å; F125-F138 HydrophobicContact CZ-CG 3.64Å; L134-F138 WeakPolarHBondContact O-CB 3.24Å; L134-F138 PolarHBondContact O-N 2.93Å; F135-F138 WeakPolarHBondContact O-CB 3.37Å; F135-F138 PolarHBondContact O-N 2.96Å; F135-F138 VanDerWaalsContact O-N 3.15Å; Y136-F138 VanDerWaalsContact C-N 3.27Å; Y136-F138 PolarHBondContact O-N 3.3Å; F138-K140 VanDerWaalsContact C-N 3.32Å; F138-K140 PolarHBondContact O-N 3.48Å; F138-I141 WeakPolarHBondContact O-CB 3.49Å; F138-I141 PolarHBondContact O-N 2.9Å; F138-I141 VanDerWaalsContact O-N 3.14Å; F138-I142 HydrophobicContact CD1-CD1 4.03Å; F138-I142 HydrophobicContact CE1-CD1 3.81Å; F138-V167 HydrophobicContact CD1-CG1 4.28Å; F138-V167 HydrophobicContact CE1-CG1 4.45Å; F138-V167 HydrophobicContact CE1-CG2 4.47Å; F138-A318 HydrophobicContact CB-CB 4.24Å; F138-L321 HydrophobicContact CD2-CB 4.43Å; F138-L321 HydrophobicContact CE2-CB 4.39Å; F138-M322 HydrophobicContact CD2-CE 3.88Å; F138-M322 HydrophobicContact CE1-CE 4.16Å; F138-M322 HydrophobicContact CE2-CE 3.4Å; F138-M322 VanDerWaalsContact CE2-CE 3.4Å; F138-M322 HydrophobicContact CE2-SD 4.09Å; F138-M322 HydrophobicContact CG-CE 4.45Å; F138-M322 HydrophobicContact CZ-CE 3.57Å; F138-M322 HydrophobicContact CZ-SD 4.2Å; F138-L325 HydrophobicContact CE2-CD1 4.23Å; F138-L325 HydrophobicContact CZ-CD1 4.3Å
139	V	95.3	Very high	92.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-64	-36.2	176.8	175.1	0	0	0	0	111.3	F135 Y136 I141 I142 K143 M146 F158 V167	F135-V139 HydrophobicContact CD2-CG2 4Å; F135-V139 HydrophobicContact CE1-CG2 4.34Å; F135-V139 HydrophobicContact CE2-CG2 3.64Å; F135-V139 HydrophobicContact CZ-CG2 3.83Å; F135-V139 WeakPolarHBondContact O-CG2 3.48Å; F135-V139 PolarHBondContact O-N 3.46Å; Y136-V139 PolarHBondContact O-N 2.98Å; V139-I141 PolarHBondContact O-N 2.73Å; V139-I142 CarbonylContact O-C 3.44Å; V139-I142 WeakPolarHBondContact O-CA 3.44Å; V139-I142 WeakPolarHBondContact O-CB 3.5Å; V139-I142 PolarHBondContact O-N 3.45Å; V139-K143 PolarHBondContact O-N 3.46Å; V139-M146 HydrophobicContact CG1-CB 4.23Å; V139-M146 HydrophobicContact CG1-CG 3.86Å; V139-M146 HydrophobicContact CG1-SD 4.45Å; V139-F158 HydrophobicContact CG1-CD1 4.11Å; V139-F158 HydrophobicContact CG1-CD2 3.62Å; V139-F158 HydrophobicContact CG1-CE1 4.19Å; V139-F158 HydrophobicContact CG1-CE2 3.71Å; V139-F158 HydrophobicContact CG1-CG 3.83Å; V139-F158 HydrophobicContact CG1-CZ 4Å; V139-F158 HydrophobicContact CG2-CB 4.37Å; V139-F158 HydrophobicContact CG2-CD1 4.32Å; V139-F158 HydrophobicContact CG2-CG 4.25Å; V139-V167 HydrophobicContact CG2-CB 4.28Å; V139-V167 HydrophobicContact CG2-CG1 4.07Å
140	K	95.1	Very high	91.1	Very high	43 Å²	43	41.8 Å²	41.8	19%	0.187	22%	0.223	C	C	.	.	H	α-helix	trans	-60.3	-26.4	174.5	-80	173.1	173.1	177.3	0	113.2	Y136 F138 I142 K143 P144 M146 E148 E311	Y136-K140 WeakPolarHBondContact O-CB 3.27Å; Y136-K140 VanDerWaalsContact O-CG 3.29Å; Y136-K140 WeakPolarHBondContact O-CG 3.01Å; Y136-K140 PolarHBondContact O-N 2.92Å; F138-K140 VanDerWaalsContact C-N 3.32Å; F138-K140 PolarHBondContact O-N 3.48Å; K140-I142 VanDerWaalsContact C-N 3.33Å; K140-K143 CarbonylContact O-C 3.49Å; K140-P144 WeakPolarHBondContact O-CA 3.33Å; K140-M146 WeakPolarHBondContact CE-O 3.32Å; K140-M146 HydrophobicContact CG-CB 4.42Å; K140-E148 IonicContact NZ-OE1 2.7Å; K140-E148 PolarHBondContact NZ-OE1 3.48Å; K140-E311 IonicContact NZ-OE1 3.92Å; K140-E311 PolarHBondContact NZ-OE1 3.21Å
141	I	95	Very high	90.1	Very high	15 Å²	15	46 Å²	46	8%	0.077	25%	0.247	C	C	.	.	H	α-helix	trans	-66.9	-40	172.2	-59.2	172.9	0	0	0	110.4	S111 A114 S137 F138 V139 A318 M319 M322	S111-I141 VanDerWaalsContact CA-O 3.25Å; S111-I141 WeakPolarHBondContact CA-O 3.5Å; S111-I141 PolarHBondContact N-O 2.89Å; A114-I141 HydrophobicContact CB-CG2 4.04Å; S137-I141 WeakPolarHBondContact O-CG1 3.35Å; S137-I141 PolarHBondContact O-N 3.12Å; F138-I141 WeakPolarHBondContact O-CB 3.49Å; F138-I141 PolarHBondContact O-N 2.9Å; F138-I141 VanDerWaalsContact O-N 3.14Å; V139-I141 PolarHBondContact O-N 2.73Å; I141-A318 HydrophobicContact CD1-CB 3.78Å; I141-M319 HydrophobicContact CB-CE 4.47Å; I141-M319 HydrophobicContact CD1-CE 3.43Å; I141-M319 VanDerWaalsContact CD1-CE 3.43Å; I141-M319 HydrophobicContact CD1-CG 4.36Å; I141-M319 HydrophobicContact CD1-SD 3.93Å; I141-M319 HydrophobicContact CG1-CE 3.54Å; I141-M319 HydrophobicContact CG2-CE 4.14Å; I141-M322 HydrophobicContact CB-CE 4.19Å; I141-M322 HydrophobicContact CD1-CE 4.15Å; I141-M322 HydrophobicContact CG2-CE 4.02Å
142	I	93.7	Very high	89.4	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.021	28%	0.28	C	S	.	.	H	α-helix	trans	-76.2	-47.6	-179.1	-61.6	156.4	0	0	0	110.4	S111 A114 I115 L118 F138 V139 K140 F158 L165 V167	S111-I142 VanDerWaalsContact CB-O 3.25Å; S111-I142 WeakPolarHBondContact CB-O 3.14Å; S111-I142 PolarHBondContact OG-O 2.79Å; A114-I142 HydrophobicContact CB-CG1 4.1Å; I115-I142 HydrophobicContact CD1-CG2 4.42Å; I115-I142 HydrophobicContact CG1-CG2 3.85Å; L118-I142 HydrophobicContact CD1-CD1 3.93Å; L118-I142 HydrophobicContact CD1-CG1 4.34Å; F138-I142 HydrophobicContact CD1-CD1 4.03Å; F138-I142 HydrophobicContact CE1-CD1 3.81Å; V139-I142 CarbonylContact O-C 3.44Å; V139-I142 WeakPolarHBondContact O-CA 3.44Å; V139-I142 WeakPolarHBondContact O-CB 3.5Å; V139-I142 PolarHBondContact O-N 3.45Å; K140-I142 VanDerWaalsContact C-N 3.33Å; I142-F158 HydrophobicContact CG2-CE1 4.19Å; I142-F158 HydrophobicContact CG2-CZ 4.28Å; I142-L165 HydrophobicContact CD1-CD2 3.93Å; I142-L165 HydrophobicContact CG1-CD2 4.41Å; I142-L165 HydrophobicContact CG2-CD2 4.02Å; I142-V167 HydrophobicContact CD1-CG2 4.16Å
143	K	92.6	Very high	89	Confident	102 Å²	102	56.6 Å²	56.6	44%	0.443	30%	0.295	S	S	.	.			trans	-130.6	92.6	-179.5	-171.2	179	-177.9	-177.1	0	109.8	V139 K140 E145 M146 F158	V139-K143 PolarHBondContact O-N 3.46Å; K140-K143 CarbonylContact O-C 3.49Å; K143-E145 PolarHBondContact O-N 3.36Å; K143-E145 VanDerWaalsContact O-N 3.11Å; K143-M146 VanDerWaalsContact O-CB 3.25Å; K143-M146 WeakPolarHBondContact O-CB 3.36Å; K143-M146 PolarHBondContact O-N 3.03Å; K143-F158 HydrophobicContact CB-CE2 4.33Å; K143-F158 HydrophobicContact CB-CZ 4.21Å; K143-F158 HydrophobicContact CD-CE2 4.02Å; K143-F158 HydrophobicContact CD-CZ 4.45Å
144	P	91.4	Very high	88.9	Confident	95 Å²	95	60.3 Å²	60.3	62%	0.617	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-24.5	-175.4	-27.6	36	0	0	0	115.4	K140 M146	K140-P144 WeakPolarHBondContact O-CA 3.33Å; P144-M146 PolarHBondContact O-N 3.33Å
145	E	88.9	Confident	88.7	Confident	172 Å²	172	63 Å²	63	80%	0.804	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-0.6	179.1	-59.7	-179.9	-178.8	0	0	113.4	K143 T147	K143-E145 PolarHBondContact O-N 3.36Å; K143-E145 VanDerWaalsContact O-N 3.11Å; E145-T147 PolarHBondContact O-N 3Å
146	M	86.9	Confident	88.6	Confident	41 Å²	41	63.9 Å²	63.9	20%	0.202	33%	0.331	C	S	.	.			trans	-66.2	122.5	-178.4	-170.6	71.5	-169	0	0	111.5	V139 K140 K143 P144 F158	V139-M146 HydrophobicContact CG1-CB 4.23Å; V139-M146 HydrophobicContact CG1-CG 3.86Å; V139-M146 HydrophobicContact CG1-SD 4.45Å; K140-M146 WeakPolarHBondContact CE-O 3.32Å; K140-M146 HydrophobicContact CG-CB 4.42Å; K143-M146 VanDerWaalsContact O-CB 3.25Å; K143-M146 WeakPolarHBondContact O-CB 3.36Å; K143-M146 PolarHBondContact O-N 3.03Å; P144-M146 PolarHBondContact O-N 3.33Å; M146-F158 HydrophobicContact SD-CD2 4.3Å; M146-F158 HydrophobicContact SD-CE2 4.44Å
147	T	85.4	Confident	88.5	Confident	77 Å²	77	70 Å²	70	47%	0.472	36%	0.358	S	S	.	.			trans	-84.3	151.8	171	37.5	0	0	0	0	111	E145 D149	E145-T147 PolarHBondContact O-N 3Å; T147-D149 WeakPolarHBondContact CB-OD2 3.48Å; T147-D149 PolarHBondContact O-N 3.3Å; T147-D149 VanDerWaalsContact OG1-CG 3.24Å; T147-D149 PolarHBondContact OG1-OD2 2.91Å
148	E	84.6	Confident	88.2	Confident	82 Å²	82	70.8 Å²	70.8	38%	0.383	36%	0.362	S	S	.	.			trans	-78.2	60.6	176.3	-62.2	-171.7	-166.9	0	0	110.7	Y136 K140 R314	Y136-E148 HydrophobicContact CD1-CB 4.33Å; Y136-E148 HydrophobicContact CD1-CG 4.08Å; Y136-E148 HydrophobicContact CD2-CB 4.18Å; Y136-E148 HydrophobicContact CD2-CG 3.94Å; Y136-E148 HydrophobicContact CE1-CB 4.28Å; Y136-E148 HydrophobicContact CE2-CB 4.11Å; Y136-E148 HydrophobicContact CE2-CG 4.39Å; Y136-E148 HydrophobicContact CG-CB 4.29Å; Y136-E148 HydrophobicContact CG-CG 3.77Å; K140-E148 IonicContact NZ-OE1 2.7Å; K140-E148 PolarHBondContact NZ-OE1 3.48Å; E148-R314 IonicContact OE1-NH1 3.39Å; E148-R314 IonicContact OE2-NH1 2.83Å
149	D	70.3	Confident	87.9	Confident	103 Å²	103	76.8 Å²	76.8	55%	0.551	39%	0.39	S	S	*	.			trans	-91.9	146.2	-177.4	-63.1	-26.2	0	0	0	111.3	Y136 T147	Y136-D149 PolarHBondContact OH-O 3.5Å; T147-D149 WeakPolarHBondContact CB-OD2 3.48Å; T147-D149 PolarHBondContact O-N 3.3Å; T147-D149 VanDerWaalsContact OG1-CG 3.24Å; T147-D149 PolarHBondContact OG1-OD2 2.91Å
150	G	69	Low	87.3	Confident	53 Å²	53	78.7 Å²	78.7	55%	0.546	40%	0.4	S	S	.	.	S	Bend	trans	137.5	157	179.2	0	0	0	0	0	112.6
151	N	75.4	Confident	86.5	Confident	102 Å²	102	84.9 Å²	84.9	55%	0.545	43%	0.429	S	S	.	.			trans	-67.2	149.3	175.4	-71.4	-29.1	0	0	0	110.8	R132 E154	R132-N151 PolarHBondContact NH1-O 2.91Å; N151-E154 HydrophobicContact CB-CB 4.28Å; N151-E154 VanDerWaalsContact CB-CD 3.41Å; N151-E154 HydrophobicContact CB-CG 4.05Å; N151-E154 WeakPolarHBondContact CB-OE2 3.46Å; N151-E154 PolarHBondContact ND2-OE1 3.29Å; N151-E154 PolarHBondContact ND2-OE2 2.84Å
152	K	81.3	Confident	85.7	Confident	165 Å²	165	93.6 Å²	93.6	72%	0.717	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	135.5	172.3	-65.6	178.7	-177.5	175.5	0	109.1
153	H	87.8	Confident	84.9	Confident	94 Å²	94	94 Å²	94	44%	0.435	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	30.8	175	-43	153.9	0	0	0	115.7	W171 W204	H153-W171 HydrophobicContact CB-CD2 3.97Å; H153-W171 HydrophobicContact CB-CE3 4.43Å; H153-W171 HydrophobicContact CB-CG 4.45Å; H153-W171 HydrophobicContact CB-CH2 4.27Å; H153-W171 HydrophobicContact CB-CZ2 3.74Å; H153-W171 AromaticContact CD2-CH2 3.18Å; H153-W171 WeakPolarHBondContact CD2-CH2 3.29Å; H153-W171 AromaticContact CD2-CZ2 3.32Å; H153-W171 WeakPolarHBondContact CD2-CZ2 3.29Å; H153-W171 AromaticContact CD2-CZ3 3.81Å; H153-W171 AromaticContact CG-CE2 3.97Å; H153-W171 AromaticContact CG-CH2 3.92Å; H153-W171 AromaticContact CG-CZ2 3.59Å; H153-W171 AromaticContact NE2-CH2 3.98Å; H153-W204 AromaticContact NE2-CZ2 3.89Å
154	E	91.7	Very high	84.6	Confident	99 Å²	99	92.7 Å²	92.7	46%	0.463	47%	0.474	S	S	.	.	S	Bend	trans	-125.9	162.8	176.4	-69	-179.9	-170.4	0	0	111.1	N151	N151-E154 HydrophobicContact CB-CB 4.28Å; N151-E154 VanDerWaalsContact CB-CD 3.41Å; N151-E154 HydrophobicContact CB-CG 4.05Å; N151-E154 WeakPolarHBondContact CB-OE2 3.46Å; N151-E154 PolarHBondContact ND2-OE1 3.29Å; N151-E154 PolarHBondContact ND2-OE2 2.84Å
155	D	93.9	Very high	84.5	Confident	69 Å²	69	88.2 Å²	88.2	37%	0.369	45%	0.445	S	S	.	.			trans	-68.7	142.6	172.6	-65.6	-10.6	0	0	0	110.2	F157 F169 L170 W171	D155-F157 HydrophobicContact CB-CE2 3.87Å; D155-F157 HydrophobicContact CB-CZ 3.72Å; D155-F169 CarbonylContact C-O 3.59Å; D155-F169 VanDerWaalsContact CA-O 3.29Å; D155-F169 WeakPolarHBondContact CA-O 3.48Å; D155-L170 HydrophobicContact CB-CD2 4.2Å; D155-L170 VanDerWaalsContact OD1-CA 3.3Å; D155-L170 WeakPolarHBondContact OD1-CA 3.4Å; D155-W171 PolarHBondContact OD1-N 3.45Å
156	I	94.1	Very high	84.7	Confident	20 Å²	20	82.3 Å²	82.3	10%	0.103	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	127.5	-176.8	-53.2	174.9	0	0	0	108.3	R132 F135 Y136 F169	R132-I156 HydrophobicContact CG-CD1 4.16Å; F135-I156 HydrophobicContact CE1-CB 4.4Å; F135-I156 HydrophobicContact CE1-CG2 3.98Å; F135-I156 HydrophobicContact CZ-CG2 4.16Å; Y136-I156 HydrophobicContact CE2-CD1 4.49Å; Y136-I156 VanDerWaalsContact OH-CD1 3.3Å; Y136-I156 WeakPolarHBondContact OH-CD1 3.41Å; I156-F169 HydrophobicContact CB-CB 4.21Å; I156-F169 HydrophobicContact CB-CD1 4.33Å; I156-F169 HydrophobicContact CD1-CD1 4.12Å; I156-F169 HydrophobicContact CG1-CD1 4.08Å; I156-F169 PolarHBondContact N-O 2.92Å; I156-F169 PolarHBondContact O-N 3.42Å
157	F	93	Very high	85.1	Confident	133 Å²	133	80.3 Å²	80.3	58%	0.583	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.6	125.2	-176.6	-54.6	-79.4	0	0	0	109.8	D155 D168 L170	D155-F157 HydrophobicContact CB-CE2 3.87Å; D155-F157 HydrophobicContact CB-CZ 3.72Å; F157-D168 HydrophobicContact CD1-CB 4.03Å; F157-D168 WeakPolarHBondContact CD1-OD1 3.25Å; F157-D168 HydrophobicContact CE1-CB 4.34Å; F157-L170 HydrophobicContact CE1-CD2 4.06Å; F157-L170 HydrophobicContact CZ-CD2 4.38Å
158	F	91.5	Very high	85.6	Confident	18 Å²	18	77.2 Å²	77.2	8%	0.079	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	121.8	171.7	172.2	-93.2	0	0	0	109.4	F135 V139 I142 K143 M146 D160 V167	F135-F158 HydrophobicContact CE2-CB 4.47Å; F135-F158 HydrophobicContact CZ-CB 4.12Å; V139-F158 HydrophobicContact CG1-CD1 4.11Å; V139-F158 HydrophobicContact CG1-CD2 3.62Å; V139-F158 HydrophobicContact CG1-CE1 4.19Å; V139-F158 HydrophobicContact CG1-CE2 3.71Å; V139-F158 HydrophobicContact CG1-CG 3.83Å; V139-F158 HydrophobicContact CG1-CZ 4Å; V139-F158 HydrophobicContact CG2-CB 4.37Å; V139-F158 HydrophobicContact CG2-CD1 4.32Å; V139-F158 HydrophobicContact CG2-CG 4.25Å; I142-F158 HydrophobicContact CG2-CE1 4.19Å; I142-F158 HydrophobicContact CG2-CZ 4.28Å; K143-F158 HydrophobicContact CB-CE2 4.33Å; K143-F158 HydrophobicContact CB-CZ 4.21Å; K143-F158 HydrophobicContact CD-CE2 4.02Å; K143-F158 HydrophobicContact CD-CZ 4.45Å; M146-F158 HydrophobicContact SD-CD2 4.3Å; M146-F158 HydrophobicContact SD-CE2 4.44Å; F158-D160 HydrophobicContact CE1-CB 4.38Å; F158-D160 HydrophobicContact CZ-CB 4.47Å; F158-V167 WeakPolarHBondContact CA-O 3.35Å; F158-V167 HydrophobicContact CB-CB 4.37Å; F158-V167 WeakPolarHBondContact CB-O 3.34Å; F158-V167 HydrophobicContact CD1-CB 4.03Å; F158-V167 HydrophobicContact CD1-CG2 4.01Å; F158-V167 PolarHBondContact N-O 2.89Å; F158-V167 PolarHBondContact O-N 3.33Å
159	Q	88.7	Confident	86.1	Confident	126 Å²	126	73.3 Å²	73.3	59%	0.589	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.2	126.1	177.9	-179.6	167	45.2	0	0	110.3	N166	Q159-N166 WeakPolarHBondContact CG-OD1 3.39Å; Q159-N166 PolarHBondContact NE2-OD1 2.96Å
160	D	83.1	Confident	87.4	Confident	40 Å²	40	68.9 Å²	68.9	21%	0.214	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	105.5	168.7	-178.3	58.6	0	0	0	110.2	F158 K162 S163 S164 L165	F158-D160 HydrophobicContact CE1-CB 4.38Å; F158-D160 HydrophobicContact CZ-CB 4.47Å; D160-K162 PolarHBondContact O-N 3.12Å; D160-S163 PolarHBondContact O-N 3.43Å; D160-S163 WeakPolarHBondContact OD2-CB 3.27Å; D160-S163 PolarHBondContact OD2-N 3.31Å; D160-S163 PolarHBondContact OD2-OG 3.3Å; D160-S164 PolarHBondContact O-N 3.46Å; D160-L165 HydrophobicContact CB-CB 4.43Å; D160-L165 PolarHBondContact N-O 2.95Å; D160-L165 PolarHBondContact O-N 3.36Å
161	Q	78.4	Confident	88.7	Confident	172 Å²	172	68.3 Å²	68.3	80%	0.804	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-24.3	-176.8	-67.1	-179.1	-9.8	0	0	113.3
162	K	78.1	Confident	89.7	Confident	198 Å²	198	64.7 Å²	64.7	86%	0.861	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-35.1	-177.5	-69.7	-178.6	-179.9	176.8	0	112.8	D160	D160-K162 PolarHBondContact O-N 3.12Å
163	S	77.1	Confident	90.4	Very high	12 Å²	12	57.7 Å²	57.7	8%	0.084	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	2.1	-177.7	60.5	0	0	0	0	114.3	I115 S119 E120 D160 L165	I115-S163 VanDerWaalsContact CG2-CB 3.49Å; S119-S163 PolarHBondContact OG-O 3.23Å; E120-S163 PolarHBondContact N-O 2.63Å; D160-S163 PolarHBondContact O-N 3.43Å; D160-S163 WeakPolarHBondContact OD2-CB 3.27Å; D160-S163 PolarHBondContact OD2-N 3.31Å; D160-S163 PolarHBondContact OD2-OG 3.3Å; S163-L165 PolarHBondContact O-N 2.94Å; S163-L165 VanDerWaalsContact O-N 3.12Å; S163-L165 WeakPolarHBondContact OG-CB 3.32Å
164	S	85.3	Confident	90.7	Very high	76 Å²	76	55 Å²	55	53%	0.531	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	29.9	-173.3	-55.6	0	0	0	0	113.1	D160	D160-S164 PolarHBondContact O-N 3.46Å
165	L	89.6	Confident	90.8	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	127.5	177.6	166.2	59.2	0	0	0	109.6	L118 K121 I142 D160 S163 V167	L118-L165 HydrophobicContact CB-CD1 3.77Å; L118-L165 HydrophobicContact CB-CD2 3.96Å; L118-L165 HydrophobicContact CB-CG 4.48Å; L118-L165 HydrophobicContact CD1-CD2 4.43Å; L118-L165 WeakPolarHBondContact O-CD1 3.46Å; K121-L165 WeakPolarHBondContact O-CD1 3.29Å; I142-L165 HydrophobicContact CD1-CD2 3.93Å; I142-L165 HydrophobicContact CG1-CD2 4.41Å; I142-L165 HydrophobicContact CG2-CD2 4.02Å; D160-L165 HydrophobicContact CB-CB 4.43Å; D160-L165 PolarHBondContact N-O 2.95Å; D160-L165 PolarHBondContact O-N 3.36Å; S163-L165 PolarHBondContact O-N 2.94Å; S163-L165 VanDerWaalsContact O-N 3.12Å; S163-L165 WeakPolarHBondContact OG-CB 3.32Å; L165-V167 HydrophobicContact CD1-CG2 3.84Å; L165-V167 HydrophobicContact CD2-CG2 4.46Å; L165-V167 HydrophobicContact CG-CG2 4.08Å
166	N	93	Very high	90.8	Very high	48 Å²	48	49.7 Å²	49.7	26%	0.257	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	124.2	174.2	-64.1	-6.4	0	0	0	109.7	K121 R122 V123 Q159	K121-N166 PolarHBondContact O-N 3.05Å; R122-N166 WeakPolarHBondContact CA-O 3.35Å; R122-N166 HydrophobicContact CG-CB 4.43Å; V123-N166 PolarHBondContact N-O 3.45Å; Q159-N166 WeakPolarHBondContact CG-OD1 3.39Å; Q159-N166 PolarHBondContact NE2-OD1 2.96Å
167	V	95.3	Very high	90.8	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	112.1	172.4	-167.9	0	0	0	0	108	V123 F125 F135 F138 V139 I142 F158 L165	V123-V167 HydrophobicContact CB-CG1 4.15Å; V123-V167 HydrophobicContact CB-CG2 4.31Å; V123-V167 HydrophobicContact CG1-CG1 4.23Å; V123-V167 CarbonylContact O-C 3.55Å; V123-V167 VanDerWaalsContact O-CA 3.29Å; V123-V167 WeakPolarHBondContact O-CA 3.33Å; F125-V167 HydrophobicContact CD2-CG1 3.98Å; F125-V167 HydrophobicContact CE2-CG1 3.84Å; F135-V167 HydrophobicContact CD2-CG1 3.82Å; F135-V167 HydrophobicContact CE2-CB 4.19Å; F135-V167 HydrophobicContact CE2-CG1 3.65Å; F135-V167 WeakPolarHBondContact CE2-O 3.35Å; F138-V167 HydrophobicContact CD1-CG1 4.28Å; F138-V167 HydrophobicContact CE1-CG1 4.45Å; F138-V167 HydrophobicContact CE1-CG2 4.47Å; V139-V167 HydrophobicContact CG2-CB 4.28Å; V139-V167 HydrophobicContact CG2-CG1 4.07Å; I142-V167 HydrophobicContact CD1-CG2 4.16Å; F158-V167 WeakPolarHBondContact CA-O 3.35Å; F158-V167 HydrophobicContact CB-CB 4.37Å; F158-V167 WeakPolarHBondContact CB-O 3.34Å; F158-V167 HydrophobicContact CD1-CB 4.03Å; F158-V167 HydrophobicContact CD1-CG2 4.01Å; F158-V167 PolarHBondContact N-O 2.89Å; F158-V167 PolarHBondContact O-N 3.33Å; L165-V167 HydrophobicContact CD1-CG2 3.84Å; L165-V167 HydrophobicContact CD2-CG2 4.46Å; L165-V167 HydrophobicContact CG-CG2 4.08Å
168	D	95.4	Very high	90.9	Very high	11 Å²	11	50.4 Å²	50.4	6%	0.059	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	137.9	-176.6	-53.6	-27.4	0	0	0	109.4	R122 V123 V124 F125 F157 L170	R122-D168 IonicContact CZ-OD2 3.5Å; R122-D168 IonicContact NE-OD2 3.48Å; R122-D168 PolarHBondContact NE-OD2 3.16Å; R122-D168 IonicContact NH2-OD2 3.6Å; R122-D168 PolarHBondContact NH2-OD2 3.24Å; V123-D168 PolarHBondContact O-N 3.25Å; V124-D168 CarbonylContact C-O 3.6Å; V124-D168 WeakPolarHBondContact CA-O 3.36Å; V124-D168 HydrophobicContact CG2-CB 4.33Å; F125-D168 PolarHBondContact N-O 3.41Å; F157-D168 HydrophobicContact CD1-CB 4.03Å; F157-D168 WeakPolarHBondContact CD1-OD1 3.25Å; F157-D168 HydrophobicContact CE1-CB 4.34Å; D168-L170 HydrophobicContact CB-CD2 4.48Å
169	F	97.1	Very high	91.1	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	128.5	162.4	169.3	-97.6	0	0	0	109.3	F125 I131 R132 F135 D155 I156 W171	F125-F169 HydrophobicContact CB-CD2 4.06Å; F125-F169 CarbonylContact O-C 3.51Å; F125-F169 VanDerWaalsContact O-CA 3.28Å; F125-F169 WeakPolarHBondContact O-CA 3.37Å; I131-F169 HydrophobicContact CB-CE2 4.34Å; I131-F169 HydrophobicContact CG2-CD2 4.47Å; I131-F169 HydrophobicContact CG2-CE2 4.22Å; R132-F169 HydrophobicContact CB-CD1 4.34Å; R132-F169 HydrophobicContact CB-CD2 4.01Å; R132-F169 HydrophobicContact CB-CE1 3.94Å; R132-F169 HydrophobicContact CB-CE2 3.58Å; R132-F169 HydrophobicContact CB-CG 4.38Å; R132-F169 HydrophobicContact CB-CZ 3.55Å; R132-F169 HydrophobicContact CG-CD1 3.93Å; R132-F169 HydrophobicContact CG-CD2 4.29Å; R132-F169 HydrophobicContact CG-CE1 3.85Å; R132-F169 HydrophobicContact CG-CE2 4.21Å; R132-F169 HydrophobicContact CG-CG 4.16Å; R132-F169 HydrophobicContact CG-CZ 4.01Å; F135-F169 HydrophobicContact CB-CB 4.33Å; F135-F169 HydrophobicContact CB-CD2 4.42Å; F135-F169 HydrophobicContact CD1-CB 3.98Å; F135-F169 HydrophobicContact CD2-CB 3.88Å; F135-F169 HydrophobicContact CE1-CB 4.23Å; F135-F169 HydrophobicContact CE2-CB 4.11Å; F135-F169 HydrophobicContact CG-CB 3.8Å; F135-F169 HydrophobicContact CZ-CB 4.28Å; D155-F169 CarbonylContact C-O 3.59Å; D155-F169 VanDerWaalsContact CA-O 3.29Å; D155-F169 WeakPolarHBondContact CA-O 3.48Å; I156-F169 HydrophobicContact CB-CB 4.21Å; I156-F169 HydrophobicContact CB-CD1 4.33Å; I156-F169 HydrophobicContact CD1-CD1 4.12Å; I156-F169 HydrophobicContact CG1-CD1 4.08Å; I156-F169 PolarHBondContact N-O 2.92Å; I156-F169 PolarHBondContact O-N 3.42Å; F169-W171 HydrophobicContact CE1-CB 4.37Å; F169-W171 AromaticContact CE1-CE3 3.94Å; F169-W171 HydrophobicContact CE1-CE3 3.94Å; F169-W171 AromaticContact CZ-CE3 3.75Å; F169-W171 HydrophobicContact CZ-CE3 3.75Å; F169-W171 HydrophobicContact CZ-CZ3 4.37Å
170	L	96.8	Very high	91.3	Very high	10 Å²	10	46.2 Å²	46.2	5%	0.052	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	129.9	-179.6	-54.1	-179	0	0	0	110.8	V124 F125 A126 G127 D155 F157 D168 Y172 W186	V124-L170 HydrophobicContact CG1-CD1 3.66Å; V124-L170 HydrophobicContact CG1-CG 3.97Å; F125-L170 PolarHBondContact O-N 2.99Å; A126-L170 WeakPolarHBondContact CA-O 3.39Å; A126-L170 HydrophobicContact CB-CB 4.25Å; G127-L170 PolarHBondContact N-O 3.27Å; G127-L170 VanDerWaalsContact N-O 3.16Å; D155-L170 HydrophobicContact CB-CD2 4.2Å; D155-L170 VanDerWaalsContact OD1-CA 3.3Å; D155-L170 WeakPolarHBondContact OD1-CA 3.4Å; F157-L170 HydrophobicContact CE1-CD2 4.06Å; F157-L170 HydrophobicContact CZ-CD2 4.38Å; D168-L170 HydrophobicContact CB-CD2 4.48Å; L170-Y172 HydrophobicContact CB-CD2 3.73Å; L170-Y172 HydrophobicContact CB-CE2 3.74Å; L170-Y172 HydrophobicContact CD1-CE2 4.38Å; L170-Y172 PolarHBondContact O-N 3.46Å; L170-Y172 VanDerWaalsContact O-N 3.08Å; L170-W186 HydrophobicContact CD1-CH2 4.02Å; L170-W186 HydrophobicContact CD1-CZ2 3.57Å
171	W	96.6	Very high	91.8	Very high	42 Å²	42	48.7 Å²	48.7	16%	0.159	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	92.2	-176.7	-175.9	-101.1	0	0	0	111.7	H153 D155 F169 P173 W204	H153-W171 HydrophobicContact CB-CD2 3.97Å; H153-W171 HydrophobicContact CB-CE3 4.43Å; H153-W171 HydrophobicContact CB-CG 4.45Å; H153-W171 HydrophobicContact CB-CH2 4.27Å; H153-W171 HydrophobicContact CB-CZ2 3.74Å; H153-W171 AromaticContact CD2-CH2 3.18Å; H153-W171 WeakPolarHBondContact CD2-CH2 3.29Å; H153-W171 AromaticContact CD2-CZ2 3.32Å; H153-W171 WeakPolarHBondContact CD2-CZ2 3.29Å; H153-W171 AromaticContact CD2-CZ3 3.81Å; H153-W171 AromaticContact CG-CE2 3.97Å; H153-W171 AromaticContact CG-CH2 3.92Å; H153-W171 AromaticContact CG-CZ2 3.59Å; H153-W171 AromaticContact NE2-CH2 3.98Å; D155-W171 PolarHBondContact OD1-N 3.45Å; F169-W171 HydrophobicContact CE1-CB 4.37Å; F169-W171 AromaticContact CE1-CE3 3.94Å; F169-W171 HydrophobicContact CE1-CE3 3.94Å; F169-W171 AromaticContact CZ-CE3 3.75Å; F169-W171 HydrophobicContact CZ-CE3 3.75Å; F169-W171 HydrophobicContact CZ-CZ3 4.37Å; W171-P173 HydrophobicContact CH2-CB 4.45Å; W171-P173 HydrophobicContact CZ2-CB 3.9Å; W171-P173 HydrophobicContact CZ2-CG 3.98Å; W171-W204 AromaticContact CH2-CZ2 3.96Å; W171-W204 HydrophobicContact CH2-CZ2 3.96Å; W171-W204 AromaticContact CH2-NE1 3.89Å; W171-W204 AromaticContact CZ2-CE2 3.74Å; W171-W204 HydrophobicContact CZ2-CH2 4.14Å; W171-W204 AromaticContact CZ2-CZ2 3.48Å; W171-W204 HydrophobicContact CZ2-CZ2 3.48Å; W171-W204 VanDerWaalsContact CZ2-CZ2 3.48Å; W171-W204 AromaticContact CZ2-NE1 3.96Å
172	Y	96.6	Very high	92.6	Very high	25 Å²	25	45 Å²	45	10%	0.098	23%	0.228	C	C	.	.			trans	-128.7	74.9	175.3	-71.8	-94.8	0	0	0	109.4	G127 L170 E174 S178 M179 R182	G127-Y172 CarbonylContact C-O 3.54Å; G127-Y172 VanDerWaalsContact CA-O 3.25Å; G127-Y172 WeakPolarHBondContact CA-O 3.29Å; G127-Y172 CarbonylContact O-C 3.52Å; G127-Y172 PolarHBondContact O-N 3.48Å; G127-Y172 VanDerWaalsContact O-N 3.11Å; L170-Y172 HydrophobicContact CB-CD2 3.73Å; L170-Y172 HydrophobicContact CB-CE2 3.74Å; L170-Y172 HydrophobicContact CD1-CE2 4.38Å; L170-Y172 PolarHBondContact O-N 3.46Å; L170-Y172 VanDerWaalsContact O-N 3.08Å; Y172-E174 PolarHBondContact O-N 2.93Å; Y172-S178 WeakPolarHBondContact CE1-O 3.25Å; Y172-S178 VanDerWaalsContact CE1-OG 3.28Å; Y172-S178 WeakPolarHBondContact CE1-OG 3.28Å; Y172-M179 HydrophobicContact CD1-CB 4.13Å; Y172-M179 WeakPolarHBondContact O-CE 3.21Å; Y172-R182 HydrophobicContact CE1-CB 3.85Å; Y172-R182 HydrophobicContact CE1-CG 4.4Å; Y172-R182 HydrophobicContact CE2-CB 4.49Å; Y172-R182 HydrophobicContact CE2-CG 4.16Å; Y172-R182 PolarHBondContact OH-NE 3.18Å; Y172-R182 PolarHBondContact OH-NH2 2.85Å
173	P	95.3	Very high	93.3	Very high	19 Å²	19	35.6 Å²	35.6	12%	0.123	19%	0.188	C	C	.	.			trans	-72.2	-11.5	-168.5	29.8	-37.7	0	0	0	114.7	D128 W171 A201 W204	D128-P173 HydrophobicContact CB-CB 3.94Å; W171-P173 HydrophobicContact CH2-CB 4.45Å; W171-P173 HydrophobicContact CZ2-CB 3.9Å; W171-P173 HydrophobicContact CZ2-CG 3.98Å; P173-A201 WeakPolarHBondContact O-CB 3.44Å; P173-W204 HydrophobicContact CB-CB 3.99Å; P173-W204 HydrophobicContact CB-CD2 3.81Å; P173-W204 HydrophobicContact CB-CG 3.53Å; P173-W204 HydrophobicContact CG-CD2 4.22Å; P173-W204 HydrophobicContact CG-CE3 4.44Å; P173-W204 HydrophobicContact CG-CG 4.34Å
174	E	94.8	Very high	94	Very high	38 Å²	38	37.1 Å²	37.1	18%	0.178	19%	0.194	C	C	.	.	S	Bend	trans	-128.6	142.7	-178	-62.2	-168.3	86.2	0	0	111.8	Y172 N176 W204 S205 L208	Y172-E174 PolarHBondContact O-N 2.93Å; E174-N176 VanDerWaalsContact C-N 3.25Å; E174-N176 HydrophobicContact CB-CB 4.44Å; E174-N176 PolarHBondContact O-N 3.49Å; E174-W204 HydrophobicContact CG-CB 3.76Å; E174-S205 WeakPolarHBondContact OE1-CA 3.23Å; E174-S205 PolarHBondContact OE1-OG 3Å; E174-L208 WeakPolarHBondContact OE2-CD1 3.33Å
175	A	94.1	Very high	94.3	Very high	2 Å²	2	34.7 Å²	34.7	2%	0.017	18%	0.177	C	C	.	.	S	Bend	trans	-78.9	75.2	171.2	0	0	0	0	0	109.9	M179 Y219 N222 I226 W241	A175-M179 HydrophobicContact CB-SD 4.44Å; A175-Y219 HydrophobicContact CB-CD2 3.99Å; A175-Y219 HydrophobicContact CB-CE2 3.67Å; A175-N222 WeakPolarHBondContact O-CB 3.25Å; A175-N222 PolarHBondContact O-ND2 3.38Å; A175-I226 HydrophobicContact CB-CD1 4.15Å; A175-W241 HydrophobicContact CB-CH2 4.45Å
176	N	93.7	Very high	94.4	Very high	53 Å²	53	34.9 Å²	34.9	28%	0.283	18%	0.178	S	C	.	.	S	Bend	trans	-124.3	-170.4	-178.4	69.2	17.7	0	0	0	111.6	E174 S178 M179 K180	E174-N176 VanDerWaalsContact C-N 3.25Å; E174-N176 HydrophobicContact CB-CB 4.44Å; E174-N176 PolarHBondContact O-N 3.49Å; N176-S178 PolarHBondContact O-N 3.32Å; N176-S178 WeakPolarHBondContact OD1-CA 3.3Å; N176-S178 WeakPolarHBondContact OD1-CB 3.38Å; N176-S178 PolarHBondContact OD1-N 3.44Å; N176-M179 PolarHBondContact O-N 2.92Å; N176-M179 PolarHBondContact OD1-N 3.24Å; N176-K180 PolarHBondContact O-N 3.49Å
177	N	93.4	Very high	94	Very high	105 Å²	105	33.3 Å²	33.3	56%	0.561	17%	0.17	S	C	*	.	H	α-helix	trans	-58.4	-32.6	179.7	-70.1	-26.6	0	0	0	113.1	K180 D181	N177-K180 WeakPolarHBondContact O-CB 3.46Å; N177-K180 PolarHBondContact O-N 2.9Å; N177-D181 WeakPolarHBondContact O-CB 3.19Å; N177-D181 PolarHBondContact O-N 2.94Å
178	S	94.8	Very high	93.4	Very high	63 Å²	63	39.7 Å²	39.7	44%	0.441	20%	0.199	S	C	.	.	H	α-helix	trans	-63.2	-47	177.5	-172.4	0	0	0	0	111.7	Y172 N176 K180 D181 R182	Y172-S178 WeakPolarHBondContact CE1-O 3.25Å; Y172-S178 VanDerWaalsContact CE1-OG 3.28Å; Y172-S178 WeakPolarHBondContact CE1-OG 3.28Å; N176-S178 PolarHBondContact O-N 3.32Å; N176-S178 WeakPolarHBondContact OD1-CA 3.3Å; N176-S178 WeakPolarHBondContact OD1-CB 3.38Å; N176-S178 PolarHBondContact OD1-N 3.44Å; S178-K180 VanDerWaalsContact C-N 3.32Å; S178-K180 PolarHBondContact O-N 3.36Å; S178-D181 PolarHBondContact O-N 3.4Å; S178-R182 PolarHBondContact O-N 3.21Å; S178-R182 VanDerWaalsContact O-N 3.07Å
179	M	95.3	Very high	92.6	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-63.4	-40.5	174.3	-178.3	178.6	-73.3	0	0	111.1	Y172 A175 N176 R182 V183 L199 A201 I226 W241	Y172-M179 HydrophobicContact CD1-CB 4.13Å; Y172-M179 WeakPolarHBondContact O-CE 3.21Å; A175-M179 HydrophobicContact CB-SD 4.44Å; N176-M179 PolarHBondContact O-N 2.92Å; N176-M179 PolarHBondContact OD1-N 3.24Å; M179-R182 PolarHBondContact O-N 2.94Å; M179-V183 HydrophobicContact CG-CG2 4.49Å; M179-V183 WeakPolarHBondContact O-CG2 3.4Å; M179-V183 PolarHBondContact O-N 3.49Å; M179-L199 HydrophobicContact CE-CD2 4.28Å; M179-L199 HydrophobicContact CG-CD2 4.47Å; M179-L199 HydrophobicContact SD-CD2 4.12Å; M179-A201 HydrophobicContact CE-CB 3.87Å; M179-I226 HydrophobicContact CB-CD1 4.32Å; M179-I226 HydrophobicContact CG-CD1 4.28Å; M179-I226 HydrophobicContact SD-CD1 4.27Å; M179-W241 HydrophobicContact SD-CH2 4.37Å; M179-W241 HydrophobicContact SD-CZ3 4.34Å
180	K	94.4	Very high	91	Very high	54 Å²	54	48.5 Å²	48.5	24%	0.235	25%	0.254	C	S	.	.	H	α-helix	trans	-59.2	-49.4	176.5	-169.3	-167.5	172.1	-173.5	0	111.7	N176 N177 S178 R182 V183 M184 A225 I226	N176-K180 PolarHBondContact O-N 3.49Å; N177-K180 WeakPolarHBondContact O-CB 3.46Å; N177-K180 PolarHBondContact O-N 2.9Å; S178-K180 VanDerWaalsContact C-N 3.32Å; S178-K180 PolarHBondContact O-N 3.36Å; K180-R182 VanDerWaalsContact C-N 3.26Å; K180-R182 PolarHBondContact O-N 3.07Å; K180-V183 PolarHBondContact O-N 3.03Å; K180-M184 HydrophobicContact CD-CE 4.17Å; K180-M184 HydrophobicContact CG-CE 3.99Å; K180-M184 HydrophobicContact CG-CG 4.48Å; K180-M184 HydrophobicContact CG-SD 4.39Å; K180-M184 WeakPolarHBondContact O-CB 3.32Å; K180-M184 VanDerWaalsContact O-CG 3.31Å; K180-M184 WeakPolarHBondContact O-CG 3.41Å; K180-M184 PolarHBondContact O-N 3.08Å; K180-A225 HydrophobicContact CD-CB 4.37Å; K180-I226 HydrophobicContact CB-CD1 4.4Å; K180-I226 HydrophobicContact CB-CG1 3.72Å; K180-I226 HydrophobicContact CG-CG1 4Å
181	D	93.8	Very high	89.5	Confident	92 Å²	92	53.3 Å²	53.3	49%	0.492	30%	0.296	S	S	.	.	H	α-helix	trans	-61.5	-37.7	180	-65.5	-20.3	0	0	0	111.2	N177 S178 M184 S185	N177-D181 WeakPolarHBondContact O-CB 3.19Å; N177-D181 PolarHBondContact O-N 2.94Å; S178-D181 PolarHBondContact O-N 3.4Å; D181-M184 HydrophobicContact CB-CE 4.37Å; D181-M184 PolarHBondContact O-N 3.48Å; D181-M184 WeakPolarHBondContact OD1-CE 3.3Å; D181-S185 PolarHBondContact O-N 3.11Å; D181-S185 PolarHBondContact O-OG 2.77Å
182	R	93.3	Very high	88	Confident	94 Å²	94	52.3 Å²	52.3	36%	0.355	30%	0.297	S	S	.	.	H	α-helix	trans	-63.4	-50	173.2	-176.9	56.3	57.9	-173.8	5	112.2	Y172 S178 M179 K180 M184 S185 W186	Y172-R182 HydrophobicContact CE1-CB 3.85Å; Y172-R182 HydrophobicContact CE1-CG 4.4Å; Y172-R182 HydrophobicContact CE2-CB 4.49Å; Y172-R182 HydrophobicContact CE2-CG 4.16Å; Y172-R182 PolarHBondContact OH-NE 3.18Å; Y172-R182 PolarHBondContact OH-NH2 2.85Å; S178-R182 PolarHBondContact O-N 3.21Å; S178-R182 VanDerWaalsContact O-N 3.07Å; M179-R182 PolarHBondContact O-N 2.94Å; K180-R182 VanDerWaalsContact C-N 3.26Å; K180-R182 PolarHBondContact O-N 3.07Å; R182-M184 VanDerWaalsContact C-N 3.28Å; R182-M184 PolarHBondContact O-N 2.9Å; R182-S185 PolarHBondContact O-N 3.11Å; R182-S185 PolarHBondContact O-OG 2.85Å; R182-W186 HydrophobicContact CG-CD2 4.47Å; R182-W186 HydrophobicContact CG-CH2 3.68Å; R182-W186 HydrophobicContact CG-CZ2 3.56Å; R182-W186 HydrophobicContact CG-CZ3 4.18Å; R182-W186 PolarHBondContact O-N 3.13Å
183	V	92.9	Very high	87.5	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.006	31%	0.31	C	S	.	.	H	α-helix	trans	-62.8	-38.6	178	176.4	0	0	0	0	110.8	M179 K180 W186 T187 I226 H229 L230	M179-V183 HydrophobicContact CG-CG2 4.49Å; M179-V183 WeakPolarHBondContact O-CG2 3.4Å; M179-V183 PolarHBondContact O-N 3.49Å; K180-V183 PolarHBondContact O-N 3.03Å; V183-W186 HydrophobicContact CG2-CE3 4.4Å; V183-W186 HydrophobicContact CG2-CZ3 4.26Å; V183-W186 PolarHBondContact O-N 3.39Å; V183-T187 PolarHBondContact O-N 3.33Å; V183-I226 HydrophobicContact CG2-CG2 4.36Å; V183-H229 HydrophobicContact CG1-CB 3.71Å; V183-L230 HydrophobicContact CG1-CD2 3.64Å; V183-L230 HydrophobicContact CG1-CG 4.16Å; V183-L230 HydrophobicContact CG2-CD2 3.98Å
184	M	91.9	Very high	87.4	Confident	44 Å²	44	54.5 Å²	54.5	22%	0.217	31%	0.305	C	S	.	.	H	α-helix	trans	-60.6	-46.3	175.4	-75.7	-169.5	-63	0	0	111.7	K180 D181 R182 W186 T187 H188 H229	K180-M184 HydrophobicContact CD-CE 4.17Å; K180-M184 HydrophobicContact CG-CE 3.99Å; K180-M184 HydrophobicContact CG-CG 4.48Å; K180-M184 HydrophobicContact CG-SD 4.39Å; K180-M184 WeakPolarHBondContact O-CB 3.32Å; K180-M184 VanDerWaalsContact O-CG 3.31Å; K180-M184 WeakPolarHBondContact O-CG 3.41Å; K180-M184 PolarHBondContact O-N 3.08Å; D181-M184 HydrophobicContact CB-CE 4.37Å; D181-M184 PolarHBondContact O-N 3.48Å; D181-M184 WeakPolarHBondContact OD1-CE 3.3Å; R182-M184 VanDerWaalsContact C-N 3.28Å; R182-M184 PolarHBondContact O-N 2.9Å; M184-W186 VanDerWaalsContact C-N 3.28Å; M184-W186 PolarHBondContact O-N 2.86Å; M184-T187 PolarHBondContact O-N 2.98Å; M184-T187 PolarHBondContact O-OG1 3.26Å; M184-H188 PolarHBondContact O-CD2 3.27Å; M184-H188 VanDerWaalsContact O-CD2 3.22Å; M184-H188 PolarHBondContact O-N 3.17Å; M184-H229 HydrophobicContact CG-CB 4.43Å; M184-H229 VanDerWaalsContact SD-CE1 3.57Å; M184-H229 PolarHBondContact SD-NE2 2.99Å; M184-H229 VanDerWaalsContact SD-NE2 3.38Å
185	S	91.4	Very high	87.3	Confident	25 Å²	25	56 Å²	56	18%	0.175	31%	0.314	C	S	.	.	H	α-helix	trans	-58.9	-38.4	-179.8	60.6	0	0	0	0	112.5	D181 R182 T187 H188 E189	D181-S185 PolarHBondContact O-N 3.11Å; D181-S185 PolarHBondContact O-OG 2.77Å; R182-S185 PolarHBondContact O-N 3.11Å; R182-S185 PolarHBondContact O-OG 2.85Å; S185-T187 PolarHBondContact O-N 3.34Å; S185-H188 PolarHBondContact O-N 3.02Å; S185-H188 VanDerWaalsContact O-N 3.16Å; S185-E189 PolarHBondContact O-N 2.87Å
186	W	91.8	Very high	87.4	Confident	5 Å²	5	56.1 Å²	56.1	2%	0.019	32%	0.315	C	S	.	.	H	α-helix	trans	-65.1	-22.1	174	-62.5	-31.6	0	0	0	114.5	V124 L170 R182 V183 M184 K193 P194 V197 L233	V124-W186 HydrophobicContact CG1-CH2 3.71Å; V124-W186 HydrophobicContact CG1-CZ2 3.83Å; L170-W186 HydrophobicContact CD1-CH2 4.02Å; L170-W186 HydrophobicContact CD1-CZ2 3.57Å; R182-W186 HydrophobicContact CG-CD2 4.47Å; R182-W186 HydrophobicContact CG-CH2 3.68Å; R182-W186 HydrophobicContact CG-CZ2 3.56Å; R182-W186 HydrophobicContact CG-CZ3 4.18Å; R182-W186 PolarHBondContact O-N 3.13Å; V183-W186 HydrophobicContact CG2-CE3 4.4Å; V183-W186 HydrophobicContact CG2-CZ3 4.26Å; V183-W186 PolarHBondContact O-N 3.39Å; M184-W186 VanDerWaalsContact C-N 3.28Å; M184-W186 PolarHBondContact O-N 2.86Å; W186-K193 WeakPolarHBondContact O-CG 3.31Å; W186-P194 HydrophobicContact CD2-CG 4.07Å; W186-P194 HydrophobicContact CE3-CG 4.35Å; W186-P194 HydrophobicContact CG-CG 4.16Å; W186-V197 HydrophobicContact CE3-CG2 4.45Å; W186-V197 HydrophobicContact CH2-CG1 4.44Å; W186-V197 HydrophobicContact CZ3-CG1 3.83Å; W186-V197 HydrophobicContact CZ3-CG2 4.41Å; W186-L233 HydrophobicContact CB-CD1 4.05Å; W186-L233 HydrophobicContact CB-CD2 4.18Å; W186-L233 HydrophobicContact CE3-CD2 4.07Å
187	T	85.1	Confident	87.6	Confident	14 Å²	14	53.6 Å²	53.6	9%	0.086	30%	0.301	C	S	.	.	H	α-helix	trans	-80.2	-26.7	175	65.6	0	0	0	0	113	V183 M184 S185 K232 L233	V183-T187 PolarHBondContact O-N 3.33Å; M184-T187 PolarHBondContact O-N 2.98Å; M184-T187 PolarHBondContact O-OG1 3.26Å; S185-T187 PolarHBondContact O-N 3.34Å; T187-K232 HydrophobicContact CG2-CD 4.48Å; T187-L233 HydrophobicContact CG2-CB 4.11Å; T187-L233 HydrophobicContact CG2-CD1 4.41Å
188	H	82.4	Confident	87.8	Confident	134 Å²	134	48.6 Å²	48.6	62%	0.62	27%	0.274	S	S	*	.	H	α-helix	trans	-100.4	-35.4	-172	-70.3	-72.9	0	0	0	113.7	M184 S185	M184-H188 PolarHBondContact O-CD2 3.27Å; M184-H188 VanDerWaalsContact O-CD2 3.22Å; M184-H188 PolarHBondContact O-N 3.17Å; S185-H188 PolarHBondContact O-N 3.02Å; S185-H188 VanDerWaalsContact O-N 3.16Å
189	E	78.3	Confident	88	Confident	113 Å²	113	45.7 Å²	45.7	53%	0.528	25%	0.254	S	S	.	.			trans	-96.2	106.7	-174	-67.7	176.7	-162.7	0	0	111.9	S185 A191 A192 K193	S185-E189 PolarHBondContact O-N 2.87Å; E189-A191 VanDerWaalsContact C-N 3.32Å; E189-A191 PolarHBondContact O-N 3.06Å; E189-A192 HydrophobicContact CB-CB 3.98Å; E189-A192 PolarHBondContact O-N 3.34Å; E189-A192 VanDerWaalsContact O-N 3.15Å; E189-K193 WeakPolarHBondContact O-CG 3.3Å
190	A	65.4	Low	88	Confident	83 Å²	83	45.6 Å²	45.6	69%	0.686	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-60.2	-35.9	-176.5	0	0	0	0	0	114.1	A192	A190-A192 VanDerWaalsContact C-N 3.27Å; A190-A192 PolarHBondContact O-N 3.18Å
191	A	63.8	Low	88.1	Confident	112 Å²	112	43 Å²	43	93%	0.926	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-75	-14.1	-180	0	0	0	0	0	113.9	E189	E189-A191 VanDerWaalsContact C-N 3.32Å; E189-A191 PolarHBondContact O-N 3.06Å
192	A	66.5	Low	88.1	Confident	21 Å²	21	38.6 Å²	38.6	17%	0.174	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-106.7	4.7	-175.9	0	0	0	0	0	113.4	R122 E189 A190 P194	R122-A192 PolarHBondContact NH1-O 3.5Å; E189-A192 HydrophobicContact CB-CB 3.98Å; E189-A192 PolarHBondContact O-N 3.34Å; E189-A192 VanDerWaalsContact O-N 3.15Å; A190-A192 VanDerWaalsContact C-N 3.27Å; A190-A192 PolarHBondContact O-N 3.18Å; A192-P194 VanDerWaalsContact O-CD 3.31Å; A192-P194 WeakPolarHBondContact O-CD 3.49Å
193	K	85.2	Confident	88.2	Confident	85 Å²	85	34.3 Å²	34.3	37%	0.37	20%	0.203	S	C	.	.			trans	-70.3	119.9	-173.6	-67.3	-168.8	172.6	-179.8	0	111.7	W186 E189	W186-K193 WeakPolarHBondContact O-CG 3.31Å; E189-K193 WeakPolarHBondContact O-CG 3.3Å
194	P	92.9	Very high	88.3	Confident	4 Å²	4	36.8 Å²	36.8	3%	0.026	21%	0.212	C	C	.	.			trans	-75.9	145.2	169.7	31.8	-33.8	0	0	0	110.8	V124 W186 A192 V197 A237	V124-P194 HydrophobicContact CB-CB 4.31Å; V124-P194 HydrophobicContact CG2-CB 3.68Å; V124-P194 HydrophobicContact CG2-CG 4.45Å; W186-P194 HydrophobicContact CD2-CG 4.07Å; W186-P194 HydrophobicContact CE3-CG 4.35Å; W186-P194 HydrophobicContact CG-CG 4.16Å; A192-P194 VanDerWaalsContact O-CD 3.31Å; A192-P194 WeakPolarHBondContact O-CD 3.49Å; P194-V197 HydrophobicContact CB-CG2 3.82Å; P194-V197 HydrophobicContact CG-CG2 3.26Å; P194-A237 WeakPolarHBondContact O-CB 3.42Å
195	D	94.1	Very high	88.4	Confident	69 Å²	69	35 Å²	35	37%	0.369	20%	0.204	S	C	.	.	S	Bend	trans	-77.2	-31	173	-60.3	-81.2	0	0	0	111.6	K121 R122 A237 E238	K121-D195 VanDerWaalsContact CA-OD2 3.29Å; K121-D195 WeakPolarHBondContact CA-OD2 3.44Å; K121-D195 HydrophobicContact CB-CB 4.18Å; K121-D195 HydrophobicContact CG-CB 4.36Å; R122-D195 PolarHBondContact N-OD2 3.2Å; R122-D195 PolarHBondContact O-N 3.3Å; D195-A237 WeakPolarHBondContact O-CA 3.49Å; D195-E238 PolarHBondContact O-N 3.24Å
196	V	96.1	Very high	88.6	Confident	5 Å²	5	33.9 Å²	33.9	3%	0.03	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	133	-178.8	-172.1	0	0	0	0	109.6	R122 V123 V124 I198 E238 Y240 L325	R122-V196 PolarHBondContact O-N 3.41Å; V123-V196 HydrophobicContact CB-CB 4.42Å; V123-V196 HydrophobicContact CG1-CB 4.14Å; V123-V196 HydrophobicContact CG1-CG1 4.31Å; V123-V196 HydrophobicContact CG2-CB 4.16Å; V123-V196 HydrophobicContact CG2-CG2 4.23Å; V124-V196 PolarHBondContact N-O 3.4Å; V196-I198 HydrophobicContact CG1-CD1 3.65Å; V196-I198 HydrophobicContact CG1-CG1 4.42Å; V196-E238 CarbonylContact C-O 3.55Å; V196-E238 WeakPolarHBondContact CA-O 3.42Å; V196-E238 HydrophobicContact CG1-CB 4.38Å; V196-E238 HydrophobicContact CG2-CB 4.37Å; V196-Y240 HydrophobicContact CG1-CD2 4.26Å; V196-Y240 HydrophobicContact CG1-CE2 4.11Å; V196-L325 HydrophobicContact CB-CD2 4.39Å; V196-L325 HydrophobicContact CG1-CD1 4.02Å; V196-L325 HydrophobicContact CG1-CD2 3.7Å; V196-L325 HydrophobicContact CG1-CG 4.5Å; V196-L325 HydrophobicContact CG2-CD1 4.41Å; V196-L325 HydrophobicContact CG2-CD2 3.7Å
197	V	97.1	Very high	88.7	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	125.1	176.6	-174.2	0	0	0	0	110	V124 W186 P194 L199 L233 E238 I239 Y240	V124-V197 CarbonylContact O-C 3.47Å; V124-V197 WeakPolarHBondContact O-CA 3.29Å; W186-V197 HydrophobicContact CE3-CG2 4.45Å; W186-V197 HydrophobicContact CH2-CG1 4.44Å; W186-V197 HydrophobicContact CZ3-CG1 3.83Å; W186-V197 HydrophobicContact CZ3-CG2 4.41Å; P194-V197 HydrophobicContact CB-CG2 3.82Å; P194-V197 HydrophobicContact CG-CG2 3.26Å; V197-L199 HydrophobicContact CG1-CD1 3.69Å; V197-L199 HydrophobicContact CG1-CD2 4.42Å; V197-L199 HydrophobicContact CG1-CG 3.76Å; V197-L233 HydrophobicContact CG2-CD2 4.06Å; V197-E238 PolarHBondContact N-O 3.03Å; V197-I239 HydrophobicContact CB-CD1 3.63Å; V197-I239 HydrophobicContact CG2-CD1 3.75Å; V197-I239 CarbonylContact O-C 3.55Å; V197-I239 WeakPolarHBondContact O-CA 3.48Å; V197-Y240 PolarHBondContact O-N 2.97Å
198	I	98.3	Very high	89.1	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	113.6	176.9	-56.3	92.3	0	0	0	108.2	V123 V124 F125 A126 L134 V196 Y240 V242 L321	V123-I198 HydrophobicContact CG1-CD1 3.67Å; V124-I198 PolarHBondContact O-N 2.95Å; F125-I198 CarbonylContact C-O 3.58Å; F125-I198 WeakPolarHBondContact CA-O 3.22Å; F125-I198 HydrophobicContact CD1-CB 3.73Å; F125-I198 HydrophobicContact CD1-CD1 4.25Å; F125-I198 HydrophobicContact CD1-CG1 4.28Å; F125-I198 HydrophobicContact CD1-CG2 3.86Å; F125-I198 HydrophobicContact CD2-CD1 4.17Å; F125-I198 HydrophobicContact CE1-CB 3.88Å; F125-I198 HydrophobicContact CE1-CD1 3.93Å; F125-I198 HydrophobicContact CE1-CG1 3.95Å; F125-I198 HydrophobicContact CE1-CG2 3.91Å; F125-I198 HydrophobicContact CE2-CD1 3.86Å; F125-I198 HydrophobicContact CG-CB 4.28Å; F125-I198 HydrophobicContact CG-CD1 4.36Å; F125-I198 HydrophobicContact CZ-CD1 3.73Å; F125-I198 HydrophobicContact CZ-CG1 4.21Å; A126-I198 PolarHBondContact N-O 2.93Å; L134-I198 HydrophobicContact CD2-CG2 4.35Å; V196-I198 HydrophobicContact CG1-CD1 3.65Å; V196-I198 HydrophobicContact CG1-CG1 4.42Å; I198-Y240 HydrophobicContact CG1-CD2 4.25Å; I198-V242 HydrophobicContact CG2-CG2 3.5Å; I198-V242 VanDerWaalsContact CG2-CG2 3.5Å; I198-L321 HydrophobicContact CG1-CD1 4.22Å; I198-L321 HydrophobicContact CG1-CD2 4.24Å; I198-L321 HydrophobicContact CG2-CD1 4.31Å
199	L	97.6	Very high	89.6	Confident	2 Å²	2	37.9 Å²	37.9	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	147.4	-174.1	-72.7	151.8	0	0	0	111.4	A126 M179 V197 L230 I239 Y240 W241 V242	A126-L199 HydrophobicContact CB-CD2 3.61Å; A126-L199 VanDerWaalsContact O-CA 3.32Å; A126-L199 WeakPolarHBondContact O-CA 3.22Å; M179-L199 HydrophobicContact CE-CD2 4.28Å; M179-L199 HydrophobicContact CG-CD2 4.47Å; M179-L199 HydrophobicContact SD-CD2 4.12Å; V197-L199 HydrophobicContact CG1-CD1 3.69Å; V197-L199 HydrophobicContact CG1-CD2 4.42Å; V197-L199 HydrophobicContact CG1-CG 3.76Å; L199-L230 HydrophobicContact CD1-CD1 4.3Å; L199-L230 HydrophobicContact CD1-CD2 3.39Å; L199-I239 HydrophobicContact CD1-CG2 4.47Å; L199-Y240 PolarHBondContact N-O 3.42Å; L199-W241 HydrophobicContact CB-CE3 3.6Å; L199-W241 HydrophobicContact CB-CZ3 3.76Å; L199-W241 CarbonylContact O-C 3.54Å; L199-W241 WeakPolarHBondContact O-CA 3.02Å; L199-V242 PolarHBondContact O-N 2.96Å
200	G	96.4	Very high	90.2	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.9	131.7	165.4	0	0	0	0	0	112.2	A126 G127 I131	A126-G200 PolarHBondContact O-N 3.3Å; A126-G200 VanDerWaalsContact O-N 3.14Å; G127-G200 WeakPolarHBondContact CA-O 2.93Å; I131-G200 WeakPolarHBondContact CG1-O 3.23Å
201	A	95.1	Very high	91.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.194	C	C	.	.			trans	-157.8	131.7	-179.9	0	0	0	0	0	110.5	P173 M179 Y219	P173-A201 WeakPolarHBondContact O-CB 3.44Å; M179-A201 HydrophobicContact CE-CB 3.87Å; A201-Y219 VanDerWaalsContact O-CE2 3.25Å; A201-Y219 WeakPolarHBondContact O-CE2 3.3Å; A201-Y219 PolarHBondContact O-OH 3.2Å
202	A	94.9	Very high	92.7	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.162	C	C	.	.			trans	-167.9	-36.4	165.4	0	0	0	0	0	111.9	W204 S205 I206 Y219 Q244 Y267	A202-W204 PolarHBondContact O-N 3.49Å; A202-S205 PolarHBondContact O-N 3.04Å; A202-I206 PolarHBondContact O-N 3.17Å; A202-Y219 HydrophobicContact CB-CE2 4.41Å; A202-Q244 HydrophobicContact CB-CG 3.58Å; A202-Y267 HydrophobicContact CB-CD1 3.74Å; A202-Y267 HydrophobicContact CB-CG 4.11Å
203	T	94.9	Very high	93.9	Very high	3 Å²	3	32.1 Å²	32.1	2%	0.018	18%	0.177	C	C	.	.	H	α-helix	trans	-58	-36.1	-170.6	67.7	0	0	0	0	113.2	D128 I206 K207 L264 L307	D128-T203 PolarHBondContact OD2-OG1 3.03Å; T203-I206 PolarHBondContact O-N 3.02Å; T203-K207 VanDerWaalsContact O-CB 3.29Å; T203-K207 WeakPolarHBondContact O-CB 3.43Å; T203-K207 PolarHBondContact O-N 2.63Å; T203-L264 HydrophobicContact CG2-CD2 4.11Å; T203-L307 HydrophobicContact CG2-CD1 4.42Å
204	W	95.1	Very high	94.3	Very high	53 Å²	53	33.6 Å²	33.6	20%	0.201	19%	0.185	C	C	.	.	H	α-helix	trans	-70.4	-41.3	176.5	-84.3	72	0	0	0	112.9	H153 W171 P173 E174 A202 I206 K207 L208	H153-W204 AromaticContact NE2-CZ2 3.89Å; W171-W204 AromaticContact CH2-CZ2 3.96Å; W171-W204 HydrophobicContact CH2-CZ2 3.96Å; W171-W204 AromaticContact CH2-NE1 3.89Å; W171-W204 AromaticContact CZ2-CE2 3.74Å; W171-W204 HydrophobicContact CZ2-CH2 4.14Å; W171-W204 AromaticContact CZ2-CZ2 3.48Å; W171-W204 HydrophobicContact CZ2-CZ2 3.48Å; W171-W204 VanDerWaalsContact CZ2-CZ2 3.48Å; W171-W204 AromaticContact CZ2-NE1 3.96Å; P173-W204 HydrophobicContact CB-CB 3.99Å; P173-W204 HydrophobicContact CB-CD2 3.81Å; P173-W204 HydrophobicContact CB-CG 3.53Å; P173-W204 HydrophobicContact CG-CD2 4.22Å; P173-W204 HydrophobicContact CG-CE3 4.44Å; P173-W204 HydrophobicContact CG-CG 4.34Å; E174-W204 HydrophobicContact CG-CB 3.76Å; A202-W204 PolarHBondContact O-N 3.49Å; W204-I206 VanDerWaalsContact C-N 3.28Å; W204-I206 PolarHBondContact O-N 3.36Å; W204-K207 PolarHBondContact O-N 2.89Å; W204-L208 HydrophobicContact CE3-CD1 4.17Å; W204-L208 HydrophobicContact CE3-CG 4.43Å; W204-L208 WeakPolarHBondContact O-CB 3.38Å; W204-L208 VanDerWaalsContact O-CG 3.31Å; W204-L208 WeakPolarHBondContact O-CG 3.42Å; W204-L208 PolarHBondContact O-N 3.26Å
205	S	94	Very high	94.2	Very high	8 Å²	8	33.9 Å²	33.9	6%	0.056	19%	0.187	C	C	.	.	H	α-helix	trans	-62.9	-37.6	175.2	-57.6	0	0	0	0	111.5	E174 A202 H209	E174-S205 WeakPolarHBondContact OE1-CA 3.23Å; E174-S205 PolarHBondContact OE1-OG 3Å; A202-S205 PolarHBondContact O-N 3.04Å; S205-H209 PolarHBondContact O-CD2 3.36Å; S205-H209 PolarHBondContact O-N 3.34Å
206	I	95.3	Very high	94.3	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-64.6	-47.9	172.5	-63.7	164.5	0	0	0	110.5	A202 T203 W204 S210 G211 M258 I259 Q263 L264 Y267	A202-I206 PolarHBondContact O-N 3.17Å; T203-I206 PolarHBondContact O-N 3.02Å; W204-I206 VanDerWaalsContact C-N 3.28Å; W204-I206 PolarHBondContact O-N 3.36Å; I206-S210 PolarHBondContact O-N 3.19Å; I206-G211 PolarHBondContact O-N 3.3Å; I206-M258 HydrophobicContact CG2-CG 4.38Å; I206-M258 WeakPolarHBondContact CG2-O 3.35Å; I206-I259 HydrophobicContact CB-CG1 4.47Å; I206-I259 HydrophobicContact CG2-CB 4.4Å; I206-I259 HydrophobicContact CG2-CG1 4.04Å; I206-Q263 HydrophobicContact CD1-CB 4.09Å; I206-Q263 HydrophobicContact CG2-CB 4.33Å; I206-L264 HydrophobicContact CD1-CD2 3.88Å; I206-Y267 HydrophobicContact CD1-CD2 3.82Å; I206-Y267 HydrophobicContact CD1-CE2 3.99Å; I206-Y267 HydrophobicContact CD1-CG 4.17Å; I206-Y267 HydrophobicContact CG1-CD2 3.84Å; I206-Y267 HydrophobicContact CG1-CE1 4.2Å; I206-Y267 HydrophobicContact CG1-CE2 3.46Å; I206-Y267 VanDerWaalsContact CG1-CE2 3.46Å; I206-Y267 HydrophobicContact CG1-CG 4.35Å
207	K	94.8	Very high	94.3	Very high	60 Å²	60	37.8 Å²	37.8	26%	0.261	20%	0.203	S	C	.	.	H	α-helix	trans	-62.6	-48.9	-176.8	-174.3	-173.9	175.3	-166.2	0	112.9	T203 W204 H209 N255 M258 I259	T203-K207 VanDerWaalsContact O-CB 3.29Å; T203-K207 WeakPolarHBondContact O-CB 3.43Å; T203-K207 PolarHBondContact O-N 2.63Å; W204-K207 PolarHBondContact O-N 2.89Å; K207-H209 VanDerWaalsContact C-N 3.27Å; K207-H209 PolarHBondContact O-N 2.83Å; K207-N255 VanDerWaalsContact CE-O 3.27Å; K207-N255 WeakPolarHBondContact CE-O 3.47Å; K207-M258 HydrophobicContact CB-SD 4.29Å; K207-M258 HydrophobicContact CG-SD 3.91Å; K207-I259 HydrophobicContact CB-CD1 4.25Å; K207-I259 HydrophobicContact CB-CG1 4.41Å
208	L	93.3	Very high	94.1	Very high	93 Å²	93	43 Å²	43	49%	0.487	23%	0.227	S	C	.	.	H	α-helix	trans	-69.4	-26.4	-174.9	-70.1	174.8	0	0	0	112.7	E174 W204	E174-L208 WeakPolarHBondContact OE2-CD1 3.33Å; W204-L208 HydrophobicContact CE3-CD1 4.17Å; W204-L208 HydrophobicContact CE3-CG 4.43Å; W204-L208 WeakPolarHBondContact O-CB 3.38Å; W204-L208 VanDerWaalsContact O-CG 3.31Å; W204-L208 WeakPolarHBondContact O-CG 3.42Å; W204-L208 PolarHBondContact O-N 3.26Å
209	H	91.9	Very high	94	Very high	84 Å²	84	43.1 Å²	43.1	39%	0.389	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.6	24.2	-176.3	-57.7	-64.5	0	0	0	113.3	S205 K207 G211 S212 T215	S205-H209 PolarHBondContact O-CD2 3.36Å; S205-H209 PolarHBondContact O-N 3.34Å; K207-H209 VanDerWaalsContact C-N 3.27Å; K207-H209 PolarHBondContact O-N 2.83Å; H209-G211 PolarHBondContact O-N 3.06Å; H209-S212 WeakPolarHBondContact O-CB 3.5Å; H209-S212 PolarHBondContact O-N 2.87Å; H209-T215 HydrophobicContact CB-CG2 3.88Å; H209-T215 WeakPolarHBondContact CB-OG1 3.32Å
210	S	91.1	Very high	93.9	Very high	92 Å²	92	47.6 Å²	47.6	64%	0.643	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	30.6	173.4	-57	0	0	0	0	114.7	I206 S212	I206-S210 PolarHBondContact O-N 3.19Å; S210-S212 VanDerWaalsContact C-N 3.34Å; S210-S212 PolarHBondContact O-N 3.46Å
211	G	88.2	Confident	93.8	Very high	11 Å²	11	50.4 Å²	50.4	11%	0.113	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	27.8	-178.9	0	0	0	0	0	115.3	I206 H209 Q263	I206-G211 PolarHBondContact O-N 3.3Å; H209-G211 PolarHBondContact O-N 3.06Å; G211-Q263 PolarHBondContact O-NE2 3.42Å
212	S	93.3	Very high	93.8	Very high	36 Å²	36	53.1 Å²	53.1	25%	0.252	28%	0.282	S	S	.	.			trans	-64.5	149.1	-179	81	0	0	0	0	113.6	H209 S210 E214 T215 L216	H209-S212 WeakPolarHBondContact O-CB 3.5Å; H209-S212 PolarHBondContact O-N 2.87Å; S210-S212 VanDerWaalsContact C-N 3.34Å; S210-S212 PolarHBondContact O-N 3.46Å; S212-E214 VanDerWaalsContact C-N 3.3Å; S212-E214 PolarHBondContact O-N 3.22Å; S212-T215 PolarHBondContact O-N 2.92Å; S212-T215 WeakPolarHBondContact OG-CB 3.35Å; S212-T215 PolarHBondContact OG-N 3.41Å; S212-T215 PolarHBondContact OG-OG1 2.84Å; S212-L216 PolarHBondContact O-N 2.87Å
213	S	92.1	Very high	93.8	Very high	70 Å²	70	53.1 Å²	53.1	49%	0.49	28%	0.282	S	S	.	.	H	α-helix	trans	-69.8	-29.9	179.8	73.4	0	0	0	0	112.6	L216 Q217	S213-L216 WeakPolarHBondContact O-CB 3.47Å; S213-L216 PolarHBondContact O-N 3.25Å; S213-Q217 PolarHBondContact O-N 3.02Å
214	E	93.1	Very high	93.7	Very high	116 Å²	116	56.3 Å²	56.3	54%	0.542	30%	0.302	S	S	.	.	H	α-helix	trans	-65	-43.8	177	-65.5	74.2	-168.7	0	0	110.2	S212 L216 Q217 Q218	S212-E214 VanDerWaalsContact C-N 3.3Å; S212-E214 PolarHBondContact O-N 3.22Å; E214-L216 VanDerWaalsContact C-N 3.33Å; E214-L216 PolarHBondContact O-N 3.36Å; E214-Q217 WeakPolarHBondContact O-CB 3.41Å; E214-Q217 PolarHBondContact O-N 2.71Å; E214-Q218 WeakPolarHBondContact O-CG 3.29Å; E214-Q218 PolarHBondContact O-N 3.19Å
215	T	92.3	Very high	93.6	Very high	10 Å²	10	55.5 Å²	55.5	6%	0.061	31%	0.306	C	S	.	.	H	α-helix	trans	-66.2	-34	175.9	-58.9	0	0	0	0	112.1	H209 S212 Q217 Q218 Y219 Y267	H209-T215 HydrophobicContact CB-CG2 3.88Å; H209-T215 WeakPolarHBondContact CB-OG1 3.32Å; S212-T215 PolarHBondContact O-N 2.92Å; S212-T215 WeakPolarHBondContact OG-CB 3.35Å; S212-T215 PolarHBondContact OG-N 3.41Å; S212-T215 PolarHBondContact OG-OG1 2.84Å; T215-Q217 VanDerWaalsContact C-N 3.32Å; T215-Q217 PolarHBondContact O-N 3.04Å; T215-Q218 PolarHBondContact O-N 3.3Å; T215-Y219 VanDerWaalsContact O-CB 3.31Å; T215-Y219 WeakPolarHBondContact O-CB 3.35Å; T215-Y219 PolarHBondContact O-N 3.31Å; T215-Y267 WeakPolarHBondContact CG2-OH 3.49Å
216	L	95.3	Very high	93.6	Very high	25 Å²	25	55.1 Å²	55.1	13%	0.131	30%	0.304	C	S	.	.	H	α-helix	trans	-62.7	-39.8	172.9	175.1	64.4	0	0	0	111.6	S212 S213 E214 Y219 R220 L266 Y267 A270	S212-L216 PolarHBondContact O-N 2.87Å; S213-L216 WeakPolarHBondContact O-CB 3.47Å; S213-L216 PolarHBondContact O-N 3.25Å; E214-L216 VanDerWaalsContact C-N 3.33Å; E214-L216 PolarHBondContact O-N 3.36Å; L216-Y219 WeakPolarHBondContact O-CB 3.3Å; L216-Y219 PolarHBondContact O-N 3.47Å; L216-R220 PolarHBondContact O-N 3.07Å; L216-L266 HydrophobicContact CD1-CB 4.47Å; L216-L266 HydrophobicContact CD2-CB 3.89Å; L216-L266 HydrophobicContact CD2-CD1 4.32Å; L216-Y267 HydrophobicContact CB-CE2 4.08Å; L216-Y267 HydrophobicContact CD1-CD1 4.2Å; L216-Y267 HydrophobicContact CD1-CD2 3.62Å; L216-Y267 HydrophobicContact CD1-CE1 4.32Å; L216-Y267 HydrophobicContact CD1-CE2 3.75Å; L216-Y267 HydrophobicContact CD1-CG 3.87Å; L216-Y267 HydrophobicContact CG-CE2 4.46Å; L216-A270 HydrophobicContact CD1-CB 4.13Å
217	Q	95.3	Very high	93.5	Very high	130 Å²	130	55.7 Å²	55.7	61%	0.607	31%	0.308	S	S	*	.	H	α-helix	trans	-66.8	-41.7	175	-65.8	179.6	17.6	0	0	111.8	S213 E214 T215 R220 A221	S213-Q217 PolarHBondContact O-N 3.02Å; E214-Q217 WeakPolarHBondContact O-CB 3.41Å; E214-Q217 PolarHBondContact O-N 2.71Å; T215-Q217 VanDerWaalsContact C-N 3.32Å; T215-Q217 PolarHBondContact O-N 3.04Å; Q217-R220 PolarHBondContact O-N 2.82Å; Q217-A221 PolarHBondContact O-N 3.06Å
218	Q	94.4	Very high	93.2	Very high	109 Å²	109	57.5 Å²	57.5	51%	0.509	32%	0.324	S	S	.	.	H	α-helix	trans	-61.9	-43.1	173.9	-70.9	174.9	-10.1	0	0	111.8	E214 T215 R220 A221 N222	E214-Q218 WeakPolarHBondContact O-CG 3.29Å; E214-Q218 PolarHBondContact O-N 3.19Å; T215-Q218 PolarHBondContact O-N 3.3Å; Q218-R220 VanDerWaalsContact C-N 3.35Å; Q218-R220 PolarHBondContact O-N 3.41Å; Q218-A221 PolarHBondContact O-N 2.92Å; Q218-N222 WeakPolarHBondContact O-CB 3.38Å; Q218-N222 VanDerWaalsContact O-CG 3.28Å; Q218-N222 PolarHBondContact O-N 3.4Å
219	Y	95.7	Very high	93.1	Very high	4 Å²	4	54.9 Å²	54.9	2%	0.016	31%	0.309	C	S	.	.	H	α-helix	trans	-57.3	-47.3	174.3	175.4	-94.9	0	0	0	111.2	A175 A201 A202 T215 L216 A221 N222 L223 W241 Y267 A270	A175-Y219 HydrophobicContact CB-CD2 3.99Å; A175-Y219 HydrophobicContact CB-CE2 3.67Å; A201-Y219 VanDerWaalsContact O-CE2 3.25Å; A201-Y219 WeakPolarHBondContact O-CE2 3.3Å; A201-Y219 PolarHBondContact O-OH 3.2Å; A202-Y219 HydrophobicContact CB-CE2 4.41Å; T215-Y219 VanDerWaalsContact O-CB 3.31Å; T215-Y219 WeakPolarHBondContact O-CB 3.35Å; T215-Y219 PolarHBondContact O-N 3.31Å; L216-Y219 WeakPolarHBondContact O-CB 3.3Å; L216-Y219 PolarHBondContact O-N 3.47Å; Y219-A221 VanDerWaalsContact C-N 3.34Å; Y219-A221 PolarHBondContact O-N 3.21Å; Y219-N222 PolarHBondContact O-N 2.97Å; Y219-L223 HydrophobicContact CE1-CD2 3.93Å; Y219-L223 VanDerWaalsContact O-CB 3.24Å; Y219-L223 WeakPolarHBondContact O-CB 3.47Å; Y219-L223 PolarHBondContact O-N 3.02Å; Y219-W241 WeakPolarHBondContact OH-CZ2 3.5Å; Y219-Y267 AromaticContact CD1-CD1 3.57Å; Y219-Y267 HydrophobicContact CD1-CD1 3.57Å; Y219-Y267 AromaticContact CD1-CE1 3.95Å; Y219-Y267 HydrophobicContact CD1-CE1 3.95Å; Y219-Y267 HydrophobicContact CD1-CG 4.49Å; Y219-Y267 AromaticContact CD2-CD1 3.82Å; Y219-Y267 HydrophobicContact CD2-CD1 3.82Å; Y219-Y267 AromaticContact CD2-CE1 3.77Å; Y219-Y267 HydrophobicContact CD2-CE1 3.77Å; Y219-Y267 AromaticContact CE1-CD1 3.75Å; Y219-Y267 HydrophobicContact CE1-CD1 3.75Å; Y219-Y267 AromaticContact CE2-CD1 3.98Å; Y219-Y267 HydrophobicContact CE2-CD1 3.98Å; Y219-Y267 HydrophobicContact CE2-CE1 4.35Å; Y219-Y267 AromaticContact CG-CD1 3.59Å; Y219-Y267 HydrophobicContact CG-CD1 3.59Å; Y219-Y267 AromaticContact CG-CE1 3.52Å; Y219-Y267 HydrophobicContact CG-CE1 3.52Å; Y219-Y267 AromaticContact CZ-CD1 3.94Å; Y219-A270 HydrophobicContact CD1-CB 4.41Å; Y219-A270 HydrophobicContact CE1-CB 4.49Å
220	R	95.3	Very high	93.1	Very high	96 Å²	96	50.9 Å²	50.9	36%	0.362	29%	0.291	S	S	.	.	H	α-helix	trans	-59.3	-44.5	176.2	-174.7	-177.2	-90.2	142.4	-8.8	111.4	L216 Q217 Q218 T224 E273 V274	L216-R220 PolarHBondContact O-N 3.07Å; Q217-R220 PolarHBondContact O-N 2.82Å; Q218-R220 VanDerWaalsContact C-N 3.35Å; Q218-R220 PolarHBondContact O-N 3.41Å; R220-T224 WeakPolarHBondContact O-CB 3.21Å; R220-T224 PolarHBondContact O-N 2.8Å; R220-T224 PolarHBondContact O-OG1 3.44Å; R220-E273 IonicContact CZ-OE2 2.92Å; R220-E273 IonicContact NE-OE2 3.83Å; R220-E273 IonicContact NH2-OE2 3.27Å; R220-E273 PolarHBondContact NH2-OE2 2.82Å; R220-V274 HydrophobicContact CG-CG2 3.78Å
221	A	94.6	Very high	93	Very high	58 Å²	58	48.6 Å²	48.6	48%	0.479	27%	0.271	S	S	.	.	H	α-helix	trans	-64.5	-46.8	178.4	0	0	0	0	0	112.4	Q217 Q218 Y219 T224 A225	Q217-A221 PolarHBondContact O-N 3.06Å; Q218-A221 PolarHBondContact O-N 2.92Å; Y219-A221 VanDerWaalsContact C-N 3.34Å; Y219-A221 PolarHBondContact O-N 3.21Å; A221-T224 WeakPolarHBondContact O-CB 3.39Å; A221-T224 PolarHBondContact O-N 3.26Å; A221-A225 PolarHBondContact O-N 3.02Å; A221-A225 VanDerWaalsContact O-N 3.09Å
222	N	95.4	Very high	93	Very high	58 Å²	58	52.9 Å²	52.9	31%	0.31	29%	0.287	S	S	.	.	H	α-helix	trans	-63.7	-45.3	178.3	-69.5	-11.8	0	0	0	111.5	A175 Q218 Y219 T224 A225 I226	A175-N222 WeakPolarHBondContact O-CB 3.25Å; A175-N222 PolarHBondContact O-ND2 3.38Å; Q218-N222 WeakPolarHBondContact O-CB 3.38Å; Q218-N222 VanDerWaalsContact O-CG 3.28Å; Q218-N222 PolarHBondContact O-N 3.4Å; Y219-N222 PolarHBondContact O-N 2.97Å; N222-T224 VanDerWaalsContact C-N 3.28Å; N222-T224 PolarHBondContact O-N 3.36Å; N222-A225 WeakPolarHBondContact O-CB 3.35Å; N222-A225 PolarHBondContact O-N 3.37Å; N222-A225 VanDerWaalsContact O-N 3.11Å; N222-I226 WeakPolarHBondContact O-CG1 3.32Å; N222-I226 PolarHBondContact O-N 3.45Å
223	L	94.5	Very high	92.8	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-64.5	-35.4	178.1	-172.1	61.1	0	0	0	111.5	Y219 A225 I226 A227 W241 A271 V274	Y219-L223 HydrophobicContact CE1-CD2 3.93Å; Y219-L223 VanDerWaalsContact O-CB 3.24Å; Y219-L223 WeakPolarHBondContact O-CB 3.47Å; Y219-L223 PolarHBondContact O-N 3.02Å; L223-A225 VanDerWaalsContact C-N 3.31Å; L223-A225 PolarHBondContact O-N 3.26Å; L223-I226 PolarHBondContact O-N 3.41Å; L223-A227 VanDerWaalsContact O-CB 3.29Å; L223-A227 WeakPolarHBondContact O-CB 3.32Å; L223-A227 PolarHBondContact O-N 2.89Å; L223-W241 HydrophobicContact CD1-CE3 4.44Å; L223-W241 HydrophobicContact CD1-CH2 3.53Å; L223-W241 HydrophobicContact CD1-CZ2 3.9Å; L223-W241 HydrophobicContact CD1-CZ3 3.83Å; L223-W241 HydrophobicContact CD2-CZ2 4.35Å; L223-A271 HydrophobicContact CD2-CB 3.71Å; L223-V274 HydrophobicContact CB-CG1 4.48Å; L223-V274 HydrophobicContact CD2-CB 4.43Å; L223-V274 HydrophobicContact CG-CG1 4.09Å
224	T	93.3	Very high	92.7	Very high	69 Å²	69	48.8 Å²	48.8	42%	0.423	26%	0.258	S	S	.	.	H	α-helix	trans	-61.4	-40.7	172.9	-56.9	0	0	0	0	111.2	R220 A221 N222 A227	R220-T224 WeakPolarHBondContact O-CB 3.21Å; R220-T224 PolarHBondContact O-N 2.8Å; R220-T224 PolarHBondContact O-OG1 3.44Å; A221-T224 WeakPolarHBondContact O-CB 3.39Å; A221-T224 PolarHBondContact O-N 3.26Å; N222-T224 VanDerWaalsContact C-N 3.28Å; N222-T224 PolarHBondContact O-N 3.36Å; T224-A227 PolarHBondContact O-N 3.14Å
225	A	93.1	Very high	92.5	Very high	36 Å²	36	48.6 Å²	48.6	30%	0.298	26%	0.257	S	S	.	.	H	α-helix	trans	-68.2	-34.3	175.6	0	0	0	0	0	112.8	K180 A221 N222 L223 H229	K180-A225 HydrophobicContact CD-CB 4.37Å; A221-A225 PolarHBondContact O-N 3.02Å; A221-A225 VanDerWaalsContact O-N 3.09Å; N222-A225 WeakPolarHBondContact O-CB 3.35Å; N222-A225 PolarHBondContact O-N 3.37Å; N222-A225 VanDerWaalsContact O-N 3.11Å; L223-A225 VanDerWaalsContact C-N 3.31Å; L223-A225 PolarHBondContact O-N 3.26Å; A225-H229 PolarHBondContact O-CD2 3.01Å; A225-H229 VanDerWaalsContact O-CD2 3.26Å
226	I	94.1	Very high	92.2	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-72.6	-39.7	176	-65.9	165.6	0	0	0	111	A175 M179 K180 V183 N222 L223 V228 H229 L230	A175-I226 HydrophobicContact CB-CD1 4.15Å; M179-I226 HydrophobicContact CB-CD1 4.32Å; M179-I226 HydrophobicContact CG-CD1 4.28Å; M179-I226 HydrophobicContact SD-CD1 4.27Å; K180-I226 HydrophobicContact CB-CD1 4.4Å; K180-I226 HydrophobicContact CB-CG1 3.72Å; K180-I226 HydrophobicContact CG-CG1 4Å; V183-I226 HydrophobicContact CG2-CG2 4.36Å; N222-I226 WeakPolarHBondContact O-CG1 3.32Å; N222-I226 PolarHBondContact O-N 3.45Å; L223-I226 PolarHBondContact O-N 3.41Å; I226-V228 VanDerWaalsContact C-N 3.27Å; I226-V228 PolarHBondContact O-N 2.88Å; I226-H229 PolarHBondContact O-N 3.2Å; I226-L230 HydrophobicContact CG2-CD1 3.79Å; I226-L230 HydrophobicContact CG2-CG 3.89Å; I226-L230 PolarHBondContact O-N 3.18Å
227	A	91.8	Very high	92	Very high	11 Å²	11	54.2 Å²	54.2	9%	0.091	28%	0.284	C	S	.	.	H	α-helix	trans	-55.5	-39.2	-175.4	0	0	0	0	0	112.9	L223 T224 H229 L230 D231 V274 L275	L223-A227 VanDerWaalsContact O-CB 3.29Å; L223-A227 WeakPolarHBondContact O-CB 3.32Å; L223-A227 PolarHBondContact O-N 2.89Å; T224-A227 PolarHBondContact O-N 3.14Å; A227-H229 VanDerWaalsContact C-N 3.27Å; A227-H229 PolarHBondContact O-N 2.91Å; A227-L230 PolarHBondContact O-N 2.94Å; A227-D231 PolarHBondContact O-N 3.42Å; A227-V274 HydrophobicContact CB-CG1 3.96Å; A227-L275 HydrophobicContact CB-CD2 3.91Å
228	V	89	Confident	91.9	Very high	98 Å²	98	51.7 Å²	51.7	59%	0.594	27%	0.272	S	S	*	.	H	α-helix	trans	-58.3	-39.7	176.4	-179.7	0	0	0	0	111.8	I226 K232	I226-V228 VanDerWaalsContact C-N 3.27Å; I226-V228 PolarHBondContact O-N 2.88Å; V228-K232 PolarHBondContact O-N 2.84Å
229	H	90.9	Very high	92	Very high	39 Å²	39	46.6 Å²	46.6	18%	0.181	25%	0.248	C	C	.	.	H	α-helix	trans	-78.2	-33.1	178.7	-59.5	-66	0	0	0	112.2	V183 M184 A225 I226 A227 K232 L233	V183-H229 HydrophobicContact CG1-CB 3.71Å; M184-H229 HydrophobicContact CG-CB 4.43Å; M184-H229 VanDerWaalsContact SD-CE1 3.57Å; M184-H229 PolarHBondContact SD-NE2 2.99Å; M184-H229 VanDerWaalsContact SD-NE2 3.38Å; A225-H229 PolarHBondContact O-CD2 3.01Å; A225-H229 VanDerWaalsContact O-CD2 3.26Å; I226-H229 PolarHBondContact O-N 3.2Å; A227-H229 VanDerWaalsContact C-N 3.27Å; A227-H229 PolarHBondContact O-N 2.91Å; H229-K232 PolarHBondContact O-N 2.89Å; H229-L233 WeakPolarHBondContact O-CB 3.34Å; H229-L233 PolarHBondContact O-N 2.92Å
230	L	91.8	Very high	92	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-64.5	-43.4	173.6	-67.1	175.8	0	0	0	111.9	V183 L199 I226 A227 K232 L233 A234 I239 W241 L275 V286	V183-L230 HydrophobicContact CG1-CD2 3.64Å; V183-L230 HydrophobicContact CG1-CG 4.16Å; V183-L230 HydrophobicContact CG2-CD2 3.98Å; L199-L230 HydrophobicContact CD1-CD1 4.3Å; L199-L230 HydrophobicContact CD1-CD2 3.39Å; I226-L230 HydrophobicContact CG2-CD1 3.79Å; I226-L230 HydrophobicContact CG2-CG 3.89Å; I226-L230 PolarHBondContact O-N 3.18Å; A227-L230 PolarHBondContact O-N 2.94Å; L230-K232 VanDerWaalsContact C-N 3.29Å; L230-K232 PolarHBondContact O-N 3.31Å; L230-L233 PolarHBondContact O-N 2.96Å; L230-A234 VanDerWaalsContact O-CB 3.29Å; L230-A234 WeakPolarHBondContact O-CB 3.34Å; L230-A234 PolarHBondContact O-N 3.44Å; L230-I239 HydrophobicContact CD2-CG2 4.01Å; L230-W241 HydrophobicContact CD1-CE3 4.49Å; L230-L275 HydrophobicContact CD1-CD2 4.23Å; L230-V286 HydrophobicContact CB-CG2 3.81Å
231	D	88.8	Confident	92.1	Very high	43 Å²	43	41.9 Å²	41.9	23%	0.23	23%	0.231	C	C	.	.	H	α-helix	trans	-60.7	-40.4	176.6	-87.6	-28.2	0	0	0	111.6	A227 A234 S278	A227-D231 PolarHBondContact O-N 3.42Å; D231-A234 PolarHBondContact O-N 3.31Å; D231-S278 WeakPolarHBondContact OD2-CB 3.34Å
232	K	88.5	Confident	92.2	Very high	102 Å²	102	39.4 Å²	39.4	44%	0.443	21%	0.21	S	C	.	.	H	α-helix	trans	-66.4	-41.4	175	-172.6	178	-179.3	-175.9	0	112.1	T187 V228 H229 L230 A234 E235	T187-K232 HydrophobicContact CG2-CD 4.48Å; V228-K232 PolarHBondContact O-N 2.84Å; H229-K232 PolarHBondContact O-N 2.89Å; L230-K232 VanDerWaalsContact C-N 3.29Å; L230-K232 PolarHBondContact O-N 3.31Å; K232-A234 VanDerWaalsContact C-N 3.29Å; K232-A234 PolarHBondContact O-N 3.02Å; K232-E235 WeakPolarHBondContact O-CB 3.37Å; K232-E235 WeakPolarHBondContact O-CG 3.33Å; K232-E235 PolarHBondContact O-N 3.46Å
233	L	89.8	Confident	92.3	Very high	7 Å²	7	37.3 Å²	37.3	4%	0.037	20%	0.199	C	C	.	.	H	α-helix	trans	-65.8	-35.8	176.7	-170.1	60.9	0	0	0	111.3	W186 T187 V197 H229 L230 E235 H236 A237 I239	W186-L233 HydrophobicContact CB-CD1 4.05Å; W186-L233 HydrophobicContact CB-CD2 4.18Å; W186-L233 HydrophobicContact CE3-CD2 4.07Å; T187-L233 HydrophobicContact CG2-CB 4.11Å; T187-L233 HydrophobicContact CG2-CD1 4.41Å; V197-L233 HydrophobicContact CG2-CD2 4.06Å; H229-L233 WeakPolarHBondContact O-CB 3.34Å; H229-L233 PolarHBondContact O-N 2.92Å; L230-L233 PolarHBondContact O-N 2.96Å; L233-E235 PolarHBondContact O-N 2.94Å; L233-H236 PolarHBondContact O-N 2.93Å; L233-A237 HydrophobicContact CG-CB 4.29Å; L233-A237 PolarHBondContact O-N 3.44Å; L233-I239 HydrophobicContact CB-CD1 4.34Å; L233-I239 HydrophobicContact CD2-CD1 3.75Å; L233-I239 HydrophobicContact CG-CD1 3.84Å
234	A	90	Very high	92.4	Very high	13 Å²	13	37.5 Å²	37.5	11%	0.107	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-2.7	178.1	0	0	0	0	0	114.6	L230 D231 K232 H236 A237 I239 R285	L230-A234 VanDerWaalsContact O-CB 3.29Å; L230-A234 WeakPolarHBondContact O-CB 3.34Å; L230-A234 PolarHBondContact O-N 3.44Å; D231-A234 PolarHBondContact O-N 3.31Å; K232-A234 VanDerWaalsContact C-N 3.29Å; K232-A234 PolarHBondContact O-N 3.02Å; A234-H236 VanDerWaalsContact C-N 3.3Å; A234-A237 WeakPolarHBondContact CA-O 3.5Å; A234-I239 HydrophobicContact CB-CB 4.42Å; A234-I239 HydrophobicContact CB-CG1 3.75Å; A234-R285 HydrophobicContact CB-CB 3.5Å; A234-R285 VanDerWaalsContact CB-CB 3.5Å
235	E	87.8	Confident	92.5	Very high	111 Å²	111	34.8 Å²	34.8	52%	0.519	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-27.6	167	-64.6	-175.5	165.1	0	0	113	K232 L233	K232-E235 WeakPolarHBondContact O-CB 3.37Å; K232-E235 WeakPolarHBondContact O-CG 3.33Å; K232-E235 PolarHBondContact O-N 3.46Å; L233-E235 PolarHBondContact O-N 2.94Å
236	H	87.2	Confident	92.7	Very high	142 Å²	142	33.2 Å²	33.2	66%	0.657	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-128.7	-15.3	-171.9	-55.3	85	0	0	0	113.3	L233 A234	L233-H236 PolarHBondContact O-N 2.93Å; A234-H236 VanDerWaalsContact C-N 3.3Å
237	A	91.3	Very high	92.8	Very high	12 Å²	12	33.3 Å²	33.3	10%	0.099	17%	0.17	C	C	.	.	S	Bend	trans	-128.2	157.2	-178.3	0	0	0	0	0	111.6	P194 D195 L233 A234 I239	P194-A237 WeakPolarHBondContact O-CB 3.42Å; D195-A237 WeakPolarHBondContact O-CA 3.49Å; L233-A237 HydrophobicContact CG-CB 4.29Å; L233-A237 PolarHBondContact O-N 3.44Å; A234-A237 WeakPolarHBondContact CA-O 3.5Å; A237-I239 HydrophobicContact CB-CD1 3.95Å
238	E	93.1	Very high	93.1	Very high	77 Å²	77	36.3 Å²	36.3	36%	0.36	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	114.4	174.7	-74.4	-74.2	171.8	0	0	110	D195 V196 V197 Y240 K287 L325	D195-E238 PolarHBondContact O-N 3.24Å; V196-E238 CarbonylContact C-O 3.55Å; V196-E238 WeakPolarHBondContact CA-O 3.42Å; V196-E238 HydrophobicContact CG1-CB 4.38Å; V196-E238 HydrophobicContact CG2-CB 4.37Å; V197-E238 PolarHBondContact N-O 3.03Å; E238-Y240 HydrophobicContact CB-CE2 3.97Å; E238-K287 IonicContact OE1-NZ 2.75Å; E238-K287 WeakPolarHBondContact OE2-CE 3.39Å; E238-K287 IonicContact OE2-NZ 3.25Å; E238-K287 PolarHBondContact OE2-NZ 3.27Å; E238-L325 HydrophobicContact CB-CD2 4.08Å; E238-L325 HydrophobicContact CG-CD2 4.38Å
239	I	95.3	Very high	93.4	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	125.5	-173.1	-48.4	-58.2	0	0	0	110.9	V197 L199 L230 L233 A234 A237 V286 K287	V197-I239 HydrophobicContact CB-CD1 3.63Å; V197-I239 HydrophobicContact CG2-CD1 3.75Å; V197-I239 CarbonylContact O-C 3.55Å; V197-I239 WeakPolarHBondContact O-CA 3.48Å; L199-I239 HydrophobicContact CD1-CG2 4.47Å; L230-I239 HydrophobicContact CD2-CG2 4.01Å; L233-I239 HydrophobicContact CB-CD1 4.34Å; L233-I239 HydrophobicContact CD2-CD1 3.75Å; L233-I239 HydrophobicContact CG-CD1 3.84Å; A234-I239 HydrophobicContact CB-CB 4.42Å; A234-I239 HydrophobicContact CB-CG1 3.75Å; A237-I239 HydrophobicContact CB-CD1 3.95Å; I239-V286 HydrophobicContact CG2-CG1 4.13Å; I239-V286 HydrophobicContact CG2-CG2 4.3Å; I239-K287 WeakPolarHBondContact O-CB 3.28Å; I239-K287 PolarHBondContact O-N 3.4Å
240	Y	96.8	Very high	93.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	133.8	177.2	-61	-95	0	0	0	110.8	L88 V196 V197 I198 L199 E238 K287 L321 S324 L325	L88-Y240 HydrophobicContact CD1-CE1 4.14Å; L88-Y240 HydrophobicContact CD2-CD1 4.31Å; L88-Y240 HydrophobicContact CD2-CE1 4.02Å; V196-Y240 HydrophobicContact CG1-CD2 4.26Å; V196-Y240 HydrophobicContact CG1-CE2 4.11Å; V197-Y240 PolarHBondContact O-N 2.97Å; I198-Y240 HydrophobicContact CG1-CD2 4.25Å; L199-Y240 PolarHBondContact N-O 3.42Å; E238-Y240 HydrophobicContact CB-CE2 3.97Å; Y240-K287 CarbonylContact C-O 3.54Å; Y240-K287 VanDerWaalsContact CA-O 3.25Å; Y240-K287 WeakPolarHBondContact CA-O 3.17Å; Y240-K287 HydrophobicContact CD1-CB 3.76Å; Y240-K287 HydrophobicContact CD1-CD 4.32Å; Y240-K287 HydrophobicContact CE1-CB 3.94Å; Y240-K287 HydrophobicContact CE1-CD 3.65Å; Y240-K287 HydrophobicContact CE1-CG 4.45Å; Y240-K287 HydrophobicContact CG-CB 4.45Å; Y240-L321 HydrophobicContact CD1-CD2 3.78Å; Y240-L321 HydrophobicContact CD2-CD2 4.22Å; Y240-L321 HydrophobicContact CE1-CD2 4.14Å; Y240-L321 HydrophobicContact CG-CD2 3.83Å; Y240-S324 WeakPolarHBondContact CE1-OG 3.44Å; Y240-S324 PolarHBondContact OH-OG 3.41Å; Y240-L325 HydrophobicContact CE2-CD2 3.78Å; Y240-L325 HydrophobicContact CE2-CG 4.44Å
241	W	96.9	Very high	93.7	Very high	1 Å²	1	43.2 Å²	43.2	0%	0.004	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	116.8	166.8	-171.1	-90.3	0	0	0	109.7	A175 M179 L199 Y219 L223 L230 L243 L275 V286 K287 L288 L289	A175-W241 HydrophobicContact CB-CH2 4.45Å; M179-W241 HydrophobicContact SD-CH2 4.37Å; M179-W241 HydrophobicContact SD-CZ3 4.34Å; L199-W241 HydrophobicContact CB-CE3 3.6Å; L199-W241 HydrophobicContact CB-CZ3 3.76Å; L199-W241 CarbonylContact O-C 3.54Å; L199-W241 WeakPolarHBondContact O-CA 3.02Å; Y219-W241 WeakPolarHBondContact OH-CZ2 3.5Å; L223-W241 HydrophobicContact CD1-CE3 4.44Å; L223-W241 HydrophobicContact CD1-CH2 3.53Å; L223-W241 HydrophobicContact CD1-CZ2 3.9Å; L223-W241 HydrophobicContact CD1-CZ3 3.83Å; L223-W241 HydrophobicContact CD2-CZ2 4.35Å; L230-W241 HydrophobicContact CD1-CE3 4.49Å; W241-L243 PolarHBondContact O-N 3.29Å; W241-L275 HydrophobicContact CB-CD1 3.57Å; W241-L275 HydrophobicContact CD2-CD1 3.65Å; W241-L275 HydrophobicContact CE3-CD1 4.22Å; W241-L275 HydrophobicContact CG-CD1 3.31Å; W241-V286 HydrophobicContact CB-CG1 4.08Å; W241-K287 PolarHBondContact N-O 2.86Å; W241-L288 HydrophobicContact CB-CD2 3.96Å; W241-L288 HydrophobicContact CG-CD2 4.45Å; W241-L288 WeakPolarHBondContact O-CA 3.47Å; W241-L289 PolarHBondContact O-N 3.09Å
242	V	97.3	Very high	94.1	Very high	7 Å²	7	41.5 Å²	41.5	4%	0.042	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	116.2	-179.6	-173.1	0	0	0	0	108.8	I131 L134 I198 L199 Q244 L289	I131-V242 HydrophobicContact CD1-CB 3.69Å; I131-V242 HydrophobicContact CD1-CG1 4.01Å; I131-V242 HydrophobicContact CD1-CG2 3.79Å; L134-V242 HydrophobicContact CD2-CG2 4.05Å; I198-V242 HydrophobicContact CG2-CG2 3.5Å; I198-V242 VanDerWaalsContact CG2-CG2 3.5Å; L199-V242 PolarHBondContact O-N 2.96Å; V242-Q244 PolarHBondContact O-NE2 2.83Å; V242-L289 HydrophobicContact CG1-CD2 4.3Å; V242-L289 HydrophobicContact CG2-CB 4.42Å; V242-L289 HydrophobicContact CG2-CD2 4Å
243	L	96.6	Very high	94.4	Very high	14 Å²	14	39.1 Å²	39.1	7%	0.073	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-65	139.7	171.2	-63.8	-171.9	0	0	0	108.9	W241 D245 N268 L289 A290 R293	W241-L243 PolarHBondContact O-N 3.29Å; L243-D245 PolarHBondContact O-N 3.43Å; L243-N268 WeakPolarHBondContact CA-OD1 3.43Å; L243-N268 HydrophobicContact CD2-CB 4.4Å; L243-L289 PolarHBondContact N-O 3.06Å; L243-A290 HydrophobicContact CD1-CB 3.63Å; L243-A290 HydrophobicContact CG-CB 4.44Å; L243-R293 HydrophobicContact CB-CB 4.5Å
244	Q	96.8	Very high	94.5	Very high	4 Å²	4	45.4 Å²	45.4	2%	0.019	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-64.3	124.7	-178	-54.1	-64.2	-69.4	0	0	108.9	A202 V242 L264 N268 R293	A202-Q244 HydrophobicContact CB-CG 3.58Å; V242-Q244 PolarHBondContact O-NE2 2.83Å; Q244-L264 HydrophobicContact CB-CD2 3.91Å; Q244-L264 HydrophobicContact CG-CD2 4.47Å; Q244-N268 PolarHBondContact N-OD1 3.44Å; Q244-N268 PolarHBondContact O-ND2 3.33Å; Q244-R293 VanDerWaalsContact O-CD 3.29Å; Q244-R293 WeakPolarHBondContact O-CD 3.3Å; Q244-R293 PolarHBondContact O-NH1 3.48Å
245	D	96.2	Very high	94.6	Very high	12 Å²	12	49.1 Å²	49.1	6%	0.064	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-73.2	165.9	177.4	-14.8	-86.2	0	0	0	111.4	R130 L243 L264 A296 L309	R130-D245 VanDerWaalsContact CZ-O 3.23Å; R130-D245 IonicContact CZ-OD2 2.66Å; R130-D245 VanDerWaalsContact CZ-OD2 3.28Å; R130-D245 IonicContact NE-OD2 3.92Å; R130-D245 PolarHBondContact NE-OD2 3.09Å; R130-D245 PolarHBondContact NH1-O 3.35Å; R130-D245 VanDerWaalsContact NH2-CG 3.35Å; R130-D245 PolarHBondContact NH2-O 3.17Å; R130-D245 IonicContact NH2-OD2 3.78Å; R130-D245 PolarHBondContact NH2-OD2 3.09Å; L243-D245 PolarHBondContact O-N 3.43Å; D245-L264 WeakPolarHBondContact O-CD1 3.48Å; D245-A296 HydrophobicContact CB-CB 3.58Å; D245-L309 HydrophobicContact CB-CD1 4.21Å; D245-L309 HydrophobicContact CB-CD2 4.21Å; D245-L309 WeakPolarHBondContact OD2-CD1 3.06Å
246	P	97	Very high	94.9	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.019	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-65.3	172.3	178.2	31.6	-39.3	0	0	0	112.1	R130 N261 R293 A296 L297 I300	R130-P246 PolarHBondContact NH2-O 3.49Å; P246-N261 WeakPolarHBondContact CA-OD1 3.16Å; P246-N261 WeakPolarHBondContact CB-OD1 3.32Å; P246-R293 VanDerWaalsContact N-NH1 3.13Å; P246-A296 HydrophobicContact CG-CB 4.07Å; P246-L297 HydrophobicContact CB-CD2 3.88Å; P246-L297 HydrophobicContact CG-CD2 3.81Å; P246-L297 HydrophobicContact CG-CG 4.08Å; P246-I300 HydrophobicContact CB-CG1 4.44Å; P246-I300 HydrophobicContact CB-CG2 4.43Å; P246-I300 HydrophobicContact CG-CB 4Å; P246-I300 HydrophobicContact CG-CG1 4.19Å; P246-I300 HydrophobicContact CG-CG2 4.07Å; P246-I300 WeakPolarHBondContact O-CD1 3.33Å
247	V	97.1	Very high	95.2	Very high	3 Å²	3	44.6 Å²	44.6	2%	0.018	22%	0.223	C	C	.	.			trans	-125	149.2	171.8	-67.7	0	0	0	0	109.8	E249 L252 I259 N261 L264 G306 L307	V247-E249 HydrophobicContact CG2-CG 3.97Å; V247-E249 PolarHBondContact O-N 3.45Å; V247-L252 HydrophobicContact CB-CD1 4.12Å; V247-L252 HydrophobicContact CB-CD2 4.38Å; V247-L252 HydrophobicContact CG2-CD1 3.99Å; V247-I259 HydrophobicContact CG1-CG2 4.14Å; V247-I259 WeakPolarHBondContact CG2-O 3.46Å; V247-N261 PolarHBondContact N-OD1 2.94Å; V247-N261 PolarHBondContact O-ND2 3.46Å; V247-N261 PolarHBondContact O-OD1 3.42Å; V247-L264 HydrophobicContact CB-CD1 4.38Å; V247-L264 HydrophobicContact CG1-CD1 3.81Å; V247-L264 HydrophobicContact CG2-CD1 3.88Å; V247-G306 CarbonylContact C-O 3.47Å; V247-G306 VanDerWaalsContact CA-O 3.24Å; V247-G306 WeakPolarHBondContact CA-O 3.14Å; V247-G306 VanDerWaalsContact CB-O 3.31Å; V247-G306 WeakPolarHBondContact CB-O 3.3Å; V247-L307 HydrophobicContact CG1-CD1 3.72Å
248	Y	97.1	Very high	95.4	Very high	74 Å²	74	46.5 Å²	46.5	29%	0.29	23%	0.23	S	C	.	.			trans	-91.9	94.6	170.1	-171.6	-124.9	0	0	0	108.7	D250 T251 L252 V301 G306	Y248-D250 HydrophobicContact CE1-CB 4.21Å; Y248-D250 PolarHBondContact O-N 3.2Å; Y248-T251 WeakPolarHBondContact CD1-OG1 3.44Å; Y248-T251 WeakPolarHBondContact CE1-OG1 3.44Å; Y248-T251 PolarHBondContact O-N 2.92Å; Y248-T251 VanDerWaalsContact O-N 3.13Å; Y248-L252 PolarHBondContact O-N 3.45Å; Y248-V301 HydrophobicContact CD2-CG2 4.37Å; Y248-V301 HydrophobicContact CE2-CG1 4.41Å; Y248-V301 HydrophobicContact CE2-CG2 4.34Å; Y248-G306 PolarHBondContact N-O 3.06Å
249	E	95.9	Very high	95.6	Very high	81 Å²	81	43 Å²	43	38%	0.379	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-58.4	-34.6	-165.6	-65.2	-178.7	-158.2	0	0	113.2	V247 T251 L252 N261	V247-E249 HydrophobicContact CG2-CG 3.97Å; V247-E249 PolarHBondContact O-N 3.45Å; E249-T251 VanDerWaalsContact C-N 3.28Å; E249-T251 PolarHBondContact O-N 3.03Å; E249-L252 PolarHBondContact O-N 3.42Å; E249-N261 WeakPolarHBondContact OE1-CB 3.46Å; E249-N261 PolarHBondContact OE1-N 3.04Å; E249-N261 PolarHBondContact OE1-ND2 3.3Å
250	D	94	Very high	95.6	Very high	139 Å²	139	44.6 Å²	44.6	74%	0.743	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-68.3	-24.8	-178.2	-65.7	-25.7	0	0	0	113.7	Y248	Y248-D250 HydrophobicContact CE1-CB 4.21Å; Y248-D250 PolarHBondContact O-N 3.2Å
251	T	95.3	Very high	95.7	Very high	61 Å²	61	46.5 Å²	46.5	37%	0.374	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-99	-6.4	-179.5	-56.8	0	0	0	0	112.5	Y248 E249 S253	Y248-T251 WeakPolarHBondContact CD1-OG1 3.44Å; Y248-T251 WeakPolarHBondContact CE1-OG1 3.44Å; Y248-T251 PolarHBondContact O-N 2.92Å; Y248-T251 VanDerWaalsContact O-N 3.13Å; E249-T251 VanDerWaalsContact C-N 3.28Å; E249-T251 PolarHBondContact O-N 3.03Å; T251-S253 PolarHBondContact O-N 2.82Å
252	L	95.9	Very high	95.6	Very high	8 Å²	8	53.3 Å²	53.3	4%	0.042	27%	0.266	C	S	.	.	S	Bend	trans	-64.2	135.1	176.6	-68.7	177.4	0	0	0	111.1	V247 Y248 E249 R256 I259 G306 L307	V247-L252 HydrophobicContact CB-CD1 4.12Å; V247-L252 HydrophobicContact CB-CD2 4.38Å; V247-L252 HydrophobicContact CG2-CD1 3.99Å; Y248-L252 PolarHBondContact O-N 3.45Å; E249-L252 PolarHBondContact O-N 3.42Å; L252-R256 HydrophobicContact CB-CB 4.31Å; L252-R256 HydrophobicContact CD2-CB 4.25Å; L252-I259 VanDerWaalsContact CD1-O 3.3Å; L252-I259 WeakPolarHBondContact CD1-O 3.1Å; L252-G306 VanDerWaalsContact CD2-C 3.5Å; L252-L307 HydrophobicContact CD2-CB 4.03Å
253	S	94.3	Very high	95.6	Very high	51 Å²	51	54.7 Å²	54.7	36%	0.357	27%	0.272	S	S	.	.			trans	-62.1	152.9	170.3	53	0	0	0	0	111.5	T251 N255 R256 K257	T251-S253 PolarHBondContact O-N 2.82Å; S253-N255 WeakPolarHBondContact CB-OD1 3.27Å; S253-N255 PolarHBondContact O-N 3.38Å; S253-N255 PolarHBondContact OG-OD1 3.08Å; S253-R256 WeakPolarHBondContact O-CA 3.49Å; S253-R256 WeakPolarHBondContact O-CB 3.48Å; S253-R256 PolarHBondContact O-N 3.38Å; S253-R256 WeakPolarHBondContact OG-CD 3.42Å; S253-K257 PolarHBondContact O-N 3.13Å
254	E	92.9	Very high	95.6	Very high	140 Å²	140	54 Å²	54	65%	0.654	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-50.1	-39.8	-177.9	-65.5	-56.7	140.6	0	0	113.3	R256 K257	E254-R256 PolarHBondContact O-N 3.32Å; E254-R256 VanDerWaalsContact O-N 3.13Å; E254-K257 PolarHBondContact O-N 3.48Å; E254-K257 VanDerWaalsContact OE1-CE 3.22Å; E254-K257 WeakPolarHBondContact OE1-CE 3.4Å; E254-K257 IonicContact OE1-NZ 2.93Å; E254-K257 PolarHBondContact OE1-NZ 2.87Å; E254-K257 WeakPolarHBondContact OE2-CD 3.46Å; E254-K257 WeakPolarHBondContact OE2-CE 3.32Å; E254-K257 IonicContact OE2-NZ 3.96Å; E254-K257 PolarHBondContact OE2-NZ 3.44Å
255	N	91.9	Very high	95.6	Very high	91 Å²	91	57.5 Å²	57.5	49%	0.487	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-72.4	1.5	178.5	69	-9.7	0	0	0	115	K207 S253	K207-N255 VanDerWaalsContact CE-O 3.27Å; K207-N255 WeakPolarHBondContact CE-O 3.47Å; S253-N255 WeakPolarHBondContact CB-OD1 3.27Å; S253-N255 PolarHBondContact O-N 3.38Å; S253-N255 PolarHBondContact OG-OD1 3.08Å
256	R	94.3	Very high	95.7	Very high	53 Å²	53	60 Å²	60	20%	0.2	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-124.4	-5.4	178.7	-70.9	176.8	179.2	173.6	-0.8	113	L252 S253 E254 M258 I259 D305	L252-R256 HydrophobicContact CB-CB 4.31Å; L252-R256 HydrophobicContact CD2-CB 4.25Å; S253-R256 WeakPolarHBondContact O-CA 3.49Å; S253-R256 WeakPolarHBondContact O-CB 3.48Å; S253-R256 PolarHBondContact O-N 3.38Å; S253-R256 WeakPolarHBondContact OG-CD 3.42Å; E254-R256 PolarHBondContact O-N 3.32Å; E254-R256 VanDerWaalsContact O-N 3.13Å; R256-M258 VanDerWaalsContact CA-SD 3.56Å; R256-M258 PolarHBondContact O-N 3.36Å; R256-M258 VanDerWaalsContact O-N 3.08Å; R256-I259 HydrophobicContact CB-CD1 4.29Å; R256-I259 HydrophobicContact CG-CD1 4.42Å; R256-I259 WeakPolarHBondContact O-CB 3.46Å; R256-I259 WeakPolarHBondContact O-CG1 3.41Å; R256-I259 PolarHBondContact O-N 2.89Å; R256-D305 IonicContact CZ-OD2 3.47Å; R256-D305 IonicContact NH1-OD2 3.19Å; R256-D305 PolarHBondContact NH1-OD2 3.03Å; R256-D305 IonicContact NH2-OD2 2.97Å
257	K	94.3	Very high	95.7	Very high	104 Å²	104	59.8 Å²	59.8	45%	0.452	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-20.9	-176.5	-79.1	-171.8	174.6	172.3	0	115.2	S253 E254 I259	S253-K257 PolarHBondContact O-N 3.13Å; E254-K257 PolarHBondContact O-N 3.48Å; E254-K257 VanDerWaalsContact OE1-CE 3.22Å; E254-K257 WeakPolarHBondContact OE1-CE 3.4Å; E254-K257 IonicContact OE1-NZ 2.93Å; E254-K257 PolarHBondContact OE1-NZ 2.87Å; E254-K257 WeakPolarHBondContact OE2-CD 3.46Å; E254-K257 WeakPolarHBondContact OE2-CE 3.32Å; E254-K257 IonicContact OE2-NZ 3.96Å; E254-K257 PolarHBondContact OE2-NZ 3.44Å; K257-I259 PolarHBondContact O-N 2.96Å
258	M	95	Very high	95.7	Very high	52 Å²	52	60 Å²	60	26%	0.256	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-18.1	172.4	69.1	-69	-72.6	0	0	113.2	I206 K207 R256 T260	I206-M258 HydrophobicContact CG2-CG 4.38Å; I206-M258 WeakPolarHBondContact CG2-O 3.35Å; K207-M258 HydrophobicContact CB-SD 4.29Å; K207-M258 HydrophobicContact CG-SD 3.91Å; R256-M258 VanDerWaalsContact CA-SD 3.56Å; R256-M258 PolarHBondContact O-N 3.36Å; R256-M258 VanDerWaalsContact O-N 3.08Å; M258-T260 PolarHBondContact O-N 3.38Å
259	I	96.5	Very high	95.6	Very high	3 Å²	3	61.4 Å²	61.4	2%	0.015	31%	0.309	C	S	.	.			trans	-83.1	92.8	175.3	-51.7	169.1	0	0	0	107.6	I206 K207 V247 L252 R256 K257 L264	I206-I259 HydrophobicContact CB-CG1 4.47Å; I206-I259 HydrophobicContact CG2-CB 4.4Å; I206-I259 HydrophobicContact CG2-CG1 4.04Å; K207-I259 HydrophobicContact CB-CD1 4.25Å; K207-I259 HydrophobicContact CB-CG1 4.41Å; V247-I259 HydrophobicContact CG1-CG2 4.14Å; V247-I259 WeakPolarHBondContact CG2-O 3.46Å; L252-I259 VanDerWaalsContact CD1-O 3.3Å; L252-I259 WeakPolarHBondContact CD1-O 3.1Å; R256-I259 HydrophobicContact CB-CD1 4.29Å; R256-I259 HydrophobicContact CG-CD1 4.42Å; R256-I259 WeakPolarHBondContact O-CB 3.46Å; R256-I259 WeakPolarHBondContact O-CG1 3.41Å; R256-I259 PolarHBondContact O-N 2.89Å; K257-I259 PolarHBondContact O-N 2.96Å; I259-L264 HydrophobicContact CG2-CD1 4.08Å; I259-L264 HydrophobicContact CG2-CD2 4.03Å; I259-L264 HydrophobicContact CG2-CG 4.14Å
260	T	96.6	Very high	95.6	Very high	35 Å²	35	57.5 Å²	57.5	22%	0.215	29%	0.291	C	S	.	.			trans	-101.8	158.5	175.6	67.8	0	0	0	0	111.1	M258 Q262 Q263 L264	M258-T260 PolarHBondContact O-N 3.38Å; T260-Q262 PolarHBondContact O-N 3.16Å; T260-Q263 WeakPolarHBondContact O-CB 3.2Å; T260-Q263 PolarHBondContact O-N 2.83Å; T260-Q263 VanDerWaalsContact O-N 3.13Å; T260-Q263 WeakPolarHBondContact OG1-CG 3.45Å; T260-Q263 PolarHBondContact OG1-N 3.36Å; T260-L264 WeakPolarHBondContact O-CG 3.38Å; T260-L264 PolarHBondContact O-N 3.49Å
261	N	97	Very high	95.6	Very high	40 Å²	40	50.9 Å²	50.9	21%	0.214	26%	0.256	C	S	.	.	H	α-helix	trans	-60.9	-35.3	175.5	-72.9	-63.1	0	0	0	112	P246 V247 E249 Q263 L264 D265	P246-N261 WeakPolarHBondContact CA-OD1 3.16Å; P246-N261 WeakPolarHBondContact CB-OD1 3.32Å; V247-N261 PolarHBondContact N-OD1 2.94Å; V247-N261 PolarHBondContact O-ND2 3.46Å; V247-N261 PolarHBondContact O-OD1 3.42Å; E249-N261 WeakPolarHBondContact OE1-CB 3.46Å; E249-N261 PolarHBondContact OE1-N 3.04Å; E249-N261 PolarHBondContact OE1-ND2 3.3Å; N261-Q263 PolarHBondContact O-N 3.28Å; N261-L264 PolarHBondContact O-N 3.38Å; N261-D265 PolarHBondContact O-N 2.93Å
262	Q	96.5	Very high	95.5	Very high	144 Å²	144	50 Å²	50	67%	0.673	25%	0.25	S	S	*	.	H	α-helix	trans	-60.4	-44.1	173.6	-174.4	-178.2	3.1	0	0	112	T260 D265 L266	T260-Q262 PolarHBondContact O-N 3.16Å; Q262-D265 PolarHBondContact O-N 3.12Å; Q262-L266 WeakPolarHBondContact O-CG 3.38Å; Q262-L266 PolarHBondContact O-N 3.3Å; Q262-L266 VanDerWaalsContact O-N 3.1Å
263	Q	96.2	Very high	95.3	Very high	37 Å²	37	53.4 Å²	53.4	17%	0.173	27%	0.266	C	S	.	.	H	α-helix	trans	-62.9	-45.3	175.1	-74.4	-70.9	-22.6	0	0	111	I206 G211 T260 N261 D265 L266 Y267	I206-Q263 HydrophobicContact CD1-CB 4.09Å; I206-Q263 HydrophobicContact CG2-CB 4.33Å; G211-Q263 PolarHBondContact O-NE2 3.42Å; T260-Q263 WeakPolarHBondContact O-CB 3.2Å; T260-Q263 PolarHBondContact O-N 2.83Å; T260-Q263 VanDerWaalsContact O-N 3.13Å; T260-Q263 WeakPolarHBondContact OG1-CG 3.45Å; T260-Q263 PolarHBondContact OG1-N 3.36Å; N261-Q263 PolarHBondContact O-N 3.28Å; Q263-D265 VanDerWaalsContact C-N 3.28Å; Q263-D265 PolarHBondContact O-N 2.85Å; Q263-L266 PolarHBondContact O-N 2.88Å; Q263-L266 VanDerWaalsContact O-N 3.16Å; Q263-Y267 VanDerWaalsContact O-CD2 3.28Å; Q263-Y267 WeakPolarHBondContact O-CD2 3.25Å; Q263-Y267 PolarHBondContact O-N 2.91Å
264	L	97.1	Very high	95.2	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-60.7	-37.8	178.4	-64.6	167.4	0	0	0	112.3	T203 I206 Q244 D245 V247 I259 T260 N261 Y267 N268	T203-L264 HydrophobicContact CG2-CD2 4.11Å; I206-L264 HydrophobicContact CD1-CD2 3.88Å; Q244-L264 HydrophobicContact CB-CD2 3.91Å; Q244-L264 HydrophobicContact CG-CD2 4.47Å; D245-L264 WeakPolarHBondContact O-CD1 3.48Å; V247-L264 HydrophobicContact CB-CD1 4.38Å; V247-L264 HydrophobicContact CG1-CD1 3.81Å; V247-L264 HydrophobicContact CG2-CD1 3.88Å; I259-L264 HydrophobicContact CG2-CD1 4.08Å; I259-L264 HydrophobicContact CG2-CD2 4.03Å; I259-L264 HydrophobicContact CG2-CG 4.14Å; T260-L264 WeakPolarHBondContact O-CG 3.38Å; T260-L264 PolarHBondContact O-N 3.49Å; N261-L264 PolarHBondContact O-N 3.38Å; L264-Y267 PolarHBondContact O-N 3.35Å; L264-N268 VanDerWaalsContact O-CB 3.29Å; L264-N268 WeakPolarHBondContact O-CB 3.48Å; L264-N268 VanDerWaalsContact O-CG 3.22Å; L264-N268 PolarHBondContact O-N 3.29Å; L264-N268 PolarHBondContact O-ND2 2.77Å
265	D	96.9	Very high	95	Very high	77 Å²	77	45.2 Å²	45.2	41%	0.412	22%	0.223	S	C	.	.	H	α-helix	trans	-64.1	-43.4	174.4	-76.6	-33.1	0	0	0	112.3	N261 Q262 Q263 Y267 N268 Q269 R293	N261-D265 PolarHBondContact O-N 2.93Å; Q262-D265 PolarHBondContact O-N 3.12Å; Q263-D265 VanDerWaalsContact C-N 3.28Å; Q263-D265 PolarHBondContact O-N 2.85Å; D265-Y267 PolarHBondContact O-N 2.89Å; D265-N268 PolarHBondContact O-N 3.04Å; D265-Q269 VanDerWaalsContact O-CB 3.32Å; D265-Q269 WeakPolarHBondContact O-CB 3.22Å; D265-Q269 PolarHBondContact O-N 3.01Å; D265-R293 IonicContact OD1-CZ 3.6Å; D265-R293 IonicContact OD1-NE 2.83Å; D265-R293 IonicContact OD1-NH2 3.65Å; D265-R293 PolarHBondContact OD1-NH2 3.21Å; D265-R293 IonicContact OD2-NH2 3.85Å
266	L	97.3	Very high	94.6	Very high	63 Å²	63	45.3 Å²	45.3	33%	0.33	22%	0.224	S	C	.	.	H	α-helix	trans	-61.5	-43.4	176.2	-69.5	172.3	0	0	0	112.1	L216 Q262 Q263 Q269 A270	L216-L266 HydrophobicContact CD1-CB 4.47Å; L216-L266 HydrophobicContact CD2-CB 3.89Å; L216-L266 HydrophobicContact CD2-CD1 4.32Å; Q262-L266 WeakPolarHBondContact O-CG 3.38Å; Q262-L266 PolarHBondContact O-N 3.3Å; Q262-L266 VanDerWaalsContact O-N 3.1Å; Q263-L266 PolarHBondContact O-N 2.88Å; Q263-L266 VanDerWaalsContact O-N 3.16Å; L266-Q269 PolarHBondContact O-N 3.43Å; L266-A270 WeakPolarHBondContact O-CB 3.43Å; L266-A270 PolarHBondContact O-N 3.27Å
267	Y	97.3	Very high	93.2	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-68.5	-40.3	177.4	-84.7	-105	0	0	0	112	A202 I206 T215 L216 Y219 Q263 L264 D265 Q269 A270 A271	A202-Y267 HydrophobicContact CB-CD1 3.74Å; A202-Y267 HydrophobicContact CB-CG 4.11Å; I206-Y267 HydrophobicContact CD1-CD2 3.82Å; I206-Y267 HydrophobicContact CD1-CE2 3.99Å; I206-Y267 HydrophobicContact CD1-CG 4.17Å; I206-Y267 HydrophobicContact CG1-CD2 3.84Å; I206-Y267 HydrophobicContact CG1-CE1 4.2Å; I206-Y267 HydrophobicContact CG1-CE2 3.46Å; I206-Y267 VanDerWaalsContact CG1-CE2 3.46Å; I206-Y267 HydrophobicContact CG1-CG 4.35Å; T215-Y267 WeakPolarHBondContact CG2-OH 3.49Å; L216-Y267 HydrophobicContact CB-CE2 4.08Å; L216-Y267 HydrophobicContact CD1-CD1 4.2Å; L216-Y267 HydrophobicContact CD1-CD2 3.62Å; L216-Y267 HydrophobicContact CD1-CE1 4.32Å; L216-Y267 HydrophobicContact CD1-CE2 3.75Å; L216-Y267 HydrophobicContact CD1-CG 3.87Å; L216-Y267 HydrophobicContact CG-CE2 4.46Å; Y219-Y267 AromaticContact CD1-CD1 3.57Å; Y219-Y267 HydrophobicContact CD1-CD1 3.57Å; Y219-Y267 AromaticContact CD1-CE1 3.95Å; Y219-Y267 HydrophobicContact CD1-CE1 3.95Å; Y219-Y267 HydrophobicContact CD1-CG 4.49Å; Y219-Y267 AromaticContact CD2-CD1 3.82Å; Y219-Y267 HydrophobicContact CD2-CD1 3.82Å; Y219-Y267 AromaticContact CD2-CE1 3.77Å; Y219-Y267 HydrophobicContact CD2-CE1 3.77Å; Y219-Y267 AromaticContact CE1-CD1 3.75Å; Y219-Y267 HydrophobicContact CE1-CD1 3.75Å; Y219-Y267 AromaticContact CE2-CD1 3.98Å; Y219-Y267 HydrophobicContact CE2-CD1 3.98Å; Y219-Y267 HydrophobicContact CE2-CE1 4.35Å; Y219-Y267 AromaticContact CG-CD1 3.59Å; Y219-Y267 HydrophobicContact CG-CD1 3.59Å; Y219-Y267 AromaticContact CG-CE1 3.52Å; Y219-Y267 HydrophobicContact CG-CE1 3.52Å; Y219-Y267 AromaticContact CZ-CD1 3.94Å; Q263-Y267 VanDerWaalsContact O-CD2 3.28Å; Q263-Y267 WeakPolarHBondContact O-CD2 3.25Å; Q263-Y267 PolarHBondContact O-N 2.91Å; L264-Y267 PolarHBondContact O-N 3.35Å; D265-Y267 PolarHBondContact O-N 2.89Å; Y267-Q269 VanDerWaalsContact C-N 3.35Å; Y267-A270 PolarHBondContact O-N 3.15Å; Y267-A271 WeakPolarHBondContact O-CB 3.3Å; Y267-A271 PolarHBondContact O-N 2.86Å
268	N	96.9	Very high	91.4	Very high	8 Å²	8	42.4 Å²	42.4	4%	0.043	23%	0.225	C	C	.	.	H	α-helix	trans	-64.2	-39.7	174.6	-78.8	-29.1	0	0	0	112.2	L243 Q244 L264 D265 A271 T272 R293	L243-N268 WeakPolarHBondContact CA-OD1 3.43Å; L243-N268 HydrophobicContact CD2-CB 4.4Å; Q244-N268 PolarHBondContact N-OD1 3.44Å; Q244-N268 PolarHBondContact O-ND2 3.33Å; L264-N268 VanDerWaalsContact O-CB 3.29Å; L264-N268 WeakPolarHBondContact O-CB 3.48Å; L264-N268 VanDerWaalsContact O-CG 3.22Å; L264-N268 PolarHBondContact O-N 3.29Å; L264-N268 PolarHBondContact O-ND2 2.77Å; D265-N268 PolarHBondContact O-N 3.04Å; N268-A271 PolarHBondContact O-N 3.28Å; N268-T272 WeakPolarHBondContact O-CB 3.32Å; N268-T272 PolarHBondContact O-N 2.94Å; N268-T272 PolarHBondContact O-OG1 3.02Å; N268-R293 PolarHBondContact ND2-NE 3.33Å
269	Q	96.1	Very high	89.1	Confident	102 Å²	102	49.4 Å²	49.4	48%	0.477	25%	0.254	S	S	.	.	H	α-helix	trans	-62.4	-48	174	-178.9	179.2	-0.9	0	0	110.4	D265 L266 Y267 A271 T272 E273	D265-Q269 VanDerWaalsContact O-CB 3.32Å; D265-Q269 WeakPolarHBondContact O-CB 3.22Å; D265-Q269 PolarHBondContact O-N 3.01Å; L266-Q269 PolarHBondContact O-N 3.43Å; Y267-Q269 VanDerWaalsContact C-N 3.35Å; Q269-A271 VanDerWaalsContact C-N 3.31Å; Q269-A271 PolarHBondContact O-N 3.38Å; Q269-T272 PolarHBondContact O-N 3.26Å; Q269-E273 HydrophobicContact CG-CG 4.35Å; Q269-E273 VanDerWaalsContact CG-OE1 3.31Å; Q269-E273 WeakPolarHBondContact CG-OE1 3.34Å; Q269-E273 PolarHBondContact NE2-OE1 3.35Å; Q269-E273 WeakPolarHBondContact O-CB 3.47Å; Q269-E273 VanDerWaalsContact O-CG 3.3Å; Q269-E273 WeakPolarHBondContact O-CG 3.33Å; Q269-E273 PolarHBondContact O-N 3.39Å
270	A	95.3	Very high	86.9	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-58.7	-42.7	176.4	0	0	0	0	0	112	L216 Y219 L266 Y267 V274	L216-A270 HydrophobicContact CD1-CB 4.13Å; Y219-A270 HydrophobicContact CD1-CB 4.41Å; Y219-A270 HydrophobicContact CE1-CB 4.49Å; L266-A270 WeakPolarHBondContact O-CB 3.43Å; L266-A270 PolarHBondContact O-N 3.27Å; Y267-A270 PolarHBondContact O-N 3.15Å; A270-V274 WeakPolarHBondContact O-CB 3.48Å; A270-V274 VanDerWaalsContact O-CG2 3.25Å; A270-V274 WeakPolarHBondContact O-CG2 3.24Å; A270-V274 PolarHBondContact O-N 3.33Å
271	A	94.8	Very high	84.4	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-64.8	-44.5	176.3	0	0	0	0	0	112.7	L223 Y267 N268 Q269 V274 L275	L223-A271 HydrophobicContact CD2-CB 3.71Å; Y267-A271 WeakPolarHBondContact O-CB 3.3Å; Y267-A271 PolarHBondContact O-N 2.86Å; N268-A271 PolarHBondContact O-N 3.28Å; Q269-A271 VanDerWaalsContact C-N 3.31Å; Q269-A271 PolarHBondContact O-N 3.38Å; A271-V274 PolarHBondContact O-N 2.81Å; A271-L275 VanDerWaalsContact O-CB 3.23Å; A271-L275 WeakPolarHBondContact O-CB 3.3Å; A271-L275 VanDerWaalsContact O-CG 3.26Å; A271-L275 WeakPolarHBondContact O-CG 3.39Å; A271-L275 PolarHBondContact O-N 2.93Å
272	T	93.1	Very high	82.2	Confident	42 Å²	42	64.3 Å²	64.3	26%	0.258	34%	0.34	S	S	.	.	H	α-helix	trans	-62.8	-45.3	178.1	-58.7	0	0	0	0	111.1	N268 Q269 N276 L288	N268-T272 WeakPolarHBondContact O-CB 3.32Å; N268-T272 PolarHBondContact O-N 2.94Å; N268-T272 PolarHBondContact O-OG1 3.02Å; Q269-T272 PolarHBondContact O-N 3.26Å; T272-N276 VanDerWaalsContact CG2-ND2 3.35Å; T272-N276 WeakPolarHBondContact CG2-ND2 3.35Å; T272-N276 WeakPolarHBondContact O-CB 3.28Å; T272-N276 VanDerWaalsContact O-CG 3.31Å; T272-N276 PolarHBondContact O-N 3.42Å; T272-N276 PolarHBondContact O-ND2 3.47Å; T272-L288 HydrophobicContact CG2-CD1 3.83Å
273	E	91.6	Very high	80.3	Confident	79 Å²	79	65.2 Å²	65.2	37%	0.369	34%	0.337	S	S	.	.	H	α-helix	trans	-60.8	-50.8	177.3	-74.8	170.5	-177.8	0	0	111.2	R220 Q269 S277	R220-E273 IonicContact CZ-OE2 2.92Å; R220-E273 IonicContact NE-OE2 3.83Å; R220-E273 IonicContact NH2-OE2 3.27Å; R220-E273 PolarHBondContact NH2-OE2 2.82Å; Q269-E273 HydrophobicContact CG-CG 4.35Å; Q269-E273 VanDerWaalsContact CG-OE1 3.31Å; Q269-E273 WeakPolarHBondContact CG-OE1 3.34Å; Q269-E273 PolarHBondContact NE2-OE1 3.35Å; Q269-E273 WeakPolarHBondContact O-CB 3.47Å; Q269-E273 VanDerWaalsContact O-CG 3.3Å; Q269-E273 WeakPolarHBondContact O-CG 3.33Å; Q269-E273 PolarHBondContact O-N 3.39Å; E273-S277 WeakPolarHBondContact O-CB 3.4Å; E273-S277 PolarHBondContact O-N 3.06Å; E273-S277 PolarHBondContact O-OG 3.41Å
274	V	91.5	Very high	78.7	Confident	17 Å²	17	64.7 Å²	64.7	10%	0.103	34%	0.338	C	S	.	.	H	α-helix	trans	-64.1	-48.5	-178.7	170	0	0	0	0	111.3	R220 L223 A227 A270 A271 S277	R220-V274 HydrophobicContact CG-CG2 3.78Å; L223-V274 HydrophobicContact CB-CG1 4.48Å; L223-V274 HydrophobicContact CD2-CB 4.43Å; L223-V274 HydrophobicContact CG-CG1 4.09Å; A227-V274 HydrophobicContact CB-CG1 3.96Å; A270-V274 WeakPolarHBondContact O-CB 3.48Å; A270-V274 VanDerWaalsContact O-CG2 3.25Å; A270-V274 WeakPolarHBondContact O-CG2 3.24Å; A270-V274 PolarHBondContact O-N 3.33Å; A271-V274 PolarHBondContact O-N 2.81Å; V274-S277 PolarHBondContact O-N 2.92Å; V274-S277 PolarHBondContact O-OG 2.95Å
275	L	89.7	Confident	77.9	Confident	2 Å²	2	70.9 Å²	70.9	1%	0.01	36%	0.361	C	S	.	.	H	α-helix	trans	-77.3	-25.1	-173.5	-63.9	173	0	0	0	112.8	A227 L230 W241 A271 S284 V286 L288	A227-L275 HydrophobicContact CB-CD2 3.91Å; L230-L275 HydrophobicContact CD1-CD2 4.23Å; W241-L275 HydrophobicContact CB-CD1 3.57Å; W241-L275 HydrophobicContact CD2-CD1 3.65Å; W241-L275 HydrophobicContact CE3-CD1 4.22Å; W241-L275 HydrophobicContact CG-CD1 3.31Å; A271-L275 VanDerWaalsContact O-CB 3.23Å; A271-L275 WeakPolarHBondContact O-CB 3.3Å; A271-L275 VanDerWaalsContact O-CG 3.26Å; A271-L275 WeakPolarHBondContact O-CG 3.39Å; A271-L275 PolarHBondContact O-N 2.93Å; L275-S284 WeakPolarHBondContact O-CB 3.43Å; L275-S284 PolarHBondContact O-OG 2.97Å; L275-V286 HydrophobicContact CD1-CG1 4.31Å; L275-V286 HydrophobicContact CD2-CG1 4.36Å; L275-L288 HydrophobicContact CB-CD2 4.19Å; L275-L288 HydrophobicContact CD1-CD2 3.9Å
276	N	82.2	Confident	77.5	Confident	93 Å²	93	67.5 Å²	67.5	50%	0.497	34%	0.343	S	S	.	.	H	α-helix	trans	-84.6	-20.3	173.9	-73.2	-17.8	0	0	0	113.6	T272 S278	T272-N276 VanDerWaalsContact CG2-ND2 3.35Å; T272-N276 WeakPolarHBondContact CG2-ND2 3.35Å; T272-N276 WeakPolarHBondContact O-CB 3.28Å; T272-N276 VanDerWaalsContact O-CG 3.31Å; T272-N276 PolarHBondContact O-N 3.42Å; T272-N276 PolarHBondContact O-ND2 3.47Å; N276-S278 PolarHBondContact O-N 3.05Å
277	S	66.1	Low	77.3	Confident	71 Å²	71	67.2 Å²	67.2	50%	0.497	34%	0.339	S	S	.	.			trans	-91.3	26.3	-169.1	60.6	0	0	0	0	115.4	E273 V274 K279	E273-S277 WeakPolarHBondContact O-CB 3.4Å; E273-S277 PolarHBondContact O-N 3.06Å; E273-S277 PolarHBondContact O-OG 3.41Å; V274-S277 PolarHBondContact O-N 2.92Å; V274-S277 PolarHBondContact O-OG 2.95Å; S277-K279 VanDerWaalsContact C-N 3.33Å; S277-K279 PolarHBondContact O-N 3.5Å
278	S	55.7	Low	77.1	Confident	26 Å²	26	68.6 Å²	68.6	18%	0.182	35%	0.347	C	S	.	.			trans	-67.7	90.8	174.5	62.4	0	0	0	0	111.4	D231 N276 Y280 S284	D231-S278 WeakPolarHBondContact OD2-CB 3.34Å; N276-S278 PolarHBondContact O-N 3.05Å; S278-Y280 PolarHBondContact O-N 3.36Å; S278-S284 VanDerWaalsContact OG-CA 3.31Å; S278-S284 WeakPolarHBondContact OG-CA 3.39Å
279	K	47.2	Very low	77.1	Confident	199 Å²	199	68.2 Å²	68.2	87%	0.865	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-4.3	-171.3	-81.5	178	177	177.6	0	116.2	S277	S277-K279 VanDerWaalsContact C-N 3.33Å; S277-K279 PolarHBondContact O-N 3.5Å
280	Y	49.6	Very low	77	Confident	238 Å²	238	64.4 Å²	64.4	93%	0.933	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	-13.2	-169.2	-88	-83.9	0	0	0	115.9	S278	S278-Y280 PolarHBondContact O-N 3.36Å
281	S	43.7	Very low	76.9	Confident	77 Å²	77	64.4 Å²	64.4	54%	0.538	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.6	2.7	-175.8	71.8	0	0	0	0	116.1	R283	S281-R283 PolarHBondContact O-N 2.93Å; S281-R283 PolarHBondContact OG-O 3.28Å
282	G	50.9	Low	76.9	Confident	76 Å²	76	64.7 Å²	64.7	78%	0.784	33%	0.333	S	S	*	.	S	Bend	trans	76.9	-3	175.9	0	0	0	0	0	115.9
283	R	56.3	Low	77	Confident	162 Å²	162	63.9 Å²	63.9	61%	0.611	33%	0.325	S	S	*	.	S	Bend	trans	-163.5	130.3	164.7	-101.5	169.6	-166.8	-167.3	-2.4	109.9	G80 S281	G80-R283 PolarHBondContact O-NH2 3.44Å; S281-R283 PolarHBondContact O-N 2.93Å; S281-R283 PolarHBondContact OG-O 3.28Å
284	S	63.8	Low	77.1	Confident	26 Å²	26	63.2 Å²	63.2	18%	0.182	32%	0.322	C	S	.	.			trans	-62.3	140.2	169	178.8	0	0	0	0	111.1	L275 S278 V286	L275-S284 WeakPolarHBondContact O-CB 3.43Å; L275-S284 PolarHBondContact O-OG 2.97Å; S278-S284 VanDerWaalsContact OG-CA 3.31Å; S278-S284 WeakPolarHBondContact OG-CA 3.39Å; S284-V286 VanDerWaalsContact C-N 3.34Å; S284-V286 PolarHBondContact OG-N 3.06Å
285	R	78.9	Confident	77.2	Confident	131 Å²	131	62.4 Å²	62.4	49%	0.494	32%	0.317	S	S	.	.	S	Bend	trans	-88.3	-8.7	177.9	-62.3	-174.7	-174.3	-173	8.4	112.2	A234	A234-R285 HydrophobicContact CB-CB 3.5Å; A234-R285 VanDerWaalsContact CB-CB 3.5Å
286	V	89.9	Confident	77.4	Confident	6 Å²	6	62.3 Å²	62.3	4%	0.036	32%	0.317	C	S	.	.	S	Bend	trans	-78.7	122.6	174.5	-177.6	0	0	0	0	109.4	L230 I239 W241 L275 S284	L230-V286 HydrophobicContact CB-CG2 3.81Å; I239-V286 HydrophobicContact CG2-CG1 4.13Å; I239-V286 HydrophobicContact CG2-CG2 4.3Å; W241-V286 HydrophobicContact CB-CG1 4.08Å; L275-V286 HydrophobicContact CD1-CG1 4.31Å; L275-V286 HydrophobicContact CD2-CG1 4.36Å; S284-V286 VanDerWaalsContact C-N 3.34Å; S284-V286 PolarHBondContact OG-N 3.06Å
287	K	92.5	Very high	78	Confident	56 Å²	56	62.5 Å²	62.5	24%	0.243	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	126.1	-177.1	-67.4	175.8	178.9	174.8	0	110.9	L88 E238 I239 Y240 W241	L88-K287 HydrophobicContact CD1-CB 3.99Å; L88-K287 HydrophobicContact CD1-CD 4.05Å; L88-K287 HydrophobicContact CD1-CG 4.3Å; E238-K287 IonicContact OE1-NZ 2.75Å; E238-K287 WeakPolarHBondContact OE2-CE 3.39Å; E238-K287 IonicContact OE2-NZ 3.25Å; E238-K287 PolarHBondContact OE2-NZ 3.27Å; I239-K287 WeakPolarHBondContact O-CB 3.28Å; I239-K287 PolarHBondContact O-N 3.4Å; Y240-K287 CarbonylContact C-O 3.54Å; Y240-K287 VanDerWaalsContact CA-O 3.25Å; Y240-K287 WeakPolarHBondContact CA-O 3.17Å; Y240-K287 HydrophobicContact CD1-CB 3.76Å; Y240-K287 HydrophobicContact CD1-CD 4.32Å; Y240-K287 HydrophobicContact CE1-CB 3.94Å; Y240-K287 HydrophobicContact CE1-CD 3.65Å; Y240-K287 HydrophobicContact CE1-CG 4.45Å; Y240-K287 HydrophobicContact CG-CB 4.45Å; W241-K287 PolarHBondContact N-O 2.86Å
288	L	93.8	Very high	79.2	Confident	30 Å²	30	64.5 Å²	64.5	16%	0.157	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	122.8	176	-58	-179.1	0	0	0	110.6	W241 T272 L275 A290	W241-L288 HydrophobicContact CB-CD2 3.96Å; W241-L288 HydrophobicContact CG-CD2 4.45Å; W241-L288 WeakPolarHBondContact O-CA 3.47Å; T272-L288 HydrophobicContact CG2-CD1 3.83Å; L275-L288 HydrophobicContact CB-CD2 4.19Å; L275-L288 HydrophobicContact CD1-CD2 3.9Å; L288-A290 PolarHBondContact O-N 3.32Å
289	L	95.5	Very high	81	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	84.3	173.1	-178	66.7	0	0	0	109.6	L88 L134 W241 V242 L243 A292 V320 L321	L88-L289 HydrophobicContact CD2-CD1 3.74Å; L134-L289 HydrophobicContact CD2-CD2 4.25Å; W241-L289 PolarHBondContact O-N 3.09Å; V242-L289 HydrophobicContact CG1-CD2 4.3Å; V242-L289 HydrophobicContact CG2-CB 4.42Å; V242-L289 HydrophobicContact CG2-CD2 4Å; L243-L289 PolarHBondContact N-O 3.06Å; L289-A292 HydrophobicContact CD2-CB 4.1Å; L289-A292 HydrophobicContact CG-CB 4.04Å; L289-V320 HydrophobicContact CD1-CB 4.24Å; L289-V320 HydrophobicContact CD1-CG1 3.37Å; L289-L321 HydrophobicContact CD2-CD1 4.25Å; L289-L321 HydrophobicContact CD2-CD2 4.08Å; L289-L321 HydrophobicContact CD2-CG 3.99Å
290	A	94.6	Very high	83.2	Confident	21 Å²	21	55.3 Å²	55.3	17%	0.174	28%	0.278	C	S	.	.			trans	-92.1	-24.5	179.2	0	0	0	0	0	113.3	L88 L243 L288 A292 R293 Q294	L88-A290 CarbonylContact O-C 3.58Å; L88-A290 WeakPolarHBondContact O-CA 3.36Å; L88-A290 PolarHBondContact O-N 3.34Å; L243-A290 HydrophobicContact CD1-CB 3.63Å; L243-A290 HydrophobicContact CG-CB 4.44Å; L288-A290 PolarHBondContact O-N 3.32Å; A290-A292 VanDerWaalsContact C-N 3.26Å; A290-A292 PolarHBondContact O-N 3.24Å; A290-R293 WeakPolarHBondContact O-CB 3.48Å; A290-R293 PolarHBondContact O-N 3.12Å; A290-R293 VanDerWaalsContact O-N 3.11Å; A290-Q294 PolarHBondContact O-N 3.27Å
291	A	94.4	Very high	85.3	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.1	-33.7	-179.7	0	0	0	0	0	112.6	L87 L88 W99 Q294 A295 V320	L87-A291 WeakPolarHBondContact O-CB 3.48Å; L88-A291 WeakPolarHBondContact O-CB 3.28Å; L88-A291 PolarHBondContact O-N 2.99Å; W99-A291 HydrophobicContact CZ2-CB 4.3Å; A291-Q294 PolarHBondContact O-N 3.49Å; A291-A295 PolarHBondContact O-N 2.84Å; A291-V320 HydrophobicContact CB-CG1 4.48Å; A291-V320 HydrophobicContact CB-CG2 4.45Å
292	A	93.3	Very high	87.7	Confident	7 Å²	7	50.1 Å²	50.1	6%	0.058	26%	0.263	C	S	.	.	H	α-helix	trans	-62.7	-44.8	174.3	0	0	0	0	0	111.8	L289 A290 Q294 A295 A296	L289-A292 HydrophobicContact CD2-CB 4.1Å; L289-A292 HydrophobicContact CG-CB 4.04Å; A290-A292 VanDerWaalsContact C-N 3.26Å; A290-A292 PolarHBondContact O-N 3.24Å; A292-Q294 VanDerWaalsContact C-N 3.35Å; A292-Q294 PolarHBondContact O-N 3.15Å; A292-A295 PolarHBondContact O-N 3.47Å; A292-A296 WeakPolarHBondContact O-CB 3.38Å; A292-A296 PolarHBondContact O-N 3Å
293	R	95	Very high	89.8	Confident	24 Å²	24	47 Å²	47	9%	0.091	23%	0.229	C	C	.	.	H	α-helix	trans	-60.6	-42.4	173.4	173	175.5	-178.6	67.3	6.5	111.8	L243 Q244 P246 D265 N268 A290 A296 L297	L243-R293 HydrophobicContact CB-CB 4.5Å; Q244-R293 VanDerWaalsContact O-CD 3.29Å; Q244-R293 WeakPolarHBondContact O-CD 3.3Å; Q244-R293 PolarHBondContact O-NH1 3.48Å; P246-R293 VanDerWaalsContact N-NH1 3.13Å; D265-R293 IonicContact OD1-CZ 3.6Å; D265-R293 IonicContact OD1-NE 2.83Å; D265-R293 IonicContact OD1-NH2 3.65Å; D265-R293 PolarHBondContact OD1-NH2 3.21Å; D265-R293 IonicContact OD2-NH2 3.85Å; N268-R293 PolarHBondContact ND2-NE 3.33Å; A290-R293 WeakPolarHBondContact O-CB 3.48Å; A290-R293 PolarHBondContact O-N 3.12Å; A290-R293 VanDerWaalsContact O-N 3.11Å; R293-A296 PolarHBondContact O-N 3.02Å; R293-L297 WeakPolarHBondContact O-CG 3.36Å; R293-L297 PolarHBondContact O-N 3.24Å
294	Q	94.2	Very high	91.5	Very high	66 Å²	66	46.8 Å²	46.8	31%	0.308	24%	0.24	S	C	.	.	H	α-helix	trans	-63.2	-44.1	178.4	-70.3	-162.8	-8	0	0	112.5	S89 K90 G91 W99 A290 A291 A292 A296 L297	S89-Q294 PolarHBondContact O-NE2 3.33Å; K90-Q294 VanDerWaalsContact CB-OE1 3.24Å; G91-Q294 PolarHBondContact O-OE1 3.46Å; W99-Q294 HydrophobicContact CH2-CB 3.75Å; W99-Q294 HydrophobicContact CZ2-CB 4.21Å; A290-Q294 PolarHBondContact O-N 3.27Å; A291-Q294 PolarHBondContact O-N 3.49Å; A292-Q294 VanDerWaalsContact C-N 3.35Å; A292-Q294 PolarHBondContact O-N 3.15Å; Q294-A296 VanDerWaalsContact C-N 3.27Å; Q294-A296 PolarHBondContact O-N 2.72Å; Q294-L297 PolarHBondContact O-N 2.81Å
295	A	94.1	Very high	92.9	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.9	-42.2	174.4	0	0	0	0	0	111.2	Y93 W99 A291 A292 L297 E298 T299 T313 V316	Y93-A295 HydrophobicContact CE2-CB 3.98Å; Y93-A295 WeakPolarHBondContact CE2-O 3.26Å; W99-A295 HydrophobicContact CD2-CB 4.24Å; W99-A295 HydrophobicContact CE3-CB 3.84Å; W99-A295 HydrophobicContact CH2-CB 4.03Å; W99-A295 HydrophobicContact CZ2-CB 4.38Å; W99-A295 HydrophobicContact CZ3-CB 3.75Å; A291-A295 PolarHBondContact O-N 2.84Å; A292-A295 PolarHBondContact O-N 3.47Å; A295-L297 PolarHBondContact O-N 3.06Å; A295-E298 PolarHBondContact O-N 3.28Å; A295-T299 PolarHBondContact O-OG1 3.01Å; A295-T313 HydrophobicContact CB-CG2 4.14Å; A295-V316 HydrophobicContact CB-CB 4.33Å; A295-V316 HydrophobicContact CB-CG1 3.98Å
296	A	94.7	Very high	93.7	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-66.6	-30.9	178.3	0	0	0	0	0	114.4	D245 P246 A292 R293 Q294 E298 T299 I300 L309 T313	D245-A296 HydrophobicContact CB-CB 3.58Å; P246-A296 HydrophobicContact CG-CB 4.07Å; A292-A296 WeakPolarHBondContact O-CB 3.38Å; A292-A296 PolarHBondContact O-N 3Å; R293-A296 PolarHBondContact O-N 3.02Å; Q294-A296 VanDerWaalsContact C-N 3.27Å; Q294-A296 PolarHBondContact O-N 2.72Å; A296-E298 PolarHBondContact O-N 3.12Å; A296-T299 PolarHBondContact O-N 3.39Å; A296-T299 VanDerWaalsContact O-N 3.16Å; A296-I300 VanDerWaalsContact O-CB 3.22Å; A296-I300 WeakPolarHBondContact O-CB 3.31Å; A296-I300 PolarHBondContact O-N 2.83Å; A296-L309 HydrophobicContact CB-CD1 3.94Å; A296-L309 HydrophobicContact CB-CD2 3.52Å; A296-L309 HydrophobicContact CB-CG 4.39Å; A296-T313 HydrophobicContact CB-CG2 3.96Å
297	L	94.1	Very high	93.9	Very high	97 Å²	97	41.5 Å²	41.5	51%	0.508	22%	0.22	S	C	.	.	H	α-helix	trans	-58.4	-30.6	175	-75.3	166.4	0	0	0	112.8	P246 R293 Q294 A295	P246-L297 HydrophobicContact CB-CD2 3.88Å; P246-L297 HydrophobicContact CG-CD2 3.81Å; P246-L297 HydrophobicContact CG-CG 4.08Å; R293-L297 WeakPolarHBondContact O-CG 3.36Å; R293-L297 PolarHBondContact O-N 3.24Å; Q294-L297 PolarHBondContact O-N 2.81Å; A295-L297 PolarHBondContact O-N 3.06Å
298	E	91.6	Very high	94.1	Very high	112 Å²	112	40.1 Å²	40.1	52%	0.523	21%	0.214	S	C	.	.	H	α-helix	trans	-85.2	-21.3	179.6	-63.9	-175.3	-137.5	0	0	113.2	Y93 A295 A296	Y93-E298 HydrophobicContact CD2-CB 4.11Å; Y93-E298 HydrophobicContact CD2-CG 4.47Å; Y93-E298 WeakPolarHBondContact CD2-OE2 3.46Å; Y93-E298 HydrophobicContact CE2-CB 4.26Å; A295-E298 PolarHBondContact O-N 3.28Å; A296-E298 PolarHBondContact O-N 3.12Å
299	T	93.1	Very high	94.1	Very high	21 Å²	21	39.3 Å²	39.3	13%	0.129	21%	0.21	C	C	.	.	H	α-helix	trans	-121.5	-7.7	-167.9	61.4	0	0	0	0	114.9	Y93 A295 A296 V301 N302 T313	Y93-T299 HydrophobicContact CE2-CG2 3.83Å; A295-T299 PolarHBondContact O-OG1 3.01Å; A296-T299 PolarHBondContact O-N 3.39Å; A296-T299 VanDerWaalsContact O-N 3.16Å; T299-V301 PolarHBondContact O-N 3.3Å; T299-V301 VanDerWaalsContact O-N 3.1Å; T299-N302 WeakPolarHBondContact O-CB 3.3Å; T299-N302 PolarHBondContact O-N 3.19Å; T299-T313 VanDerWaalsContact CB-OG1 3.31Å; T299-T313 WeakPolarHBondContact CB-OG1 3.34Å; T299-T313 WeakPolarHBondContact OG1-CG2 3.31Å; T299-T313 PolarHBondContact OG1-OG1 3.05Å
300	I	94.1	Very high	93.9	Very high	12 Å²	12	40.9 Å²	40.9	6%	0.062	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-58.6	-26.4	-175	-171	61.2	0	0	0	113.7	P246 A296 N302 S303 L309	P246-I300 HydrophobicContact CB-CG1 4.44Å; P246-I300 HydrophobicContact CB-CG2 4.43Å; P246-I300 HydrophobicContact CG-CB 4Å; P246-I300 HydrophobicContact CG-CG1 4.19Å; P246-I300 HydrophobicContact CG-CG2 4.07Å; P246-I300 WeakPolarHBondContact O-CD1 3.33Å; A296-I300 VanDerWaalsContact O-CB 3.22Å; A296-I300 WeakPolarHBondContact O-CB 3.31Å; A296-I300 PolarHBondContact O-N 2.83Å; I300-N302 PolarHBondContact O-N 3Å; I300-N302 VanDerWaalsContact O-N 3.14Å; I300-S303 WeakPolarHBondContact O-CB 3.41Å; I300-S303 PolarHBondContact O-N 3.09Å; I300-L309 HydrophobicContact CD1-CD2 3.76Å
301	V	93.7	Very high	93.8	Very high	89 Å²	89	44.7 Å²	44.7	54%	0.539	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-58.6	-25.3	175.6	-178.4	0	0	0	0	112.2	Y248 T299 S303	Y248-V301 HydrophobicContact CD2-CG2 4.37Å; Y248-V301 HydrophobicContact CE2-CG1 4.41Å; Y248-V301 HydrophobicContact CE2-CG2 4.34Å; T299-V301 PolarHBondContact O-N 3.3Å; T299-V301 VanDerWaalsContact O-N 3.1Å; V301-S303 VanDerWaalsContact C-N 3.28Å; V301-S303 PolarHBondContact O-N 3Å
302	N	92.8	Very high	93.5	Very high	117 Å²	117	47 Å²	47	63%	0.626	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-88.7	13.9	177.9	-59.2	-34.5	0	0	0	113.1	T299 I300 P310	T299-N302 WeakPolarHBondContact O-CB 3.3Å; T299-N302 PolarHBondContact O-N 3.19Å; I300-N302 PolarHBondContact O-N 3Å; I300-N302 VanDerWaalsContact O-N 3.14Å; N302-P310 HydrophobicContact CB-CG 3.87Å
303	S	94.4	Very high	93.5	Very high	10 Å²	10	46.9 Å²	46.9	7%	0.07	26%	0.256	C	S	.	.			trans	-74.7	134.2	178.5	-179.4	0	0	0	0	111.8	I300 V301 G306 H308	I300-S303 WeakPolarHBondContact O-CB 3.41Å; I300-S303 PolarHBondContact O-N 3.09Å; V301-S303 VanDerWaalsContact C-N 3.28Å; V301-S303 PolarHBondContact O-N 3Å; S303-G306 WeakPolarHBondContact OG-CA 3.39Å; S303-G306 PolarHBondContact OG-N 3.15Å; S303-G306 VanDerWaalsContact OG-N 3.09Å; S303-H308 WeakPolarHBondContact CB-O 3.31Å; S303-H308 PolarHBondContact OG-O 3.23Å
304	D	92.9	Very high	93.4	Very high	158 Å²	158	47.2 Å²	47.2	85%	0.845	26%	0.257	S	S	*	.	S	Bend	trans	-70.4	-30.9	179.3	-61.1	-43.8	0	0	0	113.5
305	D	94.1	Very high	93.4	Very high	46 Å²	46	46.8 Å²	46.8	25%	0.246	26%	0.257	C	S	.	.	S	Bend	trans	-127.5	12.4	-174.2	80.1	-18.9	0	0	0	113.9	R256 L307 H308	R256-D305 IonicContact CZ-OD2 3.47Å; R256-D305 IonicContact NH1-OD2 3.19Å; R256-D305 PolarHBondContact NH1-OD2 3.03Å; R256-D305 IonicContact NH2-OD2 2.97Å; D305-L307 PolarHBondContact O-N 3.32Å; D305-L307 PolarHBondContact OD1-N 2.92Å; D305-L307 VanDerWaalsContact OD1-N 3.08Å; D305-H308 VanDerWaalsContact CG-ND1 3.3Å; D305-H308 WeakPolarHBondContact OD1-CB 3.37Å; D305-H308 IonicContact OD1-CG 3.94Å; D305-H308 PolarHBondContact OD1-N 3.42Å; D305-H308 IonicContact OD1-ND1 2.62Å; D305-H308 PolarHBondContact OD1-ND1 3.48Å; D305-H308 IonicContact OD2-CE1 2.86Å; D305-H308 PolarHBondContact OD2-CE1 3.38Å; D305-H308 IonicContact OD2-CG 3.67Å; D305-H308 IonicContact OD2-ND1 3.04Å; D305-H308 PolarHBondContact OD2-ND1 3.21Å
306	G	94.8	Very high	93.5	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.26	C	S	.	.	S	Bend	trans	70	-11.2	-178.2	0	0	0	0	0	115.6	V247 Y248 L252 S303	V247-G306 CarbonylContact C-O 3.47Å; V247-G306 VanDerWaalsContact CA-O 3.24Å; V247-G306 WeakPolarHBondContact CA-O 3.14Å; V247-G306 VanDerWaalsContact CB-O 3.31Å; V247-G306 WeakPolarHBondContact CB-O 3.3Å; Y248-G306 PolarHBondContact N-O 3.06Å; L252-G306 VanDerWaalsContact CD2-C 3.5Å; S303-G306 WeakPolarHBondContact OG-CA 3.39Å; S303-G306 PolarHBondContact OG-N 3.15Å; S303-G306 VanDerWaalsContact OG-N 3.09Å
307	L	95.3	Very high	93.5	Very high	6 Å²	6	47.3 Å²	47.3	3%	0.031	26%	0.261	C	S	.	.	S	Bend	trans	-109	-42.4	-177.1	-179.7	65.1	0	0	0	112.4	T203 V247 L252 D305	T203-L307 HydrophobicContact CG2-CD1 4.42Å; V247-L307 HydrophobicContact CG1-CD1 3.72Å; L252-L307 HydrophobicContact CD2-CB 4.03Å; D305-L307 PolarHBondContact O-N 3.32Å; D305-L307 PolarHBondContact OD1-N 2.92Å; D305-L307 VanDerWaalsContact OD1-N 3.08Å
308	H	94.9	Very high	93.6	Very high	26 Å²	26	42.7 Å²	42.7	12%	0.12	24%	0.237	C	C	.	.	S	Bend	trans	-93.7	136.1	-172.6	-66.3	110.7	0	0	0	111.6	S129 Q133 S303 D305	S129-H308 WeakPolarHBondContact CB-NE2 3.44Å; S129-H308 PolarHBondContact OG-NE2 2.96Å; Q133-H308 VanDerWaalsContact NE2-CB 3.29Å; Q133-H308 PolarHBondContact NE2-CD2 2.98Å; Q133-H308 PolarHBondContact OE1-CD2 3.47Å; Q133-H308 VanDerWaalsContact OE1-CD2 3.23Å; S303-H308 WeakPolarHBondContact CB-O 3.31Å; S303-H308 PolarHBondContact OG-O 3.23Å; D305-H308 VanDerWaalsContact CG-ND1 3.3Å; D305-H308 WeakPolarHBondContact OD1-CB 3.37Å; D305-H308 IonicContact OD1-CG 3.94Å; D305-H308 PolarHBondContact OD1-N 3.42Å; D305-H308 IonicContact OD1-ND1 2.62Å; D305-H308 PolarHBondContact OD1-ND1 3.48Å; D305-H308 IonicContact OD2-CE1 2.86Å; D305-H308 PolarHBondContact OD2-CE1 3.38Å; D305-H308 IonicContact OD2-CG 3.67Å; D305-H308 IonicContact OD2-ND1 3.04Å; D305-H308 PolarHBondContact OD2-ND1 3.21Å
309	L	93.8	Very high	93.8	Very high	14 Å²	14	39.2 Å²	39.2	7%	0.073	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-73.2	154.1	-174.2	-61.8	-177.8	0	0	0	112.4	D245 A296 I300 T313 R314	D245-L309 HydrophobicContact CB-CD1 4.21Å; D245-L309 HydrophobicContact CB-CD2 4.21Å; D245-L309 WeakPolarHBondContact OD2-CD1 3.06Å; A296-L309 HydrophobicContact CB-CD1 3.94Å; A296-L309 HydrophobicContact CB-CD2 3.52Å; A296-L309 HydrophobicContact CB-CG 4.39Å; I300-L309 HydrophobicContact CD1-CD2 3.76Å; L309-T313 HydrophobicContact CD1-CG2 4Å; L309-R314 HydrophobicContact CB-CG 3.84Å; L309-R314 PolarHBondContact O-NE 2.85Å; L309-R314 PolarHBondContact O-NH2 3.49Å
310	P	92.8	Very high	94	Very high	32 Å²	32	38.2 Å²	38.2	21%	0.208	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-62	150.1	167	-20.8	32.4	0	0	0	112.1	N302 G312 T313 R314	N302-P310 HydrophobicContact CB-CG 3.87Å; P310-G312 VanDerWaalsContact C-N 3.3Å; P310-G312 PolarHBondContact O-N 3.12Å; P310-T313 WeakPolarHBondContact O-CB 3.05Å; P310-T313 PolarHBondContact O-N 3.09Å; P310-R314 PolarHBondContact O-N 3.2Å; P310-R314 VanDerWaalsContact O-N 3.16Å
311	E	91.1	Very high	94.1	Very high	101 Å²	101	37.7 Å²	37.7	47%	0.472	21%	0.212	S	C	.	.	H	α-helix	trans	-55	-42.5	-177.3	-177.4	172.5	-150.5	0	0	112.9	K140 T313 R314 N315	K140-E311 IonicContact NZ-OE1 3.92Å; K140-E311 PolarHBondContact NZ-OE1 3.21Å; E311-T313 PolarHBondContact O-N 3.44Å; E311-R314 PolarHBondContact O-N 3.43Å; E311-N315 WeakPolarHBondContact O-CB 3.14Å; E311-N315 PolarHBondContact O-N 3.41Å; E311-N315 PolarHBondContact O-ND2 2.93Å; E311-N315 PolarHBondContact O-OD1 2.96Å
312	G	89.7	Confident	94.3	Very high	48 Å²	48	33.4 Å²	33.4	50%	0.495	19%	0.186	S	C	.	.	H	α-helix	trans	-56.8	-33.8	177.5	0	0	0	0	0	113.5	P310	P310-G312 VanDerWaalsContact C-N 3.3Å; P310-G312 PolarHBondContact O-N 3.12Å
313	T	92.7	Very high	94.4	Very high	6 Å²	6	27.9 Å²	27.9	4%	0.037	16%	0.156	C	C	.	.	H	α-helix	trans	-79.6	-41.6	179.2	-53.2	0	0	0	0	111.6	A295 A296 T299 L309 P310 E311 N315 V316 G317	A295-T313 HydrophobicContact CB-CG2 4.14Å; A296-T313 HydrophobicContact CB-CG2 3.96Å; T299-T313 VanDerWaalsContact CB-OG1 3.31Å; T299-T313 WeakPolarHBondContact CB-OG1 3.34Å; T299-T313 WeakPolarHBondContact OG1-CG2 3.31Å; T299-T313 PolarHBondContact OG1-OG1 3.05Å; L309-T313 HydrophobicContact CD1-CG2 4Å; P310-T313 WeakPolarHBondContact O-CB 3.05Å; P310-T313 PolarHBondContact O-N 3.09Å; E311-T313 PolarHBondContact O-N 3.44Å; T313-N315 PolarHBondContact O-N 3.2Å; T313-V316 VanDerWaalsContact O-CB 3.31Å; T313-V316 WeakPolarHBondContact O-CB 3.31Å; T313-V316 PolarHBondContact O-N 3Å; T313-G317 PolarHBondContact O-N 2.96Å
314	R	92.9	Very high	94.4	Very high	30 Å²	30	27.8 Å²	27.8	11%	0.113	16%	0.156	C	C	.	.	H	α-helix	trans	-58.4	-38.8	174.5	-58.8	171.2	-171.7	174.8	15.4	111.4	Q133 S137 E148 L309 P310 E311 V316 G317 A318	Q133-R314 VanDerWaalsContact OE1-CZ 3.25Å; S137-R314 WeakPolarHBondContact OG-CB 3.38Å; E148-R314 IonicContact OE1-NH1 3.39Å; E148-R314 IonicContact OE2-NH1 2.83Å; L309-R314 HydrophobicContact CB-CG 3.84Å; L309-R314 PolarHBondContact O-NE 2.85Å; L309-R314 PolarHBondContact O-NH2 3.49Å; P310-R314 PolarHBondContact O-N 3.2Å; P310-R314 VanDerWaalsContact O-N 3.16Å; E311-R314 PolarHBondContact O-N 3.43Å; R314-V316 VanDerWaalsContact C-N 3.26Å; R314-V316 PolarHBondContact O-N 3.41Å; R314-G317 PolarHBondContact O-N 3.49Å; R314-A318 PolarHBondContact O-N 2.89Å; R314-A318 VanDerWaalsContact O-N 3.1Å
315	N	94.3	Very high	94.5	Very high	57 Å²	57	21.3 Å²	21.3	31%	0.305	12%	0.121	S	C	.	.	H	α-helix	trans	-63.7	-29.5	176.9	-68.7	-14.4	0	0	0	112.8	S137 E311 T313 M319	S137-N315 WeakPolarHBondContact CB-OD1 3.47Å; S137-N315 PolarHBondContact OG-OD1 3.36Å; E311-N315 WeakPolarHBondContact O-CB 3.14Å; E311-N315 PolarHBondContact O-N 3.41Å; E311-N315 PolarHBondContact O-ND2 2.93Å; E311-N315 PolarHBondContact O-OD1 2.96Å; T313-N315 PolarHBondContact O-N 3.2Å; N315-M319 WeakPolarHBondContact O-CB 3.25Å; N315-M319 VanDerWaalsContact O-CG 3.25Å; N315-M319 WeakPolarHBondContact O-CG 3.5Å; N315-M319 PolarHBondContact O-N 2.93Å
316	V	95.1	Very high	94.5	Very high	11 Å²	11	19.1 Å²	19.1	7%	0.067	11%	0.11	C	C	.	.	H	α-helix	trans	-63.6	-49.9	172.4	174.9	0	0	0	0	110.4	Y93 W99 A295 T313 R314 A318 M319 V320	Y93-V316 HydrophobicContact CE1-CG2 4.25Å; W99-V316 HydrophobicContact CB-CB 4.33Å; W99-V316 HydrophobicContact CB-CG1 3.61Å; W99-V316 HydrophobicContact CB-CG2 3.73Å; W99-V316 VanDerWaalsContact CD1-CG1 3.43Å; W99-V316 HydrophobicContact CD2-CG1 3.81Å; W99-V316 HydrophobicContact CG-CB 4.49Å; W99-V316 HydrophobicContact CG-CG1 3.33Å; W99-V316 HydrophobicContact CG-CG2 4.33Å; A295-V316 HydrophobicContact CB-CB 4.33Å; A295-V316 HydrophobicContact CB-CG1 3.98Å; T313-V316 VanDerWaalsContact O-CB 3.31Å; T313-V316 WeakPolarHBondContact O-CB 3.31Å; T313-V316 PolarHBondContact O-N 3Å; R314-V316 VanDerWaalsContact C-N 3.26Å; R314-V316 PolarHBondContact O-N 3.41Å; V316-A318 VanDerWaalsContact C-N 3.31Å; V316-A318 PolarHBondContact O-N 2.66Å; V316-M319 PolarHBondContact O-N 3.25Å; V316-V320 HydrophobicContact CG1-CG2 4.25Å; V316-V320 WeakPolarHBondContact O-CB 3.35Å; V316-V320 VanDerWaalsContact O-CG2 3.31Å; V316-V320 WeakPolarHBondContact O-CG2 3.44Å; V316-V320 PolarHBondContact O-N 2.91Å
317	G	95.5	Very high	94.5	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.01	11%	0.11	C	C	.	.	H	α-helix	trans	-57.4	-44.5	177.8	0	0	0	0	0	112.3	T313 R314 V320 L321	T313-G317 PolarHBondContact O-N 2.96Å; R314-G317 PolarHBondContact O-N 3.49Å; G317-V320 PolarHBondContact O-N 2.94Å; G317-L321 WeakPolarHBondContact O-CG 3.45Å; G317-L321 PolarHBondContact O-N 3.5Å
318	A	96.6	Very high	94.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63.6	-41.7	176.8	0	0	0	0	0	112.7	L134 F138 I141 R314 V316 L321 M322	L134-A318 HydrophobicContact CD1-CB 4.3Å; F138-A318 HydrophobicContact CB-CB 4.24Å; I141-A318 HydrophobicContact CD1-CB 3.78Å; R314-A318 PolarHBondContact O-N 2.89Å; R314-A318 VanDerWaalsContact O-N 3.1Å; V316-A318 VanDerWaalsContact C-N 3.31Å; V316-A318 PolarHBondContact O-N 2.66Å; A318-L321 PolarHBondContact O-N 2.94Å; A318-M322 WeakPolarHBondContact O-CB 3.41Å; A318-M322 PolarHBondContact O-N 3.35Å
319	M	96.1	Very high	93.9	Very high	39 Å²	39	29.2 Å²	29.2	19%	0.192	16%	0.157	C	C	.	.	H	α-helix	trans	-67.4	-37.8	176.5	-75.3	-66.2	160.5	0	0	112.7	I141 N315 V316 M322 N323	I141-M319 HydrophobicContact CB-CE 4.47Å; I141-M319 HydrophobicContact CD1-CE 3.43Å; I141-M319 VanDerWaalsContact CD1-CE 3.43Å; I141-M319 HydrophobicContact CD1-CG 4.36Å; I141-M319 HydrophobicContact CD1-SD 3.93Å; I141-M319 HydrophobicContact CG1-CE 3.54Å; I141-M319 HydrophobicContact CG2-CE 4.14Å; N315-M319 WeakPolarHBondContact O-CB 3.25Å; N315-M319 VanDerWaalsContact O-CG 3.25Å; N315-M319 WeakPolarHBondContact O-CG 3.5Å; N315-M319 PolarHBondContact O-N 2.93Å; V316-M319 PolarHBondContact O-N 3.25Å; M319-M322 PolarHBondContact O-N 3.04Å; M319-N323 WeakPolarHBondContact O-CB 3.12Å; M319-N323 PolarHBondContact O-N 3.38Å; M319-N323 PolarHBondContact O-ND2 3.46Å
320	V	96.8	Very high	93.7	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.7	-47.6	174.5	166.9	0	0	0	0	110.3	L87 L88 M106 L289 A291 V316 G317 M322 N323 S324	L87-V320 HydrophobicContact CD1-CG1 4.25Å; L87-V320 HydrophobicContact CD1-CG2 4.19Å; L87-V320 HydrophobicContact CG-CG1 4.06Å; L88-V320 HydrophobicContact CD2-CG1 3.83Å; M106-V320 HydrophobicContact SD-CG2 3.86Å; L289-V320 HydrophobicContact CD1-CB 4.24Å; L289-V320 HydrophobicContact CD1-CG1 3.37Å; A291-V320 HydrophobicContact CB-CG1 4.48Å; A291-V320 HydrophobicContact CB-CG2 4.45Å; V316-V320 HydrophobicContact CG1-CG2 4.25Å; V316-V320 WeakPolarHBondContact O-CB 3.35Å; V316-V320 VanDerWaalsContact O-CG2 3.31Å; V316-V320 WeakPolarHBondContact O-CG2 3.44Å; V316-V320 PolarHBondContact O-N 2.91Å; G317-V320 PolarHBondContact O-N 2.94Å; V320-M322 PolarHBondContact O-N 3.33Å; V320-N323 PolarHBondContact O-N 3.26Å; V320-S324 WeakPolarHBondContact O-CB 3.11Å; V320-S324 PolarHBondContact O-N 3.36Å
321	L	96.9	Very high	93.4	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-59.1	-47.1	174.8	-75.2	172.5	0	0	0	111.7	F125 L134 F138 I198 Y240 L289 G317 A318 N323 S324 L325	F125-L321 HydrophobicContact CE1-CD1 4.06Å; F125-L321 HydrophobicContact CZ-CD1 4.34Å; L134-L321 HydrophobicContact CD1-CD1 4.32Å; L134-L321 HydrophobicContact CD2-CD1 3.89Å; L134-L321 HydrophobicContact CG-CD1 4.19Å; F138-L321 HydrophobicContact CD2-CB 4.43Å; F138-L321 HydrophobicContact CE2-CB 4.39Å; I198-L321 HydrophobicContact CG1-CD1 4.22Å; I198-L321 HydrophobicContact CG1-CD2 4.24Å; I198-L321 HydrophobicContact CG2-CD1 4.31Å; Y240-L321 HydrophobicContact CD1-CD2 3.78Å; Y240-L321 HydrophobicContact CD2-CD2 4.22Å; Y240-L321 HydrophobicContact CE1-CD2 4.14Å; Y240-L321 HydrophobicContact CG-CD2 3.83Å; L289-L321 HydrophobicContact CD2-CD1 4.25Å; L289-L321 HydrophobicContact CD2-CD2 4.08Å; L289-L321 HydrophobicContact CD2-CG 3.99Å; G317-L321 WeakPolarHBondContact O-CG 3.45Å; G317-L321 PolarHBondContact O-N 3.5Å; A318-L321 PolarHBondContact O-N 2.94Å; L321-N323 VanDerWaalsContact C-N 3.34Å; L321-N323 PolarHBondContact O-N 2.89Å; L321-S324 PolarHBondContact O-N 3.36Å; L321-S324 VanDerWaalsContact O-N 3.17Å; L321-L325 WeakPolarHBondContact O-CB 3.44Å; L321-L325 VanDerWaalsContact O-CG 3.27Å; L321-L325 WeakPolarHBondContact O-CG 3.17Å; L321-L325 PolarHBondContact O-N 2.81Å
322	M	96.1	Very high	93.3	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-60.7	-43.5	-179.9	-160.1	64.7	72.1	0	0	111.8	Y109 A114 L118 F138 I141 A318 M319 V320 S324 L325 C326	Y109-M322 HydrophobicContact CD1-CG 3.54Å; Y109-M322 HydrophobicContact CD1-SD 4.47Å; Y109-M322 HydrophobicContact CD2-CB 3.85Å; Y109-M322 HydrophobicContact CD2-CG 3.43Å; Y109-M322 VanDerWaalsContact CD2-CG 3.43Å; Y109-M322 HydrophobicContact CE1-CG 3.97Å; Y109-M322 HydrophobicContact CE2-CB 4.3Å; Y109-M322 HydrophobicContact CE2-CG 3.89Å; Y109-M322 HydrophobicContact CG-CB 4.14Å; Y109-M322 HydrophobicContact CG-CG 3.26Å; A114-M322 HydrophobicContact CB-CE 4.03Å; A114-M322 HydrophobicContact CB-SD 4.18Å; L118-M322 HydrophobicContact CD1-CE 4.08Å; L118-M322 HydrophobicContact CD1-SD 4.02Å; F138-M322 HydrophobicContact CD2-CE 3.88Å; F138-M322 HydrophobicContact CE1-CE 4.16Å; F138-M322 HydrophobicContact CE2-CE 3.4Å; F138-M322 VanDerWaalsContact CE2-CE 3.4Å; F138-M322 HydrophobicContact CE2-SD 4.09Å; F138-M322 HydrophobicContact CG-CE 4.45Å; F138-M322 HydrophobicContact CZ-CE 3.57Å; F138-M322 HydrophobicContact CZ-SD 4.2Å; I141-M322 HydrophobicContact CB-CE 4.19Å; I141-M322 HydrophobicContact CD1-CE 4.15Å; I141-M322 HydrophobicContact CG2-CE 4.02Å; A318-M322 WeakPolarHBondContact O-CB 3.41Å; A318-M322 PolarHBondContact O-N 3.35Å; M319-M322 PolarHBondContact O-N 3.04Å; V320-M322 PolarHBondContact O-N 3.33Å; M322-S324 PolarHBondContact O-N 2.87Å; M322-L325 PolarHBondContact O-N 2.85Å; M322-C326 WeakPolarHBondContact O-CB 3.47Å; M322-C326 PolarHBondContact O-N 2.89Å; M322-C326 VanDerWaalsContact SD-SG 3.67Å
323	N	96.2	Very high	92.9	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.7	-40.5	175.8	-85.3	-95.4	0	0	0	112.3	L87 M106 H107 M319 V320 L321 N327	L87-N323 HydrophobicContact CD1-CB 4.49Å; L87-N323 HydrophobicContact CD2-CB 3.66Å; M106-N323 WeakPolarHBondContact CA-OD1 3.33Å; H107-N323 PolarHBondContact N-OD1 2.73Å; H107-N323 PolarHBondContact O-ND2 2.95Å; M319-N323 WeakPolarHBondContact O-CB 3.12Å; M319-N323 PolarHBondContact O-N 3.38Å; M319-N323 PolarHBondContact O-ND2 3.46Å; V320-N323 PolarHBondContact O-N 3.26Å; L321-N323 VanDerWaalsContact C-N 3.34Å; L321-N323 PolarHBondContact O-N 2.89Å; N323-N327 WeakPolarHBondContact O-CB 3.35Å; N323-N327 VanDerWaalsContact O-CG 3.22Å; N323-N327 PolarHBondContact O-N 2.91Å; N323-N327 PolarHBondContact O-ND2 3.41Å; N323-N327 PolarHBondContact OD1-ND2 3.48Å; N323-N327 PolarHBondContact OD1-OD1 2.66Å
324	S	94.9	Very high	92.6	Very high	9 Å²	9	36.1 Å²	36.1	6%	0.063	17%	0.174	C	C	.	.	H	α-helix	trans	-63.1	-41.3	176.8	-174.4	0	0	0	0	112.6	Y240 V320 L321 M322	Y240-S324 WeakPolarHBondContact CE1-OG 3.44Å; Y240-S324 PolarHBondContact OH-OG 3.41Å; V320-S324 WeakPolarHBondContact O-CB 3.11Å; V320-S324 PolarHBondContact O-N 3.36Å; L321-S324 PolarHBondContact O-N 3.36Å; L321-S324 VanDerWaalsContact O-N 3.17Å; M322-S324 PolarHBondContact O-N 2.87Å
325	L	94.1	Very high	92.4	Very high	22 Å²	22	34.9 Å²	34.9	12%	0.115	17%	0.17	C	C	.	.	H	α-helix	trans	-78	-40.6	-177.6	-67.5	170.5	0	0	0	113.1	F138 V196 E238 Y240 L321 M322	F138-L325 HydrophobicContact CE2-CD1 4.23Å; F138-L325 HydrophobicContact CZ-CD1 4.3Å; V196-L325 HydrophobicContact CB-CD2 4.39Å; V196-L325 HydrophobicContact CG1-CD1 4.02Å; V196-L325 HydrophobicContact CG1-CD2 3.7Å; V196-L325 HydrophobicContact CG1-CG 4.5Å; V196-L325 HydrophobicContact CG2-CD1 4.41Å; V196-L325 HydrophobicContact CG2-CD2 3.7Å; E238-L325 HydrophobicContact CB-CD2 4.08Å; E238-L325 HydrophobicContact CG-CD2 4.38Å; Y240-L325 HydrophobicContact CE2-CD2 3.78Å; Y240-L325 HydrophobicContact CE2-CG 4.44Å; L321-L325 WeakPolarHBondContact O-CB 3.44Å; L321-L325 VanDerWaalsContact O-CG 3.27Å; L321-L325 WeakPolarHBondContact O-CG 3.17Å; L321-L325 PolarHBondContact O-N 2.81Å; M322-L325 PolarHBondContact O-N 2.85Å
326	C	94.5	Very high	92.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-108.2	-22.6	-160.9	-65	0	0	0	0	114.9	Y109 C117 M322 K328 L329 L330	Y109-C326 HydrophobicContact CE1-CB 3.51Å; Y109-C326 HydrophobicContact CE2-CB 4.36Å; Y109-C326 WeakPolarHBondContact OH-CB 3.29Å; C117-C326 HydrophobicContact CB-CB 3.65Å; C117-C326 WeakPolarHBondContact CB-SG 3.47Å; C117-C326 WeakPolarHBondContact SG-CA 3.25Å; C117-C326 WeakPolarHBondContact SG-CB 3.4Å; C117-C326 CovalentContact SG-SG 2.01Å; C117-C326 PolarHBondContact SG-SG 3.09Å; M322-C326 WeakPolarHBondContact O-CB 3.47Å; M322-C326 PolarHBondContact O-N 2.89Å; M322-C326 VanDerWaalsContact SD-SG 3.67Å; C326-K328 VanDerWaalsContact C-N 3.25Å; C326-K328 PolarHBondContact O-N 2.96Å; C326-L329 PolarHBondContact O-N 3.44Å; C326-L329 VanDerWaalsContact O-N 3.09Å; C326-L330 PolarHBondContact O-N 3.43Å
327	N	93.4	Very high	92	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-64.8	-31.1	-175.6	-77	-8.4	0	0	0	112.6	Y109 N323 L329 R331 P332 C337 C338 Q339	Y109-N327 PolarHBondContact OH-N 2.89Å; Y109-N327 PolarHBondContact OH-OD1 3.38Å; N323-N327 WeakPolarHBondContact O-CB 3.35Å; N323-N327 VanDerWaalsContact O-CG 3.22Å; N323-N327 PolarHBondContact O-N 2.91Å; N323-N327 PolarHBondContact O-ND2 3.41Å; N323-N327 PolarHBondContact OD1-ND2 3.48Å; N323-N327 PolarHBondContact OD1-OD1 2.66Å; N327-L329 VanDerWaalsContact C-N 3.28Å; N327-L329 PolarHBondContact O-N 3.38Å; N327-R331 VanDerWaalsContact O-CA 3.32Å; N327-R331 WeakPolarHBondContact O-CA 3.32Å; N327-R331 PolarHBondContact O-N 3.44Å; N327-P332 WeakPolarHBondContact OD1-CG 3.42Å; N327-C337 VanDerWaalsContact CB-O 3.3Å; N327-C337 WeakPolarHBondContact CB-O 3.47Å; N327-C337 PolarHBondContact ND2-O 2.93Å; N327-C338 HydrophobicContact CB-CB 4.3Å; N327-Q339 HydrophobicContact CB-CG 3.99Å
328	K	88.9	Confident	91.7	Very high	136 Å²	136	32.8 Å²	32.8	59%	0.591	16%	0.16	S	C	*	.	H	α-helix	trans	-64.2	-34.2	176.2	-172.5	175.9	178.8	-176.3	0	112.5	C326 C338 T340	C326-K328 VanDerWaalsContact C-N 3.25Å; C326-K328 PolarHBondContact O-N 2.96Å; K328-C338 PolarHBondContact N-O 2.93Å; K328-T340 HydrophobicContact CG-CG2 4.23Å
329	L	89	Confident	91.3	Very high	107 Å²	107	35.3 Å²	35.3	56%	0.56	17%	0.172	S	C	*	.	H	α-helix	trans	-86.1	-55.2	-178	-179.2	64.6	0	0	0	111.7	C326 N327	C326-L329 PolarHBondContact O-N 3.44Å; C326-L329 VanDerWaalsContact O-N 3.09Å; N327-L329 VanDerWaalsContact C-N 3.28Å; N327-L329 PolarHBondContact O-N 3.38Å
330	L	89.6	Confident	90.3	Very high	59 Å²	59	36.3 Å²	36.3	31%	0.309	18%	0.181	S	C	.	.	H	α-helix	trans	-81.7	-26.1	-173	-62	-175	0	0	0	113.8	Y109 D113 T116 C117 C326	Y109-L330 HydrophobicContact CE1-CD1 3.76Å; D113-L330 HydrophobicContact CB-CD1 4.15Å; D113-L330 WeakPolarHBondContact O-CD1 3.22Å; T116-L330 HydrophobicContact CG2-CD2 4.14Å; C117-L330 HydrophobicContact CB-CD1 4.11Å; C117-L330 HydrophobicContact CB-CG 4.28Å; C326-L330 PolarHBondContact O-N 3.43Å
331	R	88.1	Confident	89.2	Confident	131 Å²	131	41.2 Å²	41.2	49%	0.494	21%	0.206	S	C	.	.			trans	48	58.3	-177.6	-57.7	178.7	-178.4	174.1	-2.3	113.1	N327 T340	N327-R331 VanDerWaalsContact O-CA 3.32Å; N327-R331 WeakPolarHBondContact O-CA 3.32Å; N327-R331 PolarHBondContact O-N 3.44Å; R331-T340 PolarHBondContact NH2-OG1 2.92Å
332	P	88.1	Confident	88.1	Confident	14 Å²	14	44.6 Å²	44.6	9%	0.091	23%	0.229	C	C	.	.			trans	-62.4	141	-177.5	26.2	-34.3	0	0	0	111.9	H107 N327 D334 G335 Q339	H107-P332 HydrophobicContact CB-CB 3.87Å; H107-P332 HydrophobicContact CB-CG 3.52Å; N327-P332 WeakPolarHBondContact OD1-CG 3.42Å; P332-D334 VanDerWaalsContact C-N 3.32Å; P332-D334 PolarHBondContact O-N 3.18Å; P332-G335 PolarHBondContact O-N 3.4Å; P332-Q339 PolarHBondContact O-NE2 3.41Å
333	I	82.2	Confident	87.3	Confident	87 Å²	87	49.3 Å²	49.3	45%	0.446	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-30.4	-175.3	-59.2	171.8	0	0	0	112.1	D756	I333-D756 HydrophobicContact CG2-CB 4Å
334	D	85.8	Confident	86.7	Confident	56 Å²	56	52 Å²	52	30%	0.299	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-3.3	-179	61.2	-34.4	0	0	0	113.9	H107 P332 K758	H107-D334 IonicContact CE1-OD1 2.62Å; H107-D334 PolarHBondContact CE1-OD1 2.99Å; H107-D334 IonicContact CE1-OD2 3.87Å; H107-D334 IonicContact CG-OD1 3.64Å; H107-D334 IonicContact ND1-OD1 3.34Å; H107-D334 PolarHBondContact ND1-OD1 3.27Å; H107-D334 IonicContact ND1-OD2 3.65Å; H107-D334 PolarHBondContact ND1-OD2 3.48Å; P332-D334 VanDerWaalsContact C-N 3.32Å; P332-D334 PolarHBondContact O-N 3.18Å; D334-K758 HydrophobicContact CB-CB 3.96Å; D334-K758 HydrophobicContact CB-CD 4.32Å; D334-K758 HydrophobicContact CB-CG 3.82Å
335	G	88.3	Confident	86.3	Confident	3 Å²	3	55.3 Å²	55.3	3%	0.031	29%	0.294	C	S	.	.			trans	-106.8	155.8	172.5	0	0	0	0	0	112.1	M105 P332 Q339	M105-G335 WeakPolarHBondContact O-CA 3.16Å; P332-G335 PolarHBondContact O-N 3.4Å; G335-Q339 PolarHBondContact O-NE2 2.9Å
336	S	89.7	Confident	85.9	Confident	11 Å²	11	60.3 Å²	60.3	8%	0.077	32%	0.32	C	S	.	.			trans	-137.1	-14.2	171.6	46.9	0	0	0	0	114	M105	M105-S336 WeakPolarHBondContact CB-OG 3.31Å; M105-S336 PolarHBondContact N-OG 2.9Å; M105-S336 PolarHBondContact O-N 3.25Å
337	C	91.6	Very high	85.3	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	143.9	174.9	-56.3	0	0	0	0	111.8	L87 C104 M105 N327 Q339	L87-C337 HydrophobicContact CB-CB 4.03Å; L87-C337 HydrophobicContact CD1-CB 4.2Å; L87-C337 HydrophobicContact CD2-CB 3.97Å; L87-C337 HydrophobicContact CG-CB 4.27Å; C104-C337 HydrophobicContact CB-CB 3.93Å; C104-C337 WeakPolarHBondContact CB-SG 3.45Å; C104-C337 VanDerWaalsContact SG-CA 3.56Å; C104-C337 WeakPolarHBondContact SG-CB 3.25Å; C104-C337 CovalentContact SG-SG 2.03Å; C104-C337 PolarHBondContact SG-SG 3.5Å; M105-C337 PolarHBondContact N-SG 2.82Å; M105-C337 VanDerWaalsContact N-SG 3.44Å; M105-C337 PolarHBondContact O-N 3.22Å; M105-C337 VanDerWaalsContact O-N 3.12Å; M105-C337 PolarHBondContact O-SG 3.38Å; N327-C337 VanDerWaalsContact CB-O 3.3Å; N327-C337 WeakPolarHBondContact CB-O 3.47Å; N327-C337 PolarHBondContact ND2-O 2.93Å; C337-Q339 PolarHBondContact O-N 3.33Å; C337-Q339 VanDerWaalsContact O-N 3.11Å
338	C	89.6	Confident	85	Confident	14 Å²	14	64.3 Å²	64.3	10%	0.095	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	28	175.7	-53.1	0	0	0	0	115	S83 C84 L87 N327 K328	S83-C338 PolarHBondContact OG-N 3.11Å; C84-C338 WeakPolarHBondContact CA-SG 3.28Å; C84-C338 HydrophobicContact CB-CB 3.8Å; C84-C338 WeakPolarHBondContact CB-SG 3.21Å; C84-C338 WeakPolarHBondContact SG-CB 3.35Å; C84-C338 CovalentContact SG-SG 2.05Å; C84-C338 PolarHBondContact SG-SG 3.09Å; L87-C338 WeakPolarHBondContact CD2-SG 3.41Å; N327-C338 HydrophobicContact CB-CB 4.3Å; K328-C338 PolarHBondContact N-O 2.93Å
339	Q	87.1	Confident	84.9	Confident	54 Å²	54	63.5 Å²	63.5	25%	0.252	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-99.9	139.8	176.4	-67.6	-168.3	7.8	0	0	111.7	N327 P332 G335 C337	N327-Q339 HydrophobicContact CB-CG 3.99Å; P332-Q339 PolarHBondContact O-NE2 3.41Å; G335-Q339 PolarHBondContact O-NE2 2.9Å; C337-Q339 PolarHBondContact O-N 3.33Å; C337-Q339 VanDerWaalsContact O-N 3.11Å
340	T	76.7	Confident	84.8	Confident	60 Å²	60	63.5 Å²	63.5	37%	0.368	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-82.2	131.1	171.1	53.1	0	0	0	0	110.1	K328 R331 S342	K328-T340 HydrophobicContact CG-CG2 4.23Å; R331-T340 PolarHBondContact NH2-OG1 2.92Å; T340-S342 PolarHBondContact O-N 3.31Å
341	I	72.9	Confident	84.5	Confident	103 Å²	103	61.3 Å²	61.3	53%	0.528	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-66.4	123.2	176.2	-55.4	171.4	0	0	0	109	D422	I341-D422 HydrophobicContact CD1-CB 3.62Å; I341-D422 HydrophobicContact CG1-CB 4.14Å
342	S	72.8	Confident	84.5	Confident	70 Å²	70	57.4 Å²	57.4	49%	0.49	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-67.6	137.5	173.8	-63.6	0	0	0	0	110.5	T340	T340-S342 PolarHBondContact O-N 3.31Å
343	P	80.8	Confident	84.5	Confident	99 Å²	99	60.7 Å²	60.7	64%	0.643	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-64.5	151.1	176.5	28.3	-34.2	0	0	0	110.8	N345	P343-N345 PolarHBondContact O-N 3.23Å
344	P	83.3	Confident	84.8	Confident	57 Å²	57	62.1 Å²	62.1	37%	0.37	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-61.7	134.1	179.6	-21.2	30.5	0	0	0	112.6	Q348 K349	P344-Q348 VanDerWaalsContact CA-OE1 3.3Å; P344-Q348 HydrophobicContact CB-CB 4.2Å; P344-K349 HydrophobicContact CB-CG 4.28Å; P344-K349 WeakPolarHBondContact O-CE 3.46Å
345	N	85.8	Confident	84.8	Confident	78 Å²	78	60.8 Å²	60.8	42%	0.417	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-70.6	163.4	177.7	-74.4	-6.5	0	0	0	111.6	P343 I347 Q348 K349 D543	P343-N345 PolarHBondContact O-N 3.23Å; N345-I347 VanDerWaalsContact C-N 3.25Å; N345-I347 PolarHBondContact O-N 3.19Å; N345-Q348 WeakPolarHBondContact O-CB 3.45Å; N345-Q348 PolarHBondContact O-N 3.35Å; N345-K349 PolarHBondContact O-N 3.18Å; N345-D543 PolarHBondContact ND2-OD2 3.04Å
346	L	85.5	Confident	84.7	Confident	127 Å²	127	66.1 Å²	66.1	67%	0.665	37%	0.366	S	S	*	.	H	α-helix	trans	-54.3	-42.5	-179.4	179.2	63.2	0	0	0	112	Q348 K349 L350	L346-Q348 VanDerWaalsContact C-N 3.32Å; L346-Q348 PolarHBondContact O-N 3.01Å; L346-K349 PolarHBondContact O-N 3.26Å; L346-L350 HydrophobicContact CD1-CD1 4.42Å; L346-L350 HydrophobicContact CD1-CG 4.34Å; L346-L350 HydrophobicContact CG-CD1 4.12Å; L346-L350 HydrophobicContact CG-CG 4.45Å; L346-L350 VanDerWaalsContact O-CG 3.31Å; L346-L350 WeakPolarHBondContact O-CG 3.48Å; L346-L350 PolarHBondContact O-N 3.18Å
347	I	82.4	Confident	84.4	Confident	67 Å²	67	67.2 Å²	67.2	34%	0.344	38%	0.38	S	S	.	.	H	α-helix	trans	-62	-40.6	178.4	-61.9	173.8	0	0	0	111.2	N345 L350 S351 I540	N345-I347 VanDerWaalsContact C-N 3.25Å; N345-I347 PolarHBondContact O-N 3.19Å; I347-L350 PolarHBondContact O-N 3.14Å; I347-S351 WeakPolarHBondContact O-CB 3.34Å; I347-S351 PolarHBondContact O-N 3.12Å; I347-S351 PolarHBondContact O-OG 2.75Å; I347-I540 HydrophobicContact CG2-CG2 3.78Å
348	Q	86.7	Confident	84	Confident	18 Å²	18	67.6 Å²	67.6	8%	0.084	38%	0.383	C	S	.	.	H	α-helix	trans	-69	-37.8	177.7	-64.8	177.4	-36.6	0	0	111.8	P344 N345 L346 S351 A352 V541	P344-Q348 VanDerWaalsContact CA-OE1 3.3Å; P344-Q348 HydrophobicContact CB-CB 4.2Å; N345-Q348 WeakPolarHBondContact O-CB 3.45Å; N345-Q348 PolarHBondContact O-N 3.35Å; L346-Q348 VanDerWaalsContact C-N 3.32Å; L346-Q348 PolarHBondContact O-N 3.01Å; Q348-S351 WeakPolarHBondContact CA-OG 3.19Å; Q348-S351 PolarHBondContact O-N 3.04Å; Q348-S351 PolarHBondContact O-OG 2.73Å; Q348-A352 WeakPolarHBondContact O-CB 3.44Å; Q348-A352 PolarHBondContact O-N 3.1Å; Q348-V541 PolarHBondContact NE2-O 3.28Å; Q348-V541 VanDerWaalsContact NE2-O 3.15Å
349	K	87.1	Confident	83.7	Confident	119 Å²	119	69.8 Å²	69.8	52%	0.517	40%	0.395	S	S	.	.	H	α-helix	trans	-63.7	-45.5	173	-68.5	174.4	179	169.1	0	111.1	P344 N345 L346 A352 C353	P344-K349 HydrophobicContact CB-CG 4.28Å; P344-K349 WeakPolarHBondContact O-CE 3.46Å; N345-K349 PolarHBondContact O-N 3.18Å; L346-K349 PolarHBondContact O-N 3.26Å; K349-A352 PolarHBondContact O-N 2.84Å; K349-C353 PolarHBondContact O-N 3.32Å; K349-C353 PolarHBondContact O-SG 3.19Å
350	L	86.3	Confident	83.5	Confident	107 Å²	107	71.5 Å²	71.5	56%	0.56	41%	0.41	S	S	*	.	H	α-helix	trans	-63.6	-40.9	177.5	-71	174.1	0	0	0	112.1	L346 I347 C353 F354	L346-L350 HydrophobicContact CD1-CD1 4.42Å; L346-L350 HydrophobicContact CD1-CG 4.34Å; L346-L350 HydrophobicContact CG-CD1 4.12Å; L346-L350 HydrophobicContact CG-CG 4.45Å; L346-L350 VanDerWaalsContact O-CG 3.31Å; L346-L350 WeakPolarHBondContact O-CG 3.48Å; L346-L350 PolarHBondContact O-N 3.18Å; I347-L350 PolarHBondContact O-N 3.14Å; L350-C353 PolarHBondContact O-N 3.37Å; L350-F354 WeakPolarHBondContact O-CB 3.44Å; L350-F354 PolarHBondContact O-N 3.28Å
351	S	84.5	Confident	83.7	Confident	13 Å²	13	71.7 Å²	71.7	9%	0.091	41%	0.41	C	S	.	.	H	α-helix	trans	-67	-39.7	176.9	69	0	0	0	0	111.9	I347 Q348 F354 F355	I347-S351 WeakPolarHBondContact O-CB 3.34Å; I347-S351 PolarHBondContact O-N 3.12Å; I347-S351 PolarHBondContact O-OG 2.75Å; Q348-S351 WeakPolarHBondContact CA-OG 3.19Å; Q348-S351 PolarHBondContact O-N 3.04Å; Q348-S351 PolarHBondContact O-OG 2.73Å; S351-F354 WeakPolarHBondContact O-CB 3.37Å; S351-F354 PolarHBondContact O-N 3.07Å; S351-F355 WeakPolarHBondContact O-CD2 3.44Å; S351-F355 PolarHBondContact O-N 3.34Å
352	A	87.3	Confident	84.1	Confident	48 Å²	48	69.5 Å²	69.5	40%	0.397	40%	0.397	S	S	.	.	H	α-helix	trans	-60	-47.2	171.7	0	0	0	0	0	111.6	Q348 K349 F354 F355 L356	Q348-A352 WeakPolarHBondContact O-CB 3.44Å; Q348-A352 PolarHBondContact O-N 3.1Å; K349-A352 PolarHBondContact O-N 2.84Å; A352-F354 VanDerWaalsContact C-N 3.31Å; A352-F354 PolarHBondContact O-N 3.43Å; A352-F355 PolarHBondContact O-N 2.93Å; A352-L356 WeakPolarHBondContact O-CB 3.41Å; A352-L356 VanDerWaalsContact O-CG 3.28Å; A352-L356 WeakPolarHBondContact O-CG 3.34Å; A352-L356 PolarHBondContact O-N 3.47Å
353	C	88.6	Confident	84.6	Confident	83 Å²	83	70.1 Å²	70.1	56%	0.561	40%	0.398	S	S	*	.	H	α-helix	trans	-59.3	-39.9	175	-71.2	0	0	0	0	112.4	K349 L350 L356 G357	K349-C353 PolarHBondContact O-N 3.32Å; K349-C353 PolarHBondContact O-SG 3.19Å; L350-C353 PolarHBondContact O-N 3.37Å; C353-L356 PolarHBondContact O-N 3.02Å; C353-G357 PolarHBondContact O-N 2.88Å
354	F	87.4	Confident	84.6	Confident	118 Å²	118	68.7 Å²	68.7	52%	0.518	39%	0.387	S	S	.	.	H	α-helix	trans	-62	-49.3	177.3	172.5	-96.1	0	0	0	112.1	L350 S351 A352 G357 A358 L405	L350-F354 WeakPolarHBondContact O-CB 3.44Å; L350-F354 PolarHBondContact O-N 3.28Å; S351-F354 WeakPolarHBondContact O-CB 3.37Å; S351-F354 PolarHBondContact O-N 3.07Å; A352-F354 VanDerWaalsContact C-N 3.31Å; A352-F354 PolarHBondContact O-N 3.43Å; F354-G357 PolarHBondContact O-N 3.48Å; F354-A358 PolarHBondContact O-N 3.49Å; F354-L405 HydrophobicContact CE1-CD2 4.34Å; F354-L405 HydrophobicContact CZ-CD1 4.38Å; F354-L405 HydrophobicContact CZ-CD2 4.45Å
355	F	87.1	Confident	84.3	Confident	27 Å²	27	68.4 Å²	68.4	12%	0.118	38%	0.382	C	S	.	.	H	α-helix	trans	-66.8	-39.2	178.8	-73	-62.2	0	0	0	112.1	S351 A352 A358 V359 M408 M412 V537 V541	S351-F355 WeakPolarHBondContact O-CD2 3.44Å; S351-F355 PolarHBondContact O-N 3.34Å; A352-F355 PolarHBondContact O-N 2.93Å; F355-A358 WeakPolarHBondContact O-CB 3.41Å; F355-A358 PolarHBondContact O-N 3.27Å; F355-V359 WeakPolarHBondContact O-CG2 3.46Å; F355-V359 PolarHBondContact O-N 3.45Å; F355-V359 VanDerWaalsContact O-N 3.09Å; F355-M408 HydrophobicContact CE1-CB 4.27Å; F355-M408 HydrophobicContact CE1-CG 4.07Å; F355-M408 HydrophobicContact CZ-CG 4.27Å; F355-M412 HydrophobicContact CE2-CB 4.26Å; F355-M412 HydrophobicContact CE2-CG 4.14Å; F355-M412 HydrophobicContact CZ-CG 4Å; F355-V537 HydrophobicContact CZ-CG1 4.12Å; F355-V541 HydrophobicContact CE2-CG2 4.06Å
356	L	86	Confident	83.9	Confident	115 Å²	115	71.1 Å²	71.1	60%	0.602	39%	0.392	S	S	*	.	H	α-helix	trans	-62.4	-44.1	173.7	-73.2	169.4	0	0	0	111.6	A352 C353 A358 V359 V360	A352-L356 WeakPolarHBondContact O-CB 3.41Å; A352-L356 VanDerWaalsContact O-CG 3.28Å; A352-L356 WeakPolarHBondContact O-CG 3.34Å; A352-L356 PolarHBondContact O-N 3.47Å; C353-L356 PolarHBondContact O-N 3.02Å; L356-A358 VanDerWaalsContact C-N 3.32Å; L356-A358 PolarHBondContact O-N 2.81Å; L356-V359 WeakPolarHBondContact O-CB 3.32Å; L356-V359 PolarHBondContact O-N 3.36Å; L356-V360 WeakPolarHBondContact O-CG2 3.4Å; L356-V360 PolarHBondContact O-N 3.37Å
357	G	83.3	Confident	83.5	Confident	34 Å²	34	69 Å²	69	35%	0.351	39%	0.393	S	S	.	.	H	α-helix	trans	-59	-42	174.4	0	0	0	0	0	112.3	C353 F354 V359 V360 V361	C353-G357 PolarHBondContact O-N 2.88Å; F354-G357 PolarHBondContact O-N 3.48Å; G357-V359 VanDerWaalsContact C-N 3.32Å; G357-V359 PolarHBondContact O-N 2.85Å; G357-V360 PolarHBondContact O-N 2.93Å; G357-V361 WeakPolarHBondContact O-CG2 3.38Å; G357-V361 PolarHBondContact O-N 3.44Å
358	A	83.1	Confident	83.3	Confident	8 Å²	8	71.7 Å²	71.7	7%	0.066	41%	0.408	C	S	.	.	H	α-helix	trans	-61.3	-39.7	175.6	0	0	0	0	0	112.4	F354 F355 L356 F362 L405 C406	F354-A358 PolarHBondContact O-N 3.49Å; F355-A358 WeakPolarHBondContact O-CB 3.41Å; F355-A358 PolarHBondContact O-N 3.27Å; L356-A358 VanDerWaalsContact C-N 3.32Å; L356-A358 PolarHBondContact O-N 2.81Å; A358-F362 WeakPolarHBondContact O-CB 3.45Å; A358-F362 PolarHBondContact O-N 2.97Å; A358-L405 HydrophobicContact CB-CB 4.31Å; A358-C406 PolarHBondContact O-SG 2.98Å
359	V	82.8	Confident	82.1	Confident	60 Å²	60	73.2 Å²	73.2	36%	0.364	43%	0.428	S	S	.	.	H	α-helix	trans	-64	-46.7	174.7	173.5	0	0	0	0	111	F355 L356 G357 V361 F362 V363 C406	F355-V359 WeakPolarHBondContact O-CG2 3.46Å; F355-V359 PolarHBondContact O-N 3.45Å; F355-V359 VanDerWaalsContact O-N 3.09Å; L356-V359 WeakPolarHBondContact O-CB 3.32Å; L356-V359 PolarHBondContact O-N 3.36Å; G357-V359 VanDerWaalsContact C-N 3.32Å; G357-V359 PolarHBondContact O-N 2.85Å; V359-V361 PolarHBondContact O-N 3.32Å; V359-F362 PolarHBondContact O-N 3.37Å; V359-V363 HydrophobicContact CG1-CG2 4.47Å; V359-V363 WeakPolarHBondContact O-CG2 3.27Å; V359-V363 PolarHBondContact O-N 2.69Å; V359-C406 HydrophobicContact CG2-CB 4.2Å
360	V	83.4	Confident	80.5	Confident	91 Å²	91	71.5 Å²	71.5	55%	0.552	43%	0.43	S	S	*	.	H	α-helix	trans	-60.3	-47.4	178.1	173.4	0	0	0	0	110.9	L356 G357 F362 V363 V364	L356-V360 WeakPolarHBondContact O-CG2 3.4Å; L356-V360 PolarHBondContact O-N 3.37Å; G357-V360 PolarHBondContact O-N 2.93Å; V360-F362 VanDerWaalsContact C-N 3.31Å; V360-F362 PolarHBondContact O-N 3.28Å; V360-V363 PolarHBondContact O-N 3.4Å; V360-V364 HydrophobicContact CG1-CG2 4.32Å; V360-V364 WeakPolarHBondContact O-CB 3.31Å; V360-V364 VanDerWaalsContact O-CG2 3.29Å; V360-V364 WeakPolarHBondContact O-CG2 3.35Å; V360-V364 PolarHBondContact O-N 3.12Å
361	V	81.8	Confident	78.7	Confident	63 Å²	63	72.8 Å²	72.8	38%	0.382	44%	0.437	S	S	.	.	H	α-helix	trans	-60.2	-42.3	177.3	171.5	0	0	0	0	111.1	G357 V359 V364 L365 F402	G357-V361 WeakPolarHBondContact O-CG2 3.38Å; G357-V361 PolarHBondContact O-N 3.44Å; V359-V361 PolarHBondContact O-N 3.32Å; V361-V364 PolarHBondContact O-N 2.7Å; V361-L365 HydrophobicContact CG1-CD1 3.93Å; V361-L365 HydrophobicContact CG1-CG 4.31Å; V361-L365 WeakPolarHBondContact O-CB 3.32Å; V361-L365 VanDerWaalsContact O-CG 3.27Å; V361-L365 WeakPolarHBondContact O-CG 3.25Å; V361-L365 PolarHBondContact O-N 3.44Å; V361-F402 HydrophobicContact CG1-CD1 4.15Å; V361-F402 HydrophobicContact CG1-CE1 3.94Å; V361-F402 HydrophobicContact CG1-CZ 4.22Å
362	F	80.9	Confident	76.8	Confident	57 Å²	57	83.3 Å²	83.3	25%	0.25	48%	0.475	C	S	.	.	H	α-helix	trans	-61.3	-45.7	176.3	176.5	-99	0	0	0	112.2	A358 V359 V360 L365 H366 F402 Q403	A358-F362 WeakPolarHBondContact O-CB 3.45Å; A358-F362 PolarHBondContact O-N 2.97Å; V359-F362 PolarHBondContact O-N 3.37Å; V360-F362 VanDerWaalsContact C-N 3.31Å; V360-F362 PolarHBondContact O-N 3.28Å; F362-L365 PolarHBondContact O-N 2.97Å; F362-H366 WeakPolarHBondContact O-CB 3.36Å; F362-H366 PolarHBondContact O-N 3.5Å; F362-F402 HydrophobicContact CD2-CB 4.45Å; F362-Q403 HydrophobicContact CD2-CB 4.42Å; F362-Q403 HydrophobicContact CE2-CB 3.99Å; F362-Q403 HydrophobicContact CE2-CG 4.32Å
363	V	81.8	Confident	74.6	Confident	84 Å²	84	90.2 Å²	90.2	51%	0.509	50%	0.499	S	S	.	.	H	α-helix	trans	-63.1	-42.6	177.1	172.5	0	0	0	0	111	V359 V360 H366 A367	V359-V363 HydrophobicContact CG1-CG2 4.47Å; V359-V363 WeakPolarHBondContact O-CG2 3.27Å; V359-V363 PolarHBondContact O-N 2.69Å; V360-V363 PolarHBondContact O-N 3.4Å; V363-H366 WeakPolarHBondContact O-CB 3.42Å; V363-H366 PolarHBondContact O-N 2.99Å; V363-A367 WeakPolarHBondContact O-CB 3.42Å; V363-A367 PolarHBondContact O-N 3.3Å
364	V	81.5	Confident	72	Confident	69 Å²	69	97.5 Å²	97.5	42%	0.418	51%	0.514	S	S	.	.	H	α-helix	trans	-63.3	-45.5	176.6	170.5	0	0	0	0	111.1	V360 V361 H366 A367 L368	V360-V364 HydrophobicContact CG1-CG2 4.32Å; V360-V364 WeakPolarHBondContact O-CB 3.31Å; V360-V364 VanDerWaalsContact O-CG2 3.29Å; V360-V364 WeakPolarHBondContact O-CG2 3.35Å; V360-V364 PolarHBondContact O-N 3.12Å; V361-V364 PolarHBondContact O-N 2.7Å; V364-H366 PolarHBondContact O-N 3.5Å; V364-A367 PolarHBondContact O-N 2.61Å; V364-L368 HydrophobicContact CG1-CD1 3.51Å; V364-L368 HydrophobicContact CG1-CG 4.03Å; V364-L368 VanDerWaalsContact O-CB 3.3Å; V364-L368 WeakPolarHBondContact O-CB 3.31Å; V364-L368 VanDerWaalsContact O-CG 3.23Å; V364-L368 WeakPolarHBondContact O-CG 3.3Å; V364-L368 PolarHBondContact O-N 3.44Å
365	L	77.1	Confident	69.4	Low	51 Å²	51	102.2 Å²	102.2	27%	0.267	53%	0.529	S	S	.	.	H	α-helix	trans	-63.3	-29.7	175.8	-72.4	173	0	0	0	113	V361 F362 F402	V361-L365 HydrophobicContact CG1-CD1 3.93Å; V361-L365 HydrophobicContact CG1-CG 4.31Å; V361-L365 WeakPolarHBondContact O-CB 3.32Å; V361-L365 VanDerWaalsContact O-CG 3.27Å; V361-L365 WeakPolarHBondContact O-CG 3.25Å; V361-L365 PolarHBondContact O-N 3.44Å; F362-L365 PolarHBondContact O-N 2.97Å; L365-F402 HydrophobicContact CD1-CD2 3.89Å; L365-F402 HydrophobicContact CD1-CE2 4.13Å
366	H	76.8	Confident	66.6	Low	135 Å²	135	109.3 Å²	109.3	63%	0.625	56%	0.562	S	S	*	*	H	α-helix	trans	-74.7	-44.5	174	-170	-84.4	0	0	0	111.4	F362 V363 V364 G369	F362-H366 WeakPolarHBondContact O-CB 3.36Å; F362-H366 PolarHBondContact O-N 3.5Å; V363-H366 WeakPolarHBondContact O-CB 3.42Å; V363-H366 PolarHBondContact O-N 2.99Å; V364-H366 PolarHBondContact O-N 3.5Å; H366-G369 PolarHBondContact O-N 2.91Å
367	A	78.3	Confident	64	Low	82 Å²	82	107.4 Å²	107.4	68%	0.678	56%	0.563	S	S	*	*	H	α-helix	trans	-68.9	-37.2	179.8	0	0	0	0	0	113	V363 V364 G369	V363-A367 WeakPolarHBondContact O-CB 3.42Å; V363-A367 PolarHBondContact O-N 3.3Å; V364-A367 PolarHBondContact O-N 2.61Å; A367-G369 PolarHBondContact O-N 2.98Å
368	L	78.6	Confident	61.5	Low	124 Å²	124	109.4 Å²	109.4	65%	0.649	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	5.1	178.1	-70.8	174.7	0	0	0	114	V364 C370	V364-L368 HydrophobicContact CG1-CD1 3.51Å; V364-L368 HydrophobicContact CG1-CG 4.03Å; V364-L368 VanDerWaalsContact O-CB 3.3Å; V364-L368 WeakPolarHBondContact O-CB 3.31Å; V364-L368 VanDerWaalsContact O-CG 3.23Å; V364-L368 WeakPolarHBondContact O-CG 3.3Å; V364-L368 PolarHBondContact O-N 3.44Å; L368-C370 VanDerWaalsContact C-N 3.3Å; L368-C370 PolarHBondContact O-N 3.33Å; L368-C370 VanDerWaalsContact O-N 3.16Å
369	G	60.4	Low	59	Low	50 Å²	50	114.9 Å²	114.9	52%	0.515	60%	0.603	S	S	.	*	T	Hydrogen-bonded Turn	trans	63.7	30	165.3	0	0	0	0	0	114.7	H366 A367 N371	H366-G369 PolarHBondContact O-N 2.91Å; A367-G369 PolarHBondContact O-N 2.98Å; G369-N371 PolarHBondContact O-N 3.08Å
370	C	52.9	Low	56.5	Low	83 Å²	83	116.7 Å²	116.7	56%	0.561	61%	0.611	S	S	*	*			trans	-66.8	54.6	163.8	-78	0	0	0	0	110.3	L368 K399	L368-C370 VanDerWaalsContact C-N 3.3Å; L368-C370 PolarHBondContact O-N 3.33Å; L368-C370 VanDerWaalsContact O-N 3.16Å; C370-K399 WeakPolarHBondContact O-CE 3.37Å; C370-K399 PolarHBondContact O-NZ 2.92Å
371	N	49.8	Very low	54.3	Low	133 Å²	133	117.8 Å²	117.8	71%	0.711	62%	0.618	S	S	*	*			trans	-105.3	19.3	-162.1	-144.5	18.6	0	0	0	112.7	G369	G369-N371 PolarHBondContact O-N 3.08Å
372	R	43.5	Very low	51.9	Low	235 Å²	235	120.3 Å²	120.3	89%	0.887	63%	0.625	S	S	*	*			trans	-104.8	77.1	172.5	-84.8	179.9	148.5	-178.6	-5.7	109.8
373	H	41.3	Very low	49.2	Very low	192 Å²	192	122 Å²	122	89%	0.889	64%	0.644	S	S	*	*	S	Bend	trans	-162	117.5	138.5	-101.8	-66.9	0	0	0	108.3	W375	H373-W375 PolarHBondContact O-N 3.07Å
374	R	35.2	Very low	46.9	Very low	236 Å²	236	122.6 Å²	122.6	89%	0.891	64%	0.644	S	S	*	*			trans	-50	127.4	175	-93.7	176.2	168.8	175.1	-4.2	109.5	H376	R374-H376 PolarHBondContact O-N 2.81Å; R374-H376 VanDerWaalsContact O-N 3.16Å
375	W	31.9	Very low	44.2	Very low	217 Å²	217	125.2 Å²	125.2	82%	0.822	65%	0.652	S	S	*	*			trans	-53.9	111.2	167.8	-160.5	48.6	0	0	0	109	H373	H373-W375 PolarHBondContact O-N 3.07Å
376	H	28.9	Very low	41.9	Very low	177 Å²	177	131.1 Å²	131.1	82%	0.819	68%	0.678	S	S	*	*			trans	-87.9	124.8	153.6	-83.7	-75.7	0	0	0	106.6	R374 T378	R374-H376 PolarHBondContact O-N 2.81Å; R374-H376 VanDerWaalsContact O-N 3.16Å; H376-T378 PolarHBondContact O-N 3.03Å
377	A	29.8	Very low	39.4	Very low	75 Å²	75	134.1 Å²	134.1	62%	0.62	69%	0.689	S	S	*	*			trans	-47.8	130.9	178.3	0	0	0	0	0	110.6
378	T	32.2	Very low	36.7	Very low	75 Å²	75	139 Å²	139	46%	0.46	70%	0.695	S	S	.	*			trans	-45.7	132.2	162.3	42.5	0	0	0	0	109.2	H376 D380	H376-T378 PolarHBondContact O-N 3.03Å; T378-D380 PolarHBondContact O-N 3.41Å
379	P	29.7	Very low	34.2	Very low	124 Å²	124	139.3 Å²	139.3	81%	0.805	71%	0.705	S	S	*	*			trans	-62.6	115.4	170	25.8	-29.3	0	0	0	107.4
380	D	30.6	Very low	32.6	Very low	98 Å²	98	142.5 Å²	142.5	52%	0.524	71%	0.714	S	S	.	*			trans	-57.5	136.7	172.9	-69.3	-50.5	0	0	0	108.8	T378 E382	T378-D380 PolarHBondContact O-N 3.41Å; D380-E382 HydrophobicContact CB-CB 4.14Å; D380-E382 PolarHBondContact O-N 3.26Å
381	V	37.6	Very low	31.4	Very low	114 Å²	114	145.7 Å²	145.7	69%	0.691	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	22.8	172.7	-179.2	0	0	0	0	110.7
382	E	30.5	Very low	30.6	Very low	116 Å²	116	143.8 Å²	143.8	54%	0.542	73%	0.734	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.4	1	-175.4	-101	-168.6	144.5	0	0	114.7	N49 D380 L384	N49-E382 PolarHBondContact ND2-OE1 3.02Å; D380-E382 HydrophobicContact CB-CB 4.14Å; D380-E382 PolarHBondContact O-N 3.26Å; E382-L384 PolarHBondContact O-N 3.36Å
383	S	25.1	Very low	30.1	Very low	91 Å²	91	136.1 Å²	136.1	64%	0.636	72%	0.721	S	S	*	*			trans	-92.2	109.6	172.4	74.6	0	0	0	0	111.3	E385	S383-E385 PolarHBondContact O-N 3.42Å
384	L	33.5	Very low	30	Very low	97 Å²	97	130.8 Å²	130.8	51%	0.508	71%	0.71	S	S	.	*	S	Bend	trans	-65.9	26.1	168.5	-145	123.6	0	0	0	113.2	E382 E452	E382-L384 PolarHBondContact O-N 3.36Å; L384-E452 VanDerWaalsContact CD1-OE2 3.32Å; L384-E452 WeakPolarHBondContact CD1-OE2 3.49Å; L384-E452 WeakPolarHBondContact CD2-OE2 3.32Å
385	E	25	Very low	30.5	Very low	125 Å²	125	125.6 Å²	125.6	58%	0.584	71%	0.707	S	S	*	*			trans	-134	107.9	176.4	-58.5	-147	104.2	0	0	110.7	S383 K387 K455	S383-E385 PolarHBondContact O-N 3.42Å; E385-K387 PolarHBondContact O-N 2.92Å; E385-K455 VanDerWaalsContact CB-NZ 3.33Å; E385-K455 IonicContact OE1-NZ 3.34Å; E385-K455 PolarHBondContact OE1-NZ 3.34Å
386	E	29.1	Very low	31.6	Very low	174 Å²	174	118.6 Å²	118.6	81%	0.813	69%	0.685	S	S	*	*			trans	-60.1	101.4	160.5	-82	-171.6	151.9	0	0	108.8
387	K	23.2	Very low	33.3	Very low	199 Å²	199	112.1 Å²	112.1	87%	0.865	67%	0.667	S	S	*	*			trans	-85.5	130.4	154.9	-106.7	-177.8	-179.9	175.3	0	109.3	E385	E385-K387 PolarHBondContact O-N 2.92Å
388	K	22.1	Very low	35	Very low	183 Å²	183	113.3 Å²	113.3	80%	0.796	67%	0.668	S	S	*	*			trans	-41.7	139.3	177.9	-145	173.8	-174	179.1	0	112.5	T390	K388-T390 PolarHBondContact O-N 3.42Å
389	P	26.1	Very low	36.8	Very low	132 Å²	132	113.4 Å²	113.4	86%	0.857	66%	0.662	S	S	*	*			trans	-75.7	98.7	178	30.7	-30.9	0	0	0	109
390	T	26.2	Very low	38.9	Very low	117 Å²	117	108.8 Å²	108.8	72%	0.718	63%	0.634	S	S	*	*			trans	-122.4	129.7	166.7	2.1	0	0	0	0	108.2	K388	K388-T390 PolarHBondContact O-N 3.42Å
391	T	27.8	Very low	41.2	Very low	149 Å²	149	105.2 Å²	105.2	91%	0.914	62%	0.616	S	S	*	*	S	Bend	trans	81.3	137.6	176.5	10.8	0	0	0	0	118.1
392	A	32.8	Very low	43.3	Very low	93 Å²	93	103.1 Å²	103.1	77%	0.769	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-56.2	129.9	-161.6	0	0	0	0	0	114.5	A394	A392-A394 PolarHBondContact O-N 3.31Å
393	A	34.2	Very low	45.8	Very low	74 Å²	74	101.3 Å²	101.3	61%	0.612	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-59.2	118.8	165.1	0	0	0	0	0	109
394	A	38.1	Very low	48.7	Very low	80 Å²	80	97.2 Å²	97.2	66%	0.661	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-57.4	146.4	172.7	0	0	0	0	0	110	A392 L396	A392-A394 PolarHBondContact O-N 3.31Å; A394-L396 PolarHBondContact O-N 3.21Å
395	P	46.9	Very low	51.3	Low	128 Å²	128	94.5 Å²	94.5	83%	0.831	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-60.1	126	178.4	-14.4	26.4	0	0	0	109.8	G397	P395-G397 PolarHBondContact O-N 3.4Å
396	L	55.3	Low	54.3	Low	69 Å²	69	89.3 Å²	89.3	36%	0.361	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-58.7	127.7	170.2	-82.1	102.7	0	0	0	108.8	A394 A400	A394-L396 PolarHBondContact O-N 3.21Å; L396-A400 HydrophobicContact CB-CB 4.25Å; L396-A400 HydrophobicContact CD2-CB 3.53Å; L396-A400 HydrophobicContact CG-CB 4.49Å
397	G	64.6	Low	57.2	Low	42 Å²	42	85.8 Å²	85.8	43%	0.433	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-60.1	156	175.2	0	0	0	0	0	111.7	P395 K399 A400 P401	P395-G397 PolarHBondContact O-N 3.4Å; G397-K399 PolarHBondContact O-N 3.38Å; G397-A400 PolarHBondContact O-N 3.46Å; G397-A400 VanDerWaalsContact O-N 3.12Å; G397-P401 WeakPolarHBondContact O-CD 3.39Å
398	P	65.1	Low	60.4	Low	100 Å²	100	76.4 Å²	76.4	65%	0.649	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-19.9	-173.4	21.1	-32.2	0	0	0	114.1	P401 F402	P398-P401 VanDerWaalsContact O-CD 3.32Å; P398-P401 WeakPolarHBondContact O-CD 3.44Å; P398-P401 WeakPolarHBondContact O-CG 3.3Å; P398-F402 WeakPolarHBondContact O-CD2 3.32Å
399	K	69.4	Low	63.7	Low	77 Å²	77	68.2 Å²	68.2	34%	0.335	43%	0.43	S	S	.	.	H	α-helix	trans	-70	-32.8	178.7	-61.1	-174.2	-178	-176.2	0	114.1	C370 G397 F402 Q403	C370-K399 WeakPolarHBondContact O-CE 3.37Å; C370-K399 PolarHBondContact O-NZ 2.92Å; G397-K399 PolarHBondContact O-N 3.38Å; K399-F402 PolarHBondContact O-N 3.25Å; K399-Q403 WeakPolarHBondContact O-CB 3.35Å; K399-Q403 PolarHBondContact O-N 3.05Å
400	A	74.7	Confident	66.9	Low	27 Å²	27	65.6 Å²	65.6	22%	0.223	41%	0.412	C	S	.	.	H	α-helix	trans	-61.9	-48.4	-175.5	0	0	0	0	0	113.6	L396 G397 F402 Q403 A404	L396-A400 HydrophobicContact CB-CB 4.25Å; L396-A400 HydrophobicContact CD2-CB 3.53Å; L396-A400 HydrophobicContact CG-CB 4.49Å; G397-A400 PolarHBondContact O-N 3.46Å; G397-A400 VanDerWaalsContact O-N 3.12Å; A400-F402 PolarHBondContact O-N 3.02Å; A400-Q403 PolarHBondContact O-N 3.37Å; A400-A404 WeakPolarHBondContact O-CB 3.32Å; A400-A404 PolarHBondContact O-N 3.17Å
401	P	78.8	Confident	70.1	Confident	22 Å²	22	60.7 Å²	60.7	14%	0.143	38%	0.381	C	S	.	.	H	α-helix	trans	-64.7	-38.1	177.6	23.7	-34.2	0	0	0	112.9	G397 P398 A404 L405 L793 V796	G397-P401 WeakPolarHBondContact O-CD 3.39Å; P398-P401 VanDerWaalsContact O-CD 3.32Å; P398-P401 WeakPolarHBondContact O-CD 3.44Å; P398-P401 WeakPolarHBondContact O-CG 3.3Å; P401-A404 PolarHBondContact O-N 3.19Å; P401-L405 WeakPolarHBondContact O-CG 3.36Å; P401-L405 PolarHBondContact O-N 3.34Å; P401-L793 HydrophobicContact CB-CD2 4.23Å; P401-V796 HydrophobicContact CB-CG1 4.28Å; P401-V796 HydrophobicContact CB-CG2 4.36Å; P401-V796 HydrophobicContact CG-CG1 4.44Å
402	F	80.1	Confident	73.2	Confident	70 Å²	70	53.8 Å²	53.8	31%	0.307	34%	0.338	S	S	.	.	H	α-helix	trans	-65.2	-40.8	176	-70.4	-68.9	0	0	0	112	V361 F362 L365 P398 K399 A400 A404 L405 C406	V361-F402 HydrophobicContact CG1-CD1 4.15Å; V361-F402 HydrophobicContact CG1-CE1 3.94Å; V361-F402 HydrophobicContact CG1-CZ 4.22Å; F362-F402 HydrophobicContact CD2-CB 4.45Å; L365-F402 HydrophobicContact CD1-CD2 3.89Å; L365-F402 HydrophobicContact CD1-CE2 4.13Å; P398-F402 WeakPolarHBondContact O-CD2 3.32Å; K399-F402 PolarHBondContact O-N 3.25Å; A400-F402 PolarHBondContact O-N 3.02Å; F402-A404 VanDerWaalsContact C-N 3.33Å; F402-A404 PolarHBondContact O-N 3.49Å; F402-L405 PolarHBondContact O-N 3.42Å; F402-C406 PolarHBondContact O-N 2.87Å; F402-C406 PolarHBondContact O-SG 3.17Å
403	Q	84.3	Confident	76	Confident	79 Å²	79	54.3 Å²	54.3	37%	0.369	33%	0.328	S	S	.	.	H	α-helix	trans	-62	-42.7	174.5	-172.3	175.2	23.7	0	0	111.5	F362 K399 A400 C406 R407	F362-Q403 HydrophobicContact CD2-CB 4.42Å; F362-Q403 HydrophobicContact CE2-CB 3.99Å; F362-Q403 HydrophobicContact CE2-CG 4.32Å; K399-Q403 WeakPolarHBondContact O-CB 3.35Å; K399-Q403 PolarHBondContact O-N 3.05Å; A400-Q403 PolarHBondContact O-N 3.37Å; Q403-C406 PolarHBondContact O-N 3.22Å; Q403-R407 VanDerWaalsContact CD-NH2 3.3Å; Q403-R407 WeakPolarHBondContact O-CG 3.38Å; Q403-R407 PolarHBondContact O-N 3.45Å
404	A	86.1	Confident	78.8	Confident	5 Å²	5	51.5 Å²	51.5	4%	0.041	30%	0.301	C	S	.	.	H	α-helix	trans	-62.1	-41.6	176.3	0	0	0	0	0	111.9	A400 P401 F402 R407 M408 I789 L793	A400-A404 WeakPolarHBondContact O-CB 3.32Å; A400-A404 PolarHBondContact O-N 3.17Å; P401-A404 PolarHBondContact O-N 3.19Å; F402-A404 VanDerWaalsContact C-N 3.33Å; F402-A404 PolarHBondContact O-N 3.49Å; A404-R407 PolarHBondContact O-N 3.06Å; A404-M408 WeakPolarHBondContact O-CB 3.33Å; A404-M408 PolarHBondContact O-N 2.83Å; A404-I789 HydrophobicContact CB-CG1 4.45Å; A404-I789 HydrophobicContact CB-CG2 4.18Å; A404-L793 HydrophobicContact CB-CD2 4.25Å; A404-L793 HydrophobicContact CB-CG 4.25Å
405	L	87.4	Confident	81.4	Confident	39 Å²	39	47.7 Å²	47.7	20%	0.204	27%	0.27	C	S	.	.	H	α-helix	trans	-65.1	-39.5	174.4	-71.8	173.3	0	0	0	112.7	F354 A358 P401 F402 M408 G409 L793	F354-L405 HydrophobicContact CE1-CD2 4.34Å; F354-L405 HydrophobicContact CZ-CD1 4.38Å; F354-L405 HydrophobicContact CZ-CD2 4.45Å; A358-L405 HydrophobicContact CB-CB 4.31Å; P401-L405 WeakPolarHBondContact O-CG 3.36Å; P401-L405 PolarHBondContact O-N 3.34Å; F402-L405 PolarHBondContact O-N 3.42Å; L405-M408 WeakPolarHBondContact O-CB 3.3Å; L405-M408 PolarHBondContact O-N 2.96Å; L405-G409 PolarHBondContact O-N 3.44Å; L405-L793 HydrophobicContact CD2-CD1 4.3Å; L405-L793 HydrophobicContact CG-CD2 4.45Å
406	C	87.7	Confident	83.4	Confident	16 Å²	16	43.9 Å²	43.9	11%	0.108	24%	0.239	C	C	.	.	H	α-helix	trans	-63.3	-47.5	176.1	-66.8	0	0	0	0	111.3	A358 V359 F402 Q403 M408 G409 V410	A358-C406 PolarHBondContact O-SG 2.98Å; V359-C406 HydrophobicContact CG2-CB 4.2Å; F402-C406 PolarHBondContact O-N 2.87Å; F402-C406 PolarHBondContact O-SG 3.17Å; Q403-C406 PolarHBondContact O-N 3.22Å; C406-M408 VanDerWaalsContact C-N 3.3Å; C406-M408 PolarHBondContact O-N 3.26Å; C406-G409 PolarHBondContact O-N 3.26Å; C406-G409 VanDerWaalsContact O-N 3.13Å; C406-V410 PolarHBondContact O-N 3.18Å; C406-V410 VanDerWaalsContact O-N 3.08Å
407	R	90	Very high	85	Confident	101 Å²	101	42.3 Å²	42.3	38%	0.381	23%	0.231	S	C	.	.	H	α-helix	trans	-62.3	-39.7	176.5	-66.8	-175.7	-166.2	167.1	5.6	111.4	Q403 A404 G409 V410 I411 E785 I789	Q403-R407 VanDerWaalsContact CD-NH2 3.3Å; Q403-R407 WeakPolarHBondContact O-CG 3.38Å; Q403-R407 PolarHBondContact O-N 3.45Å; A404-R407 PolarHBondContact O-N 3.06Å; R407-G409 VanDerWaalsContact C-N 3.33Å; R407-G409 PolarHBondContact O-N 3.19Å; R407-V410 PolarHBondContact O-N 2.86Å; R407-I411 WeakPolarHBondContact O-CG1 3.36Å; R407-I411 PolarHBondContact O-N 3.13Å; R407-I411 VanDerWaalsContact O-N 3.12Å; R407-E785 WeakPolarHBondContact CD-OE1 3.34Å; R407-E785 IonicContact CZ-OE1 3.71Å; R407-E785 IonicContact NE-OE1 3.63Å; R407-E785 IonicContact NH1-OE1 2.78Å; R407-E785 PolarHBondContact NH1-OE1 2.95Å; R407-I789 HydrophobicContact CB-CD1 3.77Å
408	M	91.8	Very high	86.1	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-59.6	-44.6	172.5	-174.1	60.6	94.7	0	0	111.4	F355 A404 L405 C406 V410 I411 M412 F533 L534 I789	F355-M408 HydrophobicContact CE1-CB 4.27Å; F355-M408 HydrophobicContact CE1-CG 4.07Å; F355-M408 HydrophobicContact CZ-CG 4.27Å; A404-M408 WeakPolarHBondContact O-CB 3.33Å; A404-M408 PolarHBondContact O-N 2.83Å; L405-M408 WeakPolarHBondContact O-CB 3.3Å; L405-M408 PolarHBondContact O-N 2.96Å; C406-M408 VanDerWaalsContact C-N 3.3Å; C406-M408 PolarHBondContact O-N 3.26Å; M408-V410 VanDerWaalsContact C-N 3.33Å; M408-V410 PolarHBondContact O-N 2.98Å; M408-I411 PolarHBondContact O-N 3.39Å; M408-I411 VanDerWaalsContact O-N 3.16Å; M408-M412 HydrophobicContact CG-CG 4.15Å; M408-M412 WeakPolarHBondContact O-CB 3.33Å; M408-M412 VanDerWaalsContact O-CG 3.29Å; M408-M412 WeakPolarHBondContact O-CG 3.37Å; M408-M412 PolarHBondContact O-N 3.18Å; M408-M412 HydrophobicContact SD-CE 3.8Å; M408-M412 HydrophobicContact SD-CG 4.24Å; M408-F533 HydrophobicContact CE-CD1 4.3Å; M408-F533 HydrophobicContact CE-CE1 3.32Å; M408-F533 HydrophobicContact CE-CZ 3.78Å; M408-L534 HydrophobicContact CE-CD1 4.45Å; M408-I789 HydrophobicContact CB-CD1 4.42Å; M408-I789 HydrophobicContact CB-CG2 4.32Å; M408-I789 HydrophobicContact CE-CG2 3.83Å
409	G	91.4	Very high	87	Confident	11 Å²	11	35.9 Å²	35.9	11%	0.113	18%	0.181	C	C	.	.	H	α-helix	trans	-58.2	-41.4	177.3	0	0	0	0	0	113.3	L405 C406 R407 M412 L413	L405-G409 PolarHBondContact O-N 3.44Å; C406-G409 PolarHBondContact O-N 3.26Å; C406-G409 VanDerWaalsContact O-N 3.13Å; R407-G409 VanDerWaalsContact C-N 3.33Å; R407-G409 PolarHBondContact O-N 3.19Å; G409-M412 PolarHBondContact O-N 3.42Å; G409-L413 WeakPolarHBondContact O-CB 3.41Å; G409-L413 PolarHBondContact O-N 3.47Å
410	V	91.9	Very high	87.7	Confident	76 Å²	76	34.6 Å²	34.6	46%	0.461	18%	0.175	S	C	.	.	H	α-helix	trans	-63.8	-43	175	175.8	0	0	0	0	111.5	L62 C406 R407 M408 L413 Y414	L62-V410 HydrophobicContact CD1-CG1 4.19Å; C406-V410 PolarHBondContact O-N 3.18Å; C406-V410 VanDerWaalsContact O-N 3.08Å; R407-V410 PolarHBondContact O-N 2.86Å; M408-V410 VanDerWaalsContact C-N 3.33Å; M408-V410 PolarHBondContact O-N 2.98Å; V410-L413 PolarHBondContact O-N 3.39Å; V410-Y414 PolarHBondContact O-N 3.27Å
411	I	93.8	Very high	87.9	Confident	15 Å²	15	34.1 Å²	34.1	8%	0.077	17%	0.171	C	C	.	.	H	α-helix	trans	-66.5	-42.1	178.2	-64.6	166.7	0	0	0	110.9	R407 M408 Y414 F415 V782 E785 V786 I789	R407-I411 WeakPolarHBondContact O-CG1 3.36Å; R407-I411 PolarHBondContact O-N 3.13Å; R407-I411 VanDerWaalsContact O-N 3.12Å; M408-I411 PolarHBondContact O-N 3.39Å; M408-I411 VanDerWaalsContact O-N 3.16Å; I411-Y414 WeakPolarHBondContact O-CB 3.41Å; I411-Y414 PolarHBondContact O-N 3.28Å; I411-F415 HydrophobicContact CG2-CD1 4.38Å; I411-F415 HydrophobicContact CG2-CD2 4.34Å; I411-F415 HydrophobicContact CG2-CE1 3.83Å; I411-F415 HydrophobicContact CG2-CE2 3.86Å; I411-F415 HydrophobicContact CG2-CZ 3.57Å; I411-F415 WeakPolarHBondContact O-CG 3.4Å; I411-F415 PolarHBondContact O-N 3.5Å; I411-V782 HydrophobicContact CD1-CG1 4.43Å; I411-V782 HydrophobicContact CG1-CG1 4.35Å; I411-V782 HydrophobicContact CG2-CG1 3.57Å; I411-E785 HydrophobicContact CD1-CB 4.22Å; I411-E785 HydrophobicContact CD1-CG 4.03Å; I411-V786 HydrophobicContact CD1-CG2 3.88Å; I411-V786 HydrophobicContact CG2-CG2 4.06Å; I411-I789 HydrophobicContact CD1-CD1 4.01Å
412	M	93.8	Very high	87.7	Confident	4 Å²	4	34.3 Å²	34.3	2%	0.02	17%	0.17	C	C	.	.	H	α-helix	trans	-64.5	-40.3	176.7	-69.8	-56.6	98.3	0	0	111.9	F355 M408 G409 F415 Y416 L534 V537 L538 V541	F355-M412 HydrophobicContact CE2-CB 4.26Å; F355-M412 HydrophobicContact CE2-CG 4.14Å; F355-M412 HydrophobicContact CZ-CG 4Å; M408-M412 HydrophobicContact CG-CG 4.15Å; M408-M412 WeakPolarHBondContact O-CB 3.33Å; M408-M412 VanDerWaalsContact O-CG 3.29Å; M408-M412 WeakPolarHBondContact O-CG 3.37Å; M408-M412 PolarHBondContact O-N 3.18Å; M408-M412 HydrophobicContact SD-CE 3.8Å; M408-M412 HydrophobicContact SD-CG 4.24Å; G409-M412 PolarHBondContact O-N 3.42Å; M412-F415 HydrophobicContact CE-CD2 3.5Å; M412-F415 HydrophobicContact CE-CE2 3.61Å; M412-F415 PolarHBondContact O-N 2.9Å; M412-F415 HydrophobicContact SD-CD2 4.46Å; M412-Y416 WeakPolarHBondContact O-CB 3.23Å; M412-Y416 PolarHBondContact O-N 2.86Å; M412-L534 HydrophobicContact CE-CD1 4.22Å; M412-V537 HydrophobicContact CG-CG1 3.91Å; M412-V537 HydrophobicContact SD-CG1 3.62Å; M412-L538 HydrophobicContact CE-CD2 4.18Å; M412-L538 HydrophobicContact SD-CD2 4.03Å; M412-L538 HydrophobicContact SD-CG 4.49Å; M412-V541 HydrophobicContact CB-CG1 4.29Å; M412-V541 HydrophobicContact CB-CG2 4.2Å; M412-V541 HydrophobicContact CG-CG2 4.17Å; M412-V541 HydrophobicContact SD-CG2 4.24Å
413	L	91.1	Very high	87.9	Confident	104 Å²	104	32.7 Å²	32.7	55%	0.545	17%	0.166	S	C	.	.	H	α-helix	trans	-60.7	-46.6	172.3	177.2	62	0	0	0	110.8	G409 V410 F415 Y416 L417	G409-L413 WeakPolarHBondContact O-CB 3.41Å; G409-L413 PolarHBondContact O-N 3.47Å; V410-L413 PolarHBondContact O-N 3.39Å; L413-F415 PolarHBondContact O-N 3.43Å; L413-Y416 PolarHBondContact O-N 3.45Å; L413-L417 HydrophobicContact CD1-CD1 4.34Å; L413-L417 HydrophobicContact CD1-CG 4.23Å; L413-L417 HydrophobicContact CG-CD1 4.17Å; L413-L417 HydrophobicContact CG-CG 4.47Å; L413-L417 VanDerWaalsContact O-CG 3.3Å; L413-L417 WeakPolarHBondContact O-CG 3.42Å; L413-L417 PolarHBondContact O-N 2.87Å
414	Y	92.3	Very high	88.1	Confident	14 Å²	14	29.1 Å²	29.1	6%	0.055	15%	0.149	C	C	.	.	H	α-helix	trans	-57.6	-47.7	176.5	172.9	-120.3	0	0	0	111.8	V65 V410 I411 Y416 L417 C418 I751 I778	V65-Y414 HydrophobicContact CB-CE2 4.43Å; V65-Y414 HydrophobicContact CG1-CD2 3.47Å; V65-Y414 VanDerWaalsContact CG1-CD2 3.47Å; V65-Y414 HydrophobicContact CG1-CE2 3.68Å; V65-Y414 HydrophobicContact CG1-CG 4.28Å; V65-Y414 HydrophobicContact CG2-CD2 4.25Å; V65-Y414 HydrophobicContact CG2-CE2 3.84Å; V410-Y414 PolarHBondContact O-N 3.27Å; I411-Y414 WeakPolarHBondContact O-CB 3.41Å; I411-Y414 PolarHBondContact O-N 3.28Å; Y414-Y416 VanDerWaalsContact C-N 3.32Å; Y414-Y416 PolarHBondContact O-N 3.06Å; Y414-L417 PolarHBondContact O-N 3.28Å; Y414-C418 WeakPolarHBondContact CE2-SG 3.39Å; Y414-C418 VanDerWaalsContact CZ-SG 3.52Å; Y414-C418 PolarHBondContact O-N 3.48Å; Y414-C418 PolarHBondContact O-SG 3.01Å; Y414-I751 HydrophobicContact CE1-CD1 4.04Å; Y414-I751 HydrophobicContact CE1-CG1 3.95Å; Y414-I778 HydrophobicContact CE1-CG2 4.03Å
415	F	92.5	Very high	88.2	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.6	-41.9	177.3	-65.6	-9	0	0	0	112.2	I411 M412 L413 L417 C418 D419 L538 M542 C747 H750 I751 V782	I411-F415 HydrophobicContact CG2-CD1 4.38Å; I411-F415 HydrophobicContact CG2-CD2 4.34Å; I411-F415 HydrophobicContact CG2-CE1 3.83Å; I411-F415 HydrophobicContact CG2-CE2 3.86Å; I411-F415 HydrophobicContact CG2-CZ 3.57Å; I411-F415 WeakPolarHBondContact O-CG 3.4Å; I411-F415 PolarHBondContact O-N 3.5Å; M412-F415 HydrophobicContact CE-CD2 3.5Å; M412-F415 HydrophobicContact CE-CE2 3.61Å; M412-F415 PolarHBondContact O-N 2.9Å; M412-F415 HydrophobicContact SD-CD2 4.46Å; L413-F415 PolarHBondContact O-N 3.43Å; F415-L417 VanDerWaalsContact C-N 3.3Å; F415-L417 PolarHBondContact O-N 2.9Å; F415-C418 PolarHBondContact O-N 3.04Å; F415-D419 PolarHBondContact O-N 3.17Å; F415-D419 VanDerWaalsContact O-N 3.1Å; F415-L538 HydrophobicContact CD2-CD2 3.66Å; F415-L538 HydrophobicContact CE2-CD2 4.18Å; F415-M542 HydrophobicContact CB-CE 3.21Å; F415-M542 HydrophobicContact CG-CE 4.38Å; F415-C747 HydrophobicContact CZ-CB 4.18Å; F415-H750 HydrophobicContact CB-CB 3.88Å; F415-H750 HydrophobicContact CD1-CB 4.15Å; F415-H750 HydrophobicContact CD2-CB 4.33Å; F415-H750 HydrophobicContact CG-CB 3.89Å; F415-I751 HydrophobicContact CD1-CG1 4.06Å; F415-I751 HydrophobicContact CE1-CD1 3.6Å; F415-I751 HydrophobicContact CE1-CG1 3.55Å; F415-I751 HydrophobicContact CZ-CD1 4.24Å; F415-I751 HydrophobicContact CZ-CG1 4.37Å; F415-V782 HydrophobicContact CE1-CG1 3.8Å; F415-V782 HydrophobicContact CZ-CG1 3.73Å
416	Y	89.8	Confident	88.4	Confident	48 Å²	48	28.2 Å²	28.2	19%	0.188	14%	0.143	C	C	.	.	H	α-helix	trans	-60.5	-41.9	176.7	-172.1	-87.5	0	0	0	111.1	M412 L413 Y414 C418 R420 A421 V541	M412-Y416 WeakPolarHBondContact O-CB 3.23Å; M412-Y416 PolarHBondContact O-N 2.86Å; L413-Y416 PolarHBondContact O-N 3.45Å; Y414-Y416 VanDerWaalsContact C-N 3.32Å; Y414-Y416 PolarHBondContact O-N 3.06Å; Y416-C418 VanDerWaalsContact C-N 3.34Å; Y416-C418 PolarHBondContact O-N 3.36Å; Y416-R420 HydrophobicContact CD1-CB 4.31Å; Y416-R420 HydrophobicContact CD2-CB 3.93Å; Y416-R420 HydrophobicContact CD2-CG 4.09Å; Y416-R420 HydrophobicContact CE1-CB 4.17Å; Y416-R420 HydrophobicContact CE2-CB 3.78Å; Y416-R420 HydrophobicContact CE2-CG 4.07Å; Y416-R420 HydrophobicContact CG-CB 4.2Å; Y416-R420 CarbonylContact O-C 3.6Å; Y416-R420 WeakPolarHBondContact O-CA 3.17Å; Y416-R420 WeakPolarHBondContact O-CB 3.49Å; Y416-R420 PolarHBondContact O-N 3.23Å; Y416-A421 PolarHBondContact O-N 3.13Å; Y416-V541 HydrophobicContact CD2-CG1 4.32Å
417	L	88.3	Confident	88.5	Confident	37 Å²	37	29.4 Å²	29.4	19%	0.194	15%	0.147	C	C	.	.	H	α-helix	trans	-66.6	-32.8	177	-67.5	174.9	0	0	0	113.3	L69 L413 Y414 F415 A421 V423 F424	L69-L417 HydrophobicContact CD1-CD1 4.21Å; L69-L417 HydrophobicContact CD2-CD1 4.18Å; L413-L417 HydrophobicContact CD1-CD1 4.34Å; L413-L417 HydrophobicContact CD1-CG 4.23Å; L413-L417 HydrophobicContact CG-CD1 4.17Å; L413-L417 HydrophobicContact CG-CG 4.47Å; L413-L417 VanDerWaalsContact O-CG 3.3Å; L413-L417 WeakPolarHBondContact O-CG 3.42Å; L413-L417 PolarHBondContact O-N 2.87Å; Y414-L417 PolarHBondContact O-N 3.28Å; F415-L417 VanDerWaalsContact C-N 3.3Å; F415-L417 PolarHBondContact O-N 2.9Å; L417-A421 HydrophobicContact CD2-CB 3.87Å; L417-V423 HydrophobicContact CD2-CG2 4.25Å; L417-F424 HydrophobicContact CB-CE2 4.49Å
418	C	87.6	Confident	88.5	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.007	14%	0.139	C	C	.	.	H	α-helix	trans	-72.3	-40.9	178	-69.9	0	0	0	0	113.7	Y414 F415 Y416 H750 L761	Y414-C418 WeakPolarHBondContact CE2-SG 3.39Å; Y414-C418 VanDerWaalsContact CZ-SG 3.52Å; Y414-C418 PolarHBondContact O-N 3.48Å; Y414-C418 PolarHBondContact O-SG 3.01Å; F415-C418 PolarHBondContact O-N 3.04Å; Y416-C418 VanDerWaalsContact C-N 3.34Å; Y416-C418 PolarHBondContact O-N 3.36Å; C418-H750 WeakPolarHBondContact CB-O 3.44Å; C418-L761 HydrophobicContact CB-CD1 4.44Å; C418-L761 HydrophobicContact CB-CD2 3.69Å; C418-L761 WeakPolarHBondContact O-CD1 3.47Å
419	D	84.4	Confident	88.3	Confident	5 Å²	5	29.3 Å²	29.3	3%	0.027	15%	0.15	C	C	.	.	H	α-helix	trans	-105.6	-44.9	-169.7	-159.8	17.9	0	0	0	112.7	F415 K426 H750 A755	F415-D419 PolarHBondContact O-N 3.17Å; F415-D419 VanDerWaalsContact O-N 3.1Å; D419-K426 PolarHBondContact O-NZ 3.33Å; D419-H750 IonicContact OD2-CE1 2.63Å; D419-H750 IonicContact OD2-ND1 2.82Å; D419-H750 PolarHBondContact OD2-ND1 2.8Å; D419-H750 VanDerWaalsContact OD2-ND1 3.11Å; D419-A755 PolarHBondContact OD1-N 3.42Å; D419-A755 VanDerWaalsContact OD1-N 3.11Å
420	R	83.6	Confident	88	Confident	51 Å²	51	32.1 Å²	32.1	19%	0.192	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-32.1	-172.7	-62.6	-64.9	178.2	-121.4	-12.6	113.7	Y416 M542 D756	Y416-R420 HydrophobicContact CD1-CB 4.31Å; Y416-R420 HydrophobicContact CD2-CB 3.93Å; Y416-R420 HydrophobicContact CD2-CG 4.09Å; Y416-R420 HydrophobicContact CE1-CB 4.17Å; Y416-R420 HydrophobicContact CE2-CB 3.78Å; Y416-R420 HydrophobicContact CE2-CG 4.07Å; Y416-R420 HydrophobicContact CG-CB 4.2Å; Y416-R420 CarbonylContact O-C 3.6Å; Y416-R420 WeakPolarHBondContact O-CA 3.17Å; Y416-R420 WeakPolarHBondContact O-CB 3.49Å; Y416-R420 PolarHBondContact O-N 3.23Å; R420-M542 HydrophobicContact CG-SD 4.03Å; R420-M542 PolarHBondContact NE-O 3.38Å; R420-M542 PolarHBondContact NH2-O 2.78Å; R420-D756 IonicContact CZ-OD1 3.96Å; R420-D756 IonicContact NH1-OD1 3.18Å; R420-D756 PolarHBondContact NH1-OD1 3.45Å; R420-D756 IonicContact NH1-OD2 3Å; R420-D756 IonicContact NH2-OD1 3.54Å; R420-D756 PolarHBondContact NH2-OD1 3.24Å
421	A	78.5	Confident	87.8	Confident	17 Å²	17	30.4 Å²	30.4	14%	0.14	15%	0.145	C	C	.	.	S	Bend	trans	-84.3	139.8	168.2	0	0	0	0	0	109.4	Y416 L417 V423	Y416-A421 PolarHBondContact O-N 3.13Å; L417-A421 HydrophobicContact CD2-CB 3.87Å; A421-V423 HydrophobicContact CB-CG2 3.78Å; A421-V423 PolarHBondContact O-N 2.94Å
422	D	76.2	Confident	87.6	Confident	25 Å²	25	31.8 Å²	31.8	13%	0.134	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	34.4	176.1	-165.2	35.9	0	0	0	111.2	R76 I341	R76-D422 IonicContact CZ-OD2 3.84Å; R76-D422 VanDerWaalsContact CZ-OD2 3.29Å; R76-D422 VanDerWaalsContact NH1-CG 3.26Å; R76-D422 PolarHBondContact NH1-O 3.33Å; R76-D422 IonicContact NH1-OD2 3.42Å; R76-D422 PolarHBondContact NH1-OD2 3.37Å; R76-D422 IonicContact NH2-OD2 3.11Å; R76-D422 PolarHBondContact NH2-OD2 3.45Å; I341-D422 HydrophobicContact CD1-CB 3.62Å; I341-D422 HydrophobicContact CG1-CB 4.14Å
423	V	83.7	Confident	87.4	Confident	36 Å²	36	36.4 Å²	36.4	22%	0.218	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-43.8	-174.6	172.5	0	0	0	0	110.8	L69 H72 L417 A421	L69-V423 HydrophobicContact CD1-CG1 3.61Å; H72-V423 HydrophobicContact CB-CG1 4.31Å; L417-V423 HydrophobicContact CD2-CG2 4.25Å; A421-V423 HydrophobicContact CB-CG2 3.78Å; A421-V423 PolarHBondContact O-N 2.94Å
424	F	88.5	Confident	87.4	Confident	4 Å²	4	34.6 Å²	34.6	2%	0.018	17%	0.171	C	C	.	.	S	Bend	trans	-103.7	148.9	-177.1	-61.7	-71.7	0	0	0	111.2	L68 H72 L417 L761 L763	L68-F424 HydrophobicContact CB-CE1 4.14Å; H72-F424 AromaticContact CD2-CD1 3.66Å; H72-F424 AromaticContact CD2-CE1 3.75Å; H72-F424 AromaticContact CG-CD1 3.97Å; H72-F424 AromaticContact NE2-CD1 3.96Å; L417-F424 HydrophobicContact CB-CE2 4.49Å; F424-L761 HydrophobicContact CB-CD1 3.85Å; F424-L761 HydrophobicContact CB-CG 4.44Å; F424-L763 HydrophobicContact CB-CD2 4.47Å; F424-L763 HydrophobicContact CD1-CD2 3.68Å; F424-L763 HydrophobicContact CD2-CD2 4.37Å; F424-L763 HydrophobicContact CE1-CD2 3.92Å; F424-L763 HydrophobicContact CG-CD2 3.92Å; F424-L763 HydrophobicContact CZ-CD2 4.34Å
425	M	88.9	Confident	87.1	Confident	9 Å²	9	36.1 Å²	36.1	4%	0.044	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	154.5	-178.4	-70.4	-179.1	-173.6	0	0	112	L75 W86 Y102 G103 V762 P765	L75-M425 HydrophobicContact CD2-CE 3.87Å; W86-M425 HydrophobicContact CH2-CE 4.15Å; W86-M425 HydrophobicContact CZ3-CE 4.42Å; Y102-M425 HydrophobicContact CE1-CE 3.63Å; Y102-M425 HydrophobicContact CE1-SD 4.04Å; G103-M425 WeakPolarHBondContact O-CA 3.34Å; M425-V762 HydrophobicContact CB-CB 4.06Å; M425-V762 PolarHBondContact N-O 2.62Å; M425-V762 PolarHBondContact O-N 3.35Å; M425-P765 HydrophobicContact SD-CB 3.86Å; M425-P765 HydrophobicContact SD-CG 4.33Å
426	K	90.1	Very high	87.1	Confident	17 Å²	17	36.5 Å²	36.5	7%	0.074	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	135.9	-178.3	-59.4	174.9	-178.4	172.3	0	110.7	G103 C104 M105 D419 A754	G103-K426 CarbonylContact C-O 3.51Å; G103-K426 PolarHBondContact O-N 2.78Å; C104-K426 CarbonylContact C-O 3.48Å; C104-K426 VanDerWaalsContact CA-O 3.27Å; C104-K426 WeakPolarHBondContact CA-O 3.15Å; C104-K426 PolarHBondContact N-O 3.4Å; M105-K426 HydrophobicContact CE-CB 3.89Å; M105-K426 HydrophobicContact CE-CD 4.28Å; M105-K426 HydrophobicContact CG-CB 4.02Å; M105-K426 HydrophobicContact SD-CB 4.26Å; D419-K426 PolarHBondContact O-NZ 3.33Å; K426-A754 HydrophobicContact CB-CB 4.42Å; K426-A754 HydrophobicContact CD-CB 3.97Å; K426-A754 HydrophobicContact CG-CB 3.82Å
427	E	90.1	Very high	87.3	Confident	41 Å²	41	38.4 Å²	38.4	19%	0.192	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	150.7	176.7	-78.1	-172.5	161.8	0	0	111.7	R92 Q100 M105 G759 I760 V762	R92-E427 IonicContact CZ-OE1 3.54Å; R92-E427 IonicContact NE-OE1 3.42Å; R92-E427 IonicContact NH2-OE1 2.66Å; R92-E427 PolarHBondContact NH2-OE1 2.94Å; R92-E427 IonicContact NH2-OE2 2.73Å; R92-E427 PolarHBondContact NH2-OE2 3.3Å; Q100-E427 HydrophobicContact CG-CG 4.12Å; M105-E427 VanDerWaalsContact CG-C 3.48Å; E427-G759 CarbonylContact O-C 3.58Å; E427-G759 WeakPolarHBondContact O-CA 3.34Å; E427-I760 PolarHBondContact N-O 3.14Å; E427-I760 PolarHBondContact O-N 2.9Å; E427-V762 HydrophobicContact CB-CG2 3.95Å; E427-V762 HydrophobicContact CG-CG2 3.67Å
428	Q	89.4	Confident	87.5	Confident	44 Å²	44	40.7 Å²	40.7	21%	0.206	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	148.1	175.8	-70.2	172.6	81.3	0	0	111.2	W99 Q100 M105 F430	W99-Q428 PolarHBondContact O-NE2 3.29Å; Q100-Q428 VanDerWaalsContact OE1-CG 3.24Å; Q100-Q428 VanDerWaalsContact OE1-NE2 3.11Å; M105-Q428 HydrophobicContact CB-CG 4.02Å; M105-Q428 HydrophobicContact CG-CG 4.1Å; Q428-F430 PolarHBondContact O-N 2.91Å
429	K	87.6	Confident	87.7	Confident	56 Å²	56	42.9 Å²	42.9	24%	0.243	22%	0.223	C	C	.	.			trans	-71.9	126.3	171.2	-70.7	179.2	178.5	-169.5	0	110.2	H480 L753 T757 K758 G759 I760	K429-H480 WeakPolarHBondContact CE-O 3.24Å; K429-H480 PolarHBondContact NZ-O 3.49Å; K429-L753 VanDerWaalsContact NZ-CD2 3.29Å; K429-T757 WeakPolarHBondContact CE-O 3.35Å; K429-T757 PolarHBondContact NZ-O 2.95Å; K429-K758 WeakPolarHBondContact CG-O 3.26Å; K429-G759 VanDerWaalsContact CE-O 3.27Å; K429-G759 WeakPolarHBondContact CE-O 3.46Å; K429-I760 HydrophobicContact CG-CD1 4.23Å; K429-I760 HydrophobicContact CG-CG1 3.78Å
430	F	85.6	Confident	88.2	Confident	70 Å²	70	45 Å²	45	31%	0.307	23%	0.234	S	C	.	.			trans	-128.5	120.7	174	-176	-106.4	0	0	0	110.5	L94 V98 Q428 T432	L94-F430 HydrophobicContact CB-CB 3.95Å; L94-F430 HydrophobicContact CB-CD1 4.04Å; L94-F430 HydrophobicContact CB-CD2 4.07Å; L94-F430 HydrophobicContact CB-CG 3.75Å; L94-F430 HydrophobicContact CD1-CB 3.9Å; L94-F430 VanDerWaalsContact O-CE2 3.3Å; L94-F430 WeakPolarHBondContact O-CE2 3.21Å; L94-F430 WeakPolarHBondContact O-CZ 3.27Å; V98-F430 HydrophobicContact CB-CD2 4.28Å; V98-F430 HydrophobicContact CB-CE2 4.45Å; V98-F430 HydrophobicContact CG2-CD2 4.03Å; V98-F430 HydrophobicContact CG2-CE2 4Å; Q428-F430 PolarHBondContact O-N 2.91Å; F430-T432 HydrophobicContact CD1-CG2 3.69Å; F430-T432 HydrophobicContact CE1-CG2 3.33Å; F430-T432 HydrophobicContact CZ-CG2 4.35Å
431	Y	88.8	Confident	88.7	Confident	41 Å²	41	47.4 Å²	47.4	16%	0.161	25%	0.25	C	S	.	.			trans	-85.1	128.3	-178.7	174.5	-105	0	0	0	111.2	H433 F436 S482 A484 F487	Y431-H433 PolarHBondContact OH-CE1 3.35Å; Y431-H433 PolarHBondContact OH-ND1 2.93Å; Y431-H433 VanDerWaalsContact OH-ND1 3.15Å; Y431-F436 HydrophobicContact CE2-CB 3.89Å; Y431-F436 HydrophobicContact CE2-CG 4.41Å; Y431-S482 VanDerWaalsContact CA-O 3.31Å; Y431-S482 WeakPolarHBondContact CA-O 3.11Å; Y431-A484 HydrophobicContact CD2-CB 3.72Å; Y431-A484 HydrophobicContact CE2-CB 3.52Å; Y431-F487 HydrophobicContact CD1-CB 4.46Å; Y431-F487 HydrophobicContact CE1-CB 3.73Å; Y431-F487 HydrophobicContact CE1-CG 4.27Å; Y431-F487 WeakPolarHBondContact OH-CD1 3.46Å
432	T	88.6	Confident	89.4	Confident	43 Å²	43	54.2 Å²	54.2	26%	0.264	27%	0.273	S	S	.	.			trans	-132.8	149	164.8	60.5	0	0	0	0	109.4	F430 S434 A435 F436	F430-T432 HydrophobicContact CD1-CG2 3.69Å; F430-T432 HydrophobicContact CE1-CG2 3.33Å; F430-T432 HydrophobicContact CZ-CG2 4.35Å; T432-S434 VanDerWaalsContact C-N 3.27Å; T432-S434 PolarHBondContact O-N 3.36Å; T432-S434 PolarHBondContact OG1-OG 2.98Å; T432-A435 PolarHBondContact O-N 3.4Å; T432-A435 WeakPolarHBondContact OG1-CB 3.28Å; T432-A435 PolarHBondContact OG1-N 2.89Å; T432-F436 PolarHBondContact O-N 2.94Å
433	H	90.7	Very high	90.2	Very high	102 Å²	102	54.2 Å²	54.2	47%	0.472	27%	0.273	S	S	.	.	H	α-helix	trans	-59.5	-40.1	177.1	-74.2	-72.2	0	0	0	111.7	Y431 F436 F437	Y431-H433 PolarHBondContact OH-CE1 3.35Å; Y431-H433 PolarHBondContact OH-ND1 2.93Å; Y431-H433 VanDerWaalsContact OH-ND1 3.15Å; H433-F436 PolarHBondContact O-N 3.49Å; H433-F437 HydrophobicContact CB-CD2 4.25Å; H433-F437 AromaticContact ND1-CE2 3.75Å; H433-F437 WeakPolarHBondContact O-CB 3.45Å; H433-F437 VanDerWaalsContact O-CD2 3.28Å; H433-F437 WeakPolarHBondContact O-CD2 3.39Å; H433-F437 PolarHBondContact O-N 2.71Å
434	S	90	Very high	90.6	Very high	66 Å²	66	57.6 Å²	57.6	46%	0.462	29%	0.289	S	S	.	.	H	α-helix	trans	-62.9	-46.1	177.4	49.1	0	0	0	0	112.1	T432 F436 I438	T432-S434 VanDerWaalsContact C-N 3.27Å; T432-S434 PolarHBondContact O-N 3.36Å; T432-S434 PolarHBondContact OG1-OG 2.98Å; S434-F436 PolarHBondContact O-N 2.89Å; S434-I438 VanDerWaalsContact O-CB 3.25Å; S434-I438 WeakPolarHBondContact O-CB 3.44Å; S434-I438 WeakPolarHBondContact O-CG1 3.47Å; S434-I438 PolarHBondContact O-N 2.88Å
435	A	86.6	Confident	90.8	Very high	45 Å²	45	60.5 Å²	60.5	37%	0.372	31%	0.307	S	S	.	.	H	α-helix	trans	-62.9	-23.8	179.3	0	0	0	0	0	113.7	T432 P439	T432-A435 PolarHBondContact O-N 3.4Å; T432-A435 WeakPolarHBondContact OG1-CB 3.28Å; T432-A435 PolarHBondContact OG1-N 2.89Å; A435-P439 VanDerWaalsContact O-CD 3.32Å; A435-P439 WeakPolarHBondContact O-CD 3.42Å; A435-P439 WeakPolarHBondContact O-CG 3Å
436	F	92.1	Very high	90.9	Very high	8 Å²	8	63.5 Å²	63.5	4%	0.035	32%	0.323	C	S	.	.	H	α-helix	trans	-91	-51.5	176.2	179.2	-102.9	0	0	0	113	Y431 T432 H433 S434 L440 I478 S482 A484 V490	Y431-F436 HydrophobicContact CE2-CB 3.89Å; Y431-F436 HydrophobicContact CE2-CG 4.41Å; T432-F436 PolarHBondContact O-N 2.94Å; H433-F436 PolarHBondContact O-N 3.49Å; S434-F436 PolarHBondContact O-N 2.89Å; F436-L440 HydrophobicContact CE1-CD2 4.31Å; F436-L440 PolarHBondContact O-N 3.45Å; F436-I478 HydrophobicContact CD2-CG2 3.85Å; F436-I478 HydrophobicContact CE2-CG2 4.16Å; F436-S482 WeakPolarHBondContact CD2-OG 3.34Å; F436-A484 HydrophobicContact CD2-CB 3.7Å; F436-A484 HydrophobicContact CE2-CB 4.09Å; F436-A484 HydrophobicContact CG-CB 4.18Å; F436-V490 HydrophobicContact CD1-CG2 4.23Å; F436-V490 HydrophobicContact CE1-CB 4.46Å; F436-V490 HydrophobicContact CE1-CG1 3.85Å; F436-V490 HydrophobicContact CE1-CG2 3.68Å; F436-V490 HydrophobicContact CE2-CG1 3.9Å; F436-V490 HydrophobicContact CZ-CG1 3.46Å; F436-V490 VanDerWaalsContact CZ-CG1 3.46Å; F436-V490 HydrophobicContact CZ-CG2 4.17Å
437	F	94.1	Very high	90.9	Very high	88 Å²	88	62.8 Å²	62.8	39%	0.386	32%	0.321	S	S	.	.	H	α-helix	trans	-78.3	-30.8	-171.6	-73.5	-69.8	0	0	0	113.8	H433 L440 I441 V490	H433-F437 HydrophobicContact CB-CD2 4.25Å; H433-F437 AromaticContact ND1-CE2 3.75Å; H433-F437 WeakPolarHBondContact O-CB 3.45Å; H433-F437 VanDerWaalsContact O-CD2 3.28Å; H433-F437 WeakPolarHBondContact O-CD2 3.39Å; H433-F437 PolarHBondContact O-N 2.71Å; F437-L440 HydrophobicContact CD1-CD2 4.15Å; F437-L440 WeakPolarHBondContact O-CB 3.39Å; F437-L440 PolarHBondContact O-N 3.4Å; F437-I441 WeakPolarHBondContact O-CG1 3.38Å; F437-I441 PolarHBondContact O-N 2.87Å; F437-V490 HydrophobicContact CZ-CG2 4.41Å
438	I	92.7	Very high	90.8	Very high	86 Å²	86	65.5 Å²	65.5	44%	0.441	34%	0.34	S	S	.	.	H	α-helix	trans	-63.7	-52.3	179.2	-67.4	172.2	0	0	0	111	S434 L440 I441 Y442	S434-I438 VanDerWaalsContact O-CB 3.25Å; S434-I438 WeakPolarHBondContact O-CB 3.44Å; S434-I438 WeakPolarHBondContact O-CG1 3.47Å; S434-I438 PolarHBondContact O-N 2.88Å; I438-L440 PolarHBondContact O-N 2.87Å; I438-I441 PolarHBondContact O-N 3.17Å; I438-Y442 HydrophobicContact CG2-CD2 3.75Å; I438-Y442 HydrophobicContact CG2-CE2 3.4Å; I438-Y442 VanDerWaalsContact CG2-CE2 3.4Å; I438-Y442 VanDerWaalsContact O-CD2 3.22Å; I438-Y442 WeakPolarHBondContact O-CD2 3.33Å; I438-Y442 PolarHBondContact O-N 3.33Å; I438-Y442 VanDerWaalsContact O-N 3.12Å
439	P	92.2	Very high	90.8	Very high	47 Å²	47	71.4 Å²	71.4	31%	0.305	37%	0.365	S	S	.	.	H	α-helix	trans	-58.4	-35.5	174.3	-26.1	36.4	0	0	0	113.2	A435 Y442 I443 I478	A435-P439 VanDerWaalsContact O-CD 3.32Å; A435-P439 WeakPolarHBondContact O-CD 3.42Å; A435-P439 WeakPolarHBondContact O-CG 3Å; P439-Y442 PolarHBondContact O-N 3.24Å; P439-I443 PolarHBondContact O-N 3.02Å; P439-I478 HydrophobicContact CB-CD1 3.93Å; P439-I478 HydrophobicContact CB-CG1 4.23Å; P439-I478 HydrophobicContact CB-CG2 4.21Å
440	L	93.8	Very high	90.8	Very high	49 Å²	49	73.9 Å²	73.9	26%	0.257	37%	0.374	S	S	.	.	H	α-helix	trans	-61.8	-42.9	177.4	-175.1	61.3	0	0	0	112.1	F436 F437 I438 I443 L444 V475	F436-L440 HydrophobicContact CE1-CD2 4.31Å; F436-L440 PolarHBondContact O-N 3.45Å; F437-L440 HydrophobicContact CD1-CD2 4.15Å; F437-L440 WeakPolarHBondContact O-CB 3.39Å; F437-L440 PolarHBondContact O-N 3.4Å; I438-L440 PolarHBondContact O-N 2.87Å; L440-I443 HydrophobicContact CD1-CD1 4Å; L440-I443 HydrophobicContact CD1-CG1 4.29Å; L440-I443 WeakPolarHBondContact O-CG1 3.3Å; L440-L444 WeakPolarHBondContact O-CB 3.35Å; L440-L444 PolarHBondContact O-N 3.35Å; L440-L444 VanDerWaalsContact O-N 3.09Å; L440-V475 HydrophobicContact CD1-CG2 3.73Å
441	I	94.8	Very high	90.9	Very high	102 Å²	102	73.5 Å²	73.5	52%	0.523	38%	0.38	S	S	.	.	H	α-helix	trans	-64.3	-44.9	175.7	-67.3	164.7	0	0	0	110.2	F437 I438 I443 L444 V445	F437-I441 WeakPolarHBondContact O-CG1 3.38Å; F437-I441 PolarHBondContact O-N 2.87Å; I438-I441 PolarHBondContact O-N 3.17Å; I441-I443 PolarHBondContact O-N 2.81Å; I441-L444 PolarHBondContact O-N 2.96Å; I441-V445 HydrophobicContact CG2-CG2 4.28Å; I441-V445 VanDerWaalsContact O-CG2 3.3Å; I441-V445 WeakPolarHBondContact O-CG2 3.27Å; I441-V445 PolarHBondContact O-N 3.44Å
442	Y	92	Very high	90.9	Very high	159 Å²	159	74 Å²	74	62%	0.624	38%	0.383	S	S	*	.	H	α-helix	trans	-58.8	-46.5	178.1	-79.7	-65.1	0	0	0	112.7	I438 P439 L444 V445 L446	I438-Y442 HydrophobicContact CG2-CD2 3.75Å; I438-Y442 HydrophobicContact CG2-CE2 3.4Å; I438-Y442 VanDerWaalsContact CG2-CE2 3.4Å; I438-Y442 VanDerWaalsContact O-CD2 3.22Å; I438-Y442 WeakPolarHBondContact O-CD2 3.33Å; I438-Y442 PolarHBondContact O-N 3.33Å; I438-Y442 VanDerWaalsContact O-N 3.12Å; P439-Y442 PolarHBondContact O-N 3.24Å; Y442-L444 VanDerWaalsContact C-N 3.31Å; Y442-L444 PolarHBondContact O-N 3.44Å; Y442-V445 PolarHBondContact O-N 2.94Å; Y442-L446 WeakPolarHBondContact O-CG 3.4Å; Y442-L446 PolarHBondContact O-N 3.39Å
443	I	93.6	Very high	90.8	Very high	26 Å²	26	78.1 Å²	78.1	13%	0.133	40%	0.404	C	S	.	.	H	α-helix	trans	-67.1	-33.6	178.7	64.9	166.7	0	0	0	112.2	P439 L440 I441 G447 L474 V475 I478 F734	P439-I443 PolarHBondContact O-N 3.02Å; L440-I443 HydrophobicContact CD1-CD1 4Å; L440-I443 HydrophobicContact CD1-CG1 4.29Å; L440-I443 WeakPolarHBondContact O-CG1 3.3Å; I441-I443 PolarHBondContact O-N 2.81Å; I443-G447 PolarHBondContact O-N 2.91Å; I443-L474 HydrophobicContact CD1-CB 3.79Å; I443-V475 HydrophobicContact CD1-CG2 4.33Å; I443-I478 HydrophobicContact CD1-CD1 3.71Å; I443-I478 HydrophobicContact CG1-CD1 4.32Å; I443-I478 HydrophobicContact CG2-CD1 4.33Å; I443-F734 VanDerWaalsContact O-CZ 3.25Å; I443-F734 WeakPolarHBondContact O-CZ 3.24Å
444	L	92.9	Very high	90.4	Very high	106 Å²	106	73.6 Å²	73.6	56%	0.555	38%	0.384	S	S	*	.	H	α-helix	trans	-65	-46.5	176.1	179.9	66	0	0	0	110.7	L440 I441 Y442 G447 V448	L440-L444 WeakPolarHBondContact O-CB 3.35Å; L440-L444 PolarHBondContact O-N 3.35Å; L440-L444 VanDerWaalsContact O-N 3.09Å; I441-L444 PolarHBondContact O-N 2.96Å; Y442-L444 VanDerWaalsContact C-N 3.31Å; Y442-L444 PolarHBondContact O-N 3.44Å; L444-G447 PolarHBondContact O-N 3.48Å; L444-V448 WeakPolarHBondContact O-CG2 3.41Å; L444-V448 PolarHBondContact O-N 3.27Å
445	V	92.9	Very high	89.9	Confident	65 Å²	65	74.9 Å²	74.9	39%	0.394	38%	0.381	S	S	.	.	H	α-helix	trans	-59.4	-48.5	177.5	171.3	0	0	0	0	110.6	I441 Y442 G447 V448 F449	I441-V445 HydrophobicContact CG2-CG2 4.28Å; I441-V445 VanDerWaalsContact O-CG2 3.3Å; I441-V445 WeakPolarHBondContact O-CG2 3.27Å; I441-V445 PolarHBondContact O-N 3.44Å; Y442-V445 PolarHBondContact O-N 2.94Å; V445-G447 VanDerWaalsContact C-N 3.32Å; V445-G447 PolarHBondContact O-N 3.28Å; V445-V448 PolarHBondContact O-N 3.25Å; V445-F449 HydrophobicContact CG1-CD2 3.64Å; V445-F449 HydrophobicContact CG1-CE2 3.41Å; V445-F449 VanDerWaalsContact CG1-CE2 3.41Å; V445-F449 WeakPolarHBondContact O-CD2 3.43Å; V445-F449 PolarHBondContact O-N 3.37Å; V445-F449 VanDerWaalsContact O-N 3.12Å
446	L	90.3	Very high	89.6	Confident	72 Å²	72	77.5 Å²	77.5	38%	0.377	39%	0.386	S	S	.	.	H	α-helix	trans	-58.5	-44.5	174.6	-70	172.6	0	0	0	111.6	Y442 V448 F449 Y450 F733	Y442-L446 WeakPolarHBondContact O-CG 3.4Å; Y442-L446 PolarHBondContact O-N 3.39Å; L446-V448 VanDerWaalsContact C-N 3.3Å; L446-V448 PolarHBondContact O-N 2.92Å; L446-F449 PolarHBondContact O-N 2.81Å; L446-Y450 HydrophobicContact CD2-CE2 4.28Å; L446-Y450 VanDerWaalsContact O-CD2 3.27Å; L446-Y450 WeakPolarHBondContact O-CD2 3.27Å; L446-Y450 PolarHBondContact O-N 3.49Å; L446-F733 HydrophobicContact CB-CD1 4.42Å; L446-F733 HydrophobicContact CB-CE1 4.2Å; L446-F733 HydrophobicContact CB-CZ 4.31Å; L446-F733 HydrophobicContact CD1-CE2 4.48Å; L446-F733 HydrophobicContact CD1-CZ 4.14Å
447	G	89.3	Confident	89.1	Confident	3 Å²	3	77.6 Å²	77.6	3%	0.031	39%	0.387	C	S	.	.	H	α-helix	trans	-55.8	-42.7	177.6	0	0	0	0	0	113.6	I443 L444 V445 S731 F734	I443-G447 PolarHBondContact O-N 2.91Å; L444-G447 PolarHBondContact O-N 3.48Å; V445-G447 VanDerWaalsContact C-N 3.32Å; V445-G447 PolarHBondContact O-N 3.28Å; G447-S731 WeakPolarHBondContact O-CB 3.45Å; G447-S731 PolarHBondContact O-OG 3.33Å; G447-F734 VanDerWaalsContact CA-CE2 3.45Å
448	V	88.9	Confident	88.7	Confident	98 Å²	98	77.4 Å²	77.4	59%	0.594	39%	0.386	S	S	*	.	H	α-helix	trans	-68.8	-43.9	178.9	173.1	0	0	0	0	111.6	L444 V445 L446 Y450 S451	L444-V448 WeakPolarHBondContact O-CG2 3.41Å; L444-V448 PolarHBondContact O-N 3.27Å; V445-V448 PolarHBondContact O-N 3.25Å; L446-V448 VanDerWaalsContact C-N 3.3Å; L446-V448 PolarHBondContact O-N 2.92Å; V448-Y450 VanDerWaalsContact C-N 3.31Å; V448-Y450 PolarHBondContact O-N 3.21Å; V448-S451 PolarHBondContact O-N 3.46Å; V448-S451 PolarHBondContact O-OG 2.9Å
449	F	89.4	Confident	88.5	Confident	167 Å²	167	73.7 Å²	73.7	73%	0.732	37%	0.368	S	S	*	.	H	α-helix	trans	-64.4	-32	-178.5	-82.3	-65.8	0	0	0	113.6	V445 L446 S451	V445-F449 HydrophobicContact CG1-CD2 3.64Å; V445-F449 HydrophobicContact CG1-CE2 3.41Å; V445-F449 VanDerWaalsContact CG1-CE2 3.41Å; V445-F449 WeakPolarHBondContact O-CD2 3.43Å; V445-F449 PolarHBondContact O-N 3.37Å; V445-F449 VanDerWaalsContact O-N 3.12Å; L446-F449 PolarHBondContact O-N 2.81Å; F449-S451 VanDerWaalsContact C-N 3.34Å; F449-S451 PolarHBondContact O-N 2.77Å
450	Y	88.6	Confident	88.3	Confident	109 Å²	109	72.1 Å²	72.1	43%	0.427	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	41.3	-179.4	-70.4	-76.6	0	0	0	113.4	L446 V448 S731 S732 F733	L446-Y450 HydrophobicContact CD2-CE2 4.28Å; L446-Y450 VanDerWaalsContact O-CD2 3.27Å; L446-Y450 WeakPolarHBondContact O-CD2 3.27Å; L446-Y450 PolarHBondContact O-N 3.49Å; V448-Y450 VanDerWaalsContact C-N 3.31Å; V448-Y450 PolarHBondContact O-N 3.21Å; Y450-S731 WeakPolarHBondContact O-CA 3.42Å; Y450-S732 PolarHBondContact O-N 3.19Å; Y450-S732 PolarHBondContact O-OG 3.49Å; Y450-F733 HydrophobicContact CD2-CB 4.14Å; Y450-F733 HydrophobicContact CG-CB 4.14Å
451	S	86.9	Confident	88.1	Confident	62 Å²	62	70.4 Å²	70.4	43%	0.434	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	132.1	178.7	-63.1	0	0	0	0	112.5	V448 F449 Y730	V448-S451 PolarHBondContact O-N 3.46Å; V448-S451 PolarHBondContact O-OG 2.9Å; F449-S451 VanDerWaalsContact C-N 3.34Å; F449-S451 PolarHBondContact O-N 2.77Å; S451-Y730 WeakPolarHBondContact CA-O 3.35Å
452	E	88.3	Confident	87.8	Confident	50 Å²	50	71.7 Å²	71.7	23%	0.234	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	158.7	179.1	-65	-176	163.7	0	0	111.2	L384 V729 Y730	L384-E452 VanDerWaalsContact CD1-OE2 3.32Å; L384-E452 WeakPolarHBondContact CD1-OE2 3.49Å; L384-E452 WeakPolarHBondContact CD2-OE2 3.32Å; E452-V729 CarbonylContact O-C 3.59Å; E452-V729 WeakPolarHBondContact O-CA 3.4Å; E452-Y730 HydrophobicContact CB-CE1 4.02Å; E452-Y730 PolarHBondContact N-O 3.4Å; E452-Y730 WeakPolarHBondContact O-CD1 3.38Å; E452-Y730 PolarHBondContact O-N 3.26Å; E452-Y730 PolarHBondContact OE2-OH 3.1Å
453	N	86.7	Confident	87.7	Confident	130 Å²	130	66 Å²	66	70%	0.695	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.3	137.5	178.4	-68.7	-60.2	0	0	0	111	S728	N453-S728 CarbonylContact C-O 3.52Å; N453-S728 WeakPolarHBondContact CA-O 3.25Å
454	T	82.9	Confident	87.7	Confident	8 Å²	8	65 Å²	65	5%	0.049	32%	0.32	C	S	.	.			trans	-75.7	150.3	178.1	63.9	0	0	0	0	111.7	E456 N461 E463 R727 S728 Y730	T454-E456 PolarHBondContact OG1-O 2.73Å; T454-N461 WeakPolarHBondContact CB-ND2 3.39Å; T454-N461 WeakPolarHBondContact CG2-ND2 3.33Å; T454-E463 WeakPolarHBondContact CA-OE2 3.38Å; T454-E463 WeakPolarHBondContact CB-OE2 3.28Å; T454-R727 PolarHBondContact OG1-O 3.23Å; T454-S728 PolarHBondContact N-O 2.93Å; T454-S728 WeakPolarHBondContact OG1-CA 3.44Å; T454-S728 PolarHBondContact OG1-O 2.62Å; T454-Y730 HydrophobicContact CG2-CD1 3.48Å; T454-Y730 VanDerWaalsContact CG2-CD1 3.48Å; T454-Y730 HydrophobicContact CG2-CE1 4.36Å; T454-Y730 HydrophobicContact CG2-CG 4.07Å
455	K	79.5	Confident	87.7	Confident	93 Å²	93	60.7 Å²	60.7	40%	0.404	30%	0.298	S	S	.	.	S	Bend	trans	-75.8	-36.9	174.7	-63.5	-170.9	-178.2	-151.3	0	112.3	E385 E463	E385-K455 VanDerWaalsContact CB-NZ 3.33Å; E385-K455 IonicContact OE1-NZ 3.34Å; E385-K455 PolarHBondContact OE1-NZ 3.34Å; K455-E463 PolarHBondContact N-OE2 2.93Å
456	E	79.8	Confident	87.7	Confident	100 Å²	100	57.9 Å²	57.9	47%	0.467	28%	0.281	S	S	.	.			trans	-119	128.7	179.9	-60.2	-167.9	176.2	0	0	110.9	T454 K458 N461	T454-E456 PolarHBondContact OG1-O 2.73Å; E456-K458 PolarHBondContact O-N 3.37Å; E456-K458 IonicContact OE1-NZ 2.81Å; E456-K458 WeakPolarHBondContact OE2-CD 3.15Å; E456-K458 WeakPolarHBondContact OE2-CE 3.39Å; E456-K458 IonicContact OE2-NZ 2.83Å; E456-K458 PolarHBondContact OE2-NZ 2.84Å; E456-N461 PolarHBondContact O-ND2 3.11Å
457	A	81.3	Confident	87.9	Confident	9 Å²	9	55.5 Å²	55.5	7%	0.074	27%	0.268	C	S	.	.			trans	-88.3	23.8	176.9	0	0	0	0	0	113.1	K664 R727	A457-K664 HydrophobicContact CB-CG 4.23Å; A457-R727 WeakPolarHBondContact O-CD 3.49Å; A457-R727 PolarHBondContact O-NE 2.63Å
458	K	86.4	Confident	88.2	Confident	84 Å²	84	55.9 Å²	55.9	37%	0.365	27%	0.268	S	S	.	.	S	Bend	trans	-72.8	150.2	177.1	-64.3	-178.2	-171	139.6	0	111.1	E456 L460 N461 E662	E456-K458 PolarHBondContact O-N 3.37Å; E456-K458 IonicContact OE1-NZ 2.81Å; E456-K458 WeakPolarHBondContact OE2-CD 3.15Å; E456-K458 WeakPolarHBondContact OE2-CE 3.39Å; E456-K458 IonicContact OE2-NZ 2.83Å; E456-K458 PolarHBondContact OE2-NZ 2.84Å; K458-L460 PolarHBondContact O-N 3.46Å; K458-N461 PolarHBondContact O-N 2.85Å; K458-E662 WeakPolarHBondContact CA-OE1 3.12Å
459	L	87.6	Confident	88.5	Confident	9 Å²	9	53.9 Å²	53.9	5%	0.047	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	130.8	174.3	178.6	144.8	0	0	0	110.7	N461 F647 Y651 E662 L668 N721	L459-N461 PolarHBondContact O-N 3.26Å; L459-F647 HydrophobicContact CD2-CE1 4.01Å; L459-F647 HydrophobicContact CD2-CZ 4.01Å; L459-Y651 HydrophobicContact CB-CD2 4.31Å; L459-Y651 HydrophobicContact CB-CE2 3.65Å; L459-Y651 HydrophobicContact CD2-CD2 3.81Å; L459-Y651 HydrophobicContact CD2-CE2 3.93Å; L459-Y651 HydrophobicContact CD2-CG 4.21Å; L459-Y651 HydrophobicContact CG-CD2 4.46Å; L459-Y651 HydrophobicContact CG-CE2 4.26Å; L459-E662 PolarHBondContact N-OE1 3.37Å; L459-L668 HydrophobicContact CD1-CD1 4.39Å; L459-L668 HydrophobicContact CD1-CD2 3.57Å; L459-N721 HydrophobicContact CD1-CB 4.05Å; L459-N721 HydrophobicContact CG-CB 4.19Å
460	L	88.4	Confident	88.8	Confident	14 Å²	14	45.9 Å²	45.9	7%	0.073	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	53.1	-178.3	-63	177	0	0	0	113.1	K458 T465 W468 Y507 F647 I717 N721	K458-L460 PolarHBondContact O-N 3.46Å; L460-T465 HydrophobicContact CB-CG2 4.03Å; L460-W468 HydrophobicContact CD2-CE3 4.1Å; L460-W468 HydrophobicContact CD2-CZ3 4.1Å; L460-Y507 HydrophobicContact CB-CE1 4.15Å; L460-Y507 HydrophobicContact CD1-CE1 4.22Å; L460-Y507 HydrophobicContact CD1-CE2 4.25Å; L460-F647 HydrophobicContact CD1-CE1 3.79Å; L460-I717 HydrophobicContact CD1-CD1 4.29Å; L460-I717 HydrophobicContact CD1-CG1 4.44Å; L460-I717 HydrophobicContact CD1-CG2 4.26Å; L460-I717 HydrophobicContact CD2-CG1 4.43Å; L460-I717 HydrophobicContact CD2-CG2 4.43Å; L460-I717 HydrophobicContact CG-CG2 4.36Å; L460-N721 PolarHBondContact N-OD1 2.77Å
461	N	89	Confident	89.1	Confident	12 Å²	12	43.3 Å²	43.3	6%	0.064	21%	0.206	C	C	.	.			trans	-61.5	168.2	174.8	74.4	18	0	0	0	111.8	T454 E456 K458 L459 E463 Q464 T465	T454-N461 WeakPolarHBondContact CB-ND2 3.39Å; T454-N461 WeakPolarHBondContact CG2-ND2 3.33Å; E456-N461 PolarHBondContact O-ND2 3.11Å; K458-N461 PolarHBondContact O-N 2.85Å; L459-N461 PolarHBondContact O-N 3.26Å; N461-E463 VanDerWaalsContact C-N 3.3Å; N461-E463 PolarHBondContact O-N 3.13Å; N461-E463 PolarHBondContact OD1-N 3.13Å; N461-Q464 PolarHBondContact O-N 3.38Å; N461-Q464 WeakPolarHBondContact OD1-CB 3.08Å; N461-Q464 WeakPolarHBondContact OD1-CG 3.4Å; N461-Q464 PolarHBondContact OD1-N 3.45Å; N461-T465 WeakPolarHBondContact O-CG2 3.28Å; N461-T465 PolarHBondContact O-N 2.9Å; N461-T465 PolarHBondContact O-OG1 3.49Å; N461-T465 VanDerWaalsContact O-OG1 3.07Å
462	R	89.2	Confident	89.6	Confident	130 Å²	130	40.3 Å²	40.3	49%	0.491	19%	0.185	S	C	.	.	H	α-helix	trans	-58.6	-42.7	-177.7	-176	69.6	-174.8	108.1	15.9	112.1	T465 D466	R462-T465 WeakPolarHBondContact CA-OG1 3.34Å; R462-T465 PolarHBondContact O-N 3.2Å; R462-T465 PolarHBondContact O-OG1 3.22Å; R462-D466 VanDerWaalsContact CZ-CG 3.43Å; R462-D466 IonicContact CZ-OD1 3.64Å; R462-D466 IonicContact CZ-OD2 2.66Å; R462-D466 IonicContact NE-OD2 3.72Å; R462-D466 IonicContact NH1-OD1 2.93Å; R462-D466 PolarHBondContact NH1-OD1 2.8Å; R462-D466 IonicContact NH1-OD2 2.95Å; R462-D466 PolarHBondContact NH1-OD2 2.95Å; R462-D466 IonicContact NH2-OD1 3.09Å; R462-D466 PolarHBondContact NH2-OD1 3.27Å; R462-D466 IonicContact NH2-OD2 3.06Å; R462-D466 PolarHBondContact NH2-OD2 3.41Å; R462-D466 PolarHBondContact O-N 2.89Å
463	E	90.7	Very high	90	Very high	39 Å²	39	38.1 Å²	38.1	18%	0.182	18%	0.175	C	C	.	.	H	α-helix	trans	-63.3	-43.4	-178.7	-67	171.5	162.4	0	0	111.9	T454 K455 N461 D466 E467 Y730	T454-E463 WeakPolarHBondContact CA-OE2 3.38Å; T454-E463 WeakPolarHBondContact CB-OE2 3.28Å; K455-E463 PolarHBondContact N-OE2 2.93Å; N461-E463 VanDerWaalsContact C-N 3.3Å; N461-E463 PolarHBondContact O-N 3.13Å; N461-E463 PolarHBondContact OD1-N 3.13Å; E463-D466 PolarHBondContact O-N 3.48Å; E463-E467 WeakPolarHBondContact O-CB 3.5Å; E463-E467 PolarHBondContact O-N 3.07Å; E463-Y730 HydrophobicContact CB-CD1 4.22Å; E463-Y730 HydrophobicContact CB-CD2 3.86Å; E463-Y730 HydrophobicContact CB-CE1 4.31Å; E463-Y730 HydrophobicContact CB-CE2 3.96Å; E463-Y730 HydrophobicContact CB-CG 3.98Å; E463-Y730 HydrophobicContact CG-CE1 4.4Å; E463-Y730 HydrophobicContact CG-CE2 4.27Å
464	Q	91.9	Very high	90.4	Very high	6 Å²	6	32.8 Å²	32.8	3%	0.028	15%	0.146	C	C	.	.	H	α-helix	trans	-70.6	-38	176.5	-76	177	-17.3	0	0	112.7	N461 D466 E467 W468 N721 R727	N461-Q464 PolarHBondContact O-N 3.38Å; N461-Q464 WeakPolarHBondContact OD1-CB 3.08Å; N461-Q464 WeakPolarHBondContact OD1-CG 3.4Å; N461-Q464 PolarHBondContact OD1-N 3.45Å; Q464-D466 VanDerWaalsContact C-N 3.33Å; Q464-E467 PolarHBondContact O-N 2.76Å; Q464-W468 WeakPolarHBondContact O-CB 3.39Å; Q464-W468 PolarHBondContact O-N 2.96Å; Q464-N721 PolarHBondContact OE1-OD1 2.95Å; Q464-R727 PolarHBondContact NE2-O 3.08Å
465	T	93.4	Very high	91	Very high	15 Å²	15	33.3 Å²	33.3	9%	0.092	15%	0.149	C	C	.	.	H	α-helix	trans	-68.1	-36.2	175.8	51.8	0	0	0	0	111.2	L460 N461 R462 K469	L460-T465 HydrophobicContact CB-CG2 4.03Å; N461-T465 WeakPolarHBondContact O-CG2 3.28Å; N461-T465 PolarHBondContact O-N 2.9Å; N461-T465 PolarHBondContact O-OG1 3.49Å; N461-T465 VanDerWaalsContact O-OG1 3.07Å; R462-T465 WeakPolarHBondContact CA-OG1 3.34Å; R462-T465 PolarHBondContact O-N 3.2Å; R462-T465 PolarHBondContact O-OG1 3.22Å; T465-K469 VanDerWaalsContact O-CG 3.29Å; T465-K469 WeakPolarHBondContact O-CG 3.49Å; T465-K469 PolarHBondContact O-N 3.35Å
466	D	93.4	Very high	91.8	Very high	6 Å²	6	29.1 Å²	29.1	3%	0.032	13%	0.131	C	C	.	.	H	α-helix	trans	-67.8	-44.2	170.3	-76.6	-25.3	0	0	0	111.6	R462 E463 Q464 W468 K469 G470 S735 G738	R462-D466 VanDerWaalsContact CZ-CG 3.43Å; R462-D466 IonicContact CZ-OD1 3.64Å; R462-D466 IonicContact CZ-OD2 2.66Å; R462-D466 IonicContact NE-OD2 3.72Å; R462-D466 IonicContact NH1-OD1 2.93Å; R462-D466 PolarHBondContact NH1-OD1 2.8Å; R462-D466 IonicContact NH1-OD2 2.95Å; R462-D466 PolarHBondContact NH1-OD2 2.95Å; R462-D466 IonicContact NH2-OD1 3.09Å; R462-D466 PolarHBondContact NH2-OD1 3.27Å; R462-D466 IonicContact NH2-OD2 3.06Å; R462-D466 PolarHBondContact NH2-OD2 3.41Å; R462-D466 PolarHBondContact O-N 2.89Å; E463-D466 PolarHBondContact O-N 3.48Å; Q464-D466 VanDerWaalsContact C-N 3.33Å; D466-W468 VanDerWaalsContact C-N 3.29Å; D466-W468 PolarHBondContact O-N 3.38Å; D466-K469 PolarHBondContact O-N 3.02Å; D466-G470 PolarHBondContact O-N 3.27Å; D466-S735 WeakPolarHBondContact CB-OG 3.32Å; D466-G738 VanDerWaalsContact O-CA 3.29Å; D466-G738 WeakPolarHBondContact O-CA 3.44Å
467	E	94.6	Very high	92.5	Very high	22 Å²	22	24.4 Å²	24.4	10%	0.103	11%	0.109	C	C	.	.	H	α-helix	trans	-54.3	-48	172.5	-175.4	-159.4	158	0	0	111.1	E463 Q464 K469 G470 W471 R720 Y730 S731 F734	E463-E467 WeakPolarHBondContact O-CB 3.5Å; E463-E467 PolarHBondContact O-N 3.07Å; Q464-E467 PolarHBondContact O-N 2.76Å; E467-K469 PolarHBondContact O-N 2.78Å; E467-G470 PolarHBondContact O-N 3.25Å; E467-G470 VanDerWaalsContact O-N 3.15Å; E467-W471 PolarHBondContact O-N 3.34Å; E467-R720 IonicContact OE1-NE 2.78Å; E467-R720 IonicContact OE1-NH2 3.3Å; E467-R720 PolarHBondContact OE1-NH2 2.98Å; E467-R720 IonicContact OE2-CZ 3.19Å; E467-R720 IonicContact OE2-NH2 3.22Å; E467-R720 PolarHBondContact OE2-NH2 3.18Å; E467-Y730 VanDerWaalsContact OE2-CA 3.28Å; E467-Y730 WeakPolarHBondContact OE2-CA 3.42Å; E467-Y730 VanDerWaalsContact OE2-CB 3.25Å; E467-Y730 WeakPolarHBondContact OE2-CB 3.37Å; E467-S731 PolarHBondContact OE2-N 3.41Å; E467-F734 HydrophobicContact CB-CB 4.5Å; E467-F734 HydrophobicContact CG-CB 3.83Å; E467-F734 HydrophobicContact CG-CD2 4.38Å
468	W	95.4	Very high	93.2	Very high	11 Å²	11	25 Å²	25	4%	0.042	11%	0.111	C	C	.	.	H	α-helix	trans	-60.6	-45.8	-179.9	-172.8	10.5	0	0	0	111.3	L460 Q464 D466 G470 W471 M472 A500 F503 Q504 I713 F716 I717	L460-W468 HydrophobicContact CD2-CE3 4.1Å; L460-W468 HydrophobicContact CD2-CZ3 4.1Å; Q464-W468 WeakPolarHBondContact O-CB 3.39Å; Q464-W468 PolarHBondContact O-N 2.96Å; D466-W468 VanDerWaalsContact C-N 3.29Å; D466-W468 PolarHBondContact O-N 3.38Å; W468-G470 PolarHBondContact O-N 3.41Å; W468-W471 AromaticContact CD1-CE2 3.46Å; W468-W471 VanDerWaalsContact CD1-CE2 3.46Å; W468-W471 AromaticContact CD1-CZ2 3.34Å; W468-W471 AromaticContact CD1-NE1 3.38Å; W468-W471 AromaticContact NE1-CZ2 3.5Å; W468-M472 VanDerWaalsContact CD1-CE 3.42Å; W468-M472 VanDerWaalsContact CD1-SD 3.52Å; W468-M472 HydrophobicContact CD2-CE 4.22Å; W468-M472 HydrophobicContact CG-CE 3.9Å; W468-M472 HydrophobicContact CG-SD 4.49Å; W468-M472 PolarHBondContact NE1-SD 2.83Å; W468-M472 WeakPolarHBondContact O-CB 3.09Å; W468-M472 WeakPolarHBondContact O-CE 3.49Å; W468-M472 WeakPolarHBondContact O-CG 3.39Å; W468-M472 PolarHBondContact O-N 3.43Å; W468-A500 HydrophobicContact CH2-CB 4.47Å; W468-A500 HydrophobicContact CZ2-CB 3.68Å; W468-F503 HydrophobicContact CH2-CD1 4.36Å; W468-Q504 HydrophobicContact CE3-CG 4Å; W468-Q504 VanDerWaalsContact CG-NE2 3.31Å; W468-Q504 HydrophobicContact CH2-CG 4.21Å; W468-Q504 HydrophobicContact CZ3-CG 3.78Å; W468-I713 HydrophobicContact CH2-CG2 3.95Å; W468-I713 HydrophobicContact CZ2-CG2 4.28Å; W468-F716 AromaticContact CD1-CE1 3.61Å; W468-F716 AromaticContact CD1-CZ 3.99Å; W468-F716 HydrophobicContact CD2-CD1 4.16Å; W468-F716 AromaticContact CD2-CE1 3.58Å; W468-F716 HydrophobicContact CD2-CE1 3.58Å; W468-F716 AromaticContact CE2-CD1 3.61Å; W468-F716 AromaticContact CE2-CE1 3.41Å; W468-F716 VanDerWaalsContact CE2-CE1 3.41Å; W468-F716 HydrophobicContact CE3-CE1 4.27Å; W468-F716 AromaticContact CG-CE1 3.76Å; W468-F716 HydrophobicContact CG-CE1 3.76Å; W468-F716 HydrophobicContact CG-CZ 4.35Å; W468-F716 HydrophobicContact CH2-CD1 4.35Å; W468-F716 AromaticContact CZ2-CD1 3.71Å; W468-F716 HydrophobicContact CZ2-CD1 3.71Å; W468-F716 HydrophobicContact CZ2-CE1 4Å; W468-F716 AromaticContact NE1-CD1 3.79Å; W468-F716 AromaticContact NE1-CE1 3.37Å; W468-I717 HydrophobicContact CH2-CD1 4.08Å; W468-I717 HydrophobicContact CH2-CG1 3.95Å; W468-I717 HydrophobicContact CZ3-CD1 4.31Å; W468-I717 HydrophobicContact CZ3-CG1 4.07Å
469	K	95.4	Very high	93.5	Very high	55 Å²	55	21.9 Å²	21.9	24%	0.239	10%	0.097	C	C	.	.	H	α-helix	trans	-59	-47.7	172.9	-72	175.3	-177	179.4	0	111.6	T465 D466 E467 M472 Q473 Y501	T465-K469 VanDerWaalsContact O-CG 3.29Å; T465-K469 WeakPolarHBondContact O-CG 3.49Å; T465-K469 PolarHBondContact O-N 3.35Å; D466-K469 PolarHBondContact O-N 3.02Å; E467-K469 PolarHBondContact O-N 2.78Å; K469-M472 PolarHBondContact O-N 2.97Å; K469-Q473 WeakPolarHBondContact O-CB 3.41Å; K469-Q473 PolarHBondContact O-N 3.17Å; K469-Y501 HydrophobicContact CB-CE1 4Å; K469-Y501 HydrophobicContact CD-CE1 4.32Å; K469-Y501 HydrophobicContact CG-CD1 4.36Å; K469-Y501 HydrophobicContact CG-CE1 3.69Å; K469-Y501 PolarHBondContact O-OH 3.43Å
470	G	95.3	Very high	93.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-59.2	-52.4	-175.2	0	0	0	0	0	113.7	D466 E467 W468 M472 Q473 L474 F734	D466-G470 PolarHBondContact O-N 3.27Å; E467-G470 PolarHBondContact O-N 3.25Å; E467-G470 VanDerWaalsContact O-N 3.15Å; W468-G470 PolarHBondContact O-N 3.41Å; G470-M472 PolarHBondContact O-N 3.1Å; G470-Q473 WeakPolarHBondContact O-CB 3.43Å; G470-Q473 PolarHBondContact O-N 3.39Å; G470-L474 WeakPolarHBondContact O-CG 3.4Å; G470-L474 PolarHBondContact O-N 3.31Å; G470-F734 VanDerWaalsContact CA-O 3.29Å; G470-F734 WeakPolarHBondContact CA-O 3.11Å
471	W	95.6	Very high	93.9	Very high	54 Å²	54	23.7 Å²	23.7	21%	0.205	11%	0.107	C	C	.	.	H	α-helix	trans	-66.5	-39.4	179.7	74.8	-107.9	0	0	0	111.5	E467 W468 Q473 L474 V475 L497 F716 F734	E467-W471 PolarHBondContact O-N 3.34Å; W468-W471 AromaticContact CD1-CE2 3.46Å; W468-W471 VanDerWaalsContact CD1-CE2 3.46Å; W468-W471 AromaticContact CD1-CZ2 3.34Å; W468-W471 AromaticContact CD1-NE1 3.38Å; W468-W471 AromaticContact NE1-CZ2 3.5Å; W471-Q473 VanDerWaalsContact C-N 3.28Å; W471-Q473 PolarHBondContact O-N 3.39Å; W471-L474 PolarHBondContact O-N 2.91Å; W471-V475 HydrophobicContact CE3-CG2 4.12Å; W471-V475 WeakPolarHBondContact O-CG2 3.16Å; W471-V475 PolarHBondContact O-N 3.42Å; W471-L497 HydrophobicContact CH2-CD2 3.53Å; W471-L497 HydrophobicContact CZ3-CD1 4.03Å; W471-L497 HydrophobicContact CZ3-CD2 3.68Å; W471-F716 HydrophobicContact CZ2-CE1 4.23Å; W471-F716 AromaticContact CZ2-CE2 3.83Å; W471-F716 HydrophobicContact CZ2-CE2 3.83Å; W471-F716 AromaticContact CZ2-CZ 3.65Å; W471-F716 HydrophobicContact CZ2-CZ 3.65Å; W471-F716 AromaticContact NE1-CZ 3.92Å; W471-F734 HydrophobicContact CB-CB 4.42Å; W471-F734 HydrophobicContact CB-CD1 3.76Å; W471-F734 HydrophobicContact CB-CD2 3.91Å; W471-F734 HydrophobicContact CB-CE1 3.88Å; W471-F734 HydrophobicContact CB-CE2 4.01Å; W471-F734 HydrophobicContact CB-CG 3.79Å; W471-F734 HydrophobicContact CB-CZ 4Å
472	M	96.2	Very high	94	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-60.4	-41.5	175.3	-73.6	-168.7	-62.6	0	0	111.3	W468 K469 G470 V475 I476 L497 A500 Y501	W468-M472 VanDerWaalsContact CD1-CE 3.42Å; W468-M472 VanDerWaalsContact CD1-SD 3.52Å; W468-M472 HydrophobicContact CD2-CE 4.22Å; W468-M472 HydrophobicContact CG-CE 3.9Å; W468-M472 HydrophobicContact CG-SD 4.49Å; W468-M472 PolarHBondContact NE1-SD 2.83Å; W468-M472 WeakPolarHBondContact O-CB 3.09Å; W468-M472 WeakPolarHBondContact O-CE 3.49Å; W468-M472 WeakPolarHBondContact O-CG 3.39Å; W468-M472 PolarHBondContact O-N 3.43Å; K469-M472 PolarHBondContact O-N 2.97Å; G470-M472 PolarHBondContact O-N 3.1Å; M472-V475 PolarHBondContact O-N 3.33Å; M472-I476 WeakPolarHBondContact O-CD1 3.46Å; M472-I476 VanDerWaalsContact O-CG1 3.25Å; M472-I476 WeakPolarHBondContact O-CG1 3.45Å; M472-I476 PolarHBondContact O-N 2.96Å; M472-L497 HydrophobicContact CB-CB 4.47Å; M472-L497 HydrophobicContact CG-CB 4.29Å; M472-L497 HydrophobicContact CG-CD1 4.46Å; M472-L497 HydrophobicContact CG-CD2 4.03Å; M472-L497 HydrophobicContact CG-CG 4.48Å; M472-L497 HydrophobicContact SD-CB 4.18Å; M472-L497 HydrophobicContact SD-CD2 4.21Å; M472-A500 HydrophobicContact CE-CB 4.33Å; M472-A500 HydrophobicContact SD-CB 3.65Å; M472-Y501 HydrophobicContact CB-CD2 4.41Å; M472-Y501 HydrophobicContact CB-CE2 3.69Å; M472-Y501 HydrophobicContact CE-CD2 3.98Å; M472-Y501 HydrophobicContact CE-CE2 3.97Å; M472-Y501 HydrophobicContact CE-CG 4.3Å; M472-Y501 HydrophobicContact SD-CD2 4.41Å
473	Q	96.4	Very high	94.1	Very high	3 Å²	3	18 Å²	18	1%	0.014	9%	0.09	C	C	.	.	H	α-helix	trans	-61.6	-48.6	178.3	-171.1	55.5	37.4	0	0	111	K469 G470 W471 V475 I476 L477 Y501 S741 L744 F745	K469-Q473 WeakPolarHBondContact O-CB 3.41Å; K469-Q473 PolarHBondContact O-N 3.17Å; G470-Q473 WeakPolarHBondContact O-CB 3.43Å; G470-Q473 PolarHBondContact O-N 3.39Å; W471-Q473 VanDerWaalsContact C-N 3.28Å; W471-Q473 PolarHBondContact O-N 3.39Å; Q473-V475 VanDerWaalsContact C-N 3.31Å; Q473-V475 PolarHBondContact O-N 3.26Å; Q473-I476 PolarHBondContact O-N 3.41Å; Q473-L477 HydrophobicContact CG-CD1 4.04Å; Q473-L477 HydrophobicContact CG-CG 4.36Å; Q473-L477 WeakPolarHBondContact O-CB 3.45Å; Q473-L477 WeakPolarHBondContact O-CG 3.36Å; Q473-L477 PolarHBondContact O-N 2.87Å; Q473-Y501 WeakPolarHBondContact CB-OH 3.44Å; Q473-Y501 PolarHBondContact OE1-OH 2.87Å; Q473-S741 VanDerWaalsContact CD-O 3.27Å; Q473-S741 PolarHBondContact OE1-O 3.38Å; Q473-L744 HydrophobicContact CG-CB 4.21Å; Q473-L744 HydrophobicContact CG-CD1 4.41Å; Q473-F745 VanDerWaalsContact NE2-CA 3.28Å; Q473-F745 VanDerWaalsContact NE2-CB 3.31Å
474	L	96.1	Very high	94.1	Very high	18 Å²	18	16.1 Å²	16.1	9%	0.094	8%	0.081	C	C	.	.	H	α-helix	trans	-60.8	-40.6	179.4	-68.4	176.1	0	0	0	111.9	I443 G470 W471 L477 I478 F733 F734 F737	I443-L474 HydrophobicContact CD1-CB 3.79Å; G470-L474 WeakPolarHBondContact O-CG 3.4Å; G470-L474 PolarHBondContact O-N 3.31Å; W471-L474 PolarHBondContact O-N 2.91Å; L474-L477 HydrophobicContact CD2-CD1 4.32Å; L474-L477 PolarHBondContact O-N 3.34Å; L474-I478 WeakPolarHBondContact O-CG1 3.31Å; L474-I478 PolarHBondContact O-N 3.09Å; L474-F733 HydrophobicContact CD1-CE1 3.89Å; L474-F733 HydrophobicContact CD1-CZ 4.41Å; L474-F734 HydrophobicContact CD1-CD1 3.81Å; L474-F734 HydrophobicContact CD1-CE1 3.79Å; L474-F737 HydrophobicContact CD1-CD2 4.16Å; L474-F737 HydrophobicContact CD1-CG 4.15Å; L474-F737 HydrophobicContact CD2-CD1 3.68Å; L474-F737 HydrophobicContact CD2-CE1 3.85Å; L474-F737 HydrophobicContact CD2-CG 4.13Å; L474-F737 HydrophobicContact CD2-CZ 4.41Å; L474-F737 HydrophobicContact CG-CD1 4.31Å; L474-F737 HydrophobicContact CG-CG 4.3Å
475	V	96.6	Very high	94	Very high	20 Å²	20	18.2 Å²	18.2	12%	0.121	10%	0.096	C	C	.	.	H	α-helix	trans	-62.9	-45.2	174.9	175.6	0	0	0	0	111.6	L440 I443 W471 M472 Q473 L477 I478 Y479 V494 L497	L440-V475 HydrophobicContact CD1-CG2 3.73Å; I443-V475 HydrophobicContact CD1-CG2 4.33Å; W471-V475 HydrophobicContact CE3-CG2 4.12Å; W471-V475 WeakPolarHBondContact O-CG2 3.16Å; W471-V475 PolarHBondContact O-N 3.42Å; M472-V475 PolarHBondContact O-N 3.33Å; Q473-V475 VanDerWaalsContact C-N 3.31Å; Q473-V475 PolarHBondContact O-N 3.26Å; V475-L477 VanDerWaalsContact C-N 3.3Å; V475-L477 PolarHBondContact O-N 2.65Å; V475-I478 PolarHBondContact O-N 3.14Å; V475-Y479 VanDerWaalsContact O-CB 3.28Å; V475-Y479 WeakPolarHBondContact O-CB 3.43Å; V475-Y479 PolarHBondContact O-N 3.47Å; V475-V494 HydrophobicContact CG1-CG2 4.46Å; V475-L497 HydrophobicContact CB-CD1 3.93Å; V475-L497 HydrophobicContact CG1-CD1 3.66Å
476	I	95.5	Very high	93.7	Very high	5 Å²	5	20.8 Å²	20.8	3%	0.026	12%	0.119	C	C	.	.	H	α-helix	trans	-61.4	-39.7	177.4	-70.2	164.9	0	0	0	111.2	M472 Q473 Y479 H480 V494 L497 V498 Y501 F745	M472-I476 WeakPolarHBondContact O-CD1 3.46Å; M472-I476 VanDerWaalsContact O-CG1 3.25Å; M472-I476 WeakPolarHBondContact O-CG1 3.45Å; M472-I476 PolarHBondContact O-N 2.96Å; Q473-I476 PolarHBondContact O-N 3.41Å; I476-Y479 WeakPolarHBondContact O-CB 3.22Å; I476-Y479 PolarHBondContact O-N 3.35Å; I476-H480 PolarHBondContact O-N 3.31Å; I476-H480 VanDerWaalsContact O-N 3.1Å; I476-H480 PolarHBondContact O-ND1 2.8Å; I476-V494 HydrophobicContact CG1-CG1 4.15Å; I476-L497 HydrophobicContact CD1-CB 4.35Å; I476-V498 HydrophobicContact CD1-CG2 4.34Å; I476-Y501 HydrophobicContact CD1-CD2 4.12Å; I476-Y501 HydrophobicContact CD1-CE2 3.85Å; I476-F745 HydrophobicContact CG2-CD2 4.2Å; I476-F745 HydrophobicContact CG2-CE2 4.01Å
477	L	94.7	Very high	93.6	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-65.3	-48.4	178.4	-72	172	0	0	0	112	Q473 L474 V475 Y479 H480 V481 L744 Q748 W752 F779	Q473-L477 HydrophobicContact CG-CD1 4.04Å; Q473-L477 HydrophobicContact CG-CG 4.36Å; Q473-L477 WeakPolarHBondContact O-CB 3.45Å; Q473-L477 WeakPolarHBondContact O-CG 3.36Å; Q473-L477 PolarHBondContact O-N 2.87Å; L474-L477 HydrophobicContact CD2-CD1 4.32Å; L474-L477 PolarHBondContact O-N 3.34Å; V475-L477 VanDerWaalsContact C-N 3.3Å; V475-L477 PolarHBondContact O-N 2.65Å; L477-Y479 VanDerWaalsContact C-N 3.27Å; L477-Y479 PolarHBondContact O-N 2.95Å; L477-H480 PolarHBondContact O-N 3.48Å; L477-V481 PolarHBondContact O-N 3.27Å; L477-V481 VanDerWaalsContact O-N 3.17Å; L477-L744 HydrophobicContact CD1-CB 4.21Å; L477-Q748 HydrophobicContact CD2-CB 3.67Å; L477-Q748 HydrophobicContact CD2-CG 4.19Å; L477-W752 HydrophobicContact CB-CZ3 3.76Å; L477-W752 HydrophobicContact CD2-CZ3 4.47Å; L477-W752 HydrophobicContact CG-CZ3 4.5Å; L477-F779 HydrophobicContact CD1-CE1 4.02Å; L477-F779 HydrophobicContact CD1-CZ 4.07Å; L477-F779 HydrophobicContact CD2-CZ 3.96Å
478	I	94.6	Very high	93.5	Very high	22 Å²	22	24 Å²	24	11%	0.113	14%	0.135	C	C	.	.	H	α-helix	trans	-59.6	-42	175.5	-66.4	163.8	0	0	0	110.1	F436 P439 I443 L474 V475 H480 V481 S482	F436-I478 HydrophobicContact CD2-CG2 3.85Å; F436-I478 HydrophobicContact CE2-CG2 4.16Å; P439-I478 HydrophobicContact CB-CD1 3.93Å; P439-I478 HydrophobicContact CB-CG1 4.23Å; P439-I478 HydrophobicContact CB-CG2 4.21Å; I443-I478 HydrophobicContact CD1-CD1 3.71Å; I443-I478 HydrophobicContact CG1-CD1 4.32Å; I443-I478 HydrophobicContact CG2-CD1 4.33Å; L474-I478 WeakPolarHBondContact O-CG1 3.31Å; L474-I478 PolarHBondContact O-N 3.09Å; V475-I478 PolarHBondContact O-N 3.14Å; I478-H480 PolarHBondContact O-N 2.98Å; I478-V481 PolarHBondContact O-N 3Å; I478-S482 WeakPolarHBondContact O-CB 3.22Å; I478-S482 PolarHBondContact O-N 3.29Å; I478-S482 PolarHBondContact O-OG 3.1Å
479	Y	94.5	Very high	93.4	Very high	17 Å²	17	24.3 Å²	24.3	7%	0.067	14%	0.138	C	C	.	.	H	α-helix	trans	-57.1	-44.5	177.3	162.8	-95.3	0	0	0	112.9	V475 I476 L477 S482 G483 A484 S485 V490 Y491 V494	V475-Y479 VanDerWaalsContact O-CB 3.28Å; V475-Y479 WeakPolarHBondContact O-CB 3.43Å; V475-Y479 PolarHBondContact O-N 3.47Å; I476-Y479 WeakPolarHBondContact O-CB 3.22Å; I476-Y479 PolarHBondContact O-N 3.35Å; L477-Y479 VanDerWaalsContact C-N 3.27Å; L477-Y479 PolarHBondContact O-N 2.95Å; Y479-S482 PolarHBondContact O-OG 3.04Å; Y479-G483 PolarHBondContact O-N 3.43Å; Y479-A484 HydrophobicContact CD2-CB 3.73Å; Y479-A484 HydrophobicContact CE2-CB 4.28Å; Y479-A484 PolarHBondContact O-N 3.45Å; Y479-S485 VanDerWaalsContact CE2-N 3.29Å; Y479-S485 WeakPolarHBondContact OH-CA 3.37Å; Y479-S485 WeakPolarHBondContact OH-CB 3.45Å; Y479-V490 HydrophobicContact CD2-CG1 3.89Å; Y479-V490 HydrophobicContact CE2-CG1 4.36Å; Y479-Y491 WeakPolarHBondContact OH-CD2 3.34Å; Y479-V494 HydrophobicContact CD1-CG1 3.87Å; Y479-V494 HydrophobicContact CD1-CG2 4.5Å; Y479-V494 HydrophobicContact CD2-CB 4.27Å; Y479-V494 HydrophobicContact CD2-CG1 4.38Å; Y479-V494 HydrophobicContact CD2-CG2 3.71Å; Y479-V494 HydrophobicContact CE1-CG1 4.06Å; Y479-V494 HydrophobicContact CE2-CB 4.39Å; Y479-V494 HydrophobicContact CE2-CG2 4.27Å; Y479-V494 HydrophobicContact CG-CB 4.38Å; Y479-V494 HydrophobicContact CG-CG1 4.04Å; Y479-V494 HydrophobicContact CG-CG2 3.83Å
480	H	93.3	Very high	93.3	Very high	38 Å²	38	22.3 Å²	22.3	18%	0.176	13%	0.13	C	C	.	.	H	α-helix	trans	-73.1	-37.2	-179	-70.1	143.5	0	0	0	113.9	K429 I476 L477 I478 Q748 L753	K429-H480 WeakPolarHBondContact CE-O 3.24Å; K429-H480 PolarHBondContact NZ-O 3.49Å; I476-H480 PolarHBondContact O-N 3.31Å; I476-H480 VanDerWaalsContact O-N 3.1Å; I476-H480 PolarHBondContact O-ND1 2.8Å; L477-H480 PolarHBondContact O-N 3.48Å; I478-H480 PolarHBondContact O-N 2.98Å; H480-Q748 PolarHBondContact ND1-OE1 3.32Å; H480-L753 HydrophobicContact CB-CD1 4.29Å
481	V	91.1	Very high	93.2	Very high	24 Å²	24	23.3 Å²	23.3	15%	0.145	13%	0.134	C	C	.	.	H	α-helix	trans	-69.8	-46.1	177.9	162.1	0	0	0	0	111.4	L477 I478 G483 W752 L753 I760	L477-V481 PolarHBondContact O-N 3.27Å; L477-V481 VanDerWaalsContact O-N 3.17Å; I478-V481 PolarHBondContact O-N 3Å; V481-G483 PolarHBondContact O-N 3.49Å; V481-W752 HydrophobicContact CG2-CB 3.77Å; V481-W752 HydrophobicContact CG2-CD2 3.91Å; V481-W752 HydrophobicContact CG2-CE3 3.39Å; V481-W752 HydrophobicContact CG2-CG 4.1Å; V481-W752 HydrophobicContact CG2-CZ3 4.1Å; V481-L753 HydrophobicContact CG2-CD2 4.13Å; V481-I760 WeakPolarHBondContact O-CD1 3.43Å
482	S	91	Very high	93.2	Very high	9 Å²	9	20.8 Å²	20.8	6%	0.063	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-7.8	-179.5	58.5	0	0	0	0	114.3	Y431 F436 I478 Y479 A484	Y431-S482 VanDerWaalsContact CA-O 3.31Å; Y431-S482 WeakPolarHBondContact CA-O 3.11Å; F436-S482 WeakPolarHBondContact CD2-OG 3.34Å; I478-S482 WeakPolarHBondContact O-CB 3.22Å; I478-S482 PolarHBondContact O-N 3.29Å; I478-S482 PolarHBondContact O-OG 3.1Å; Y479-S482 PolarHBondContact O-OG 3.04Å; S482-A484 PolarHBondContact O-N 3.14Å
483	G	89.8	Confident	93.1	Very high	13 Å²	13	23.6 Å²	23.6	13%	0.134	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.6	20.1	-176.9	0	0	0	0	0	113.9	Y479 V481 S485 A486	Y479-G483 PolarHBondContact O-N 3.43Å; V481-G483 PolarHBondContact O-N 3.49Å; G483-S485 PolarHBondContact O-N 3.3Å; G483-A486 PolarHBondContact O-N 2.92Å
484	A	92.3	Very high	93	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-61.5	-4.1	-174.6	0	0	0	0	0	115.2	Y431 F436 Y479 S482 A486 F487 V490	Y431-A484 HydrophobicContact CD2-CB 3.72Å; Y431-A484 HydrophobicContact CE2-CB 3.52Å; F436-A484 HydrophobicContact CD2-CB 3.7Å; F436-A484 HydrophobicContact CE2-CB 4.09Å; F436-A484 HydrophobicContact CG-CB 4.18Å; Y479-A484 HydrophobicContact CD2-CB 3.73Å; Y479-A484 HydrophobicContact CE2-CB 4.28Å; Y479-A484 PolarHBondContact O-N 3.45Å; S482-A484 PolarHBondContact O-N 3.14Å; A484-A486 PolarHBondContact O-N 3.06Å; A484-A486 VanDerWaalsContact O-N 3.16Å; A484-F487 PolarHBondContact O-N 3.18Å; A484-V490 HydrophobicContact CB-CG1 3.92Å
485	S	89.6	Confident	93	Very high	49 Å²	49	23.3 Å²	23.3	34%	0.343	14%	0.136	S	C	.	.	G	3₁₀ helix	trans	-56.6	-22.7	167.2	80	0	0	0	0	113.9	Y479 G483 F487 K698	Y479-S485 VanDerWaalsContact CE2-N 3.29Å; Y479-S485 WeakPolarHBondContact OH-CA 3.37Å; Y479-S485 WeakPolarHBondContact OH-CB 3.45Å; G483-S485 PolarHBondContact O-N 3.3Å; S485-F487 VanDerWaalsContact C-N 3.26Å; S485-F487 PolarHBondContact O-N 3.36Å; S485-K698 WeakPolarHBondContact O-CE 3.49Å; S485-K698 PolarHBondContact O-NZ 2.63Å
486	A	87.1	Confident	92.9	Very high	70 Å²	70	22.8 Å²	22.8	58%	0.579	13%	0.133	S	C	*	.	G	3₁₀ helix	trans	-66.7	-29.1	175	0	0	0	0	0	112.3	G483 A484	G483-A486 PolarHBondContact O-N 2.92Å; A484-A486 PolarHBondContact O-N 3.06Å; A484-A486 VanDerWaalsContact O-N 3.16Å
487	F	91.1	Very high	93	Very high	69 Å²	69	23.6 Å²	23.6	30%	0.303	14%	0.137	S	C	.	.	S	Bend	trans	-95.5	106.9	179.8	-173.6	-123.8	0	0	0	110.8	Y431 A484 S485 P489 V490 Y491	Y431-F487 HydrophobicContact CD1-CB 4.46Å; Y431-F487 HydrophobicContact CE1-CB 3.73Å; Y431-F487 HydrophobicContact CE1-CG 4.27Å; Y431-F487 WeakPolarHBondContact OH-CD1 3.46Å; A484-F487 PolarHBondContact O-N 3.18Å; S485-F487 VanDerWaalsContact C-N 3.26Å; S485-F487 PolarHBondContact O-N 3.36Å; F487-P489 VanDerWaalsContact C-CD 3.49Å; F487-P489 HydrophobicContact CD1-CG 4.49Å; F487-P489 HydrophobicContact CD2-CG 4.45Å; F487-P489 HydrophobicContact CE1-CB 3.94Å; F487-P489 HydrophobicContact CE1-CG 3.93Å; F487-P489 HydrophobicContact CE2-CG 3.9Å; F487-P489 HydrophobicContact CZ-CB 4.08Å; F487-P489 HydrophobicContact CZ-CG 3.6Å; F487-V490 HydrophobicContact CD1-CB 3.89Å; F487-V490 HydrophobicContact CD1-CG2 3.5Å; F487-V490 HydrophobicContact CE1-CG2 3.9Å; F487-V490 PolarHBondContact O-N 3.31Å; F487-Y491 PolarHBondContact O-N 3.39Å
488	V	91.7	Very high	93	Very high	26 Å²	26	23.9 Å²	23.9	16%	0.158	14%	0.139	C	C	.	.	H	α-helix	trans	-54.6	-43.8	-172.2	179.8	0	0	0	0	113.8	V490 Y491 M492 C695 K698	V488-V490 PolarHBondContact O-N 3.37Å; V488-Y491 WeakPolarHBondContact O-CB 3.27Å; V488-Y491 PolarHBondContact O-N 3.14Å; V488-M492 HydrophobicContact CG1-CG 4.31Å; V488-M492 WeakPolarHBondContact O-CG 3.42Å; V488-M492 PolarHBondContact O-N 2.89Å; V488-C695 HydrophobicContact CG1-CB 4.05Å; V488-K698 HydrophobicContact CG2-CG 4.24Å
489	P	92.8	Very high	93.1	Very high	18 Å²	18	22.8 Å²	22.8	12%	0.117	13%	0.133	C	C	.	.	H	α-helix	trans	-62.2	-41.8	-178	-24.5	36.2	0	0	0	112.7	F487 M492 H493	F487-P489 VanDerWaalsContact C-CD 3.49Å; F487-P489 HydrophobicContact CD1-CG 4.49Å; F487-P489 HydrophobicContact CD2-CG 4.45Å; F487-P489 HydrophobicContact CE1-CB 3.94Å; F487-P489 HydrophobicContact CE1-CG 3.93Å; F487-P489 HydrophobicContact CE2-CG 3.9Å; F487-P489 HydrophobicContact CZ-CB 4.08Å; F487-P489 HydrophobicContact CZ-CG 3.6Å; P489-M492 PolarHBondContact O-N 2.92Å; P489-H493 PolarHBondContact O-N 3.19Å; P489-H493 PolarHBondContact O-ND1 3.33Å
490	V	93.6	Very high	93.2	Very high	13 Å²	13	22.1 Å²	22.1	8%	0.079	13%	0.131	C	C	.	.	H	α-helix	trans	-67.6	-41.8	175.3	166.9	0	0	0	0	111	F436 F437 Y479 A484 F487 V488 M492 H493 V494	F436-V490 HydrophobicContact CD1-CG2 4.23Å; F436-V490 HydrophobicContact CE1-CB 4.46Å; F436-V490 HydrophobicContact CE1-CG1 3.85Å; F436-V490 HydrophobicContact CE1-CG2 3.68Å; F436-V490 HydrophobicContact CE2-CG1 3.9Å; F436-V490 HydrophobicContact CZ-CG1 3.46Å; F436-V490 VanDerWaalsContact CZ-CG1 3.46Å; F436-V490 HydrophobicContact CZ-CG2 4.17Å; F437-V490 HydrophobicContact CZ-CG2 4.41Å; Y479-V490 HydrophobicContact CD2-CG1 3.89Å; Y479-V490 HydrophobicContact CE2-CG1 4.36Å; A484-V490 HydrophobicContact CB-CG1 3.92Å; F487-V490 HydrophobicContact CD1-CB 3.89Å; F487-V490 HydrophobicContact CD1-CG2 3.5Å; F487-V490 HydrophobicContact CE1-CG2 3.9Å; F487-V490 PolarHBondContact O-N 3.31Å; V488-V490 PolarHBondContact O-N 3.37Å; V490-M492 VanDerWaalsContact C-N 3.3Å; V490-M492 PolarHBondContact O-N 3.39Å; V490-H493 PolarHBondContact O-N 3.01Å; V490-V494 HydrophobicContact CG1-CG2 4.29Å; V490-V494 WeakPolarHBondContact O-CG2 3.27Å; V490-V494 PolarHBondContact O-N 3.48Å
491	Y	94.3	Very high	93.3	Very high	21 Å²	21	20.9 Å²	20.9	8%	0.082	13%	0.125	C	C	.	.	H	α-helix	trans	-52.8	-48.6	173.9	167.5	-87.5	0	0	0	111.2	Y479 F487 V488 H493 V494 R495 N702	Y479-Y491 WeakPolarHBondContact OH-CD2 3.34Å; F487-Y491 PolarHBondContact O-N 3.39Å; V488-Y491 WeakPolarHBondContact O-CB 3.27Å; V488-Y491 PolarHBondContact O-N 3.14Å; Y491-H493 PolarHBondContact O-N 3.3Å; Y491-V494 PolarHBondContact O-N 3.27Å; Y491-R495 HydrophobicContact CD1-CG 4.19Å; Y491-R495 HydrophobicContact CE1-CG 3.75Å; Y491-R495 HydrophobicContact CE2-CG 4.19Å; Y491-R495 VanDerWaalsContact O-CG 3.31Å; Y491-R495 WeakPolarHBondContact O-CG 3.27Å; Y491-R495 PolarHBondContact O-N 3.45Å; Y491-N702 VanDerWaalsContact CE1-OD1 3.29Å; Y491-N702 WeakPolarHBondContact CE1-OD1 3.46Å; Y491-N702 PolarHBondContact OH-ND2 3.43Å; Y491-N702 PolarHBondContact OH-OD1 3.38Å
492	M	94.1	Very high	93.6	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.6	-42.3	-179.2	-67.3	-52.3	-61.1	0	0	113.1	V488 P489 V490 V494 R495 V496 Y688 W691 A692 C701 H705	V488-M492 HydrophobicContact CG1-CG 4.31Å; V488-M492 WeakPolarHBondContact O-CG 3.42Å; V488-M492 PolarHBondContact O-N 2.89Å; P489-M492 PolarHBondContact O-N 2.92Å; V490-M492 VanDerWaalsContact C-N 3.3Å; V490-M492 PolarHBondContact O-N 3.39Å; M492-V494 PolarHBondContact O-N 2.96Å; M492-R495 WeakPolarHBondContact O-CB 3.34Å; M492-R495 PolarHBondContact O-N 2.9Å; M492-V496 PolarHBondContact O-N 3.4Å; M492-V496 VanDerWaalsContact O-N 3.14Å; M492-Y688 PolarHBondContact O-OH 3.03Å; M492-W691 HydrophobicContact CE-CH2 3.75Å; M492-W691 HydrophobicContact CE-CZ3 3.84Å; M492-A692 HydrophobicContact CB-CB 3.98Å; M492-C701 HydrophobicContact CE-CB 3.75Å; M492-C701 WeakPolarHBondContact CE-O 3.46Å; M492-C701 HydrophobicContact CG-CB 4.22Å; M492-C701 HydrophobicContact SD-CB 3.48Å; M492-C701 WeakPolarHBondContact SD-CB 3.46Å; M492-H705 HydrophobicContact CE-CB 4.02Å
493	H	94.8	Very high	93.9	Very high	59 Å²	59	19.4 Å²	19.4	27%	0.273	12%	0.115	S	C	.	.	H	α-helix	trans	-62.9	-43.8	175.8	-74.1	82.1	0	0	0	111.9	P489 V490 Y491 R495 V496 L497 S689	P489-H493 PolarHBondContact O-N 3.19Å; P489-H493 PolarHBondContact O-ND1 3.33Å; V490-H493 PolarHBondContact O-N 3.01Å; Y491-H493 PolarHBondContact O-N 3.3Å; H493-R495 VanDerWaalsContact C-N 3.27Å; H493-R495 PolarHBondContact O-N 3.48Å; H493-V496 WeakPolarHBondContact O-CB 3.38Å; H493-V496 PolarHBondContact O-N 2.98Å; H493-V496 VanDerWaalsContact O-N 3.1Å; H493-L497 WeakPolarHBondContact O-CG 3.22Å; H493-L497 PolarHBondContact O-N 2.93Å; H493-L497 VanDerWaalsContact O-N 3.14Å; H493-S689 PolarHBondContact NE2-OG 3.34Å
494	V	95.4	Very high	94.2	Very high	7 Å²	7	19.4 Å²	19.4	4%	0.042	11%	0.112	C	C	.	.	H	α-helix	trans	-62.7	-35.8	176.3	172.2	0	0	0	0	111.4	V475 I476 Y479 V490 Y491 M492 V496 L497 V498	V475-V494 HydrophobicContact CG1-CG2 4.46Å; I476-V494 HydrophobicContact CG1-CG1 4.15Å; Y479-V494 HydrophobicContact CD1-CG1 3.87Å; Y479-V494 HydrophobicContact CD1-CG2 4.5Å; Y479-V494 HydrophobicContact CD2-CB 4.27Å; Y479-V494 HydrophobicContact CD2-CG1 4.38Å; Y479-V494 HydrophobicContact CD2-CG2 3.71Å; Y479-V494 HydrophobicContact CE1-CG1 4.06Å; Y479-V494 HydrophobicContact CE2-CB 4.39Å; Y479-V494 HydrophobicContact CE2-CG2 4.27Å; Y479-V494 HydrophobicContact CG-CB 4.38Å; Y479-V494 HydrophobicContact CG-CG1 4.04Å; Y479-V494 HydrophobicContact CG-CG2 3.83Å; V490-V494 HydrophobicContact CG1-CG2 4.29Å; V490-V494 WeakPolarHBondContact O-CG2 3.27Å; V490-V494 PolarHBondContact O-N 3.48Å; Y491-V494 PolarHBondContact O-N 3.27Å; M492-V494 PolarHBondContact O-N 2.96Å; V494-V496 VanDerWaalsContact C-N 3.32Å; V494-V496 PolarHBondContact O-N 3.33Å; V494-L497 WeakPolarHBondContact O-CB 3.42Å; V494-L497 PolarHBondContact O-N 3.41Å; V494-L497 VanDerWaalsContact O-N 3.09Å; V494-V498 PolarHBondContact O-N 2.99Å
495	R	94.2	Very high	94.3	Very high	8 Å²	8	20.3 Å²	20.3	3%	0.03	12%	0.118	C	C	.	.	H	α-helix	trans	-61.1	-39.2	172.8	-69.8	-59.4	-56.4	158.7	10.1	112.3	Y491 M492 H493 L497 V498 A499 D637 H705	Y491-R495 HydrophobicContact CD1-CG 4.19Å; Y491-R495 HydrophobicContact CE1-CG 3.75Å; Y491-R495 HydrophobicContact CE2-CG 4.19Å; Y491-R495 VanDerWaalsContact O-CG 3.31Å; Y491-R495 WeakPolarHBondContact O-CG 3.27Å; Y491-R495 PolarHBondContact O-N 3.45Å; M492-R495 WeakPolarHBondContact O-CB 3.34Å; M492-R495 PolarHBondContact O-N 2.9Å; H493-R495 VanDerWaalsContact C-N 3.27Å; H493-R495 PolarHBondContact O-N 3.48Å; R495-L497 VanDerWaalsContact C-N 3.31Å; R495-L497 PolarHBondContact O-N 3.5Å; R495-V498 PolarHBondContact O-N 3.43Å; R495-A499 PolarHBondContact O-N 3.25Å; R495-D637 IonicContact CZ-OD1 2.62Å; R495-D637 IonicContact CZ-OD2 2.7Å; R495-D637 IonicContact NH1-OD2 3.92Å; R495-D637 IonicContact NH2-OD1 3.5Å; R495-D637 PolarHBondContact NH2-OD1 3.29Å; R495-D637 IonicContact NH2-OD2 3.69Å; R495-D637 PolarHBondContact NH2-OD2 3.44Å; R495-H705 PolarHBondContact O-CE1 3.31Å
496	V	95.9	Very high	94.6	Very high	9 Å²	9	18 Å²	18	6%	0.055	10%	0.101	C	C	.	.	H	α-helix	trans	-62.9	-37.6	172.3	176	0	0	0	0	111.6	M492 H493 V494 V498 A499 A500 Y688 Q712 I713	M492-V496 PolarHBondContact O-N 3.4Å; M492-V496 VanDerWaalsContact O-N 3.14Å; H493-V496 WeakPolarHBondContact O-CB 3.38Å; H493-V496 PolarHBondContact O-N 2.98Å; H493-V496 VanDerWaalsContact O-N 3.1Å; V494-V496 VanDerWaalsContact C-N 3.32Å; V494-V496 PolarHBondContact O-N 3.33Å; V496-V498 VanDerWaalsContact C-N 3.35Å; V496-V498 PolarHBondContact O-N 3.28Å; V496-A499 PolarHBondContact O-N 3.03Å; V496-A500 WeakPolarHBondContact O-CB 3.28Å; V496-A500 PolarHBondContact O-N 3.24Å; V496-Y688 HydrophobicContact CG2-CE1 3.89Å; V496-Y688 HydrophobicContact CG2-CE2 4.13Å; V496-Y688 VanDerWaalsContact CG2-CZ 3.44Å; V496-Y688 WeakPolarHBondContact CG2-OH 3.25Å; V496-Q712 HydrophobicContact CG1-CB 3.91Å; V496-Q712 HydrophobicContact CG1-CG 3.78Å; V496-I713 HydrophobicContact CG1-CG1 4.17Å
497	L	96.4	Very high	95.1	Very high	22 Å²	22	15.9 Å²	15.9	12%	0.115	8%	0.079	C	C	.	.	H	α-helix	trans	-63.8	-39.9	176	-53.3	-172.6	0	0	0	112	W471 M472 V475 I476 H493 V494 R495 A500 Y501	W471-L497 HydrophobicContact CH2-CD2 3.53Å; W471-L497 HydrophobicContact CZ3-CD1 4.03Å; W471-L497 HydrophobicContact CZ3-CD2 3.68Å; M472-L497 HydrophobicContact CB-CB 4.47Å; M472-L497 HydrophobicContact CG-CB 4.29Å; M472-L497 HydrophobicContact CG-CD1 4.46Å; M472-L497 HydrophobicContact CG-CD2 4.03Å; M472-L497 HydrophobicContact CG-CG 4.48Å; M472-L497 HydrophobicContact SD-CB 4.18Å; M472-L497 HydrophobicContact SD-CD2 4.21Å; V475-L497 HydrophobicContact CB-CD1 3.93Å; V475-L497 HydrophobicContact CG1-CD1 3.66Å; I476-L497 HydrophobicContact CD1-CB 4.35Å; H493-L497 WeakPolarHBondContact O-CG 3.22Å; H493-L497 PolarHBondContact O-N 2.93Å; H493-L497 VanDerWaalsContact O-N 3.14Å; V494-L497 WeakPolarHBondContact O-CB 3.42Å; V494-L497 PolarHBondContact O-N 3.41Å; V494-L497 VanDerWaalsContact O-N 3.09Å; R495-L497 VanDerWaalsContact C-N 3.31Å; R495-L497 PolarHBondContact O-N 3.5Å; L497-A500 WeakPolarHBondContact O-CB 3.35Å; L497-A500 PolarHBondContact O-N 2.9Å; L497-Y501 WeakPolarHBondContact O-CD2 3.33Å; L497-Y501 PolarHBondContact O-N 3.43Å
498	V	95.5	Very high	95.2	Very high	7 Å²	7	14.2 Å²	14.2	4%	0.042	8%	0.081	C	C	.	.	H	α-helix	trans	-64.3	-43.2	174.2	177.7	0	0	0	0	111	I476 V494 R495 V496 A500 Y501 L502 F551	I476-V498 HydrophobicContact CD1-CG2 4.34Å; V494-V498 PolarHBondContact O-N 2.99Å; R495-V498 PolarHBondContact O-N 3.43Å; V496-V498 VanDerWaalsContact C-N 3.35Å; V496-V498 PolarHBondContact O-N 3.28Å; V498-A500 VanDerWaalsContact C-N 3.3Å; V498-A500 PolarHBondContact O-N 2.95Å; V498-Y501 WeakPolarHBondContact O-CB 3.33Å; V498-Y501 PolarHBondContact O-N 3.35Å; V498-L502 PolarHBondContact O-N 2.87Å; V498-F551 HydrophobicContact CG1-CE2 4.45Å
499	A	96.5	Very high	95.3	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-62.2	-37.8	173.9	0	0	0	0	0	111.9	R495 V496 Y501 L502 F503 A640 I713	R495-A499 PolarHBondContact O-N 3.25Å; V496-A499 PolarHBondContact O-N 3.03Å; A499-Y501 VanDerWaalsContact C-N 3.35Å; A499-Y501 PolarHBondContact O-N 3.32Å; A499-L502 PolarHBondContact O-N 2.82Å; A499-F503 WeakPolarHBondContact O-CB 3.34Å; A499-F503 PolarHBondContact O-N 3.5Å; A499-A640 HydrophobicContact CB-CB 4.14Å; A499-I713 HydrophobicContact CB-CD1 4.06Å
500	A	96.8	Very high	95.5	Very high	2 Å²	2	14 Å²	14	2%	0.017	8%	0.077	C	C	.	.	H	α-helix	trans	-62.5	-38.2	175.3	0	0	0	0	0	112.6	W468 M472 V496 L497 V498 F503 Q504 I713	W468-A500 HydrophobicContact CH2-CB 4.47Å; W468-A500 HydrophobicContact CZ2-CB 3.68Å; M472-A500 HydrophobicContact CE-CB 4.33Å; M472-A500 HydrophobicContact SD-CB 3.65Å; V496-A500 WeakPolarHBondContact O-CB 3.28Å; V496-A500 PolarHBondContact O-N 3.24Å; L497-A500 WeakPolarHBondContact O-CB 3.35Å; L497-A500 PolarHBondContact O-N 2.9Å; V498-A500 VanDerWaalsContact C-N 3.3Å; V498-A500 PolarHBondContact O-N 2.95Å; A500-F503 WeakPolarHBondContact O-CB 3.41Å; A500-F503 PolarHBondContact O-N 3.44Å; A500-Q504 WeakPolarHBondContact O-CG 3.31Å; A500-Q504 PolarHBondContact O-N 2.75Å; A500-I713 HydrophobicContact CB-CD1 4.31Å; A500-I713 HydrophobicContact CB-CG1 4.09Å
501	Y	95.8	Very high	95.4	Very high	12 Å²	12	14 Å²	14	5%	0.047	8%	0.078	C	C	.	.	H	α-helix	trans	-60.1	-43.9	172.1	-97.2	-72.4	0	0	0	112.9	K469 M472 Q473 I476 L497 V498 A499 Q504 T505 F551	K469-Y501 HydrophobicContact CB-CE1 4Å; K469-Y501 HydrophobicContact CD-CE1 4.32Å; K469-Y501 HydrophobicContact CG-CD1 4.36Å; K469-Y501 HydrophobicContact CG-CE1 3.69Å; K469-Y501 PolarHBondContact O-OH 3.43Å; M472-Y501 HydrophobicContact CB-CD2 4.41Å; M472-Y501 HydrophobicContact CB-CE2 3.69Å; M472-Y501 HydrophobicContact CE-CD2 3.98Å; M472-Y501 HydrophobicContact CE-CE2 3.97Å; M472-Y501 HydrophobicContact CE-CG 4.3Å; M472-Y501 HydrophobicContact SD-CD2 4.41Å; Q473-Y501 WeakPolarHBondContact CB-OH 3.44Å; Q473-Y501 PolarHBondContact OE1-OH 2.87Å; I476-Y501 HydrophobicContact CD1-CD2 4.12Å; I476-Y501 HydrophobicContact CD1-CE2 3.85Å; L497-Y501 WeakPolarHBondContact O-CD2 3.33Å; L497-Y501 PolarHBondContact O-N 3.43Å; V498-Y501 WeakPolarHBondContact O-CB 3.33Å; V498-Y501 PolarHBondContact O-N 3.35Å; A499-Y501 VanDerWaalsContact C-N 3.35Å; A499-Y501 PolarHBondContact O-N 3.32Å; Y501-Q504 PolarHBondContact O-N 2.61Å; Y501-T505 PolarHBondContact O-N 3.42Å; Y501-T505 PolarHBondContact O-OG1 2.9Å; Y501-F551 HydrophobicContact CD1-CZ 4.26Å; Y501-F551 HydrophobicContact CG-CZ 4.13Å
502	L	96.4	Very high	95.3	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-69.4	-38.3	176.7	-66.8	178.1	0	0	0	111.6	V498 A499 Q504 T505 G506 L554 V555 D637 A640 V641	V498-L502 PolarHBondContact O-N 2.87Å; A499-L502 PolarHBondContact O-N 2.82Å; L502-Q504 PolarHBondContact O-N 2.96Å; L502-T505 VanDerWaalsContact O-CB 3.32Å; L502-T505 WeakPolarHBondContact O-CB 3.37Å; L502-T505 PolarHBondContact O-N 3.11Å; L502-T505 VanDerWaalsContact O-N 3.17Å; L502-G506 PolarHBondContact O-N 3.15Å; L502-L554 HydrophobicContact CD1-CD2 3.93Å; L502-L554 HydrophobicContact CD1-CG 4.36Å; L502-L554 HydrophobicContact CD2-CG 4.41Å; L502-V555 HydrophobicContact CD2-CG2 3.83Å; L502-D637 HydrophobicContact CD1-CB 3.47Å; L502-D637 VanDerWaalsContact CD1-CB 3.47Å; L502-A640 HydrophobicContact CB-CB 3.98Å; L502-V641 HydrophobicContact CB-CG2 3.85Å
503	F	97.5	Very high	95.2	Very high	2 Å²	2	14.7 Å²	14.7	1%	0.009	8%	0.081	C	C	.	.	H	α-helix	trans	-58.3	-47.2	171.7	177.3	-81.6	0	0	0	111.4	W468 A499 A500 T505 G506 Y507 A640 H643 G644 F647 I713 L714 I717	W468-F503 HydrophobicContact CH2-CD1 4.36Å; A499-F503 WeakPolarHBondContact O-CB 3.34Å; A499-F503 PolarHBondContact O-N 3.5Å; A500-F503 WeakPolarHBondContact O-CB 3.41Å; A500-F503 PolarHBondContact O-N 3.44Å; F503-T505 VanDerWaalsContact C-N 3.27Å; F503-T505 PolarHBondContact O-N 3.22Å; F503-G506 PolarHBondContact O-N 2.8Å; F503-Y507 WeakPolarHBondContact O-CB 3.36Å; F503-Y507 PolarHBondContact O-N 3.11Å; F503-A640 WeakPolarHBondContact CA-O 3.49Å; F503-H643 HydrophobicContact CD2-CB 4.05Å; F503-H643 HydrophobicContact CE2-CB 4.18Å; F503-G644 VanDerWaalsContact CD2-CA 3.44Å; F503-G644 VanDerWaalsContact CD2-N 3.31Å; F503-G644 VanDerWaalsContact CE2-CA 3.47Å; F503-F647 HydrophobicContact CE1-CD1 4.18Å; F503-F647 HydrophobicContact CE1-CG 4.45Å; F503-F647 HydrophobicContact CE2-CB 3.94Å; F503-F647 HydrophobicContact CE2-CG 4.41Å; F503-F647 HydrophobicContact CZ-CB 3.54Å; F503-F647 AromaticContact CZ-CD1 3.76Å; F503-F647 HydrophobicContact CZ-CD1 3.76Å; F503-F647 HydrophobicContact CZ-CD2 4.29Å; F503-F647 AromaticContact CZ-CG 3.59Å; F503-F647 HydrophobicContact CZ-CG 3.59Å; F503-I713 HydrophobicContact CB-CD1 4.19Å; F503-I713 HydrophobicContact CB-CG2 4.34Å; F503-I713 HydrophobicContact CD1-CG2 3.86Å; F503-I713 HydrophobicContact CD2-CG2 3.99Å; F503-I713 HydrophobicContact CE1-CG2 4.11Å; F503-I713 HydrophobicContact CE2-CG2 4.2Å; F503-I713 HydrophobicContact CG-CG2 3.8Å; F503-I713 HydrophobicContact CZ-CG2 4.26Å; F503-L714 HydrophobicContact CE2-CD2 4.48Å; F503-L714 HydrophobicContact CZ-CD2 4.38Å; F503-I717 HydrophobicContact CD1-CD1 4.46Å; F503-I717 HydrophobicContact CE1-CD1 3.54Å; F503-I717 HydrophobicContact CZ-CD1 3.76Å
504	Q	95.9	Very high	95.1	Very high	13 Å²	13	12.1 Å²	12.1	6%	0.061	7%	0.069	C	C	.	.	H	α-helix	trans	-61.6	-35.6	175.5	-75.5	-177.9	-11.8	0	0	112.4	W468 A500 Y501 L502 Y507 G508	W468-Q504 HydrophobicContact CE3-CG 4Å; W468-Q504 VanDerWaalsContact CG-NE2 3.31Å; W468-Q504 HydrophobicContact CH2-CG 4.21Å; W468-Q504 HydrophobicContact CZ3-CG 3.78Å; A500-Q504 WeakPolarHBondContact O-CG 3.31Å; A500-Q504 PolarHBondContact O-N 2.75Å; Y501-Q504 PolarHBondContact O-N 2.61Å; L502-Q504 PolarHBondContact O-N 2.96Å; Q504-Y507 PolarHBondContact O-N 3.21Å; Q504-G508 PolarHBondContact O-N 3.35Å
505	T	95.3	Very high	94.8	Very high	20 Å²	20	15.8 Å²	15.8	12%	0.123	9%	0.088	C	C	.	.	H	α-helix	trans	-61.9	-48.3	174.3	-58.5	0	0	0	0	110.3	Y501 L502 F503 H509 V555 I562	Y501-T505 PolarHBondContact O-N 3.42Å; Y501-T505 PolarHBondContact O-OG1 2.9Å; L502-T505 VanDerWaalsContact O-CB 3.32Å; L502-T505 WeakPolarHBondContact O-CB 3.37Å; L502-T505 PolarHBondContact O-N 3.11Å; L502-T505 VanDerWaalsContact O-N 3.17Å; F503-T505 VanDerWaalsContact C-N 3.27Å; F503-T505 PolarHBondContact O-N 3.22Å; T505-H509 WeakPolarHBondContact O-CB 3.31Å; T505-H509 PolarHBondContact O-CD2 2.95Å; T505-H509 VanDerWaalsContact O-CD2 3.24Å; T505-H509 PolarHBondContact O-N 3.16Å; T505-H509 VanDerWaalsContact O-N 3.12Å; T505-V555 HydrophobicContact CG2-CG1 4.21Å; T505-I562 HydrophobicContact CG2-CD1 4.24Å
506	G	96.4	Very high	94.5	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-57.7	-51.3	173.2	0	0	0	0	0	112.7	L502 F503 F510	L502-G506 PolarHBondContact O-N 3.15Å; F503-G506 PolarHBondContact O-N 2.8Å; G506-F510 WeakPolarHBondContact O-CB 3.33Å; G506-F510 PolarHBondContact O-N 3.2Å
507	Y	96.3	Very high	94	Very high	25 Å²	25	23.2 Å²	23.2	10%	0.098	13%	0.126	C	C	.	.	H	α-helix	trans	-59.8	-51.8	-179.9	168.7	-98	0	0	0	112.4	L460 F503 Q504 S511 G644 F647 A648 Y651	L460-Y507 HydrophobicContact CB-CE1 4.15Å; L460-Y507 HydrophobicContact CD1-CE1 4.22Å; L460-Y507 HydrophobicContact CD1-CE2 4.25Å; F503-Y507 WeakPolarHBondContact O-CB 3.36Å; F503-Y507 PolarHBondContact O-N 3.11Å; Q504-Y507 PolarHBondContact O-N 3.21Å; Y507-S511 VanDerWaalsContact O-CB 3.23Å; Y507-S511 WeakPolarHBondContact O-CB 3.34Å; Y507-S511 PolarHBondContact O-N 2.92Å; Y507-S511 PolarHBondContact O-OG 3.18Å; Y507-G644 WeakPolarHBondContact CA-O 3.08Å; Y507-F647 AromaticContact CD2-CD1 3.85Å; Y507-F647 HydrophobicContact CD2-CD1 3.85Å; Y507-F647 HydrophobicContact CD2-CE1 4.28Å; Y507-F647 HydrophobicContact CE2-CD1 4.18Å; Y507-F647 HydrophobicContact CE2-CE1 4.2Å; Y507-A648 HydrophobicContact CD2-CB 3.6Å; Y507-A648 HydrophobicContact CE2-CB 4.18Å; Y507-A648 HydrophobicContact CG-CB 4.39Å; Y507-Y651 HydrophobicContact CE2-CD1 4.18Å
508	G	94	Very high	93.4	Very high	35 Å²	35	25.6 Å²	25.6	36%	0.361	14%	0.139	S	C	.	.	H	α-helix	trans	-68.3	-45.9	-173.6	0	0	0	0	0	113.1	Q504 F512	Q504-G508 PolarHBondContact O-N 3.35Å; G508-F512 WeakPolarHBondContact O-CB 3.19Å; G508-F512 PolarHBondContact O-N 3.05Å
509	H	94.2	Very high	92.9	Very high	38 Å²	38	26.5 Å²	26.5	18%	0.176	14%	0.142	C	C	.	.	H	α-helix	trans	-72.8	-38.8	-180	-71.4	-63.5	0	0	0	112.4	T505 F512 F513 F559 I562	T505-H509 WeakPolarHBondContact O-CB 3.31Å; T505-H509 PolarHBondContact O-CD2 2.95Å; T505-H509 VanDerWaalsContact O-CD2 3.24Å; T505-H509 PolarHBondContact O-N 3.16Å; T505-H509 VanDerWaalsContact O-N 3.12Å; H509-F512 PolarHBondContact O-N 3.38Å; H509-F513 HydrophobicContact CB-CE2 4.24Å; H509-F513 WeakPolarHBondContact O-CD2 3.33Å; H509-F513 PolarHBondContact O-N 2.89Å; H509-F559 AromaticContact CD2-CD2 3.75Å; H509-F559 AromaticContact CE1-CD2 3.59Å; H509-F559 AromaticContact CE1-CE2 3.61Å; H509-F559 AromaticContact CG-CD2 3.8Å; H509-F559 AromaticContact ND1-CD2 3.71Å; H509-F559 AromaticContact ND1-CE2 3.56Å; H509-F559 AromaticContact NE2-CD2 3.63Å; H509-I562 HydrophobicContact CB-CD1 4.32Å; H509-I562 HydrophobicContact CB-CG2 3.97Å
510	F	95.6	Very high	92.4	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60	-49.6	173.1	-178.9	-87	0	0	0	111.2	G506 F512 F513 W514 M566 I587 M645 A648 F649	G506-F510 WeakPolarHBondContact O-CB 3.33Å; G506-F510 PolarHBondContact O-N 3.2Å; F510-F512 VanDerWaalsContact C-N 3.28Å; F510-F512 PolarHBondContact O-N 3.27Å; F510-F513 PolarHBondContact O-N 3.24Å; F510-W514 HydrophobicContact CD1-CB 4.49Å; F510-W514 HydrophobicContact CE1-CB 4.27Å; F510-W514 HydrophobicContact CE1-CD2 4.4Å; F510-W514 HydrophobicContact CE1-CE3 4.34Å; F510-W514 HydrophobicContact CE1-CG 4.4Å; F510-W514 HydrophobicContact CZ-CD2 4.46Å; F510-W514 AromaticContact CZ-CE3 3.95Å; F510-W514 HydrophobicContact CZ-CE3 3.95Å; F510-W514 HydrophobicContact CZ-CZ3 4.49Å; F510-W514 VanDerWaalsContact O-CB 3.27Å; F510-W514 WeakPolarHBondContact O-CB 3.39Å; F510-W514 PolarHBondContact O-N 3.36Å; F510-M566 HydrophobicContact CD2-CE 3.98Å; F510-M566 HydrophobicContact CD2-CG 4.5Å; F510-M566 HydrophobicContact CD2-SD 3.58Å; F510-M566 VanDerWaalsContact CD2-SD 3.58Å; F510-M566 HydrophobicContact CE2-CE 3.82Å; F510-M566 HydrophobicContact CE2-SD 3.52Å; F510-M566 VanDerWaalsContact CE2-SD 3.52Å; F510-M566 HydrophobicContact CZ-CE 4.4Å; F510-I587 HydrophobicContact CE2-CG1 4.22Å; F510-I587 HydrophobicContact CZ-CG1 4.23Å; F510-M645 HydrophobicContact CB-CB 4.36Å; F510-M645 HydrophobicContact CB-CG 4.15Å; F510-M645 HydrophobicContact CD2-CB 4.03Å; F510-M645 HydrophobicContact CD2-CE 3.79Å; F510-M645 HydrophobicContact CD2-CG 4.29Å; F510-M645 HydrophobicContact CE2-CE 4.46Å; F510-M645 HydrophobicContact CG-CB 4.29Å; F510-A648 HydrophobicContact CB-CB 4.32Å; F510-A648 HydrophobicContact CD1-CB 3.53Å; F510-A648 HydrophobicContact CE1-CB 4.25Å; F510-A648 HydrophobicContact CG-CB 4.25Å; F510-F649 HydrophobicContact CE1-CB 3.85Å; F510-F649 HydrophobicContact CZ-CB 3.89Å; F510-F649 HydrophobicContact CZ-CD2 4.31Å
511	S	93.4	Very high	91.9	Very high	14 Å²	14	30.9 Å²	30.9	10%	0.098	17%	0.17	C	C	.	.	H	α-helix	trans	-59.9	-40	179.3	-59.4	0	0	0	0	111.7	Y507 L515	Y507-S511 VanDerWaalsContact O-CB 3.23Å; Y507-S511 WeakPolarHBondContact O-CB 3.34Å; Y507-S511 PolarHBondContact O-N 2.92Å; Y507-S511 PolarHBondContact O-OG 3.18Å; S511-L515 VanDerWaalsContact O-CB 3.28Å; S511-L515 WeakPolarHBondContact O-CB 3.44Å; S511-L515 VanDerWaalsContact O-CG 3.25Å; S511-L515 WeakPolarHBondContact O-CG 3.49Å; S511-L515 PolarHBondContact O-N 3.05Å
512	F	91.9	Very high	91.5	Very high	32 Å²	32	32.7 Å²	32.7	14%	0.14	18%	0.178	C	C	.	.	H	α-helix	trans	-60.3	-53.3	175.1	177.5	-86.4	0	0	0	112.2	G508 H509 F510 W514 K516 D518 R523	G508-F512 WeakPolarHBondContact O-CB 3.19Å; G508-F512 PolarHBondContact O-N 3.05Å; H509-F512 PolarHBondContact O-N 3.38Å; F510-F512 VanDerWaalsContact C-N 3.28Å; F510-F512 PolarHBondContact O-N 3.27Å; F512-W514 PolarHBondContact O-N 3.46Å; F512-K516 HydrophobicContact CD2-CD 3.71Å; F512-K516 HydrophobicContact CE2-CD 3.45Å; F512-K516 VanDerWaalsContact CE2-CD 3.45Å; F512-K516 HydrophobicContact CZ-CD 4.05Å; F512-K516 WeakPolarHBondContact O-CB 3.45Å; F512-K516 PolarHBondContact O-N 3.23Å; F512-D518 HydrophobicContact CE1-CB 4.15Å; F512-D518 HydrophobicContact CZ-CB 4.23Å; F512-R523 HydrophobicContact CE1-CG 4.19Å; F512-R523 HydrophobicContact CZ-CG 4.11Å
513	F	91.9	Very high	91	Very high	4 Å²	4	36 Å²	36	2%	0.018	19%	0.19	C	C	.	.	H	α-helix	trans	-67.2	-36.9	-178	-67.7	-56.4	0	0	0	112.2	H509 F510 G517 D518 F519 F559 I562 Y563 M566	H509-F513 HydrophobicContact CB-CE2 4.24Å; H509-F513 WeakPolarHBondContact O-CD2 3.33Å; H509-F513 PolarHBondContact O-N 2.89Å; F510-F513 PolarHBondContact O-N 3.24Å; F513-G517 WeakPolarHBondContact O-CA 3.49Å; F513-G517 PolarHBondContact O-N 3.12Å; F513-D518 WeakPolarHBondContact CD1-O 3.2Å; F513-D518 WeakPolarHBondContact CE1-O 3.39Å; F513-F519 HydrophobicContact CB-CE1 3.94Å; F513-F519 HydrophobicContact CB-CZ 4.1Å; F513-F519 AromaticContact CD1-CD1 3.87Å; F513-F519 HydrophobicContact CD1-CD1 3.87Å; F513-F519 AromaticContact CD1-CE1 3.78Å; F513-F519 HydrophobicContact CD1-CE1 3.78Å; F513-F519 HydrophobicContact CD1-CZ 4.48Å; F513-F519 HydrophobicContact CE1-CD1 4.28Å; F513-F519 HydrophobicContact CG-CD1 4.47Å; F513-F519 AromaticContact CG-CE1 3.95Å; F513-F519 HydrophobicContact CG-CE1 3.95Å; F513-F559 HydrophobicContact CZ-CE2 4.36Å; F513-I562 HydrophobicContact CD2-CG2 4.37Å; F513-I562 HydrophobicContact CE2-CG2 4.39Å; F513-Y563 HydrophobicContact CE1-CD2 4.03Å; F513-Y563 HydrophobicContact CE2-CD2 4.39Å; F513-Y563 AromaticContact CZ-CD2 3.73Å; F513-Y563 HydrophobicContact CZ-CD2 3.73Å; F513-M566 HydrophobicContact CB-CB 4.33Å; F513-M566 HydrophobicContact CB-CE 4.19Å; F513-M566 HydrophobicContact CB-CG 4.42Å; F513-M566 HydrophobicContact CD2-CB 4.46Å; F513-M566 HydrophobicContact CD2-CG 4.41Å
514	W	91.6	Very high	90.7	Very high	5 Å²	5	36.5 Å²	36.5	2%	0.019	19%	0.193	C	C	.	.	H	α-helix	trans	-65.6	-44.6	178.3	-176.5	-90.7	0	0	0	113.1	F510 F512 M566 I572 Q574 T577 Y584 I587 F649 L652	F510-W514 HydrophobicContact CD1-CB 4.49Å; F510-W514 HydrophobicContact CE1-CB 4.27Å; F510-W514 HydrophobicContact CE1-CD2 4.4Å; F510-W514 HydrophobicContact CE1-CE3 4.34Å; F510-W514 HydrophobicContact CE1-CG 4.4Å; F510-W514 HydrophobicContact CZ-CD2 4.46Å; F510-W514 AromaticContact CZ-CE3 3.95Å; F510-W514 HydrophobicContact CZ-CE3 3.95Å; F510-W514 HydrophobicContact CZ-CZ3 4.49Å; F510-W514 VanDerWaalsContact O-CB 3.27Å; F510-W514 WeakPolarHBondContact O-CB 3.39Å; F510-W514 PolarHBondContact O-N 3.36Å; F512-W514 PolarHBondContact O-N 3.46Å; W514-M566 HydrophobicContact CE3-CE 4.3Å; W514-I572 HydrophobicContact CH2-CG2 4.09Å; W514-I572 HydrophobicContact CZ3-CG2 3.81Å; W514-Q574 PolarHBondContact O-N 2.03Å; W514-Q574 VanDerWaalsContact O-N 3.17Å; W514-T577 HydrophobicContact CH2-CG2 3.8Å; W514-T577 HydrophobicContact CZ2-CG2 4.14Å; W514-T577 VanDerWaalsContact CZ2-OG1 3.3Å; W514-T577 WeakPolarHBondContact CZ2-OG1 3.41Å; W514-Y584 HydrophobicContact CZ2-CE1 4.46Å; W514-I587 HydrophobicContact CE3-CG1 4.44Å; W514-I587 HydrophobicContact CH2-CB 4.47Å; W514-I587 HydrophobicContact CH2-CG2 4.17Å; W514-I587 HydrophobicContact CZ3-CB 3.99Å; W514-I587 HydrophobicContact CZ3-CD1 4.29Å; W514-I587 HydrophobicContact CZ3-CG1 3.77Å; W514-I587 HydrophobicContact CZ3-CG2 4.05Å; W514-F649 HydrophobicContact CH2-CD2 4.31Å; W514-F649 HydrophobicContact CH2-CE2 4.03Å; W514-F649 HydrophobicContact CZ2-CE2 4.37Å; W514-L652 HydrophobicContact CB-CD1 4.37Å; W514-L652 HydrophobicContact CG-CD1 4.08Å
515	L	90.3	Very high	90.4	Very high	83 Å²	83	36.7 Å²	36.7	44%	0.435	20%	0.196	S	C	.	.	H	α-helix	trans	-83.3	-46.9	-176.1	-66.5	174.8	0	0	0	112.8	S511 Q574 L652	S511-L515 VanDerWaalsContact O-CB 3.28Å; S511-L515 WeakPolarHBondContact O-CB 3.44Å; S511-L515 VanDerWaalsContact O-CG 3.25Å; S511-L515 WeakPolarHBondContact O-CG 3.49Å; S511-L515 PolarHBondContact O-N 3.05Å; L515-Q574 VanDerWaalsContact CD2-OE1 3.22Å; L515-L652 HydrophobicContact CD1-CD2 4.19Å; L515-L652 HydrophobicContact CD2-CD2 4.15Å; L515-L652 HydrophobicContact CG-CD2 4.4Å
516	K	87.8	Confident	90.1	Very high	153 Å²	153	36.8 Å²	36.8	67%	0.665	20%	0.195	S	C	*	.	H	α-helix	trans	-90.1	-30.1	-173.8	-67	-175.6	178.1	-178	0	113.4	F512 D518	F512-K516 HydrophobicContact CD2-CD 3.71Å; F512-K516 HydrophobicContact CE2-CD 3.45Å; F512-K516 VanDerWaalsContact CE2-CD 3.45Å; F512-K516 HydrophobicContact CZ-CD 4.05Å; F512-K516 WeakPolarHBondContact O-CB 3.45Å; F512-K516 PolarHBondContact O-N 3.23Å; K516-D518 PolarHBondContact O-N 3.29Å
517	G	83.9	Confident	89.9	Confident	21 Å²	21	37.6 Å²	37.6	22%	0.216	20%	0.2	C	C	.	.			trans	69.2	15.3	-179.4	0	0	0	0	0	115.5	F513 F519	F513-G517 WeakPolarHBondContact O-CA 3.49Å; F513-G517 PolarHBondContact O-N 3.12Å; G517-F519 WeakPolarHBondContact O-CD2 3.4Å; G517-F519 PolarHBondContact O-N 3.28Å
518	D	84.6	Confident	89.6	Confident	72 Å²	72	38.7 Å²	38.7	39%	0.385	21%	0.207	S	C	.	.			trans	-86.6	100.1	-178.4	-177.9	8.7	0	0	0	110.4	F512 F513 K516 G520	F512-D518 HydrophobicContact CE1-CB 4.15Å; F512-D518 HydrophobicContact CZ-CB 4.23Å; F513-D518 WeakPolarHBondContact CD1-O 3.2Å; F513-D518 WeakPolarHBondContact CE1-O 3.39Å; K516-D518 PolarHBondContact O-N 3.29Å; D518-G520 PolarHBondContact OD1-N 3.27Å
519	F	85.9	Confident	89.5	Confident	26 Å²	26	38.9 Å²	38.9	11%	0.114	20%	0.198	C	C	.	.			trans	-100.7	19.9	174	-60.4	-79.9	0	0	0	112.3	F513 G517 Y563 M566 A567 Q571	F513-F519 HydrophobicContact CB-CE1 3.94Å; F513-F519 HydrophobicContact CB-CZ 4.1Å; F513-F519 AromaticContact CD1-CD1 3.87Å; F513-F519 HydrophobicContact CD1-CD1 3.87Å; F513-F519 AromaticContact CD1-CE1 3.78Å; F513-F519 HydrophobicContact CD1-CE1 3.78Å; F513-F519 HydrophobicContact CD1-CZ 4.48Å; F513-F519 HydrophobicContact CE1-CD1 4.28Å; F513-F519 HydrophobicContact CG-CD1 4.47Å; F513-F519 AromaticContact CG-CE1 3.95Å; F513-F519 HydrophobicContact CG-CE1 3.95Å; G517-F519 WeakPolarHBondContact O-CD2 3.4Å; G517-F519 PolarHBondContact O-N 3.28Å; F519-Y563 HydrophobicContact CB-CE2 4.33Å; F519-Y563 HydrophobicContact CD1-CD2 4.47Å; F519-Y563 HydrophobicContact CD1-CE2 4.15Å; F519-Y563 PolarHBondContact O-OH 3Å; F519-M566 HydrophobicContact CE1-CB 3.74Å; F519-M566 HydrophobicContact CZ-CB 4.3Å; F519-A567 HydrophobicContact CD1-CB 3.89Å; F519-A567 HydrophobicContact CE1-CB 4.32Å; F519-Q571 HydrophobicContact CE2-CB 4.48Å; F519-Q571 HydrophobicContact CE2-CG 4.44Å
520	G	85.3	Confident	89.3	Confident	25 Å²	25	41.7 Å²	41.7	26%	0.258	21%	0.207	S	C	.	.			trans	-65.5	141.2	-177.1	0	0	0	0	0	113.6	D518 Y522 R523 V524	D518-G520 PolarHBondContact OD1-N 3.27Å; G520-Y522 VanDerWaalsContact C-N 3.25Å; G520-Y522 PolarHBondContact O-N 2.83Å; G520-R523 PolarHBondContact O-N 2.89Å; G520-R523 VanDerWaalsContact O-N 3.13Å; G520-V524 PolarHBondContact O-N 3.44Å
521	L	85.7	Confident	89.1	Confident	68 Å²	68	43.1 Å²	43.1	36%	0.356	22%	0.215	S	C	.	.	H	α-helix	trans	-56.4	-39.4	177.9	-174.9	66.2	0	0	0	112.2	R523 V524 C525 L805 L809	L521-R523 VanDerWaalsContact C-N 3.3Å; L521-R523 PolarHBondContact O-N 2.91Å; L521-V524 PolarHBondContact O-N 2.99Å; L521-C525 PolarHBondContact O-N 3.26Å; L521-C525 PolarHBondContact O-SG 2.66Å; L521-C525 VanDerWaalsContact O-SG 3.38Å; L521-L805 HydrophobicContact CB-CD2 4.5Å; L521-L805 HydrophobicContact CD2-CD2 4.2Å; L521-L805 HydrophobicContact CG-CD2 4.03Å; L521-L809 HydrophobicContact CD2-CD1 4.26Å
522	Y	86.9	Confident	89.1	Confident	51 Å²	51	43.5 Å²	43.5	20%	0.2	22%	0.216	C	C	.	.	H	α-helix	trans	-50.8	-47.8	175.8	171.4	-102.9	0	0	0	112.7	G520 Q526 I798 P799 K800	G520-Y522 VanDerWaalsContact C-N 3.25Å; G520-Y522 PolarHBondContact O-N 2.83Å; Y522-Q526 WeakPolarHBondContact O-CB 3.06Å; Y522-Q526 PolarHBondContact O-N 2.73Å; Y522-I798 HydrophobicContact CD2-CG2 3.62Å; Y522-I798 HydrophobicContact CE2-CG2 3.74Å; Y522-I798 WeakPolarHBondContact CE2-O 3.38Å; Y522-P799 VanDerWaalsContact CD2-O 3.27Å; Y522-P799 WeakPolarHBondContact CD2-O 3.2Å; Y522-K800 HydrophobicContact CD2-CG 4.41Å; Y522-K800 HydrophobicContact CE1-CG 4.37Å; Y522-K800 HydrophobicContact CE2-CB 4.35Å; Y522-K800 HydrophobicContact CE2-CG 3.77Å
523	R	87.3	Confident	89.2	Confident	68 Å²	68	43.4 Å²	43.4	26%	0.257	22%	0.215	S	C	.	.	H	α-helix	trans	-67.8	-42.3	-177.8	179.4	57.8	175.7	176.6	0.5	111.4	F512 G520 L521 Q526 V527	F512-R523 HydrophobicContact CE1-CG 4.19Å; F512-R523 HydrophobicContact CZ-CG 4.11Å; G520-R523 PolarHBondContact O-N 2.89Å; G520-R523 VanDerWaalsContact O-N 3.13Å; L521-R523 VanDerWaalsContact C-N 3.3Å; L521-R523 PolarHBondContact O-N 2.91Å; R523-Q526 PolarHBondContact O-N 2.93Å; R523-V527 WeakPolarHBondContact O-CG2 3.25Å; R523-V527 PolarHBondContact O-N 3.22Å
524	V	89.9	Confident	89.2	Confident	13 Å²	13	43.6 Å²	43.6	8%	0.079	22%	0.216	C	C	.	.	H	α-helix	trans	-60.6	-50.7	177.9	178	0	0	0	0	110.1	G520 L521 Q526 V527 L528 F559 Y563	G520-V524 PolarHBondContact O-N 3.44Å; L521-V524 PolarHBondContact O-N 2.99Å; V524-Q526 VanDerWaalsContact C-N 3.29Å; V524-Q526 PolarHBondContact O-N 2.86Å; V524-V527 PolarHBondContact O-N 2.99Å; V524-L528 HydrophobicContact CG1-CD1 3.92Å; V524-L528 HydrophobicContact CG1-CG 4.41Å; V524-L528 WeakPolarHBondContact O-CB 3.45Å; V524-L528 WeakPolarHBondContact O-CG 3.39Å; V524-L528 PolarHBondContact O-N 3Å; V524-F559 HydrophobicContact CG1-CE1 4.08Å; V524-F559 HydrophobicContact CG1-CZ 4.49Å; V524-Y563 HydrophobicContact CG2-CD1 4.48Å; V524-Y563 HydrophobicContact CG2-CD2 3.71Å; V524-Y563 HydrophobicContact CG2-CE1 4.25Å; V524-Y563 HydrophobicContact CG2-CE2 3.42Å; V524-Y563 VanDerWaalsContact CG2-CE2 3.42Å; V524-Y563 HydrophobicContact CG2-CG 4.23Å
525	C	89.9	Confident	89.3	Confident	17 Å²	17	43.3 Å²	43.3	12%	0.115	22%	0.215	C	C	.	.	H	α-helix	trans	-60.4	-39.1	176.5	-66.6	0	0	0	0	112.1	L521 V527 L528 F529 I798 L805	L521-C525 PolarHBondContact O-N 3.26Å; L521-C525 PolarHBondContact O-SG 2.66Å; L521-C525 VanDerWaalsContact O-SG 3.38Å; C525-V527 PolarHBondContact O-N 3.32Å; C525-L528 PolarHBondContact O-N 3.22Å; C525-F529 VanDerWaalsContact O-CB 3.3Å; C525-F529 WeakPolarHBondContact O-CB 3.31Å; C525-F529 PolarHBondContact O-N 3.34Å; C525-I798 VanDerWaalsContact C-CD1 3.49Å; C525-I798 HydrophobicContact CB-CD1 4.24Å; C525-I798 HydrophobicContact CB-CG2 4.15Å; C525-I798 VanDerWaalsContact O-CD1 3.25Å; C525-I798 WeakPolarHBondContact O-CD1 3.18Å; C525-L805 HydrophobicContact CB-CD1 4.36Å; C525-L805 HydrophobicContact CB-CD2 4.3Å
526	Q	89.6	Confident	89.3	Confident	23 Å²	23	42.9 Å²	42.9	11%	0.107	22%	0.216	C	C	.	.	H	α-helix	trans	-61.9	-43.7	178	-171	-173.9	42.9	0	0	112.3	Y522 R523 V524 R530 I798	Y522-Q526 WeakPolarHBondContact O-CB 3.06Å; Y522-Q526 PolarHBondContact O-N 2.73Å; R523-Q526 PolarHBondContact O-N 2.93Å; V524-Q526 VanDerWaalsContact C-N 3.29Å; V524-Q526 PolarHBondContact O-N 2.86Å; Q526-R530 PolarHBondContact O-N 2.87Å; Q526-R530 VanDerWaalsContact O-N 3.15Å; Q526-I798 HydrophobicContact CB-CD1 4.39Å
527	V	91.1	Very high	89.5	Confident	17 Å²	17	36.6 Å²	36.6	10%	0.103	19%	0.19	C	C	.	.	H	α-helix	trans	-67.8	-47.4	177.2	175.4	0	0	0	0	110.3	R523 V524 C525 F529 R530 L531 F559	R523-V527 WeakPolarHBondContact O-CG2 3.25Å; R523-V527 PolarHBondContact O-N 3.22Å; V524-V527 PolarHBondContact O-N 2.99Å; C525-V527 PolarHBondContact O-N 3.32Å; V527-F529 VanDerWaalsContact C-N 3.32Å; V527-F529 PolarHBondContact O-N 3.32Å; V527-R530 PolarHBondContact O-N 3.35Å; V527-L531 HydrophobicContact CG1-CD1 3.94Å; V527-L531 HydrophobicContact CG1-CG 4.36Å; V527-L531 WeakPolarHBondContact O-CG 3.18Å; V527-L531 PolarHBondContact O-N 3.46Å; V527-F559 HydrophobicContact CB-CE1 4.05Å; V527-F559 HydrophobicContact CB-CE2 4.2Å; V527-F559 HydrophobicContact CB-CZ 3.75Å; V527-F559 HydrophobicContact CG1-CD1 4.13Å; V527-F559 HydrophobicContact CG1-CD2 3.98Å; V527-F559 HydrophobicContact CG1-CE1 3.91Å; V527-F559 HydrophobicContact CG1-CE2 3.77Å; V527-F559 HydrophobicContact CG1-CG 4.16Å; V527-F559 HydrophobicContact CG1-CZ 3.72Å; V527-F559 HydrophobicContact CG2-CE2 4.4Å; V527-F559 HydrophobicContact CG2-CZ 4.21Å
528	L	91.5	Very high	89.8	Confident	48 Å²	48	35.6 Å²	35.6	25%	0.251	18%	0.18	S	C	.	.	H	α-helix	trans	-59.8	-41.7	178.9	-70.7	176.1	0	0	0	112.2	V524 C525 L531 N532 T556 F559 V560	V524-L528 HydrophobicContact CG1-CD1 3.92Å; V524-L528 HydrophobicContact CG1-CG 4.41Å; V524-L528 WeakPolarHBondContact O-CB 3.45Å; V524-L528 WeakPolarHBondContact O-CG 3.39Å; V524-L528 PolarHBondContact O-N 3Å; C525-L528 PolarHBondContact O-N 3.22Å; L528-L531 PolarHBondContact O-N 3.31Å; L528-N532 WeakPolarHBondContact O-CB 3.39Å; L528-N532 PolarHBondContact O-N 3.05Å; L528-N532 PolarHBondContact O-ND2 3.45Å; L528-T556 HydrophobicContact CD2-CG2 3.8Å; L528-F559 HydrophobicContact CD2-CD1 3.79Å; L528-F559 HydrophobicContact CD2-CE1 4.06Å; L528-F559 HydrophobicContact CG-CD1 4.29Å; L528-F559 HydrophobicContact CG-CE1 4.04Å; L528-V560 HydrophobicContact CD2-CG2 4.15Å
529	F	91.1	Very high	90.1	Very high	39 Å²	39	33.3 Å²	33.3	17%	0.171	17%	0.169	C	C	.	.	H	α-helix	trans	-65.2	-46.5	177.4	-178.2	-86.1	0	0	0	111.7	C525 V527 L531 N532 F533 L793 A794 V797 I798	C525-F529 VanDerWaalsContact O-CB 3.3Å; C525-F529 WeakPolarHBondContact O-CB 3.31Å; C525-F529 PolarHBondContact O-N 3.34Å; V527-F529 VanDerWaalsContact C-N 3.32Å; V527-F529 PolarHBondContact O-N 3.32Å; F529-L531 VanDerWaalsContact C-N 3.28Å; F529-L531 PolarHBondContact O-N 3.48Å; F529-N532 PolarHBondContact O-N 3.22Å; F529-F533 HydrophobicContact CD1-CB 4.13Å; F529-F533 HydrophobicContact CD2-CB 4.45Å; F529-F533 HydrophobicContact CE1-CB 3.92Å; F529-F533 HydrophobicContact CE1-CD1 4.36Å; F529-F533 HydrophobicContact CE1-CD2 4.11Å; F529-F533 AromaticContact CE1-CG 3.87Å; F529-F533 HydrophobicContact CE1-CG 3.87Å; F529-F533 HydrophobicContact CE2-CB 4.26Å; F529-F533 AromaticContact CE2-CD2 3.73Å; F529-F533 HydrophobicContact CE2-CD2 3.73Å; F529-F533 HydrophobicContact CE2-CE2 4.46Å; F529-F533 HydrophobicContact CE2-CG 4.21Å; F529-F533 HydrophobicContact CG-CB 4.39Å; F529-F533 HydrophobicContact CZ-CB 4Å; F529-F533 HydrophobicContact CZ-CD1 4.38Å; F529-F533 AromaticContact CZ-CD2 3.42Å; F529-F533 HydrophobicContact CZ-CD2 3.42Å; F529-F533 VanDerWaalsContact CZ-CD2 3.42Å; F529-F533 AromaticContact CZ-CE2 3.97Å; F529-F533 HydrophobicContact CZ-CE2 3.97Å; F529-F533 AromaticContact CZ-CG 3.67Å; F529-F533 HydrophobicContact CZ-CG 3.67Å; F529-F533 WeakPolarHBondContact O-CB 3.07Å; F529-F533 PolarHBondContact O-N 3.01Å; F529-L793 HydrophobicContact CE1-CB 4.31Å; F529-L793 HydrophobicContact CZ-CB 4.13Å; F529-A794 HydrophobicContact CD1-CB 3.64Å; F529-A794 HydrophobicContact CE1-CB 3.81Å; F529-V797 HydrophobicContact CD2-CG1 4.3Å; F529-V797 HydrophobicContact CE2-CB 4.15Å; F529-V797 HydrophobicContact CE2-CG1 3.94Å; F529-V797 HydrophobicContact CE2-CG2 4.22Å; F529-V797 HydrophobicContact CZ-CB 4.39Å; F529-V797 HydrophobicContact CZ-CG2 4.22Å; F529-I798 HydrophobicContact CB-CD1 3.47Å; F529-I798 VanDerWaalsContact CB-CD1 3.47Å; F529-I798 HydrophobicContact CD2-CD1 4.44Å; F529-I798 HydrophobicContact CG-CD1 3.92Å
530	R	91.2	Very high	90.2	Very high	96 Å²	96	35.7 Å²	35.7	36%	0.362	18%	0.182	S	C	.	.	H	α-helix	trans	-59.3	-38.6	177.4	-82.9	-177.9	168.7	157.4	-2.4	113.1	Q526 V527 T790 N791	Q526-R530 PolarHBondContact O-N 2.87Å; Q526-R530 VanDerWaalsContact O-N 3.15Å; V527-R530 PolarHBondContact O-N 3.35Å; R530-T790 HydrophobicContact CG-CG2 4.46Å; R530-N791 PolarHBondContact NE-OD1 3.33Å; R530-N791 PolarHBondContact NH2-OD1 2.84Å
531	L	91.4	Very high	90.4	Very high	30 Å²	30	34.9 Å²	34.9	16%	0.157	17%	0.173	C	C	.	.	H	α-helix	trans	-70.1	-42.5	178.7	-68.9	175.3	0	0	0	112.1	V527 L528 F529 V552 V555 L742	V527-L531 HydrophobicContact CG1-CD1 3.94Å; V527-L531 HydrophobicContact CG1-CG 4.36Å; V527-L531 WeakPolarHBondContact O-CG 3.18Å; V527-L531 PolarHBondContact O-N 3.46Å; L528-L531 PolarHBondContact O-N 3.31Å; F529-L531 VanDerWaalsContact C-N 3.28Å; F529-L531 PolarHBondContact O-N 3.48Å; L531-V552 WeakPolarHBondContact O-CG1 3.44Å; L531-V555 HydrophobicContact CD1-CG1 4.17Å; L531-V555 HydrophobicContact CD2-CG1 4.14Å; L531-L742 HydrophobicContact CD2-CD2 4.07Å
532	N	93.1	Very high	90.5	Very high	22 Å²	22	31.7 Å²	31.7	12%	0.118	16%	0.156	C	C	.	.	H	α-helix	trans	-104	-20.5	-163.8	-61.5	-64.3	0	0	0	114.6	L528 F529 L534 V535 V536 Y546 V552 T556	L528-N532 WeakPolarHBondContact O-CB 3.39Å; L528-N532 PolarHBondContact O-N 3.05Å; L528-N532 PolarHBondContact O-ND2 3.45Å; F529-N532 PolarHBondContact O-N 3.22Å; N532-L534 PolarHBondContact O-N 3.29Å; N532-V535 PolarHBondContact O-N 3.04Å; N532-V536 HydrophobicContact CB-CG2 4.41Å; N532-V536 WeakPolarHBondContact O-CG2 3.41Å; N532-V536 PolarHBondContact O-N 2.95Å; N532-Y546 PolarHBondContact OD1-OH 2.97Å; N532-V552 WeakPolarHBondContact OD1-CG1 3.27Å; N532-T556 PolarHBondContact ND2-OG1 3.33Å; N532-T556 PolarHBondContact OD1-OG1 2.92Å
533	F	92.4	Very high	90.5	Very high	31 Å²	31	32.4 Å²	32.4	14%	0.136	16%	0.163	C	C	.	.	H	α-helix	trans	-54.3	-53.3	-170.4	168.8	-110.1	0	0	0	113	M408 F529 V535 V536 V537 T790 L793	M408-F533 HydrophobicContact CE-CD1 4.3Å; M408-F533 HydrophobicContact CE-CE1 3.32Å; M408-F533 HydrophobicContact CE-CZ 3.78Å; F529-F533 HydrophobicContact CD1-CB 4.13Å; F529-F533 HydrophobicContact CD2-CB 4.45Å; F529-F533 HydrophobicContact CE1-CB 3.92Å; F529-F533 HydrophobicContact CE1-CD1 4.36Å; F529-F533 HydrophobicContact CE1-CD2 4.11Å; F529-F533 AromaticContact CE1-CG 3.87Å; F529-F533 HydrophobicContact CE1-CG 3.87Å; F529-F533 HydrophobicContact CE2-CB 4.26Å; F529-F533 AromaticContact CE2-CD2 3.73Å; F529-F533 HydrophobicContact CE2-CD2 3.73Å; F529-F533 HydrophobicContact CE2-CE2 4.46Å; F529-F533 HydrophobicContact CE2-CG 4.21Å; F529-F533 HydrophobicContact CG-CB 4.39Å; F529-F533 HydrophobicContact CZ-CB 4Å; F529-F533 HydrophobicContact CZ-CD1 4.38Å; F529-F533 AromaticContact CZ-CD2 3.42Å; F529-F533 HydrophobicContact CZ-CD2 3.42Å; F529-F533 VanDerWaalsContact CZ-CD2 3.42Å; F529-F533 AromaticContact CZ-CE2 3.97Å; F529-F533 HydrophobicContact CZ-CE2 3.97Å; F529-F533 AromaticContact CZ-CG 3.67Å; F529-F533 HydrophobicContact CZ-CG 3.67Å; F529-F533 WeakPolarHBondContact O-CB 3.07Å; F529-F533 PolarHBondContact O-N 3.01Å; F533-V535 VanDerWaalsContact C-N 3.34Å; F533-V535 PolarHBondContact O-N 3.49Å; F533-V536 PolarHBondContact O-N 3.17Å; F533-V537 HydrophobicContact CD2-CG2 4.19Å; F533-V537 HydrophobicContact CE2-CG2 3.78Å; F533-V537 HydrophobicContact CZ-CG2 4.07Å; F533-V537 WeakPolarHBondContact O-CG2 3.44Å; F533-V537 PolarHBondContact O-N 3.44Å; F533-V537 VanDerWaalsContact O-N 3.09Å; F533-T790 HydrophobicContact CB-CG2 4.41Å; F533-T790 HydrophobicContact CD1-CG2 3.91Å; F533-L793 HydrophobicContact CE1-CD1 3.85Å; F533-L793 HydrophobicContact CE2-CD1 4.12Å; F533-L793 HydrophobicContact CZ-CD1 3.34Å
534	L	93	Very high	90.4	Very high	7 Å²	7	32.6 Å²	32.6	4%	0.037	16%	0.164	C	C	.	.	H	α-helix	trans	-60.6	-44	-179.2	178.7	59.8	0	0	0	111.8	M408 M412 N532 V537 L538 I746 V786	M408-L534 HydrophobicContact CE-CD1 4.45Å; M412-L534 HydrophobicContact CE-CD1 4.22Å; N532-L534 PolarHBondContact O-N 3.29Å; L534-V537 PolarHBondContact O-N 2.85Å; L534-L538 HydrophobicContact CD1-CD1 4.21Å; L534-L538 HydrophobicContact CD1-CG 4.35Å; L534-L538 HydrophobicContact CG-CD1 3.98Å; L534-L538 WeakPolarHBondContact O-CB 3.03Å; L534-L538 VanDerWaalsContact O-CG 3.31Å; L534-L538 WeakPolarHBondContact O-CG 3.45Å; L534-L538 PolarHBondContact O-N 3.16Å; L534-I746 HydrophobicContact CB-CD1 4.4Å; L534-I746 HydrophobicContact CD2-CB 3.77Å; L534-I746 HydrophobicContact CD2-CD1 3.85Å; L534-I746 HydrophobicContact CD2-CG1 4.44Å; L534-I746 HydrophobicContact CD2-CG2 3.6Å; L534-I746 HydrophobicContact CG-CD1 4.4Å; L534-I746 HydrophobicContact CG-CG2 3.92Å; L534-V786 HydrophobicContact CB-CG1 4.49Å; L534-V786 HydrophobicContact CD1-CG1 3.67Å; L534-V786 HydrophobicContact CD2-CG1 3.66Å; L534-V786 HydrophobicContact CG-CG1 4.13Å
535	V	92.8	Very high	90.4	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65.4	-42.2	-179.6	178.2	0	0	0	0	111.4	N532 F533 V537 L538 C539 Y546 Y549 V552 I746	N532-V535 PolarHBondContact O-N 3.04Å; F533-V535 VanDerWaalsContact C-N 3.34Å; F533-V535 PolarHBondContact O-N 3.49Å; V535-V537 VanDerWaalsContact C-N 3.34Å; V535-V537 PolarHBondContact O-N 3.21Å; V535-L538 WeakPolarHBondContact O-CB 3.4Å; V535-L538 PolarHBondContact O-N 3.38Å; V535-C539 PolarHBondContact O-N 2.93Å; V535-C539 PolarHBondContact O-SG 3.18Å; V535-Y546 HydrophobicContact CB-CE2 4.22Å; V535-Y546 HydrophobicContact CG1-CD2 3.52Å; V535-Y546 HydrophobicContact CG1-CE2 3.58Å; V535-Y549 HydrophobicContact CG1-CD2 3.49Å; V535-Y549 VanDerWaalsContact CG1-CD2 3.49Å; V535-Y549 HydrophobicContact CG1-CE2 4.28Å; V535-Y549 HydrophobicContact CG1-CG 3.81Å; V535-Y549 HydrophobicContact CG2-CG 4.34Å; V535-V552 HydrophobicContact CB-CG1 4.41Å; V535-V552 HydrophobicContact CG2-CB 3.87Å; V535-V552 HydrophobicContact CG2-CG1 3.9Å; V535-V552 HydrophobicContact CG2-CG2 3.61Å; V535-I746 HydrophobicContact CG2-CD1 3.66Å; V535-I746 HydrophobicContact CG2-CG1 4.1Å; V535-I746 HydrophobicContact CG2-CG2 4.38Å
536	V	91.3	Very high	90.4	Very high	73 Å²	73	34.8 Å²	34.8	44%	0.442	17%	0.174	S	C	.	.	H	α-helix	trans	-61.4	-44.3	177.5	170.3	0	0	0	0	110.8	N532 F533 L538 C539 I540	N532-V536 HydrophobicContact CB-CG2 4.41Å; N532-V536 WeakPolarHBondContact O-CG2 3.41Å; N532-V536 PolarHBondContact O-N 2.95Å; F533-V536 PolarHBondContact O-N 3.17Å; V536-L538 VanDerWaalsContact C-N 3.33Å; V536-L538 PolarHBondContact O-N 3.48Å; V536-C539 PolarHBondContact O-N 3.46Å; V536-I540 HydrophobicContact CG1-CD1 4.24Å; V536-I540 WeakPolarHBondContact O-CG1 3.27Å; V536-I540 PolarHBondContact O-N 3.15Å
537	V	91.1	Very high	90.4	Very high	21 Å²	21	33.8 Å²	33.8	13%	0.127	17%	0.169	C	C	.	.	H	α-helix	trans	-62.2	-43.4	175.8	177.6	0	0	0	0	110.7	F355 M412 F533 L534 V535 I540 V541	F355-V537 HydrophobicContact CZ-CG1 4.12Å; M412-V537 HydrophobicContact CG-CG1 3.91Å; M412-V537 HydrophobicContact SD-CG1 3.62Å; F533-V537 HydrophobicContact CD2-CG2 4.19Å; F533-V537 HydrophobicContact CE2-CG2 3.78Å; F533-V537 HydrophobicContact CZ-CG2 4.07Å; F533-V537 WeakPolarHBondContact O-CG2 3.44Å; F533-V537 PolarHBondContact O-N 3.44Å; F533-V537 VanDerWaalsContact O-N 3.09Å; L534-V537 PolarHBondContact O-N 2.85Å; V535-V537 VanDerWaalsContact C-N 3.34Å; V535-V537 PolarHBondContact O-N 3.21Å; V537-I540 PolarHBondContact O-N 3.05Å; V537-V541 HydrophobicContact CG1-CG2 4.38Å; V537-V541 WeakPolarHBondContact O-CG2 3.35Å; V537-V541 PolarHBondContact O-N 3.29Å
538	L	91.7	Very high	90.4	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.4	-43.4	176.6	-78	169.9	0	0	0	112.8	M412 F415 L534 V535 V536 I540 V541 M542 Y549 I746	M412-L538 HydrophobicContact CE-CD2 4.18Å; M412-L538 HydrophobicContact SD-CD2 4.03Å; M412-L538 HydrophobicContact SD-CG 4.49Å; F415-L538 HydrophobicContact CD2-CD2 3.66Å; F415-L538 HydrophobicContact CE2-CD2 4.18Å; L534-L538 HydrophobicContact CD1-CD1 4.21Å; L534-L538 HydrophobicContact CD1-CG 4.35Å; L534-L538 HydrophobicContact CG-CD1 3.98Å; L534-L538 WeakPolarHBondContact O-CB 3.03Å; L534-L538 VanDerWaalsContact O-CG 3.31Å; L534-L538 WeakPolarHBondContact O-CG 3.45Å; L534-L538 PolarHBondContact O-N 3.16Å; V535-L538 WeakPolarHBondContact O-CB 3.4Å; V535-L538 PolarHBondContact O-N 3.38Å; V536-L538 VanDerWaalsContact C-N 3.33Å; V536-L538 PolarHBondContact O-N 3.48Å; L538-I540 PolarHBondContact O-N 3.18Å; L538-V541 PolarHBondContact O-N 3.36Å; L538-M542 HydrophobicContact CD2-CE 4.31Å; L538-M542 HydrophobicContact CD2-CG 4.22Å; L538-M542 WeakPolarHBondContact O-CA 3.33Å; L538-M542 WeakPolarHBondContact O-CB 3.17Å; L538-M542 WeakPolarHBondContact O-CG 3.16Å; L538-M542 PolarHBondContact O-N 3.18Å; L538-Y549 HydrophobicContact CB-CE2 4.14Å; L538-Y549 HydrophobicContact CD1-CE1 4.07Å; L538-I746 HydrophobicContact CD1-CG2 3.21Å
539	C	90.1	Very high	90.5	Very high	24 Å²	24	32.2 Å²	32.2	16%	0.162	16%	0.159	C	C	.	.	H	α-helix	trans	-56.3	-39.9	176.3	-73.2	0	0	0	0	111.8	V535 V536 D543 R544	V535-C539 PolarHBondContact O-N 2.93Å; V535-C539 PolarHBondContact O-SG 3.18Å; V536-C539 PolarHBondContact O-N 3.46Å; C539-D543 WeakPolarHBondContact O-CA 3.38Å; C539-D543 PolarHBondContact O-N 3.23Å; C539-D543 VanDerWaalsContact O-N 3.11Å; C539-R544 WeakPolarHBondContact CA-O 3.48Å; C539-R544 WeakPolarHBondContact CB-O 3.32Å; C539-R544 PolarHBondContact O-N 3.41Å; C539-R544 PolarHBondContact SG-O 3.3Å
540	I	87.6	Confident	90.5	Very high	76 Å²	76	31.6 Å²	31.6	39%	0.39	16%	0.156	S	C	.	.	H	α-helix	trans	-70.4	-44.6	178.4	-65.2	166.2	0	0	0	111.5	I347 V536 V537 L538	I347-I540 HydrophobicContact CG2-CG2 3.78Å; V536-I540 HydrophobicContact CG1-CD1 4.24Å; V536-I540 WeakPolarHBondContact O-CG1 3.27Å; V536-I540 PolarHBondContact O-N 3.15Å; V537-I540 PolarHBondContact O-N 3.05Å; L538-I540 PolarHBondContact O-N 3.18Å
541	V	89.4	Confident	90.6	Very high	9 Å²	9	27.7 Å²	27.7	6%	0.055	14%	0.142	C	C	.	.	H	α-helix	trans	-76.1	-38.8	-176.5	173.8	0	0	0	0	111.8	Q348 F355 M412 Y416 V537 L538	Q348-V541 PolarHBondContact NE2-O 3.28Å; Q348-V541 VanDerWaalsContact NE2-O 3.15Å; F355-V541 HydrophobicContact CE2-CG2 4.06Å; M412-V541 HydrophobicContact CB-CG1 4.29Å; M412-V541 HydrophobicContact CB-CG2 4.2Å; M412-V541 HydrophobicContact CG-CG2 4.17Å; M412-V541 HydrophobicContact SD-CG2 4.24Å; Y416-V541 HydrophobicContact CD2-CG1 4.32Å; V537-V541 HydrophobicContact CG1-CG2 4.38Å; V537-V541 WeakPolarHBondContact O-CG2 3.35Å; V537-V541 PolarHBondContact O-N 3.29Å; L538-V541 PolarHBondContact O-N 3.36Å
542	M	87.6	Confident	90.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-93.4	-9.9	-173	-63	-61.2	-176.6	0	0	114.6	F415 R420 L538 R544 H750	F415-M542 HydrophobicContact CB-CE 3.21Å; F415-M542 HydrophobicContact CG-CE 4.38Å; R420-M542 HydrophobicContact CG-SD 4.03Å; R420-M542 PolarHBondContact NE-O 3.38Å; R420-M542 PolarHBondContact NH2-O 2.78Å; L538-M542 HydrophobicContact CD2-CE 4.31Å; L538-M542 HydrophobicContact CD2-CG 4.22Å; L538-M542 WeakPolarHBondContact O-CA 3.33Å; L538-M542 WeakPolarHBondContact O-CB 3.17Å; L538-M542 WeakPolarHBondContact O-CG 3.16Å; L538-M542 PolarHBondContact O-N 3.18Å; M542-R544 HydrophobicContact CB-CG 4.32Å; M542-H750 HydrophobicContact CE-CB 4.48Å
543	D	86.7	Confident	90.7	Very high	66 Å²	66	25.4 Å²	25.4	35%	0.353	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	52.8	-173.9	-163	31.3	0	0	0	112.1	N345 C539	N345-D543 PolarHBondContact ND2-OD2 3.04Å; C539-D543 WeakPolarHBondContact O-CA 3.38Å; C539-D543 PolarHBondContact O-N 3.23Å; C539-D543 VanDerWaalsContact O-N 3.11Å
544	R	86.4	Confident	90.8	Very high	73 Å²	73	24 Å²	24	28%	0.275	12%	0.123	S	C	.	.			trans	-125.2	140.4	179	-72.2	-65.9	-177.3	-130.4	-1.9	110.9	C539 M542 F548 D756	C539-R544 WeakPolarHBondContact CA-O 3.48Å; C539-R544 WeakPolarHBondContact CB-O 3.32Å; C539-R544 PolarHBondContact O-N 3.41Å; C539-R544 PolarHBondContact SG-O 3.3Å; M542-R544 HydrophobicContact CB-CG 4.32Å; R544-F548 HydrophobicContact CB-CB 4.33Å; R544-F548 HydrophobicContact CB-CD1 4.21Å; R544-F548 HydrophobicContact CB-CG 4.32Å; R544-F548 HydrophobicContact CG-CD1 4.44Å; R544-D756 IonicContact CZ-OD1 2.63Å; R544-D756 IonicContact CZ-OD2 3.78Å; R544-D756 IonicContact NE-OD1 3.28Å; R544-D756 PolarHBondContact NE-OD1 2.86Å; R544-D756 IonicContact NE-OD2 3.68Å; R544-D756 VanDerWaalsContact NH2-CG 3.33Å; R544-D756 IonicContact NH2-OD1 3.55Å; R544-D756 PolarHBondContact NH2-OD1 3.33Å; R544-D756 IonicContact NH2-OD2 3.85Å; R544-D756 PolarHBondContact NH2-OD2 3.15Å
545	P	89.3	Confident	90.9	Very high	43 Å²	43	24.1 Å²	24.1	28%	0.279	13%	0.125	S	C	.	.			trans	-65.5	152.5	-179.4	27.9	-34.3	0	0	0	111	Q547 F548 L623	P545-Q547 PolarHBondContact O-N 3.35Å; P545-F548 HydrophobicContact CG-CB 4.47Å; P545-F548 WeakPolarHBondContact O-CB 3.3Å; P545-F548 PolarHBondContact O-N 3.22Å; P545-L623 HydrophobicContact CG-CD1 3.56Å
546	Y	89.5	Confident	91	Very high	32 Å²	32	25.2 Å²	25.2	13%	0.125	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-56.1	-37.4	-177.3	-178.8	-125.8	0	0	0	113	N532 V535 F548 Y549 V552 P553 L620	N532-Y546 PolarHBondContact OD1-OH 2.97Å; V535-Y546 HydrophobicContact CB-CE2 4.22Å; V535-Y546 HydrophobicContact CG1-CD2 3.52Å; V535-Y546 HydrophobicContact CG1-CE2 3.58Å; Y546-F548 PolarHBondContact O-N 3.11Å; Y546-F548 VanDerWaalsContact O-N 3.16Å; Y546-Y549 PolarHBondContact O-N 2.96Å; Y546-V552 HydrophobicContact CE2-CG1 4.35Å; Y546-P553 HydrophobicContact CD1-CB 4.07Å; Y546-P553 HydrophobicContact CD1-CG 3.71Å; Y546-P553 HydrophobicContact CD2-CG 4.33Å; Y546-P553 HydrophobicContact CE1-CB 3.5Å; Y546-P553 VanDerWaalsContact CE1-CB 3.5Å; Y546-P553 HydrophobicContact CE1-CG 3.4Å; Y546-P553 VanDerWaalsContact CE1-CG 3.4Å; Y546-P553 HydrophobicContact CE2-CG 4.05Å; Y546-P553 HydrophobicContact CG-CG 4.14Å; Y546-P553 VanDerWaalsContact OH-CA 3.24Å; Y546-P553 WeakPolarHBondContact OH-CA 3.42Å; Y546-P553 VanDerWaalsContact OH-N 3.17Å; Y546-L620 HydrophobicContact CD1-CB 4.42Å; Y546-L620 HydrophobicContact CD1-CD2 4.5Å; Y546-L620 WeakPolarHBondContact CD1-O 3.4Å
547	Q	90.9	Very high	91.1	Very high	3 Å²	3	24 Å²	24	1%	0.014	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-63.6	-17.7	177.2	-172.7	57.8	19.7	0	0	114.1	P545 Y549 Y550 L623	P545-Q547 PolarHBondContact O-N 3.35Å; Q547-Y549 PolarHBondContact O-N 3.1Å; Q547-Y550 WeakPolarHBondContact O-CA 3.18Å; Q547-Y550 WeakPolarHBondContact O-CB 3.46Å; Q547-Y550 PolarHBondContact O-N 3Å; Q547-Y550 VanDerWaalsContact O-N 3.12Å; Q547-L623 HydrophobicContact CB-CB 4.41Å; Q547-L623 HydrophobicContact CG-CB 4.19Å
548	F	90.4	Very high	91.3	Very high	31 Å²	31	23.1 Å²	23.1	14%	0.136	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-57.5	-36.2	173.5	-179	-108.1	0	0	0	111.7	R544 P545 Y546 Y550 Y749 D756 T757	R544-F548 HydrophobicContact CB-CB 4.33Å; R544-F548 HydrophobicContact CB-CD1 4.21Å; R544-F548 HydrophobicContact CB-CG 4.32Å; R544-F548 HydrophobicContact CG-CD1 4.44Å; P545-F548 HydrophobicContact CG-CB 4.47Å; P545-F548 WeakPolarHBondContact O-CB 3.3Å; P545-F548 PolarHBondContact O-N 3.22Å; Y546-F548 PolarHBondContact O-N 3.11Å; Y546-F548 VanDerWaalsContact O-N 3.16Å; F548-Y550 VanDerWaalsContact C-N 3.28Å; F548-Y550 PolarHBondContact O-N 3.1Å; F548-Y749 HydrophobicContact CD1-CD1 4.27Å; F548-Y749 HydrophobicContact CD1-CE1 4.35Å; F548-Y749 AromaticContact CE1-CD1 3.47Å; F548-Y749 HydrophobicContact CE1-CD1 3.47Å; F548-Y749 VanDerWaalsContact CE1-CD1 3.47Å; F548-Y749 AromaticContact CE1-CE1 3.87Å; F548-Y749 HydrophobicContact CE1-CE1 3.87Å; F548-Y749 AromaticContact CZ-CD1 3.78Å; F548-Y749 HydrophobicContact CZ-CD1 3.78Å; F548-Y749 HydrophobicContact CZ-CE1 4.06Å; F548-D756 HydrophobicContact CE2-CB 3.75Å; F548-D756 HydrophobicContact CZ-CB 3.76Å; F548-T757 HydrophobicContact CZ-CG2 4.16Å
549	Y	92.5	Very high	91.5	Very high	1 Å²	1	23.2 Å²	23.2	0%	0.004	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-93.8	45.4	175.6	-55.4	-83.3	0	0	0	111.7	V535 L538 Y546 Q547 F551 V552 P553 I746 Y749 H750	V535-Y549 HydrophobicContact CG1-CD2 3.49Å; V535-Y549 VanDerWaalsContact CG1-CD2 3.49Å; V535-Y549 HydrophobicContact CG1-CE2 4.28Å; V535-Y549 HydrophobicContact CG1-CG 3.81Å; V535-Y549 HydrophobicContact CG2-CG 4.34Å; L538-Y549 HydrophobicContact CB-CE2 4.14Å; L538-Y549 HydrophobicContact CD1-CE1 4.07Å; Y546-Y549 PolarHBondContact O-N 2.96Å; Q547-Y549 PolarHBondContact O-N 3.1Å; Y549-F551 PolarHBondContact O-N 2.85Å; Y549-V552 PolarHBondContact O-N 3.24Å; Y549-P553 WeakPolarHBondContact O-CD 3.43Å; Y549-I746 HydrophobicContact CD1-CG2 4.35Å; Y549-I746 HydrophobicContact CE1-CG2 4.42Å; Y549-Y749 HydrophobicContact CD1-CD1 4.25Å; Y549-Y749 HydrophobicContact CD1-CD2 4.35Å; Y549-Y749 HydrophobicContact CD1-CE1 4.34Å; Y549-Y749 HydrophobicContact CD1-CE2 4.48Å; Y549-Y749 HydrophobicContact CD1-CG 4.25Å; Y549-Y749 HydrophobicContact CE1-CD1 4.14Å; Y549-Y749 HydrophobicContact CE1-CG 4.06Å; Y549-H750 AromaticContact CE1-NE2 3.77Å; Y549-H750 AromaticContact CZ-NE2 3.66Å; Y549-H750 PolarHBondContact OH-CE1 3.47Å; Y549-H750 PolarHBondContact OH-NE2 3Å
550	Y	91.7	Very high	91.8	Very high	25 Å²	25	25.4 Å²	25.4	10%	0.098	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-41.6	-31.9	-163.9	77.7	-92.5	0	0	0	117	Q547 F548 V552 P553 L554 R633	Q547-Y550 WeakPolarHBondContact O-CA 3.18Å; Q547-Y550 WeakPolarHBondContact O-CB 3.46Å; Q547-Y550 PolarHBondContact O-N 3Å; Q547-Y550 VanDerWaalsContact O-N 3.12Å; F548-Y550 VanDerWaalsContact C-N 3.28Å; F548-Y550 PolarHBondContact O-N 3.1Å; Y550-V552 VanDerWaalsContact C-N 3.33Å; Y550-V552 PolarHBondContact O-N 3.31Å; Y550-P553 WeakPolarHBondContact O-CD 3.29Å; Y550-L554 VanDerWaalsContact O-CB 3.27Å; Y550-L554 WeakPolarHBondContact O-CB 3.43Å; Y550-L554 PolarHBondContact O-N 3.19Å; Y550-L554 VanDerWaalsContact O-N 3.13Å; Y550-R633 HydrophobicContact CD2-CB 4.42Å; Y550-R633 HydrophobicContact CD2-CG 3.99Å; Y550-R633 HydrophobicContact CG-CG 4.22Å
551	F	93.1	Very high	92.1	Very high	15 Å²	15	23.7 Å²	23.7	7%	0.066	12%	0.119	C	C	.	.	H	α-helix	trans	-63.3	-38.1	-179.5	-176.4	-108.7	0	0	0	112.2	V498 Y501 Y549 L554 V555 L742 F745	V498-F551 HydrophobicContact CG1-CE2 4.45Å; Y501-F551 HydrophobicContact CD1-CZ 4.26Å; Y501-F551 HydrophobicContact CG-CZ 4.13Å; Y549-F551 PolarHBondContact O-N 2.85Å; F551-L554 PolarHBondContact O-N 2.94Å; F551-V555 HydrophobicContact CD1-CG2 4.29Å; F551-V555 HydrophobicContact CD2-CG2 4.3Å; F551-V555 HydrophobicContact CE1-CG2 3.91Å; F551-V555 HydrophobicContact CE2-CG2 3.92Å; F551-V555 HydrophobicContact CG-CG2 4.48Å; F551-V555 HydrophobicContact CZ-CG2 3.72Å; F551-V555 WeakPolarHBondContact O-CG2 3.38Å; F551-V555 PolarHBondContact O-N 3.4Å; F551-L742 HydrophobicContact CD1-CD1 4.44Å; F551-L742 HydrophobicContact CE1-CD1 4.4Å; F551-F745 HydrophobicContact CB-CD1 4.16Å; F551-F745 HydrophobicContact CB-CE1 3.41Å; F551-F745 VanDerWaalsContact CB-CE1 3.41Å; F551-F745 HydrophobicContact CB-CZ 3.71Å; F551-F745 HydrophobicContact CD1-CD1 4.05Å; F551-F745 HydrophobicContact CD1-CE1 4.13Å; F551-F745 HydrophobicContact CD1-CG 4.45Å; F551-F745 HydrophobicContact CG-CD1 4.39Å; F551-F745 HydrophobicContact CG-CE1 4.01Å; F551-F745 HydrophobicContact CG-CZ 4.18Å
552	V	93.9	Very high	92.4	Very high	2 Å²	2	23.3 Å²	23.3	1%	0.012	12%	0.117	C	C	.	.	H	α-helix	trans	-71.4	-49.3	-179	-179.5	0	0	0	0	112.4	L531 N532 V535 Y546 Y549 Y550 L554 V555 T556 L742 I746	L531-V552 WeakPolarHBondContact O-CG1 3.44Å; N532-V552 WeakPolarHBondContact OD1-CG1 3.27Å; V535-V552 HydrophobicContact CB-CG1 4.41Å; V535-V552 HydrophobicContact CG2-CB 3.87Å; V535-V552 HydrophobicContact CG2-CG1 3.9Å; V535-V552 HydrophobicContact CG2-CG2 3.61Å; Y546-V552 HydrophobicContact CE2-CG1 4.35Å; Y549-V552 PolarHBondContact O-N 3.24Å; Y550-V552 VanDerWaalsContact C-N 3.33Å; Y550-V552 PolarHBondContact O-N 3.31Å; V552-L554 PolarHBondContact O-N 3.39Å; V552-V555 PolarHBondContact O-N 3.47Å; V552-T556 VanDerWaalsContact O-CB 3.27Å; V552-T556 WeakPolarHBondContact O-CB 3.3Å; V552-T556 PolarHBondContact O-N 2.76Å; V552-T556 PolarHBondContact O-OG1 2.94Å; V552-T556 VanDerWaalsContact O-OG1 3.13Å; V552-L742 HydrophobicContact CG2-CD1 4.01Å; V552-I746 HydrophobicContact CG2-CD1 3.93Å; V552-I746 HydrophobicContact CG2-CG1 4.18Å
553	P	92.9	Very high	92.7	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.013	13%	0.127	C	C	.	.	H	α-helix	trans	-50.7	-43.1	168.1	-20.7	24.4	0	0	0	112.8	Y546 Y549 Y550 F557 F621 W630	Y546-P553 HydrophobicContact CD1-CB 4.07Å; Y546-P553 HydrophobicContact CD1-CG 3.71Å; Y546-P553 HydrophobicContact CD2-CG 4.33Å; Y546-P553 HydrophobicContact CE1-CB 3.5Å; Y546-P553 VanDerWaalsContact CE1-CB 3.5Å; Y546-P553 HydrophobicContact CE1-CG 3.4Å; Y546-P553 VanDerWaalsContact CE1-CG 3.4Å; Y546-P553 HydrophobicContact CE2-CG 4.05Å; Y546-P553 HydrophobicContact CG-CG 4.14Å; Y546-P553 VanDerWaalsContact OH-CA 3.24Å; Y546-P553 WeakPolarHBondContact OH-CA 3.42Å; Y546-P553 VanDerWaalsContact OH-N 3.17Å; Y549-P553 WeakPolarHBondContact O-CD 3.43Å; Y550-P553 WeakPolarHBondContact O-CD 3.29Å; P553-F557 VanDerWaalsContact O-CB 3.3Å; P553-F557 WeakPolarHBondContact O-CB 3.06Å; P553-F557 PolarHBondContact O-N 3.24Å; P553-F621 HydrophobicContact CB-CE1 4.28Å; P553-W630 HydrophobicContact CB-CZ3 4.28Å
554	L	94.1	Very high	93	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-64.7	-51.9	-178.6	-171.6	63.8	0	0	0	112.3	L502 Y550 F551 V552 T556 F557 W558 W630	L502-L554 HydrophobicContact CD1-CD2 3.93Å; L502-L554 HydrophobicContact CD1-CG 4.36Å; L502-L554 HydrophobicContact CD2-CG 4.41Å; Y550-L554 VanDerWaalsContact O-CB 3.27Å; Y550-L554 WeakPolarHBondContact O-CB 3.43Å; Y550-L554 PolarHBondContact O-N 3.19Å; Y550-L554 VanDerWaalsContact O-N 3.13Å; F551-L554 PolarHBondContact O-N 2.94Å; V552-L554 PolarHBondContact O-N 3.39Å; L554-T556 VanDerWaalsContact C-N 3.34Å; L554-T556 PolarHBondContact O-N 3.34Å; L554-F557 PolarHBondContact O-N 3.13Å; L554-W558 PolarHBondContact O-N 3.15Å; L554-W630 HydrophobicContact CB-CZ3 4.14Å; L554-W630 HydrophobicContact CD1-CH2 3.93Å; L554-W630 HydrophobicContact CD1-CZ3 3.88Å
555	V	94.9	Very high	93.4	Very high	11 Å²	11	21.9 Å²	21.9	7%	0.067	12%	0.116	C	C	.	.	H	α-helix	trans	-64.2	-40.4	178.7	175	0	0	0	0	111.1	L502 T505 L531 F551 V552 W558 F559	L502-V555 HydrophobicContact CD2-CG2 3.83Å; T505-V555 HydrophobicContact CG2-CG1 4.21Å; L531-V555 HydrophobicContact CD1-CG1 4.17Å; L531-V555 HydrophobicContact CD2-CG1 4.14Å; F551-V555 HydrophobicContact CD1-CG2 4.29Å; F551-V555 HydrophobicContact CD2-CG2 4.3Å; F551-V555 HydrophobicContact CE1-CG2 3.91Å; F551-V555 HydrophobicContact CE2-CG2 3.92Å; F551-V555 HydrophobicContact CG-CG2 4.48Å; F551-V555 HydrophobicContact CZ-CG2 3.72Å; F551-V555 WeakPolarHBondContact O-CG2 3.38Å; F551-V555 PolarHBondContact O-N 3.4Å; V552-V555 PolarHBondContact O-N 3.47Å; V555-W558 PolarHBondContact O-N 2.68Å; V555-F559 WeakPolarHBondContact O-CB 3.32Å; V555-F559 PolarHBondContact O-N 3.4Å
556	T	94.6	Very high	93.5	Very high	22 Å²	22	20 Å²	20	14%	0.135	10%	0.103	C	C	.	.	H	α-helix	trans	-61	-46.1	176.1	-71.5	0	0	0	0	111.6	L528 N532 V552 L554 W558 F559 V560	L528-T556 HydrophobicContact CD2-CG2 3.8Å; N532-T556 PolarHBondContact ND2-OG1 3.33Å; N532-T556 PolarHBondContact OD1-OG1 2.92Å; V552-T556 VanDerWaalsContact O-CB 3.27Å; V552-T556 WeakPolarHBondContact O-CB 3.3Å; V552-T556 PolarHBondContact O-N 2.76Å; V552-T556 PolarHBondContact O-OG1 2.94Å; V552-T556 VanDerWaalsContact O-OG1 3.13Å; L554-T556 VanDerWaalsContact C-N 3.34Å; L554-T556 PolarHBondContact O-N 3.34Å; T556-W558 PolarHBondContact O-N 3.33Å; T556-F559 PolarHBondContact O-N 3.43Å; T556-V560 WeakPolarHBondContact O-CG2 3.4Å; T556-V560 PolarHBondContact O-N 3.32Å
557	F	94.9	Very high	93.6	Very high	49 Å²	49	19.4 Å²	19.4	22%	0.215	11%	0.105	C	C	.	.	H	α-helix	trans	-58	-49.2	176	172.3	-94.9	0	0	0	111.7	P553 L554 F559 V560 L561 F612 W630 W634	P553-F557 VanDerWaalsContact O-CB 3.3Å; P553-F557 WeakPolarHBondContact O-CB 3.06Å; P553-F557 PolarHBondContact O-N 3.24Å; L554-F557 PolarHBondContact O-N 3.13Å; F557-F559 PolarHBondContact O-N 3.41Å; F557-V560 PolarHBondContact O-N 2.73Å; F557-L561 HydrophobicContact CE1-CD2 4.31Å; F557-L561 PolarHBondContact O-N 2.73Å; F557-F612 HydrophobicContact CD2-CE1 4.49Å; F557-F612 HydrophobicContact CE2-CE1 4.07Å; F557-F612 AromaticContact CE2-CZ 3.73Å; F557-F612 HydrophobicContact CE2-CZ 3.73Å; F557-F612 HydrophobicContact CZ-CZ 4.18Å; F557-W630 HydrophobicContact CB-CH2 3.77Å; F557-W630 HydrophobicContact CB-CZ2 4.18Å; F557-W630 HydrophobicContact CD1-CH2 4.23Å; F557-W630 HydrophobicContact CD1-CZ2 4.2Å; F557-W630 HydrophobicContact CD2-CH2 4.5Å; F557-W630 HydrophobicContact CD2-CZ2 4.06Å; F557-W630 AromaticContact CG-CH2 3.91Å; F557-W630 HydrophobicContact CG-CH2 3.91Å; F557-W630 AromaticContact CG-CZ2 3.87Å; F557-W630 HydrophobicContact CG-CZ2 3.87Å; F557-W634 AromaticContact CE1-CD1 3.82Å; F557-W634 AromaticContact CE1-NE1 3.49Å
558	W	95.8	Very high	93.6	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.008	13%	0.131	C	C	.	.	H	α-helix	trans	-66.2	-37.3	180	-74.2	119.1	0	0	0	112.9	L554 V555 T556 L561 I562 I598 W634 R638 V641	L554-W558 PolarHBondContact O-N 3.15Å; V555-W558 PolarHBondContact O-N 2.68Å; T556-W558 PolarHBondContact O-N 3.33Å; W558-L561 HydrophobicContact CE3-CD2 3.63Å; W558-L561 HydrophobicContact CH2-CD2 4.49Å; W558-L561 HydrophobicContact CZ3-CD2 3.46Å; W558-L561 VanDerWaalsContact CZ3-CD2 3.46Å; W558-L561 PolarHBondContact O-N 2.87Å; W558-I562 WeakPolarHBondContact O-CD1 3.48Å; W558-I562 WeakPolarHBondContact O-CG1 2.87Å; W558-I562 PolarHBondContact O-N 3.17Å; W558-I598 HydrophobicContact CH2-CD1 4.11Å; W558-I598 HydrophobicContact CH2-CG1 4.31Å; W558-I598 HydrophobicContact CZ3-CD1 3.98Å; W558-I598 HydrophobicContact CZ3-CG1 4.41Å; W558-W634 HydrophobicContact CH2-CZ2 4.37Å; W558-W634 AromaticContact CH2-NE1 3.69Å; W558-W634 AromaticContact CZ2-CD1 3.8Å; W558-W634 AromaticContact CZ2-NE1 3.36Å; W558-R638 VanDerWaalsContact CH2-O 3.28Å; W558-R638 WeakPolarHBondContact CH2-O 3.45Å; W558-V641 HydrophobicContact CB-CG1 4.44Å; W558-V641 HydrophobicContact CB-CG2 3.86Å; W558-V641 HydrophobicContact CD2-CB 4.05Å; W558-V641 HydrophobicContact CD2-CG1 4.45Å; W558-V641 HydrophobicContact CD2-CG2 3.54Å; W558-V641 HydrophobicContact CE3-CB 3.8Å; W558-V641 HydrophobicContact CE3-CG1 3.99Å; W558-V641 HydrophobicContact CE3-CG2 3.84Å; W558-V641 HydrophobicContact CG-CB 4.43Å; W558-V641 HydrophobicContact CG-CG2 3.54Å; W558-V641 HydrophobicContact CZ3-CB 4.27Å
559	F	95.7	Very high	93.2	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.009	16%	0.164	C	C	.	.	H	α-helix	trans	-59.3	-46.6	173.4	169.8	-105.1	0	0	0	111.7	H509 F513 V524 V527 L528 V555 T556 F557 L561 I562 Y563	H509-F559 AromaticContact CD2-CD2 3.75Å; H509-F559 AromaticContact CE1-CD2 3.59Å; H509-F559 AromaticContact CE1-CE2 3.61Å; H509-F559 AromaticContact CG-CD2 3.8Å; H509-F559 AromaticContact ND1-CD2 3.71Å; H509-F559 AromaticContact ND1-CE2 3.56Å; H509-F559 AromaticContact NE2-CD2 3.63Å; F513-F559 HydrophobicContact CZ-CE2 4.36Å; V524-F559 HydrophobicContact CG1-CE1 4.08Å; V524-F559 HydrophobicContact CG1-CZ 4.49Å; V527-F559 HydrophobicContact CB-CE1 4.05Å; V527-F559 HydrophobicContact CB-CE2 4.2Å; V527-F559 HydrophobicContact CB-CZ 3.75Å; V527-F559 HydrophobicContact CG1-CD1 4.13Å; V527-F559 HydrophobicContact CG1-CD2 3.98Å; V527-F559 HydrophobicContact CG1-CE1 3.91Å; V527-F559 HydrophobicContact CG1-CE2 3.77Å; V527-F559 HydrophobicContact CG1-CG 4.16Å; V527-F559 HydrophobicContact CG1-CZ 3.72Å; V527-F559 HydrophobicContact CG2-CE2 4.4Å; V527-F559 HydrophobicContact CG2-CZ 4.21Å; L528-F559 HydrophobicContact CD2-CD1 3.79Å; L528-F559 HydrophobicContact CD2-CE1 4.06Å; L528-F559 HydrophobicContact CG-CD1 4.29Å; L528-F559 HydrophobicContact CG-CE1 4.04Å; V555-F559 WeakPolarHBondContact O-CB 3.32Å; V555-F559 PolarHBondContact O-N 3.4Å; T556-F559 PolarHBondContact O-N 3.43Å; F557-F559 PolarHBondContact O-N 3.41Å; F559-L561 VanDerWaalsContact C-N 3.3Å; F559-L561 PolarHBondContact O-N 3.12Å; F559-I562 PolarHBondContact O-N 3.28Å; F559-Y563 WeakPolarHBondContact O-CB 3.17Å; F559-Y563 PolarHBondContact O-N 3.44Å
560	V	94.8	Very high	92.9	Very high	69 Å²	69	34.7 Å²	34.7	42%	0.418	17%	0.173	S	C	.	.	H	α-helix	trans	-60.9	-41.2	176.9	172.5	0	0	0	0	110.8	L528 T556 F557 Y563 A564	L528-V560 HydrophobicContact CD2-CG2 4.15Å; T556-V560 WeakPolarHBondContact O-CG2 3.4Å; T556-V560 PolarHBondContact O-N 3.32Å; F557-V560 PolarHBondContact O-N 2.73Å; V560-Y563 PolarHBondContact O-N 3.22Å; V560-A564 WeakPolarHBondContact O-CB 3.48Å; V560-A564 PolarHBondContact O-N 2.92Å
561	L	94.8	Very high	92.8	Very high	41 Å²	41	37.6 Å²	37.6	22%	0.215	19%	0.187	C	C	.	.	H	α-helix	trans	-66.7	-40.9	178.6	-169.6	63.9	0	0	0	112.9	F557 W558 F559 A564 T565 L594	F557-L561 HydrophobicContact CE1-CD2 4.31Å; F557-L561 PolarHBondContact O-N 2.73Å; W558-L561 HydrophobicContact CE3-CD2 3.63Å; W558-L561 HydrophobicContact CH2-CD2 4.49Å; W558-L561 HydrophobicContact CZ3-CD2 3.46Å; W558-L561 VanDerWaalsContact CZ3-CD2 3.46Å; W558-L561 PolarHBondContact O-N 2.87Å; F559-L561 VanDerWaalsContact C-N 3.3Å; F559-L561 PolarHBondContact O-N 3.12Å; L561-A564 PolarHBondContact O-N 3.22Å; L561-T565 WeakPolarHBondContact O-CB 3.45Å; L561-T565 PolarHBondContact O-N 3.06Å; L561-T565 PolarHBondContact O-OG1 2.83Å; L561-L594 HydrophobicContact CD1-CD1 3.94Å; L561-L594 HydrophobicContact CD2-CD1 3.67Å; L561-L594 HydrophobicContact CG-CD1 3.7Å
562	I	94.9	Very high	92.3	Very high	1 Å²	1	37 Å²	37	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-61.1	-49.2	173.3	-65.5	158.2	0	0	0	109.7	T505 H509 F513 W558 F559 A564 T565 M566 V641 M645	T505-I562 HydrophobicContact CG2-CD1 4.24Å; H509-I562 HydrophobicContact CB-CD1 4.32Å; H509-I562 HydrophobicContact CB-CG2 3.97Å; F513-I562 HydrophobicContact CD2-CG2 4.37Å; F513-I562 HydrophobicContact CE2-CG2 4.39Å; W558-I562 WeakPolarHBondContact O-CD1 3.48Å; W558-I562 WeakPolarHBondContact O-CG1 2.87Å; W558-I562 PolarHBondContact O-N 3.17Å; F559-I562 PolarHBondContact O-N 3.28Å; I562-A564 PolarHBondContact O-N 3.07Å; I562-T565 PolarHBondContact O-N 2.62Å; I562-M566 VanDerWaalsContact O-CG 3.31Å; I562-M566 WeakPolarHBondContact O-CG 3.21Å; I562-M566 PolarHBondContact O-N 3.04Å; I562-M566 VanDerWaalsContact O-N 3.08Å; I562-V641 HydrophobicContact CD1-CG1 3.67Å; I562-V641 HydrophobicContact CG1-CG1 3.77Å; I562-M645 HydrophobicContact CG1-SD 3.92Å; I562-M645 HydrophobicContact CG2-CE 4.28Å
563	Y	94.4	Very high	92	Very high	58 Å²	58	39 Å²	39	23%	0.227	20%	0.195	C	C	.	.	H	α-helix	trans	-58.4	-49.2	178.5	172.2	-102.9	0	0	0	111.2	F513 F519 V524 F559 V560 T565 M566 A567	F513-Y563 HydrophobicContact CE1-CD2 4.03Å; F513-Y563 HydrophobicContact CE2-CD2 4.39Å; F513-Y563 AromaticContact CZ-CD2 3.73Å; F513-Y563 HydrophobicContact CZ-CD2 3.73Å; F519-Y563 HydrophobicContact CB-CE2 4.33Å; F519-Y563 HydrophobicContact CD1-CD2 4.47Å; F519-Y563 HydrophobicContact CD1-CE2 4.15Å; F519-Y563 PolarHBondContact O-OH 3Å; V524-Y563 HydrophobicContact CG2-CD1 4.48Å; V524-Y563 HydrophobicContact CG2-CD2 3.71Å; V524-Y563 HydrophobicContact CG2-CE1 4.25Å; V524-Y563 HydrophobicContact CG2-CE2 3.42Å; V524-Y563 VanDerWaalsContact CG2-CE2 3.42Å; V524-Y563 HydrophobicContact CG2-CG 4.23Å; F559-Y563 WeakPolarHBondContact O-CB 3.17Å; F559-Y563 PolarHBondContact O-N 3.44Å; V560-Y563 PolarHBondContact O-N 3.22Å; Y563-T565 PolarHBondContact O-N 3.22Å; Y563-M566 PolarHBondContact O-N 3.31Å; Y563-A567 HydrophobicContact CD2-CB 4.42Å; Y563-A567 HydrophobicContact CE1-CB 4.29Å; Y563-A567 HydrophobicContact CE2-CB 4.09Å; Y563-A567 WeakPolarHBondContact O-CB 3.09Å; Y563-A567 PolarHBondContact O-N 3.5Å
564	A	93.8	Very high	91.5	Very high	33 Å²	33	41.4 Å²	41.4	27%	0.273	21%	0.206	S	C	.	.	H	α-helix	trans	-57.9	-48.6	178.1	0	0	0	0	0	111.8	V560 L561 I562 M566 A567 I568	V560-A564 WeakPolarHBondContact O-CB 3.48Å; V560-A564 PolarHBondContact O-N 2.92Å; L561-A564 PolarHBondContact O-N 3.22Å; I562-A564 PolarHBondContact O-N 3.07Å; A564-M566 VanDerWaalsContact C-N 3.28Å; A564-M566 PolarHBondContact O-N 3.14Å; A564-A567 PolarHBondContact O-N 2.81Å; A564-I568 HydrophobicContact CB-CD1 4.46Å; A564-I568 WeakPolarHBondContact O-CB 3.45Å; A564-I568 WeakPolarHBondContact O-CD1 3.45Å; A564-I568 WeakPolarHBondContact O-CG1 3.45Å; A564-I568 PolarHBondContact O-N 2.86Å
565	T	93.9	Very high	90.9	Very high	18 Å²	18	50.1 Å²	50.1	11%	0.11	24%	0.244	C	C	.	.	H	α-helix	trans	-57.9	-41	179.9	-55.9	0	0	0	0	112.1	L561 I562 Y563 K590 L594 M645	L561-T565 WeakPolarHBondContact O-CB 3.45Å; L561-T565 PolarHBondContact O-N 3.06Å; L561-T565 PolarHBondContact O-OG1 2.83Å; I562-T565 PolarHBondContact O-N 2.62Å; Y563-T565 PolarHBondContact O-N 3.22Å; T565-K590 HydrophobicContact CG2-CB 4.37Å; T565-K590 PolarHBondContact O-NZ 3.34Å; T565-K590 VanDerWaalsContact O-NZ 3.07Å; T565-L594 HydrophobicContact CG2-CB 4.46Å; T565-L594 HydrophobicContact CG2-CD2 4.32Å; T565-M645 HydrophobicContact CG2-CE 4.33Å
566	M	92.8	Very high	90.2	Very high	2 Å²	2	53 Å²	53	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-79.6	-37.1	-178.5	-63.6	-62.3	-70.6	0	0	112.7	F510 F513 W514 F519 I562 Y563 A564 I587	F510-M566 HydrophobicContact CD2-CE 3.98Å; F510-M566 HydrophobicContact CD2-CG 4.5Å; F510-M566 HydrophobicContact CD2-SD 3.58Å; F510-M566 VanDerWaalsContact CD2-SD 3.58Å; F510-M566 HydrophobicContact CE2-CE 3.82Å; F510-M566 HydrophobicContact CE2-SD 3.52Å; F510-M566 VanDerWaalsContact CE2-SD 3.52Å; F510-M566 HydrophobicContact CZ-CE 4.4Å; F513-M566 HydrophobicContact CB-CB 4.33Å; F513-M566 HydrophobicContact CB-CE 4.19Å; F513-M566 HydrophobicContact CB-CG 4.42Å; F513-M566 HydrophobicContact CD2-CB 4.46Å; F513-M566 HydrophobicContact CD2-CG 4.41Å; W514-M566 HydrophobicContact CE3-CE 4.3Å; F519-M566 HydrophobicContact CE1-CB 3.74Å; F519-M566 HydrophobicContact CZ-CB 4.3Å; I562-M566 VanDerWaalsContact O-CG 3.31Å; I562-M566 WeakPolarHBondContact O-CG 3.21Å; I562-M566 PolarHBondContact O-N 3.04Å; I562-M566 VanDerWaalsContact O-N 3.08Å; Y563-M566 PolarHBondContact O-N 3.31Å; A564-M566 VanDerWaalsContact C-N 3.28Å; A564-M566 PolarHBondContact O-N 3.14Å; M566-I587 HydrophobicContact CE-CD1 4.42Å; M566-I587 HydrophobicContact SD-CD1 4.03Å
567	A	91.2	Very high	89.5	Confident	21 Å²	21	52.1 Å²	52.1	17%	0.174	25%	0.25	C	C	.	.	H	α-helix	trans	-80.4	-31.7	-175.5	0	0	0	0	0	113.7	F519 Y563 A564 W569 Q571	F519-A567 HydrophobicContact CD1-CB 3.89Å; F519-A567 HydrophobicContact CE1-CB 4.32Å; Y563-A567 HydrophobicContact CD2-CB 4.42Å; Y563-A567 HydrophobicContact CE1-CB 4.29Å; Y563-A567 HydrophobicContact CE2-CB 4.09Å; Y563-A567 WeakPolarHBondContact O-CB 3.09Å; Y563-A567 PolarHBondContact O-N 3.5Å; A564-A567 PolarHBondContact O-N 2.81Å; A567-W569 PolarHBondContact O-N 3.22Å; A567-Q571 WeakPolarHBondContact O-CG 3.38Å
568	I	90	Very high	88.6	Confident	109 Å²	109	53.9 Å²	53.9	56%	0.559	26%	0.262	S	S	*	.	S	Bend	trans	-55.1	135.8	176.7	-75	163.8	0	0	0	109.4	A564 P570 K590	A564-I568 HydrophobicContact CB-CD1 4.46Å; A564-I568 WeakPolarHBondContact O-CB 3.45Å; A564-I568 WeakPolarHBondContact O-CD1 3.45Å; A564-I568 WeakPolarHBondContact O-CG1 3.45Å; A564-I568 PolarHBondContact O-N 2.86Å; I568-P570 CarbonylContact O-C 3.43Å; I568-K590 PolarHBondContact O-NZ 3.07Å
569	W	83.1	Confident	87.8	Confident	217 Å²	217	58.4 Å²	58.4	82%	0.822	29%	0.294	S	S	*	.	S	Bend	trans	-63.1	139	-178.4	-173.1	93.6	0	0	0	111.4	A567	A567-W569 PolarHBondContact O-N 3.22Å
570	P	86.4	Confident	87.2	Confident	30 Å²	30	60.2 Å²	60.2	20%	0.195	31%	0.306	C	S	.	.	S	Bend	cis	-80.7	139.4	0.1	30.6	-33.1	0	0	0	112.8	I568 I572 W583 K590	I568-P570 CarbonylContact O-C 3.43Å; P570-I572 HydrophobicContact CG-CD1 4.49Å; P570-I572 HydrophobicContact CG-CG1 4.4Å; P570-I572 WeakPolarHBondContact O-CG1 3.45Å; P570-I572 PolarHBondContact O-N 3.3Å; P570-W583 HydrophobicContact CB-CH2 4.08Å; P570-W583 HydrophobicContact CB-CZ3 3.68Å; P570-W583 HydrophobicContact CG-CH2 4.39Å; P570-W583 HydrophobicContact CG-CZ3 3.66Å; P570-K590 WeakPolarHBondContact O-CE 3.19Å; P570-K590 PolarHBondContact O-NZ 2.85Å
571	Q	87.9	Confident	86.6	Confident	86 Å²	86	59 Å²	59	40%	0.402	31%	0.309	S	S	.	.			trans	-72.9	113.7	170.9	-68.3	176	-3.1	0	0	109.2	F519 A567 L573	F519-Q571 HydrophobicContact CE2-CB 4.48Å; F519-Q571 HydrophobicContact CE2-CG 4.44Å; A567-Q571 WeakPolarHBondContact O-CG 3.38Å; Q571-L573 HydrophobicContact CB-CD1 4.14Å
572	I	84.5	Confident	86.2	Confident	2 Å²	2	63 Å²	63	1%	0.01	33%	0.328	C	S	.	.			trans	-106.2	111.8	-176.9	-55	176.2	0	0	0	107.8	W514 P570 T577 W583 G586 I587 K590	W514-I572 HydrophobicContact CH2-CG2 4.09Å; W514-I572 HydrophobicContact CZ3-CG2 3.81Å; P570-I572 HydrophobicContact CG-CD1 4.49Å; P570-I572 HydrophobicContact CG-CG1 4.4Å; P570-I572 WeakPolarHBondContact O-CG1 3.45Å; P570-I572 PolarHBondContact O-N 3.3Å; I572-T577 HydrophobicContact CG2-CG2 4.38Å; I572-W583 HydrophobicContact CD1-CE3 3.94Å; I572-W583 HydrophobicContact CD1-CZ3 4.46Å; I572-W583 HydrophobicContact CG1-CE3 3.75Å; I572-W583 HydrophobicContact CG1-CZ3 4.19Å; I572-W583 HydrophobicContact CG2-CB 4.09Å; I572-G586 VanDerWaalsContact CD1-C 3.44Å; I572-I587 HydrophobicContact CB-CD1 4.28Å; I572-I587 HydrophobicContact CD1-CB 4.28Å; I572-I587 HydrophobicContact CD1-CD1 4.27Å; I572-K590 HydrophobicContact CD1-CD 4.34Å
573	L	86.4	Confident	85.9	Confident	43 Å²	43	66.1 Å²	66.1	23%	0.225	34%	0.34	C	S	.	.			trans	-113.1	161.6	177.3	-64.1	87.9	0	0	0	110	Q571 K575 K576 T577	Q571-L573 HydrophobicContact CB-CD1 4.14Å; L573-K575 PolarHBondContact O-N 2.87Å; L573-K576 PolarHBondContact O-N 3.49Å; L573-T577 PolarHBondContact O-N 2.68Å; L573-T577 PolarHBondContact O-OG1 3.07Å
574	Q	83.4	Confident	85.6	Confident	54 Å²	54	66 Å²	66	25%	0.252	34%	0.34	S	S	.	.	H	α-helix	trans	-51.9	-42.1	175.4	-165.5	-177.9	28.3	0	0	112.8	W514 L515 K576 T577 N578	W514-Q574 PolarHBondContact O-N 2.03Å; W514-Q574 VanDerWaalsContact O-N 3.17Å; L515-Q574 VanDerWaalsContact CD2-OE1 3.22Å; Q574-K576 VanDerWaalsContact C-N 3.31Å; Q574-K576 PolarHBondContact O-N 3.12Å; Q574-T577 WeakPolarHBondContact CA-OG1 3.41Å; Q574-T577 PolarHBondContact O-N 3.12Å; Q574-T577 PolarHBondContact O-OG1 3.45Å; Q574-N578 PolarHBondContact O-N 3.43Å; Q574-N578 PolarHBondContact O-OD1 3.49Å; Q574-N578 VanDerWaalsContact O-OD1 3.1Å
575	K	81.6	Confident	85.4	Confident	182 Å²	182	71.7 Å²	71.7	79%	0.791	36%	0.359	S	S	*	.	H	α-helix	trans	-59.6	-40.3	178.8	-67.4	-175.4	-179	-179.5	0	112.4	L573 N578	L573-K575 PolarHBondContact O-N 2.87Å; K575-N578 PolarHBondContact O-N 3.44Å
576	K	79.4	Confident	85.3	Confident	73 Å²	73	72 Å²	72	32%	0.317	37%	0.366	S	S	.	.	H	α-helix	trans	-76.2	-32.3	-179	-159	-176.1	-168	-170.9	0	112.2	L573 Q574 N578 S579 W583	L573-K576 PolarHBondContact O-N 3.49Å; Q574-K576 VanDerWaalsContact C-N 3.31Å; Q574-K576 PolarHBondContact O-N 3.12Å; K576-N578 VanDerWaalsContact C-N 3.3Å; K576-S579 PolarHBondContact O-N 2.75Å; K576-S579 PolarHBondContact O-OG 2.95Å; K576-W583 HydrophobicContact CD-CD2 4.07Å; K576-W583 HydrophobicContact CD-CE3 4.47Å; K576-W583 HydrophobicContact CD-CH2 4.5Å; K576-W583 HydrophobicContact CD-CZ2 4.09Å; K576-W583 VanDerWaalsContact CE-CE2 3.5Å; K576-W583 HydrophobicContact CG-CD2 4.29Å; K576-W583 HydrophobicContact CG-CG 4.31Å; K576-W583 VanDerWaalsContact NZ-CZ2 3.29Å
577	T	79.5	Confident	85.3	Confident	2 Å²	2	72 Å²	72	1%	0.012	37%	0.365	C	S	.	.	H	α-helix	trans	-71	-27.1	172.8	7.8	0	0	0	0	112.7	W514 I572 L573 Q574 S579 S580 W583 Y584	W514-T577 HydrophobicContact CH2-CG2 3.8Å; W514-T577 HydrophobicContact CZ2-CG2 4.14Å; W514-T577 VanDerWaalsContact CZ2-OG1 3.3Å; W514-T577 WeakPolarHBondContact CZ2-OG1 3.41Å; I572-T577 HydrophobicContact CG2-CG2 4.38Å; L573-T577 PolarHBondContact O-N 2.68Å; L573-T577 PolarHBondContact O-OG1 3.07Å; Q574-T577 WeakPolarHBondContact CA-OG1 3.41Å; Q574-T577 PolarHBondContact O-N 3.12Å; Q574-T577 PolarHBondContact O-OG1 3.45Å; T577-S579 VanDerWaalsContact C-N 3.32Å; T577-S580 CarbonylContact O-C 3.55Å; T577-W583 VanDerWaalsContact CG2-C 3.46Å; T577-W583 HydrophobicContact CG2-CB 3.51Å; T577-Y584 HydrophobicContact CG2-CD1 3.78Å; T577-Y584 HydrophobicContact CG2-CD2 3.69Å; T577-Y584 HydrophobicContact CG2-CE1 3.88Å; T577-Y584 HydrophobicContact CG2-CE2 3.81Å; T577-Y584 HydrophobicContact CG2-CG 3.68Å
578	N	77.3	Confident	85.3	Confident	87 Å²	87	75.5 Å²	75.5	47%	0.465	38%	0.381	S	S	.	.	H	α-helix	trans	-68.3	-32.3	174.8	-66.9	-5.2	0	0	0	112.4	Q574 K575 K576 K656	Q574-N578 PolarHBondContact O-N 3.43Å; Q574-N578 PolarHBondContact O-OD1 3.49Å; Q574-N578 VanDerWaalsContact O-OD1 3.1Å; K575-N578 PolarHBondContact O-N 3.44Å; K576-N578 VanDerWaalsContact C-N 3.3Å; N578-K656 WeakPolarHBondContact OD1-CE 3.15Å; N578-K656 PolarHBondContact OD1-NZ 2.93Å
579	S	77.5	Confident	85.5	Confident	96 Å²	96	73.2 Å²	73.2	67%	0.671	38%	0.379	S	S	*	.	H	α-helix	trans	-80.2	-26.9	-179.1	56	0	0	0	0	113.8	K576 T577	K576-S579 PolarHBondContact O-N 2.75Å; K576-S579 PolarHBondContact O-OG 2.95Å; T577-S579 VanDerWaalsContact C-N 3.32Å
580	S	83.1	Confident	86.1	Confident	40 Å²	40	64.4 Å²	64.4	28%	0.28	35%	0.346	S	S	.	.			trans	-150.6	130.9	175.8	173.7	0	0	0	0	111.8	T577 I582 W583	T577-S580 CarbonylContact O-C 3.55Å; S580-I582 PolarHBondContact O-N 2.78Å; S580-I582 PolarHBondContact OG-N 2.97Å; S580-W583 PolarHBondContact O-N 2.73Å
581	G	82.3	Confident	86.5	Confident	45 Å²	45	63.2 Å²	63.2	46%	0.464	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-22.3	178.7	0	0	0	0	0	114.1	W583 Y584	G581-W583 PolarHBondContact O-N 3.36Å; G581-Y584 WeakPolarHBondContact O-CB 3.35Å; G581-Y584 PolarHBondContact O-N 2.85Å
582	I	87.8	Confident	86.8	Confident	123 Å²	123	63.7 Å²	63.7	63%	0.631	34%	0.343	S	S	*	.	H	α-helix	trans	-58.3	-32.9	179.4	-63.2	168.2	0	0	0	111.2	S580 Y584 F585 G586	S580-I582 PolarHBondContact O-N 2.78Å; S580-I582 PolarHBondContact OG-N 2.97Å; I582-Y584 PolarHBondContact O-N 3.32Å; I582-F585 WeakPolarHBondContact O-CB 3.35Å; I582-F585 PolarHBondContact O-N 3.44Å; I582-F585 VanDerWaalsContact O-N 3.09Å; I582-G586 PolarHBondContact O-N 3.32Å
583	W	87.9	Confident	87.4	Confident	67 Å²	67	65 Å²	65	25%	0.254	36%	0.357	S	S	.	.	H	α-helix	trans	-69.3	-19.4	-179.4	-65.5	111	0	0	0	113.7	P570 I572 K576 T577 S580 G581 G586 I587	P570-W583 HydrophobicContact CB-CH2 4.08Å; P570-W583 HydrophobicContact CB-CZ3 3.68Å; P570-W583 HydrophobicContact CG-CH2 4.39Å; P570-W583 HydrophobicContact CG-CZ3 3.66Å; I572-W583 HydrophobicContact CD1-CE3 3.94Å; I572-W583 HydrophobicContact CD1-CZ3 4.46Å; I572-W583 HydrophobicContact CG1-CE3 3.75Å; I572-W583 HydrophobicContact CG1-CZ3 4.19Å; I572-W583 HydrophobicContact CG2-CB 4.09Å; K576-W583 HydrophobicContact CD-CD2 4.07Å; K576-W583 HydrophobicContact CD-CE3 4.47Å; K576-W583 HydrophobicContact CD-CH2 4.5Å; K576-W583 HydrophobicContact CD-CZ2 4.09Å; K576-W583 VanDerWaalsContact CE-CE2 3.5Å; K576-W583 HydrophobicContact CG-CD2 4.29Å; K576-W583 HydrophobicContact CG-CG 4.31Å; K576-W583 VanDerWaalsContact NZ-CZ2 3.29Å; T577-W583 VanDerWaalsContact CG2-C 3.46Å; T577-W583 HydrophobicContact CG2-CB 3.51Å; S580-W583 PolarHBondContact O-N 2.73Å; G581-W583 PolarHBondContact O-N 3.36Å; W583-G586 PolarHBondContact O-N 3.36Å; W583-I587 PolarHBondContact O-N 2.93Å; W583-I587 VanDerWaalsContact O-N 3.12Å
584	Y	88.1	Confident	87.8	Confident	55 Å²	55	63.3 Å²	63.3	22%	0.216	35%	0.348	C	S	.	.	H	α-helix	trans	-68.2	-40.5	169.6	-72.8	-76.6	0	0	0	111	W514 T577 G581 I582 G586 I587 L588 F649 V653 K656	W514-Y584 HydrophobicContact CZ2-CE1 4.46Å; T577-Y584 HydrophobicContact CG2-CD1 3.78Å; T577-Y584 HydrophobicContact CG2-CD2 3.69Å; T577-Y584 HydrophobicContact CG2-CE1 3.88Å; T577-Y584 HydrophobicContact CG2-CE2 3.81Å; T577-Y584 HydrophobicContact CG2-CG 3.68Å; G581-Y584 WeakPolarHBondContact O-CB 3.35Å; G581-Y584 PolarHBondContact O-N 2.85Å; I582-Y584 PolarHBondContact O-N 3.32Å; Y584-G586 VanDerWaalsContact C-N 3.32Å; Y584-I587 WeakPolarHBondContact O-CG2 3.16Å; Y584-I587 PolarHBondContact O-N 3.41Å; Y584-L588 PolarHBondContact O-N 3.35Å; Y584-F649 AromaticContact CD1-CE2 3.73Å; Y584-F649 HydrophobicContact CD1-CE2 3.73Å; Y584-F649 AromaticContact CD1-CZ 3.75Å; Y584-F649 HydrophobicContact CD1-CZ 3.75Å; Y584-F649 HydrophobicContact CE1-CE2 4.29Å; Y584-V653 HydrophobicContact CD1-CG2 4.09Å; Y584-V653 HydrophobicContact CE1-CG2 3.71Å; Y584-K656 WeakPolarHBondContact OH-CD 3.43Å; Y584-K656 PolarHBondContact OH-NZ 3.25Å
585	F	89.5	Confident	88.4	Confident	153 Å²	153	63.6 Å²	63.6	67%	0.671	35%	0.351	S	S	*	.	H	α-helix	trans	-67.5	-35.9	171.9	-66.2	-75.6	0	0	0	111.6	I582 I587 L588 A589	I582-F585 WeakPolarHBondContact O-CB 3.35Å; I582-F585 PolarHBondContact O-N 3.44Å; I582-F585 VanDerWaalsContact O-N 3.09Å; F585-I587 PolarHBondContact O-N 3.31Å; F585-L588 PolarHBondContact O-N 2.77Å; F585-A589 WeakPolarHBondContact O-CB 3.45Å; F585-A589 PolarHBondContact O-N 3.42Å
586	G	91	Very high	89.1	Confident	25 Å²	25	60.2 Å²	60.2	26%	0.258	34%	0.341	S	S	.	.	H	α-helix	trans	-58.2	-42.4	175	0	0	0	0	0	113.5	I572 I582 W583 Y584 K590	I572-G586 VanDerWaalsContact CD1-C 3.44Å; I582-G586 PolarHBondContact O-N 3.32Å; W583-G586 PolarHBondContact O-N 3.36Å; Y584-G586 VanDerWaalsContact C-N 3.32Å; G586-K590 PolarHBondContact O-N 3.06Å
587	I	92.6	Very high	89.7	Confident	1 Å²	1	61 Å²	61	1%	0.005	35%	0.347	C	S	.	.	H	α-helix	trans	-74.1	-35.7	177.1	-154.1	61.5	0	0	0	112.1	F510 W514 M566 I572 W583 Y584 F585 A589 K590 L591 F649	F510-I587 HydrophobicContact CE2-CG1 4.22Å; F510-I587 HydrophobicContact CZ-CG1 4.23Å; W514-I587 HydrophobicContact CE3-CG1 4.44Å; W514-I587 HydrophobicContact CH2-CB 4.47Å; W514-I587 HydrophobicContact CH2-CG2 4.17Å; W514-I587 HydrophobicContact CZ3-CB 3.99Å; W514-I587 HydrophobicContact CZ3-CD1 4.29Å; W514-I587 HydrophobicContact CZ3-CG1 3.77Å; W514-I587 HydrophobicContact CZ3-CG2 4.05Å; M566-I587 HydrophobicContact CE-CD1 4.42Å; M566-I587 HydrophobicContact SD-CD1 4.03Å; I572-I587 HydrophobicContact CB-CD1 4.28Å; I572-I587 HydrophobicContact CD1-CB 4.28Å; I572-I587 HydrophobicContact CD1-CD1 4.27Å; W583-I587 PolarHBondContact O-N 2.93Å; W583-I587 VanDerWaalsContact O-N 3.12Å; Y584-I587 WeakPolarHBondContact O-CG2 3.16Å; Y584-I587 PolarHBondContact O-N 3.41Å; F585-I587 PolarHBondContact O-N 3.31Å; I587-A589 VanDerWaalsContact C-N 3.29Å; I587-A589 PolarHBondContact O-N 2.83Å; I587-K590 HydrophobicContact CD1-CB 4.35Å; I587-K590 HydrophobicContact CD1-CD 3.89Å; I587-K590 WeakPolarHBondContact O-CB 3.28Å; I587-K590 PolarHBondContact O-N 3.35Å; I587-L591 WeakPolarHBondContact O-CG 3.45Å; I587-L591 PolarHBondContact O-N 3.47Å; I587-F649 HydrophobicContact CG2-CD2 3.71Å; I587-F649 HydrophobicContact CG2-CE1 4.35Å; I587-F649 HydrophobicContact CG2-CE2 3.27Å; I587-F649 HydrophobicContact CG2-CG 4.41Å; I587-F649 HydrophobicContact CG2-CZ 3.61Å
588	L	92.5	Very high	90.5	Very high	95 Å²	95	61 Å²	61	50%	0.497	35%	0.348	S	S	.	.	H	α-helix	trans	-62.4	-39.7	175	-171.9	62.8	0	0	0	111.3	Y584 F585 L591 L592	Y584-L588 PolarHBondContact O-N 3.35Å; F585-L588 PolarHBondContact O-N 2.77Å; L588-L591 PolarHBondContact O-N 2.96Å; L588-L592 WeakPolarHBondContact O-CB 2.97Å; L588-L592 PolarHBondContact O-N 3.49Å
589	A	93.8	Very high	91.2	Very high	62 Å²	62	59.4 Å²	59.4	51%	0.512	34%	0.342	S	S	.	.	H	α-helix	trans	-62.4	-41	173.6	0	0	0	0	0	112.2	F585 I587 L592 G593	F585-A589 WeakPolarHBondContact O-CB 3.45Å; F585-A589 PolarHBondContact O-N 3.42Å; I587-A589 VanDerWaalsContact C-N 3.29Å; I587-A589 PolarHBondContact O-N 2.83Å; A589-L592 PolarHBondContact O-N 3.29Å; A589-G593 PolarHBondContact O-N 3.31Å
590	K	94.6	Very high	92	Very high	32 Å²	32	60.6 Å²	60.6	14%	0.139	34%	0.336	C	S	.	.	H	α-helix	trans	-62.9	-43.9	173.9	-76.9	-177.2	160.6	-158.2	0	112.6	T565 I568 P570 I572 G586 I587 G593 L594	T565-K590 HydrophobicContact CG2-CB 4.37Å; T565-K590 PolarHBondContact O-NZ 3.34Å; T565-K590 VanDerWaalsContact O-NZ 3.07Å; I568-K590 PolarHBondContact O-NZ 3.07Å; P570-K590 WeakPolarHBondContact O-CE 3.19Å; P570-K590 PolarHBondContact O-NZ 2.85Å; I572-K590 HydrophobicContact CD1-CD 4.34Å; G586-K590 PolarHBondContact O-N 3.06Å; I587-K590 HydrophobicContact CD1-CB 4.35Å; I587-K590 HydrophobicContact CD1-CD 3.89Å; I587-K590 WeakPolarHBondContact O-CB 3.28Å; I587-K590 PolarHBondContact O-N 3.35Å; K590-G593 PolarHBondContact O-N 2.88Å; K590-L594 PolarHBondContact O-N 3.45Å
591	L	95.3	Very high	92.4	Very high	5 Å²	5	60.8 Å²	60.8	3%	0.026	33%	0.332	C	S	.	.	H	α-helix	trans	-65.4	-40.2	177	-66.4	176.5	0	0	0	111.3	I587 L588 L594 L595 I642 M645 V646	I587-L591 WeakPolarHBondContact O-CG 3.45Å; I587-L591 PolarHBondContact O-N 3.47Å; L588-L591 PolarHBondContact O-N 2.96Å; L591-L594 PolarHBondContact O-N 3.34Å; L591-L595 PolarHBondContact O-N 2.72Å; L591-I642 WeakPolarHBondContact O-CD1 3.29Å; L591-M645 HydrophobicContact CD2-CB 3.96Å; L591-M645 HydrophobicContact CD2-CE 3.76Å; L591-M645 HydrophobicContact CD2-SD 4.37Å; L591-V646 HydrophobicContact CD1-CG2 4.03Å
592	L	95.8	Very high	92.8	Very high	96 Å²	96	59.5 Å²	59.5	50%	0.503	32%	0.317	S	S	.	.	H	α-helix	trans	-63	-44	173.7	-178.9	62.1	0	0	0	111.5	L588 A589 L594 L595 L596	L588-L592 WeakPolarHBondContact O-CB 2.97Å; L588-L592 PolarHBondContact O-N 3.49Å; A589-L592 PolarHBondContact O-N 3.29Å; L592-L594 VanDerWaalsContact C-N 3.33Å; L592-L594 PolarHBondContact O-N 3.1Å; L592-L595 WeakPolarHBondContact O-CB 3.11Å; L592-L595 PolarHBondContact O-N 2.02Å; L592-L596 HydrophobicContact CD1-CG 4.49Å; L592-L596 HydrophobicContact CG-CD1 4.38Å; L592-L596 WeakPolarHBondContact O-CG 3.3Å; L592-L596 PolarHBondContact O-N 3.13Å
593	G	95.3	Very high	92.9	Very high	29 Å²	29	62.9 Å²	62.9	30%	0.299	33%	0.327	S	S	.	.	H	α-helix	trans	-58.3	-44.6	174.5	0	0	0	0	0	112.3	A589 K590 L595 L596 I597	A589-G593 PolarHBondContact O-N 3.31Å; K590-G593 PolarHBondContact O-N 2.88Å; G593-L595 PolarHBondContact O-N 3.48Å; G593-L596 PolarHBondContact O-N 2.97Å; G593-I597 WeakPolarHBondContact O-CG1 3.12Å; G593-I597 PolarHBondContact O-N 3.25Å
594	L	95.4	Very high	93	Very high	8 Å²	8	61.5 Å²	61.5	4%	0.042	33%	0.328	C	S	.	.	H	α-helix	trans	-61	-43.4	174.1	178.7	62	0	0	0	112	L561 T565 K590 L591 L592 L596 I597 I598 I642 M645	L561-L594 HydrophobicContact CD1-CD1 3.94Å; L561-L594 HydrophobicContact CD2-CD1 3.67Å; L561-L594 HydrophobicContact CG-CD1 3.7Å; T565-L594 HydrophobicContact CG2-CB 4.46Å; T565-L594 HydrophobicContact CG2-CD2 4.32Å; K590-L594 PolarHBondContact O-N 3.45Å; L591-L594 PolarHBondContact O-N 3.34Å; L592-L594 VanDerWaalsContact C-N 3.33Å; L592-L594 PolarHBondContact O-N 3.1Å; L594-L596 PolarHBondContact O-N 2.77Å; L594-I597 PolarHBondContact O-N 3.12Å; L594-I598 HydrophobicContact CD1-CD1 4.27Å; L594-I598 HydrophobicContact CG-CD1 4.07Å; L594-I598 WeakPolarHBondContact O-CG1 3.31Å; L594-I598 PolarHBondContact O-N 2.66Å; L594-I642 HydrophobicContact CB-CD1 4.38Å; L594-I642 HydrophobicContact CD2-CD1 4.37Å; L594-I642 HydrophobicContact CG-CD1 4.27Å; L594-M645 HydrophobicContact CD2-CE 4.26Å; L594-M645 HydrophobicContact CD2-SD 3.81Å
595	L	95.9	Very high	93.1	Very high	60 Å²	60	63.9 Å²	63.9	31%	0.314	34%	0.339	S	S	.	.	H	α-helix	trans	-59.7	-45.5	176.5	-176.9	60.2	0	0	0	111.5	L591 L592 G593 I597 I598 C599 F639 I642	L591-L595 PolarHBondContact O-N 2.72Å; L592-L595 WeakPolarHBondContact O-CB 3.11Å; L592-L595 PolarHBondContact O-N 2.02Å; G593-L595 PolarHBondContact O-N 3.48Å; L595-I597 VanDerWaalsContact C-N 3.33Å; L595-I597 PolarHBondContact O-N 3.03Å; L595-I598 PolarHBondContact O-N 3.48Å; L595-C599 WeakPolarHBondContact O-CB 3.46Å; L595-C599 PolarHBondContact O-N 3.39Å; L595-C599 PolarHBondContact O-SG 3.19Å; L595-C599 VanDerWaalsContact O-SG 3.35Å; L595-F639 HydrophobicContact CD1-CD1 4.02Å; L595-F639 HydrophobicContact CD1-CE1 4Å; L595-I642 HydrophobicContact CB-CD1 3.57Å; L595-I642 HydrophobicContact CD1-CD1 4.15Å; L595-I642 HydrophobicContact CG-CD1 4.4Å
596	L	95.6	Very high	93	Very high	111 Å²	111	61.1 Å²	61.1	58%	0.581	34%	0.339	S	S	*	.	H	α-helix	trans	-62.4	-40.4	178.8	-68.8	174.7	0	0	0	111.7	L592 G593 L594 C599 F600	L592-L596 HydrophobicContact CD1-CG 4.49Å; L592-L596 HydrophobicContact CG-CD1 4.38Å; L592-L596 WeakPolarHBondContact O-CG 3.3Å; L592-L596 PolarHBondContact O-N 3.13Å; G593-L596 PolarHBondContact O-N 2.97Å; L594-L596 PolarHBondContact O-N 2.77Å; L596-C599 PolarHBondContact O-N 3.47Å; L596-F600 WeakPolarHBondContact O-CB 3.21Å; L596-F600 PolarHBondContact O-N 3.13Å
597	I	93.8	Very high	92.9	Very high	89 Å²	89	62.6 Å²	62.6	46%	0.456	34%	0.34	S	S	.	.	H	α-helix	trans	-61.9	-45	174.5	-68.4	166.2	0	0	0	110.8	G593 L594 L595 F600 F601	G593-I597 WeakPolarHBondContact O-CG1 3.12Å; G593-I597 PolarHBondContact O-N 3.25Å; L594-I597 PolarHBondContact O-N 3.12Å; L595-I597 VanDerWaalsContact C-N 3.33Å; L595-I597 PolarHBondContact O-N 3.03Å; I597-F600 PolarHBondContact O-N 3.26Å; I597-F601 HydrophobicContact CG2-CD2 3.88Å; I597-F601 HydrophobicContact CG2-CE2 3.86Å; I597-F601 WeakPolarHBondContact O-CD2 3.49Å; I597-F601 PolarHBondContact O-N 3.4Å
598	I	94.5	Very high	92.9	Very high	3 Å²	3	62.6 Å²	62.6	2%	0.015	34%	0.34	C	S	.	.	H	α-helix	trans	-61.8	-45.7	177	-67	165.5	0	0	0	110.4	W558 L594 L595 F600 F601 A602 W634 R638 F639 I642	W558-I598 HydrophobicContact CH2-CD1 4.11Å; W558-I598 HydrophobicContact CH2-CG1 4.31Å; W558-I598 HydrophobicContact CZ3-CD1 3.98Å; W558-I598 HydrophobicContact CZ3-CG1 4.41Å; L594-I598 HydrophobicContact CD1-CD1 4.27Å; L594-I598 HydrophobicContact CG-CD1 4.07Å; L594-I598 WeakPolarHBondContact O-CG1 3.31Å; L594-I598 PolarHBondContact O-N 2.66Å; L595-I598 PolarHBondContact O-N 3.48Å; I598-F600 VanDerWaalsContact C-N 3.32Å; I598-F600 PolarHBondContact O-N 3.29Å; I598-F601 PolarHBondContact O-N 3.25Å; I598-A602 WeakPolarHBondContact O-CB 3.49Å; I598-A602 PolarHBondContact O-N 3.44Å; I598-W634 HydrophobicContact CG2-CH2 4.1Å; I598-W634 HydrophobicContact CG2-CZ2 4.14Å; I598-R638 HydrophobicContact CG2-CB 4.07Å; I598-R638 HydrophobicContact CG2-CG 4.17Å; I598-F639 HydrophobicContact CG2-CD1 4.06Å; I598-F639 HydrophobicContact CG2-CE1 3.89Å; I598-I642 HydrophobicContact CD1-CB 4.38Å; I598-I642 HydrophobicContact CD1-CG2 4.29Å
599	C	93.6	Very high	92.7	Very high	52 Å²	52	60 Å²	60	35%	0.351	33%	0.326	S	S	.	.	H	α-helix	trans	-62.7	-38.3	177.5	-72	0	0	0	0	112.4	L595 L596 A602 F603	L595-C599 WeakPolarHBondContact O-CB 3.46Å; L595-C599 PolarHBondContact O-N 3.39Å; L595-C599 PolarHBondContact O-SG 3.19Å; L595-C599 VanDerWaalsContact O-SG 3.35Å; L596-C599 PolarHBondContact O-N 3.47Å; C599-A602 WeakPolarHBondContact O-CB 3.33Å; C599-A602 PolarHBondContact O-N 2.77Å; C599-F603 WeakPolarHBondContact O-CB 3.3Å; C599-F603 PolarHBondContact O-N 2.83Å
600	F	92.9	Very high	92.5	Very high	122 Å²	122	60.8 Å²	60.8	54%	0.535	33%	0.328	S	S	.	.	H	α-helix	trans	-63.1	-48.1	176.9	-179.2	-107.8	0	0	0	111.9	L596 I597 I598 A602 F603 S604 L607	L596-F600 WeakPolarHBondContact O-CB 3.21Å; L596-F600 PolarHBondContact O-N 3.13Å; I597-F600 PolarHBondContact O-N 3.26Å; I598-F600 VanDerWaalsContact C-N 3.32Å; I598-F600 PolarHBondContact O-N 3.29Å; F600-A602 VanDerWaalsContact C-N 3.33Å; F600-A602 PolarHBondContact O-N 3.46Å; F600-F603 PolarHBondContact O-N 2.86Å; F600-S604 PolarHBondContact O-N 2.05Å; F600-L607 HydrophobicContact CD1-CD2 3.96Å; F600-L607 HydrophobicContact CE1-CD1 3.6Å; F600-L607 HydrophobicContact CE1-CD2 3.48Å; F600-L607 VanDerWaalsContact CE1-CD2 3.48Å; F600-L607 HydrophobicContact CE1-CG 4.19Å; F600-L607 HydrophobicContact CZ-CD1 3.69Å; F600-L607 HydrophobicContact CZ-CD2 4.3Å
601	F	92.2	Very high	92.2	Very high	44 Å²	44	62.5 Å²	62.5	19%	0.193	34%	0.341	C	S	.	.	H	α-helix	trans	-63.5	-39	173.6	-83.3	-61.9	0	0	0	112.3	I597 I598 F603 L607 F608 V611 W631 W634	I597-F601 HydrophobicContact CG2-CD2 3.88Å; I597-F601 HydrophobicContact CG2-CE2 3.86Å; I597-F601 WeakPolarHBondContact O-CD2 3.49Å; I597-F601 PolarHBondContact O-N 3.4Å; I598-F601 PolarHBondContact O-N 3.25Å; F601-F603 VanDerWaalsContact C-N 3.35Å; F601-F603 PolarHBondContact O-N 3.11Å; F601-L607 HydrophobicContact CD1-CD2 3.52Å; F601-L607 HydrophobicContact CE1-CD2 3.41Å; F601-L607 VanDerWaalsContact CE1-CD2 3.41Å; F601-L607 HydrophobicContact CZ-CD2 4.32Å; F601-F608 HydrophobicContact CB-CD2 4.2Å; F601-F608 HydrophobicContact CD1-CB 4.12Å; F601-F608 AromaticContact CD1-CD2 3.87Å; F601-F608 HydrophobicContact CD1-CD2 3.87Å; F601-F608 HydrophobicContact CD1-CG 4.44Å; F601-F608 HydrophobicContact CG-CD2 4.25Å; F601-V611 HydrophobicContact CE1-CB 4.42Å; F601-V611 HydrophobicContact CE1-CG2 4.2Å; F601-W631 WeakPolarHBondContact O-CH2 3.48Å; F601-W631 VanDerWaalsContact O-CZ3 3.27Å; F601-W631 WeakPolarHBondContact O-CZ3 3.32Å; F601-W634 HydrophobicContact CB-CH2 3.65Å; F601-W634 HydrophobicContact CB-CZ2 4.22Å; F601-W634 HydrophobicContact CB-CZ3 4.25Å
602	A	90	Very high	92	Very high	18 Å²	18	63.1 Å²	63.1	15%	0.149	34%	0.343	C	S	.	.	H	α-helix	trans	-62.9	-36	178.2	0	0	0	0	0	113.9	I598 C599 F600 W634	I598-A602 WeakPolarHBondContact O-CB 3.49Å; I598-A602 PolarHBondContact O-N 3.44Å; C599-A602 WeakPolarHBondContact O-CB 3.33Å; C599-A602 PolarHBondContact O-N 2.77Å; F600-A602 VanDerWaalsContact C-N 3.33Å; F600-A602 PolarHBondContact O-N 3.46Å; A602-W634 HydrophobicContact CB-CH2 4.47Å; A602-W634 HydrophobicContact CB-CZ3 4.44Å
603	F	89.9	Confident	91.6	Very high	194 Å²	194	61.5 Å²	61.5	85%	0.851	34%	0.34	S	S	*	.	H	α-helix	trans	-77.9	-36.9	-179.1	-174.3	-100.5	0	0	0	112.1	C599 F600 F601	C599-F603 WeakPolarHBondContact O-CB 3.3Å; C599-F603 PolarHBondContact O-N 2.83Å; F600-F603 PolarHBondContact O-N 2.86Å; F601-F603 VanDerWaalsContact C-N 3.35Å; F601-F603 PolarHBondContact O-N 3.11Å
604	S	91.3	Very high	91.3	Very high	38 Å²	38	64.3 Å²	64.3	27%	0.266	35%	0.351	S	S	.	.			trans	-108.2	90.7	-177.1	-173.1	0	0	0	0	112.7	F600 S606 L607 F608	F600-S604 PolarHBondContact O-N 2.05Å; S604-S606 PolarHBondContact O-N 2.85Å; S604-L607 PolarHBondContact O-N 2.93Å; S604-L607 VanDerWaalsContact OG-CB 3.22Å; S604-L607 WeakPolarHBondContact OG-CB 3.49Å; S604-L607 PolarHBondContact OG-N 3.36Å; S604-F608 PolarHBondContact O-N 3.42Å; S604-F608 VanDerWaalsContact O-N 3.1Å
605	K	89.3	Confident	90.6	Very high	105 Å²	105	69.4 Å²	69.4	46%	0.457	37%	0.37	S	S	.	.	H	α-helix	trans	-54.4	-41.9	170.9	-178.7	-179	178.9	-176.4	0	111.6	F608 M609 W631	K605-F608 PolarHBondContact O-N 3.24Å; K605-M609 HydrophobicContact CG-CG 4.2Å; K605-M609 WeakPolarHBondContact O-CB 3.33Å; K605-M609 WeakPolarHBondContact O-CG 3.22Å; K605-M609 PolarHBondContact O-N 3.05Å; K605-W631 HydrophobicContact CB-CH2 4.44Å; K605-W631 HydrophobicContact CB-CZ2 3.9Å; K605-W631 HydrophobicContact CG-CD2 4.46Å; K605-W631 HydrophobicContact CG-CZ2 4.17Å
606	S	88.8	Confident	89.8	Confident	95 Å²	95	69.9 Å²	69.9	66%	0.664	38%	0.376	S	S	*	.	H	α-helix	trans	-62	-44.7	-179.2	-175.8	0	0	0	0	111.9	S604 M609 S610	S604-S606 PolarHBondContact O-N 2.85Å; S606-M609 PolarHBondContact O-N 3.41Å; S606-S610 VanDerWaalsContact O-CB 3.32Å; S606-S610 WeakPolarHBondContact O-CB 3.46Å; S606-S610 PolarHBondContact O-N 2.91Å
607	L	88.4	Confident	89.2	Confident	55 Å²	55	67.4 Å²	67.4	29%	0.288	37%	0.366	S	S	.	.	H	α-helix	trans	-66	-43.2	178.6	-179	130.9	0	0	0	111.8	F600 F601 S604 S610 V611	F600-L607 HydrophobicContact CD1-CD2 3.96Å; F600-L607 HydrophobicContact CE1-CD1 3.6Å; F600-L607 HydrophobicContact CE1-CD2 3.48Å; F600-L607 VanDerWaalsContact CE1-CD2 3.48Å; F600-L607 HydrophobicContact CE1-CG 4.19Å; F600-L607 HydrophobicContact CZ-CD1 3.69Å; F600-L607 HydrophobicContact CZ-CD2 4.3Å; F601-L607 HydrophobicContact CD1-CD2 3.52Å; F601-L607 HydrophobicContact CE1-CD2 3.41Å; F601-L607 VanDerWaalsContact CE1-CD2 3.41Å; F601-L607 HydrophobicContact CZ-CD2 4.32Å; S604-L607 PolarHBondContact O-N 2.93Å; S604-L607 VanDerWaalsContact OG-CB 3.22Å; S604-L607 WeakPolarHBondContact OG-CB 3.49Å; S604-L607 PolarHBondContact OG-N 3.36Å; L607-S610 PolarHBondContact O-N 2.59Å; L607-V611 WeakPolarHBondContact O-CG2 3.34Å; L607-V611 PolarHBondContact O-N 2.95Å
608	F	91.3	Very high	88.7	Confident	1 Å²	1	63.8 Å²	63.8	0%	0.004	35%	0.349	C	S	.	.	H	α-helix	trans	-59.1	-50.4	175.3	-174.9	-81.4	0	0	0	111.3	F601 S604 K605 S610 V611 F612 W630 W631 W634	F601-F608 HydrophobicContact CB-CD2 4.2Å; F601-F608 HydrophobicContact CD1-CB 4.12Å; F601-F608 AromaticContact CD1-CD2 3.87Å; F601-F608 HydrophobicContact CD1-CD2 3.87Å; F601-F608 HydrophobicContact CD1-CG 4.44Å; F601-F608 HydrophobicContact CG-CD2 4.25Å; S604-F608 PolarHBondContact O-N 3.42Å; S604-F608 VanDerWaalsContact O-N 3.1Å; K605-F608 PolarHBondContact O-N 3.24Å; F608-S610 VanDerWaalsContact C-N 3.29Å; F608-S610 PolarHBondContact O-N 3.25Å; F608-V611 PolarHBondContact O-N 3.4Å; F608-F612 AromaticContact CD1-CD2 3.75Å; F608-F612 HydrophobicContact CD1-CD2 3.75Å; F608-F612 HydrophobicContact CD1-CE2 4.35Å; F608-F612 AromaticContact CD2-CD2 3.93Å; F608-F612 HydrophobicContact CD2-CD2 3.93Å; F608-F612 AromaticContact CD2-CE2 3.7Å; F608-F612 HydrophobicContact CD2-CE2 3.7Å; F608-F612 AromaticContact CE1-CD2 3.62Å; F608-F612 HydrophobicContact CE1-CD2 3.62Å; F608-F612 HydrophobicContact CE1-CE2 4.09Å; F608-F612 HydrophobicContact CE1-CG 4.31Å; F608-F612 AromaticContact CE2-CD2 3.81Å; F608-F612 HydrophobicContact CE2-CD2 3.81Å; F608-F612 AromaticContact CE2-CE2 3.41Å; F608-F612 HydrophobicContact CE2-CE2 3.41Å; F608-F612 VanDerWaalsContact CE2-CE2 3.41Å; F608-F612 HydrophobicContact CE2-CZ 4.3Å; F608-F612 AromaticContact CG-CD2 3.93Å; F608-F612 HydrophobicContact CG-CD2 3.93Å; F608-F612 HydrophobicContact CG-CE2 4.19Å; F608-F612 AromaticContact CZ-CD2 3.67Å; F608-F612 HydrophobicContact CZ-CD2 3.67Å; F608-F612 AromaticContact CZ-CE2 3.63Å; F608-F612 HydrophobicContact CZ-CE2 3.63Å; F608-F612 HydrophobicContact CZ-CG 4.49Å; F608-F612 HydrophobicContact CZ-CZ 4.42Å; F608-F612 WeakPolarHBondContact O-CD2 3.35Å; F608-F612 PolarHBondContact O-N 3.08Å; F608-F612 VanDerWaalsContact O-N 3.08Å; F608-W630 AromaticContact CE1-CD1 3.45Å; F608-W630 VanDerWaalsContact CE1-CD1 3.45Å; F608-W630 HydrophobicContact CE1-CG 4.37Å; F608-W630 AromaticContact CE1-NE1 3.7Å; F608-W630 AromaticContact CZ-CD1 3.55Å; F608-W630 HydrophobicContact CZ-CG 4.41Å; F608-W630 AromaticContact CZ-NE1 3.31Å; F608-W630 VanDerWaalsContact CZ-NE1 3.31Å; F608-W631 HydrophobicContact CB-CE3 3.57Å; F608-W631 HydrophobicContact CB-CH2 4.37Å; F608-W631 HydrophobicContact CB-CZ3 3.42Å; F608-W631 VanDerWaalsContact CB-CZ3 3.42Å; F608-W631 HydrophobicContact CD1-CB 3.95Å; F608-W631 HydrophobicContact CD1-CD2 4.03Å; F608-W631 AromaticContact CD1-CE3 3.25Å; F608-W631 HydrophobicContact CD1-CE3 3.25Å; F608-W631 HydrophobicContact CD1-CG 4.36Å; F608-W631 HydrophobicContact CD1-CZ3 4.02Å; F608-W631 AromaticContact CD2-CE3 3.49Å; F608-W631 HydrophobicContact CD2-CE3 3.49Å; F608-W631 VanDerWaalsContact CD2-CE3 3.49Å; F608-W631 AromaticContact CD2-CZ3 3.51Å; F608-W631 HydrophobicContact CD2-CZ3 3.51Å; F608-W631 HydrophobicContact CE1-CB 3.73Å; F608-W631 HydrophobicContact CE1-CD2 4.37Å; F608-W631 AromaticContact CE1-CE3 3.66Å; F608-W631 HydrophobicContact CE1-CE3 3.66Å; F608-W631 HydrophobicContact CE1-CG 4.46Å; F608-W631 AromaticContact CE2-CE3 3.86Å; F608-W631 HydrophobicContact CE2-CE3 3.86Å; F608-W631 HydrophobicContact CE2-CZ3 4.17Å; F608-W631 HydrophobicContact CG-CD2 4.25Å; F608-W631 AromaticContact CG-CE3 3.14Å; F608-W631 HydrophobicContact CG-CE3 3.14Å; F608-W631 AromaticContact CG-CZ3 3.39Å; F608-W631 HydrophobicContact CG-CZ3 3.39Å; F608-W631 AromaticContact CZ-CE3 3.93Å; F608-W631 HydrophobicContact CZ-CE3 3.93Å; F608-W634 HydrophobicContact CD2-CE3 4.27Å; F608-W634 HydrophobicContact CD2-CZ3 4.46Å; F608-W634 HydrophobicContact CE2-CB 4.37Å; F608-W634 AromaticContact CE2-CD2 3.62Å; F608-W634 HydrophobicContact CE2-CD2 3.62Å; F608-W634 AromaticContact CE2-CE3 3.75Å; F608-W634 HydrophobicContact CE2-CE3 3.75Å; F608-W634 AromaticContact CE2-CG 3.88Å; F608-W634 HydrophobicContact CE2-CG 3.88Å; F608-W634 HydrophobicContact CE2-CZ3 4.33Å; F608-W634 HydrophobicContact CZ-CB 4.02Å; F608-W634 HydrophobicContact CZ-CD2 4.18Å; F608-W634 HydrophobicContact CZ-CE3 4.39Å; F608-W634 AromaticContact CZ-CG 4Å; F608-W634 HydrophobicContact CZ-CG 4Å
609	M	88.9	Confident	88.2	Confident	42 Å²	42	68.9 Å²	68.9	21%	0.207	37%	0.371	C	S	.	.	H	α-helix	trans	-61.2	-41.2	-179.8	-64.9	-68.9	-91.7	0	0	110.7	K605 S606 S613 V627 H628 W631	K605-M609 HydrophobicContact CG-CG 4.2Å; K605-M609 WeakPolarHBondContact O-CB 3.33Å; K605-M609 WeakPolarHBondContact O-CG 3.22Å; K605-M609 PolarHBondContact O-N 3.05Å; S606-M609 PolarHBondContact O-N 3.41Å; M609-S613 WeakPolarHBondContact O-CB 3.46Å; M609-S613 PolarHBondContact O-N 2.97Å; M609-S613 PolarHBondContact O-OG 2.97Å; M609-V627 HydrophobicContact SD-CB 4.3Å; M609-V627 HydrophobicContact SD-CG1 4.46Å; M609-H628 HydrophobicContact CE-CB 4.05Å; M609-W631 HydrophobicContact SD-CB 3.91Å; M609-W631 HydrophobicContact SD-CG 4.48Å
610	S	89	Confident	87.7	Confident	78 Å²	78	70.7 Å²	70.7	55%	0.545	38%	0.376	S	S	.	.	H	α-helix	trans	-60.1	-51.2	176.4	-176.2	0	0	0	0	112.3	S606 L607 F608 F612 S613 V614	S606-S610 VanDerWaalsContact O-CB 3.32Å; S606-S610 WeakPolarHBondContact O-CB 3.46Å; S606-S610 PolarHBondContact O-N 2.91Å; L607-S610 PolarHBondContact O-N 2.59Å; F608-S610 VanDerWaalsContact C-N 3.29Å; F608-S610 PolarHBondContact O-N 3.25Å; S610-F612 PolarHBondContact O-N 3.33Å; S610-S613 PolarHBondContact O-N 2.87Å; S610-V614 WeakPolarHBondContact O-CG2 3.27Å
611	V	89.9	Confident	87.5	Confident	68 Å²	68	65.9 Å²	65.9	41%	0.412	36%	0.355	S	S	.	.	H	α-helix	trans	-60.5	-44.1	-178.7	170.4	0	0	0	0	112.2	F601 L607 F608	F601-V611 HydrophobicContact CE1-CB 4.42Å; F601-V611 HydrophobicContact CE1-CG2 4.2Å; L607-V611 WeakPolarHBondContact O-CG2 3.34Å; L607-V611 PolarHBondContact O-N 2.95Å; F608-V611 PolarHBondContact O-N 3.4Å
612	F	89.6	Confident	87.2	Confident	17 Å²	17	65.8 Å²	65.8	8%	0.075	36%	0.356	C	S	.	.	H	α-helix	trans	-86.2	-6.4	-177.8	-71.3	-79.3	0	0	0	113.9	F557 F608 S610 V617 S618 F621 V627 W630	F557-F612 HydrophobicContact CD2-CE1 4.49Å; F557-F612 HydrophobicContact CE2-CE1 4.07Å; F557-F612 AromaticContact CE2-CZ 3.73Å; F557-F612 HydrophobicContact CE2-CZ 3.73Å; F557-F612 HydrophobicContact CZ-CZ 4.18Å; F608-F612 AromaticContact CD1-CD2 3.75Å; F608-F612 HydrophobicContact CD1-CD2 3.75Å; F608-F612 HydrophobicContact CD1-CE2 4.35Å; F608-F612 AromaticContact CD2-CD2 3.93Å; F608-F612 HydrophobicContact CD2-CD2 3.93Å; F608-F612 AromaticContact CD2-CE2 3.7Å; F608-F612 HydrophobicContact CD2-CE2 3.7Å; F608-F612 AromaticContact CE1-CD2 3.62Å; F608-F612 HydrophobicContact CE1-CD2 3.62Å; F608-F612 HydrophobicContact CE1-CE2 4.09Å; F608-F612 HydrophobicContact CE1-CG 4.31Å; F608-F612 AromaticContact CE2-CD2 3.81Å; F608-F612 HydrophobicContact CE2-CD2 3.81Å; F608-F612 AromaticContact CE2-CE2 3.41Å; F608-F612 HydrophobicContact CE2-CE2 3.41Å; F608-F612 VanDerWaalsContact CE2-CE2 3.41Å; F608-F612 HydrophobicContact CE2-CZ 4.3Å; F608-F612 AromaticContact CG-CD2 3.93Å; F608-F612 HydrophobicContact CG-CD2 3.93Å; F608-F612 HydrophobicContact CG-CE2 4.19Å; F608-F612 AromaticContact CZ-CD2 3.67Å; F608-F612 HydrophobicContact CZ-CD2 3.67Å; F608-F612 AromaticContact CZ-CE2 3.63Å; F608-F612 HydrophobicContact CZ-CE2 3.63Å; F608-F612 HydrophobicContact CZ-CG 4.49Å; F608-F612 HydrophobicContact CZ-CZ 4.42Å; F608-F612 WeakPolarHBondContact O-CD2 3.35Å; F608-F612 PolarHBondContact O-N 3.08Å; F608-F612 VanDerWaalsContact O-N 3.08Å; S610-F612 PolarHBondContact O-N 3.33Å; F612-V617 HydrophobicContact CD1-CG1 4.13Å; F612-S618 VanDerWaalsContact O-CA 3.25Å; F612-S618 WeakPolarHBondContact O-CA 3.47Å; F612-S618 PolarHBondContact O-N 2.8Å; F612-F621 AromaticContact CD1-CD2 3.73Å; F612-F621 HydrophobicContact CD1-CD2 3.73Å; F612-F621 AromaticContact CD1-CE2 3.84Å; F612-F621 HydrophobicContact CD1-CE2 3.84Å; F612-F621 HydrophobicContact CD1-CG 4.41Å; F612-F621 HydrophobicContact CE1-CD2 4.32Å; F612-F621 AromaticContact CE1-CE2 3.99Å; F612-F621 HydrophobicContact CE1-CE2 3.99Å; F612-F621 HydrophobicContact CE1-CZ 4.41Å; F612-V627 HydrophobicContact CB-CG1 3.82Å; F612-W630 AromaticContact CD1-NE1 3.53Å; F612-W630 AromaticContact CD2-NE1 3.91Å; F612-W630 AromaticContact CE1-NE1 3.63Å; F612-W630 AromaticContact CG-CD1 3.97Å; F612-W630 AromaticContact CG-NE1 3.68Å; F612-W630 AromaticContact CZ-NE1 3.89Å
613	S	88.1	Confident	86.9	Confident	63 Å²	63	67 Å²	67	44%	0.441	36%	0.359	S	S	.	.	H	α-helix	trans	-90.3	-5	174	-59.9	0	0	0	0	113.4	M609 S610 W615 S618	M609-S613 WeakPolarHBondContact O-CB 3.46Å; M609-S613 PolarHBondContact O-N 2.97Å; M609-S613 PolarHBondContact O-OG 2.97Å; S610-S613 PolarHBondContact O-N 2.87Å; S613-W615 PolarHBondContact O-N 3.38Å; S613-S618 WeakPolarHBondContact O-CB 3.39Å
614	V	88	Confident	86.4	Confident	87 Å²	87	64.4 Å²	64.4	53%	0.527	35%	0.354	S	S	.	.	S	Bend	trans	-71.2	128.5	177.4	-175.5	0	0	0	0	110.5	S610 V617 S618	S610-V614 WeakPolarHBondContact O-CG2 3.27Å; V614-V617 WeakPolarHBondContact O-CA 3.13Å; V614-V617 WeakPolarHBondContact O-CB 3.46Å; V614-V617 PolarHBondContact O-N 2.86Å; V614-S618 PolarHBondContact O-N 3.37Å
615	W	81.7	Confident	85.8	Confident	116 Å²	116	65.8 Å²	65.8	44%	0.439	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	136.4	172.3	-174.6	92.4	0	0	0	110.4	S613 L820 M821 L824	S613-W615 PolarHBondContact O-N 3.38Å; W615-L820 HydrophobicContact CZ2-CD2 3.69Å; W615-M821 HydrophobicContact CH2-CE 3.72Å; W615-M821 HydrophobicContact CZ3-CE 4.45Å; W615-L824 HydrophobicContact CH2-CD1 4.07Å; W615-L824 HydrophobicContact CZ2-CD1 3.5Å
616	P	79.8	Confident	85.7	Confident	69 Å²	69	63.4 Å²	63.4	45%	0.448	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	cis	-92.5	-1.3	8.6	35.7	-36	0	0	0	115	S618 K619	P616-S618 VanDerWaalsContact C-N 3.26Å; P616-S618 PolarHBondContact O-N 3.36Å; P616-K619 PolarHBondContact O-N 3.25Å
617	V	82.5	Confident	85.8	Confident	59 Å²	59	59.3 Å²	59.3	36%	0.358	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-35.6	-176.1	179.7	0	0	0	0	111.7	F612 V614 K619 L620 F621	F612-V617 HydrophobicContact CD1-CG1 4.13Å; V614-V617 WeakPolarHBondContact O-CA 3.13Å; V614-V617 WeakPolarHBondContact O-CB 3.46Å; V614-V617 PolarHBondContact O-N 2.86Å; V617-K619 PolarHBondContact O-N 3.27Å; V617-L620 WeakPolarHBondContact O-CB 2.84Å; V617-L620 PolarHBondContact O-N 3.12Å; V617-F621 HydrophobicContact CG1-CD2 3.82Å; V617-F621 HydrophobicContact CG1-CE2 3.76Å; V617-F621 WeakPolarHBondContact O-CD2 3.48Å
618	S	83.8	Confident	85.8	Confident	14 Å²	14	61 Å²	61	10%	0.098	35%	0.348	C	S	.	.	H	α-helix	trans	-53.3	-38.5	176.8	55.8	0	0	0	0	113.6	F612 S613 V614 P616 L620 F621 E622	F612-S618 VanDerWaalsContact O-CA 3.25Å; F612-S618 WeakPolarHBondContact O-CA 3.47Å; F612-S618 PolarHBondContact O-N 2.8Å; S613-S618 WeakPolarHBondContact O-CB 3.39Å; V614-S618 PolarHBondContact O-N 3.37Å; P616-S618 VanDerWaalsContact C-N 3.26Å; P616-S618 PolarHBondContact O-N 3.36Å; S618-L620 PolarHBondContact O-N 2.84Å; S618-L620 VanDerWaalsContact O-N 3.17Å; S618-F621 PolarHBondContact O-N 2.77Å; S618-F621 VanDerWaalsContact O-N 3.07Å; S618-E622 VanDerWaalsContact O-CB 3.31Å; S618-E622 WeakPolarHBondContact O-CB 3.08Å; S618-E622 WeakPolarHBondContact O-CG 3.47Å; S618-E622 PolarHBondContact O-N 3.42Å
619	K	83.8	Confident	85.8	Confident	110 Å²	110	63.6 Å²	63.6	48%	0.478	36%	0.36	S	S	.	.	H	α-helix	trans	-63.2	-22.9	179.2	-70.2	-53.6	-172.2	-176.1	0	114.3	P616 V617 E622	P616-K619 PolarHBondContact O-N 3.25Å; V617-K619 PolarHBondContact O-N 3.27Å; K619-E622 VanDerWaalsContact CD-CD 3.49Å; K619-E622 WeakPolarHBondContact CD-OE1 3.31Å; K619-E622 WeakPolarHBondContact CE-OE1 3.19Å; K619-E622 IonicContact NZ-OE1 2.93Å; K619-E622 PolarHBondContact NZ-OE1 2.7Å; K619-E622 IonicContact NZ-OE2 2.82Å
620	L	83.6	Confident	86	Confident	90 Å²	90	61.6 Å²	61.6	47%	0.471	35%	0.35	S	S	.	.	H	α-helix	trans	-80.5	-29.2	176.7	-61.7	175.3	0	0	0	112.1	Y546 V617 S618	Y546-L620 HydrophobicContact CD1-CB 4.42Å; Y546-L620 HydrophobicContact CD1-CD2 4.5Å; Y546-L620 WeakPolarHBondContact CD1-O 3.4Å; V617-L620 WeakPolarHBondContact O-CB 2.84Å; V617-L620 PolarHBondContact O-N 3.12Å; S618-L620 PolarHBondContact O-N 2.84Å; S618-L620 VanDerWaalsContact O-N 3.17Å
621	F	87.1	Confident	86.2	Confident	20 Å²	20	58.3 Å²	58.3	9%	0.088	33%	0.326	C	S	.	.	H	α-helix	trans	-117.2	-2.5	-169	-60.7	-67.4	0	0	0	114.2	P553 F612 V617 S618 V627 W630	P553-F621 HydrophobicContact CB-CE1 4.28Å; F612-F621 AromaticContact CD1-CD2 3.73Å; F612-F621 HydrophobicContact CD1-CD2 3.73Å; F612-F621 AromaticContact CD1-CE2 3.84Å; F612-F621 HydrophobicContact CD1-CE2 3.84Å; F612-F621 HydrophobicContact CD1-CG 4.41Å; F612-F621 HydrophobicContact CE1-CD2 4.32Å; F612-F621 AromaticContact CE1-CE2 3.99Å; F612-F621 HydrophobicContact CE1-CE2 3.99Å; F612-F621 HydrophobicContact CE1-CZ 4.41Å; V617-F621 HydrophobicContact CG1-CD2 3.82Å; V617-F621 HydrophobicContact CG1-CE2 3.76Å; V617-F621 WeakPolarHBondContact O-CD2 3.48Å; S618-F621 PolarHBondContact O-N 2.77Å; S618-F621 VanDerWaalsContact O-N 3.07Å; F621-V627 HydrophobicContact CB-CG1 4.39Å; F621-W630 HydrophobicContact CB-CB 4.01Å; F621-W630 HydrophobicContact CB-CD2 4.31Å; F621-W630 HydrophobicContact CB-CG 3.8Å; F621-W630 AromaticContact CD1-CD2 3.43Å; F621-W630 HydrophobicContact CD1-CD2 3.43Å; F621-W630 VanDerWaalsContact CD1-CD2 3.43Å; F621-W630 AromaticContact CD1-CE2 3.56Å; F621-W630 AromaticContact CD1-CE3 3.68Å; F621-W630 HydrophobicContact CD1-CE3 3.68Å; F621-W630 AromaticContact CD1-CG 3.86Å; F621-W630 HydrophobicContact CD1-CG 3.86Å; F621-W630 HydrophobicContact CD1-CH2 4.19Å; F621-W630 AromaticContact CD1-CZ2 3.96Å; F621-W630 HydrophobicContact CD1-CZ2 3.96Å; F621-W630 HydrophobicContact CD1-CZ3 4.05Å; F621-W630 AromaticContact CD1-NE1 3.94Å; F621-W630 AromaticContact CE1-CD2 3.99Å; F621-W630 HydrophobicContact CE1-CD2 3.99Å; F621-W630 AromaticContact CE1-CE2 3.73Å; F621-W630 HydrophobicContact CE1-CE3 4.07Å; F621-W630 AromaticContact CE1-CH2 3.74Å; F621-W630 HydrophobicContact CE1-CH2 3.74Å; F621-W630 AromaticContact CE1-CZ2 3.63Å; F621-W630 HydrophobicContact CE1-CZ2 3.63Å; F621-W630 AromaticContact CE1-CZ3 3.96Å; F621-W630 HydrophobicContact CE1-CZ3 3.96Å; F621-W630 AromaticContact CG-CD1 3.98Å; F621-W630 HydrophobicContact CG-CD2 4.07Å; F621-W630 HydrophobicContact CG-CG 4.03Å; F621-W630 HydrophobicContact CZ-CZ2 4.22Å
622	E	86.4	Confident	86.3	Confident	43 Å²	43	58.1 Å²	58.1	20%	0.201	32%	0.32	C	S	.	.			trans	-77.9	142.2	175.8	69.7	-178.8	-155.2	0	0	112.5	S618 K619	S618-E622 VanDerWaalsContact O-CB 3.31Å; S618-E622 WeakPolarHBondContact O-CB 3.08Å; S618-E622 WeakPolarHBondContact O-CG 3.47Å; S618-E622 PolarHBondContact O-N 3.42Å; K619-E622 VanDerWaalsContact CD-CD 3.49Å; K619-E622 WeakPolarHBondContact CD-OE1 3.31Å; K619-E622 WeakPolarHBondContact CE-OE1 3.19Å; K619-E622 IonicContact NZ-OE1 2.93Å; K619-E622 PolarHBondContact NZ-OE1 2.7Å; K619-E622 IonicContact NZ-OE2 2.82Å
623	L	83.8	Confident	86.4	Confident	44 Å²	44	59.9 Å²	59.9	23%	0.23	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-129.4	121.5	165.8	-177.2	65.3	0	0	0	107.3	P545 Q547 G625 S626 E629	P545-L623 HydrophobicContact CG-CD1 3.56Å; Q547-L623 HydrophobicContact CB-CB 4.41Å; Q547-L623 HydrophobicContact CG-CB 4.19Å; L623-G625 PolarHBondContact O-N 3.11Å; L623-S626 PolarHBondContact N-O 3.3Å; L623-S626 PolarHBondContact O-N 3.2Å; L623-E629 HydrophobicContact CB-CB 4.44Å; L623-E629 HydrophobicContact CD2-CB 4.2Å; L623-E629 HydrophobicContact CD2-CG 3.98Å
624	N	80.4	Confident	86.7	Confident	139 Å²	139	57.1 Å²	57.1	74%	0.743	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	39.7	-175.1	-57	-23.2	0	0	0	113.3	S626	N624-S626 VanDerWaalsContact C-N 3.31Å; N624-S626 PolarHBondContact O-N 3.37Å
625	G	78.9	Confident	87	Confident	66 Å²	66	56 Å²	56	68%	0.68	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	7	-179.8	0	0	0	0	0	115.5	L623	L623-G625 PolarHBondContact O-N 3.11Å
626	S	86.6	Confident	87.5	Confident	55 Å²	55	50.8 Å²	50.8	39%	0.385	28%	0.275	S	S	.	.	B	Isolated β-bridge	trans	-123.8	137.7	178.7	-175.9	0	0	0	0	112.9	L623 N624 H628	L623-S626 PolarHBondContact N-O 3.3Å; L623-S626 PolarHBondContact O-N 3.2Å; N624-S626 VanDerWaalsContact C-N 3.31Å; N624-S626 PolarHBondContact O-N 3.37Å; S626-H628 VanDerWaalsContact C-N 3.25Å; S626-H628 WeakPolarHBondContact OG-CB 3.2Å; S626-H628 PolarHBondContact OG-N 2.88Å
627	V	89.6	Confident	88.2	Confident	9 Å²	9	47.6 Å²	47.6	6%	0.055	26%	0.255	C	S	.	.	S	Bend	trans	-86.3	2.1	173.9	-172.7	0	0	0	0	111.3	M609 F612 F621 E629 W630 W631	M609-V627 HydrophobicContact SD-CB 4.3Å; M609-V627 HydrophobicContact SD-CG1 4.46Å; F612-V627 HydrophobicContact CB-CG1 3.82Å; F621-V627 HydrophobicContact CB-CG1 4.39Å; V627-E629 VanDerWaalsContact C-N 3.32Å; V627-E629 PolarHBondContact O-N 3.41Å; V627-W630 HydrophobicContact CG1-CB 3.99Å; V627-W630 HydrophobicContact CG1-CG 4.31Å; V627-W630 WeakPolarHBondContact O-CB 3.32Å; V627-W630 PolarHBondContact O-N 3.41Å; V627-W630 VanDerWaalsContact O-N 3.12Å; V627-W631 PolarHBondContact O-N 3.34Å; V627-W631 VanDerWaalsContact O-N 3.11Å
628	H	89.7	Confident	88.7	Confident	90 Å²	90	45.6 Å²	45.6	42%	0.417	24%	0.241	S	C	.	.	H	α-helix	trans	-61.8	-39.1	-174.4	-172.8	21.2	0	0	0	112.9	M609 S626 W630 W631 F632	M609-H628 HydrophobicContact CE-CB 4.05Å; S626-H628 VanDerWaalsContact C-N 3.25Å; S626-H628 WeakPolarHBondContact OG-CB 3.2Å; S626-H628 PolarHBondContact OG-N 2.88Å; H628-W630 VanDerWaalsContact C-N 3.31Å; H628-W630 PolarHBondContact O-N 3.1Å; H628-W631 PolarHBondContact O-N 3.11Å; H628-F632 WeakPolarHBondContact O-CB 3.46Å; H628-F632 PolarHBondContact O-N 3.01Å
629	E	90	Very high	89.3	Confident	56 Å²	56	45.9 Å²	45.9	26%	0.262	24%	0.24	S	C	.	.	H	α-helix	trans	-63	-39.7	177.4	-174.8	64.4	-166.4	0	0	111.2	L623 V627 F632 R633	L623-E629 HydrophobicContact CB-CB 4.44Å; L623-E629 HydrophobicContact CD2-CB 4.2Å; L623-E629 HydrophobicContact CD2-CG 3.98Å; V627-E629 VanDerWaalsContact C-N 3.32Å; V627-E629 PolarHBondContact O-N 3.41Å; E629-F632 PolarHBondContact O-N 2.96Å; E629-R633 HydrophobicContact CG-CG 4.49Å; E629-R633 VanDerWaalsContact O-CG 3.27Å; E629-R633 WeakPolarHBondContact O-CG 3.48Å; E629-R633 PolarHBondContact O-N 3.46Å; E629-R633 IonicContact OE1-CZ 3.29Å; E629-R633 IonicContact OE1-NE 3.55Å; E629-R633 PolarHBondContact OE1-NE 3.48Å; E629-R633 IonicContact OE1-NH2 2.75Å; E629-R633 PolarHBondContact OE1-NH2 2.62Å
630	W	93.1	Very high	89.9	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.5	-48.7	175.3	171.2	-120.8	0	0	0	111.8	P553 L554 F557 F608 F612 F621 V627 H628 F632 R633 W634	P553-W630 HydrophobicContact CB-CZ3 4.28Å; L554-W630 HydrophobicContact CB-CZ3 4.14Å; L554-W630 HydrophobicContact CD1-CH2 3.93Å; L554-W630 HydrophobicContact CD1-CZ3 3.88Å; F557-W630 HydrophobicContact CB-CH2 3.77Å; F557-W630 HydrophobicContact CB-CZ2 4.18Å; F557-W630 HydrophobicContact CD1-CH2 4.23Å; F557-W630 HydrophobicContact CD1-CZ2 4.2Å; F557-W630 HydrophobicContact CD2-CH2 4.5Å; F557-W630 HydrophobicContact CD2-CZ2 4.06Å; F557-W630 AromaticContact CG-CH2 3.91Å; F557-W630 HydrophobicContact CG-CH2 3.91Å; F557-W630 AromaticContact CG-CZ2 3.87Å; F557-W630 HydrophobicContact CG-CZ2 3.87Å; F608-W630 AromaticContact CE1-CD1 3.45Å; F608-W630 VanDerWaalsContact CE1-CD1 3.45Å; F608-W630 HydrophobicContact CE1-CG 4.37Å; F608-W630 AromaticContact CE1-NE1 3.7Å; F608-W630 AromaticContact CZ-CD1 3.55Å; F608-W630 HydrophobicContact CZ-CG 4.41Å; F608-W630 AromaticContact CZ-NE1 3.31Å; F608-W630 VanDerWaalsContact CZ-NE1 3.31Å; F612-W630 AromaticContact CD1-NE1 3.53Å; F612-W630 AromaticContact CD2-NE1 3.91Å; F612-W630 AromaticContact CE1-NE1 3.63Å; F612-W630 AromaticContact CG-CD1 3.97Å; F612-W630 AromaticContact CG-NE1 3.68Å; F612-W630 AromaticContact CZ-NE1 3.89Å; F621-W630 HydrophobicContact CB-CB 4.01Å; F621-W630 HydrophobicContact CB-CD2 4.31Å; F621-W630 HydrophobicContact CB-CG 3.8Å; F621-W630 AromaticContact CD1-CD2 3.43Å; F621-W630 HydrophobicContact CD1-CD2 3.43Å; F621-W630 VanDerWaalsContact CD1-CD2 3.43Å; F621-W630 AromaticContact CD1-CE2 3.56Å; F621-W630 AromaticContact CD1-CE3 3.68Å; F621-W630 HydrophobicContact CD1-CE3 3.68Å; F621-W630 AromaticContact CD1-CG 3.86Å; F621-W630 HydrophobicContact CD1-CG 3.86Å; F621-W630 HydrophobicContact CD1-CH2 4.19Å; F621-W630 AromaticContact CD1-CZ2 3.96Å; F621-W630 HydrophobicContact CD1-CZ2 3.96Å; F621-W630 HydrophobicContact CD1-CZ3 4.05Å; F621-W630 AromaticContact CD1-NE1 3.94Å; F621-W630 AromaticContact CE1-CD2 3.99Å; F621-W630 HydrophobicContact CE1-CD2 3.99Å; F621-W630 AromaticContact CE1-CE2 3.73Å; F621-W630 HydrophobicContact CE1-CE3 4.07Å; F621-W630 AromaticContact CE1-CH2 3.74Å; F621-W630 HydrophobicContact CE1-CH2 3.74Å; F621-W630 AromaticContact CE1-CZ2 3.63Å; F621-W630 HydrophobicContact CE1-CZ2 3.63Å; F621-W630 AromaticContact CE1-CZ3 3.96Å; F621-W630 HydrophobicContact CE1-CZ3 3.96Å; F621-W630 AromaticContact CG-CD1 3.98Å; F621-W630 HydrophobicContact CG-CD2 4.07Å; F621-W630 HydrophobicContact CG-CG 4.03Å; F621-W630 HydrophobicContact CZ-CZ2 4.22Å; V627-W630 HydrophobicContact CG1-CB 3.99Å; V627-W630 HydrophobicContact CG1-CG 4.31Å; V627-W630 WeakPolarHBondContact O-CB 3.32Å; V627-W630 PolarHBondContact O-N 3.41Å; V627-W630 VanDerWaalsContact O-N 3.12Å; H628-W630 VanDerWaalsContact C-N 3.31Å; H628-W630 PolarHBondContact O-N 3.1Å; W630-F632 VanDerWaalsContact C-N 3.34Å; W630-F632 PolarHBondContact O-N 3.29Å; W630-R633 PolarHBondContact O-N 3.27Å; W630-W634 WeakPolarHBondContact O-CB 3.44Å; W630-W634 PolarHBondContact O-N 3.36Å
631	W	93	Very high	90.5	Very high	10 Å²	10	36.5 Å²	36.5	4%	0.038	20%	0.196	C	C	.	.	H	α-helix	trans	-56	-48.4	174.5	167.9	-101.4	0	0	0	111.8	F601 K605 F608 M609 V627 H628 R633 W634 Q635	F601-W631 WeakPolarHBondContact O-CH2 3.48Å; F601-W631 VanDerWaalsContact O-CZ3 3.27Å; F601-W631 WeakPolarHBondContact O-CZ3 3.32Å; K605-W631 HydrophobicContact CB-CH2 4.44Å; K605-W631 HydrophobicContact CB-CZ2 3.9Å; K605-W631 HydrophobicContact CG-CD2 4.46Å; K605-W631 HydrophobicContact CG-CZ2 4.17Å; F608-W631 HydrophobicContact CB-CE3 3.57Å; F608-W631 HydrophobicContact CB-CH2 4.37Å; F608-W631 HydrophobicContact CB-CZ3 3.42Å; F608-W631 VanDerWaalsContact CB-CZ3 3.42Å; F608-W631 HydrophobicContact CD1-CB 3.95Å; F608-W631 HydrophobicContact CD1-CD2 4.03Å; F608-W631 AromaticContact CD1-CE3 3.25Å; F608-W631 HydrophobicContact CD1-CE3 3.25Å; F608-W631 HydrophobicContact CD1-CG 4.36Å; F608-W631 HydrophobicContact CD1-CZ3 4.02Å; F608-W631 AromaticContact CD2-CE3 3.49Å; F608-W631 HydrophobicContact CD2-CE3 3.49Å; F608-W631 VanDerWaalsContact CD2-CE3 3.49Å; F608-W631 AromaticContact CD2-CZ3 3.51Å; F608-W631 HydrophobicContact CD2-CZ3 3.51Å; F608-W631 HydrophobicContact CE1-CB 3.73Å; F608-W631 HydrophobicContact CE1-CD2 4.37Å; F608-W631 AromaticContact CE1-CE3 3.66Å; F608-W631 HydrophobicContact CE1-CE3 3.66Å; F608-W631 HydrophobicContact CE1-CG 4.46Å; F608-W631 AromaticContact CE2-CE3 3.86Å; F608-W631 HydrophobicContact CE2-CE3 3.86Å; F608-W631 HydrophobicContact CE2-CZ3 4.17Å; F608-W631 HydrophobicContact CG-CD2 4.25Å; F608-W631 AromaticContact CG-CE3 3.14Å; F608-W631 HydrophobicContact CG-CE3 3.14Å; F608-W631 AromaticContact CG-CZ3 3.39Å; F608-W631 HydrophobicContact CG-CZ3 3.39Å; F608-W631 AromaticContact CZ-CE3 3.93Å; F608-W631 HydrophobicContact CZ-CE3 3.93Å; M609-W631 HydrophobicContact SD-CB 3.91Å; M609-W631 HydrophobicContact SD-CG 4.48Å; V627-W631 PolarHBondContact O-N 3.34Å; V627-W631 VanDerWaalsContact O-N 3.11Å; H628-W631 PolarHBondContact O-N 3.11Å; W631-R633 PolarHBondContact O-N 3.41Å; W631-W634 HydrophobicContact CE3-CE3 4.11Å; W631-W634 HydrophobicContact CE3-CZ3 4.45Å; W631-W634 HydrophobicContact CH2-CZ3 4.43Å; W631-W634 AromaticContact CZ3-CE3 3.94Å; W631-W634 HydrophobicContact CZ3-CE3 3.94Å; W631-W634 AromaticContact CZ3-CZ3 3.82Å; W631-W634 HydrophobicContact CZ3-CZ3 3.82Å; W631-W634 PolarHBondContact O-N 3Å; W631-Q635 HydrophobicContact CZ2-CG 4.5Å; W631-Q635 WeakPolarHBondContact O-CB 3.32Å; W631-Q635 PolarHBondContact O-N 3.04Å
632	F	92.4	Very high	90.9	Very high	64 Å²	64	35.9 Å²	35.9	28%	0.281	19%	0.194	S	C	.	.	H	α-helix	trans	-58.5	-47.4	-179.9	175.2	-108	0	0	0	111.7	H628 E629 W630 Q635 L636	H628-F632 WeakPolarHBondContact O-CB 3.46Å; H628-F632 PolarHBondContact O-N 3.01Å; E629-F632 PolarHBondContact O-N 2.96Å; W630-F632 VanDerWaalsContact C-N 3.34Å; W630-F632 PolarHBondContact O-N 3.29Å; F632-Q635 PolarHBondContact O-N 2.91Å; F632-L636 HydrophobicContact CD1-CD1 4.22Å; F632-L636 HydrophobicContact CE1-CD1 3.77Å; F632-L636 HydrophobicContact CE2-CD1 4.15Å; F632-L636 HydrophobicContact CE2-CD2 4.42Å; F632-L636 HydrophobicContact CE2-CG 4.46Å; F632-L636 HydrophobicContact CZ-CD1 3.74Å; F632-L636 HydrophobicContact CZ-CG 4.5Å; F632-L636 VanDerWaalsContact O-CG 3.3Å; F632-L636 WeakPolarHBondContact O-CG 3.39Å; F632-L636 PolarHBondContact O-N 3.32Å
633	R	92.9	Very high	91.4	Very high	54 Å²	54	36.5 Å²	36.5	20%	0.204	20%	0.197	C	C	.	.	H	α-helix	trans	-67.2	-40.7	179.5	-63.6	-63.4	174.4	173	-0.3	112.8	Y550 E629 W630 W631	Y550-R633 HydrophobicContact CD2-CB 4.42Å; Y550-R633 HydrophobicContact CD2-CG 3.99Å; Y550-R633 HydrophobicContact CG-CG 4.22Å; E629-R633 HydrophobicContact CG-CG 4.49Å; E629-R633 VanDerWaalsContact O-CG 3.27Å; E629-R633 WeakPolarHBondContact O-CG 3.48Å; E629-R633 PolarHBondContact O-N 3.46Å; E629-R633 IonicContact OE1-CZ 3.29Å; E629-R633 IonicContact OE1-NE 3.55Å; E629-R633 PolarHBondContact OE1-NE 3.48Å; E629-R633 IonicContact OE1-NH2 2.75Å; E629-R633 PolarHBondContact OE1-NH2 2.62Å; W630-R633 PolarHBondContact O-N 3.27Å; W631-R633 PolarHBondContact O-N 3.41Å
634	W	94.3	Very high	92	Very high	5 Å²	5	34.4 Å²	34.4	2%	0.019	19%	0.186	C	C	.	.	H	α-helix	trans	-65.1	-43.5	176.8	-179	91.2	0	0	0	111.8	F557 W558 I598 F601 A602 F608 W630 W631 L636 D637 R638	F557-W634 AromaticContact CE1-CD1 3.82Å; F557-W634 AromaticContact CE1-NE1 3.49Å; W558-W634 HydrophobicContact CH2-CZ2 4.37Å; W558-W634 AromaticContact CH2-NE1 3.69Å; W558-W634 AromaticContact CZ2-CD1 3.8Å; W558-W634 AromaticContact CZ2-NE1 3.36Å; I598-W634 HydrophobicContact CG2-CH2 4.1Å; I598-W634 HydrophobicContact CG2-CZ2 4.14Å; F601-W634 HydrophobicContact CB-CH2 3.65Å; F601-W634 HydrophobicContact CB-CZ2 4.22Å; F601-W634 HydrophobicContact CB-CZ3 4.25Å; A602-W634 HydrophobicContact CB-CH2 4.47Å; A602-W634 HydrophobicContact CB-CZ3 4.44Å; F608-W634 HydrophobicContact CD2-CE3 4.27Å; F608-W634 HydrophobicContact CD2-CZ3 4.46Å; F608-W634 HydrophobicContact CE2-CB 4.37Å; F608-W634 AromaticContact CE2-CD2 3.62Å; F608-W634 HydrophobicContact CE2-CD2 3.62Å; F608-W634 AromaticContact CE2-CE3 3.75Å; F608-W634 HydrophobicContact CE2-CE3 3.75Å; F608-W634 AromaticContact CE2-CG 3.88Å; F608-W634 HydrophobicContact CE2-CG 3.88Å; F608-W634 HydrophobicContact CE2-CZ3 4.33Å; F608-W634 HydrophobicContact CZ-CB 4.02Å; F608-W634 HydrophobicContact CZ-CD2 4.18Å; F608-W634 HydrophobicContact CZ-CE3 4.39Å; F608-W634 AromaticContact CZ-CG 4Å; F608-W634 HydrophobicContact CZ-CG 4Å; W630-W634 WeakPolarHBondContact O-CB 3.44Å; W630-W634 PolarHBondContact O-N 3.36Å; W631-W634 HydrophobicContact CE3-CE3 4.11Å; W631-W634 HydrophobicContact CE3-CZ3 4.45Å; W631-W634 HydrophobicContact CH2-CZ3 4.43Å; W631-W634 AromaticContact CZ3-CE3 3.94Å; W631-W634 HydrophobicContact CZ3-CE3 3.94Å; W631-W634 AromaticContact CZ3-CZ3 3.82Å; W631-W634 HydrophobicContact CZ3-CZ3 3.82Å; W631-W634 PolarHBondContact O-N 3Å; W634-L636 VanDerWaalsContact C-N 3.3Å; W634-L636 PolarHBondContact O-N 3.39Å; W634-D637 PolarHBondContact O-N 3.31Å; W634-R638 HydrophobicContact CE3-CB 4.41Å; W634-R638 HydrophobicContact CH2-CB 4.14Å; W634-R638 HydrophobicContact CZ2-CB 4.32Å; W634-R638 HydrophobicContact CZ3-CB 4.2Å; W634-R638 PolarHBondContact O-N 3.27Å
635	Q	93.4	Very high	92.8	Very high	62 Å²	62	27.8 Å²	27.8	29%	0.29	15%	0.15	S	C	.	.	H	α-helix	trans	-61.4	-35.8	-177.2	-176.7	-179	-1	0	0	112.6	W631 F632 R638	W631-Q635 HydrophobicContact CZ2-CG 4.5Å; W631-Q635 WeakPolarHBondContact O-CB 3.32Å; W631-Q635 PolarHBondContact O-N 3.04Å; F632-Q635 PolarHBondContact O-N 2.91Å; Q635-R638 VanDerWaalsContact CG-CZ 3.47Å; Q635-R638 PolarHBondContact O-NE 3.24Å; Q635-R638 PolarHBondContact O-NH2 3.46Å
636	L	92.9	Very high	93.7	Very high	7 Å²	7	27.1 Å²	27.1	4%	0.037	13%	0.132	C	C	.	.	H	α-helix	trans	-67.5	-38.9	-176.3	-68.6	165.6	0	0	0	113.1	F632 W634 N702 H705 P706	F632-L636 HydrophobicContact CD1-CD1 4.22Å; F632-L636 HydrophobicContact CE1-CD1 3.77Å; F632-L636 HydrophobicContact CE2-CD1 4.15Å; F632-L636 HydrophobicContact CE2-CD2 4.42Å; F632-L636 HydrophobicContact CE2-CG 4.46Å; F632-L636 HydrophobicContact CZ-CD1 3.74Å; F632-L636 HydrophobicContact CZ-CG 4.5Å; F632-L636 VanDerWaalsContact O-CG 3.3Å; F632-L636 WeakPolarHBondContact O-CG 3.39Å; F632-L636 PolarHBondContact O-N 3.32Å; W634-L636 VanDerWaalsContact C-N 3.3Å; W634-L636 PolarHBondContact O-N 3.39Å; L636-N702 HydrophobicContact CD2-CB 3.63Å; L636-H705 PolarHBondContact O-CD2 3.49Å; L636-P706 WeakPolarHBondContact O-CG 3.37Å
637	D	93.5	Very high	94.2	Very high	3 Å²	3	26 Å²	26	2%	0.016	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.7	21.6	-173.9	-53.7	-51.5	0	0	0	113.1	R495 L502 W634 F639 A640 H705	R495-D637 IonicContact CZ-OD1 2.62Å; R495-D637 IonicContact CZ-OD2 2.7Å; R495-D637 IonicContact NH1-OD2 3.92Å; R495-D637 IonicContact NH2-OD1 3.5Å; R495-D637 PolarHBondContact NH2-OD1 3.29Å; R495-D637 IonicContact NH2-OD2 3.69Å; R495-D637 PolarHBondContact NH2-OD2 3.44Å; L502-D637 HydrophobicContact CD1-CB 3.47Å; L502-D637 VanDerWaalsContact CD1-CB 3.47Å; W634-D637 PolarHBondContact O-N 3.31Å; D637-F639 PolarHBondContact O-N 2.76Å; D637-A640 HydrophobicContact CB-CB 4.32Å; D637-A640 WeakPolarHBondContact O-CB 3.17Å; D637-A640 PolarHBondContact O-N 3.16Å; D637-H705 IonicContact OD1-CD2 2.72Å; D637-H705 IonicContact OD1-CE1 3.6Å; D637-H705 IonicContact OD1-NE2 3.84Å; D637-H705 PolarHBondContact OD1-NE2 3.22Å
638	R	93.8	Very high	94.5	Very high	16 Å²	16	25.6 Å²	25.6	6%	0.06	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-28.3	-169.8	76.7	-171.4	94.3	168.8	16.9	115.5	W558 I598 W634 Q635	W558-R638 VanDerWaalsContact CH2-O 3.28Å; W558-R638 WeakPolarHBondContact CH2-O 3.45Å; I598-R638 HydrophobicContact CG2-CB 4.07Å; I598-R638 HydrophobicContact CG2-CG 4.17Å; W634-R638 HydrophobicContact CE3-CB 4.41Å; W634-R638 HydrophobicContact CH2-CB 4.14Å; W634-R638 HydrophobicContact CZ2-CB 4.32Å; W634-R638 HydrophobicContact CZ3-CB 4.2Å; W634-R638 PolarHBondContact O-N 3.27Å; Q635-R638 VanDerWaalsContact CG-CZ 3.47Å; Q635-R638 PolarHBondContact O-NE 3.24Å; Q635-R638 PolarHBondContact O-NH2 3.46Å
639	F	95.8	Very high	94.7	Very high	20 Å²	20	22.5 Å²	22.5	9%	0.088	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-11.2	-179.4	-56.7	-59.2	0	0	0	114.1	L595 I598 D637 V641 I642 H643 P706 Y707	L595-F639 HydrophobicContact CD1-CD1 4.02Å; L595-F639 HydrophobicContact CD1-CE1 4Å; I598-F639 HydrophobicContact CG2-CD1 4.06Å; I598-F639 HydrophobicContact CG2-CE1 3.89Å; D637-F639 PolarHBondContact O-N 2.76Å; F639-V641 VanDerWaalsContact C-N 3.32Å; F639-V641 PolarHBondContact O-N 3.33Å; F639-I642 HydrophobicContact CB-CG2 4.35Å; F639-I642 WeakPolarHBondContact O-CG2 3.49Å; F639-I642 PolarHBondContact O-N 3.26Å; F639-H643 VanDerWaalsContact CB-CE1 3.4Å; F639-H643 WeakPolarHBondContact CB-CE1 3.31Å; F639-H643 VanDerWaalsContact O-CG 3.24Å; F639-H643 PolarHBondContact O-N 3.45Å; F639-H643 PolarHBondContact O-ND1 3.49Å; F639-P706 HydrophobicContact CD2-CB 3.99Å; F639-P706 HydrophobicContact CE2-CB 4.32Å; F639-Y707 HydrophobicContact CD2-CE1 4.47Å; F639-Y707 HydrophobicContact CE2-CD1 4.08Å; F639-Y707 AromaticContact CE2-CE1 3.64Å; F639-Y707 HydrophobicContact CE2-CE1 3.64Å; F639-Y707 HydrophobicContact CZ-CE1 4.34Å
640	A	96.3	Very high	94.9	Very high	2 Å²	2	23.9 Å²	23.9	2%	0.017	11%	0.112	C	C	.	.	H	α-helix	trans	-59.7	-41.4	-171.6	0	0	0	0	0	112.7	A499 L502 F503 D637 G644	A499-A640 HydrophobicContact CB-CB 4.14Å; L502-A640 HydrophobicContact CB-CB 3.98Å; F503-A640 WeakPolarHBondContact CA-O 3.49Å; D637-A640 HydrophobicContact CB-CB 4.32Å; D637-A640 WeakPolarHBondContact O-CB 3.17Å; D637-A640 PolarHBondContact O-N 3.16Å; A640-G644 PolarHBondContact O-N 3.38Å; A640-G644 VanDerWaalsContact O-N 3.13Å
641	V	96.6	Very high	94.9	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.012	12%	0.115	C	C	.	.	H	α-helix	trans	-69.8	-46.3	-177.7	177.2	0	0	0	0	112.2	L502 W558 I562 F639 H643 G644 M645	L502-V641 HydrophobicContact CB-CG2 3.85Å; W558-V641 HydrophobicContact CB-CG1 4.44Å; W558-V641 HydrophobicContact CB-CG2 3.86Å; W558-V641 HydrophobicContact CD2-CB 4.05Å; W558-V641 HydrophobicContact CD2-CG1 4.45Å; W558-V641 HydrophobicContact CD2-CG2 3.54Å; W558-V641 HydrophobicContact CE3-CB 3.8Å; W558-V641 HydrophobicContact CE3-CG1 3.99Å; W558-V641 HydrophobicContact CE3-CG2 3.84Å; W558-V641 HydrophobicContact CG-CB 4.43Å; W558-V641 HydrophobicContact CG-CG2 3.54Å; W558-V641 HydrophobicContact CZ3-CB 4.27Å; I562-V641 HydrophobicContact CD1-CG1 3.67Å; I562-V641 HydrophobicContact CG1-CG1 3.77Å; F639-V641 VanDerWaalsContact C-N 3.32Å; F639-V641 PolarHBondContact O-N 3.33Å; V641-H643 VanDerWaalsContact C-N 3.31Å; V641-H643 PolarHBondContact O-N 2.97Å; V641-G644 WeakPolarHBondContact O-CA 3.46Å; V641-G644 PolarHBondContact O-N 3.2Å; V641-M645 HydrophobicContact CG1-SD 4.42Å; V641-M645 WeakPolarHBondContact O-CG 3.32Å; V641-M645 PolarHBondContact O-N 3.28Å
642	I	96.5	Very high	94.8	Very high	7 Å²	7	24.4 Å²	24.4	4%	0.036	12%	0.115	C	C	.	.	H	α-helix	trans	-65.2	-37.2	179.1	-174.2	163.8	0	0	0	111.2	L591 L594 L595 I598 F639 G644 M645 V646	L591-I642 WeakPolarHBondContact O-CD1 3.29Å; L594-I642 HydrophobicContact CB-CD1 4.38Å; L594-I642 HydrophobicContact CD2-CD1 4.37Å; L594-I642 HydrophobicContact CG-CD1 4.27Å; L595-I642 HydrophobicContact CB-CD1 3.57Å; L595-I642 HydrophobicContact CD1-CD1 4.15Å; L595-I642 HydrophobicContact CG-CD1 4.4Å; I598-I642 HydrophobicContact CD1-CB 4.38Å; I598-I642 HydrophobicContact CD1-CG2 4.29Å; F639-I642 HydrophobicContact CB-CG2 4.35Å; F639-I642 WeakPolarHBondContact O-CG2 3.49Å; F639-I642 PolarHBondContact O-N 3.26Å; I642-G644 VanDerWaalsContact C-N 3.28Å; I642-G644 PolarHBondContact O-N 3.41Å; I642-M645 PolarHBondContact O-N 2.95Å; I642-V646 HydrophobicContact CG1-CG2 4.27Å; I642-V646 VanDerWaalsContact O-CG2 3.31Å; I642-V646 WeakPolarHBondContact O-CG2 3.38Å; I642-V646 PolarHBondContact O-N 2.78Å
643	H	96.6	Very high	94.7	Very high	56 Å²	56	22.6 Å²	22.6	26%	0.259	11%	0.109	S	C	.	.	H	α-helix	trans	-58.6	-40.8	170.8	-67.8	137.3	0	0	0	111.8	F503 F639 V641 V646 F647 V710	F503-H643 HydrophobicContact CD2-CB 4.05Å; F503-H643 HydrophobicContact CE2-CB 4.18Å; F639-H643 VanDerWaalsContact CB-CE1 3.4Å; F639-H643 WeakPolarHBondContact CB-CE1 3.31Å; F639-H643 VanDerWaalsContact O-CG 3.24Å; F639-H643 PolarHBondContact O-N 3.45Å; F639-H643 PolarHBondContact O-ND1 3.49Å; V641-H643 VanDerWaalsContact C-N 3.31Å; V641-H643 PolarHBondContact O-N 2.97Å; H643-V646 PolarHBondContact O-N 3.39Å; H643-F647 VanDerWaalsContact O-CB 3.27Å; H643-F647 WeakPolarHBondContact O-CB 3.25Å; H643-F647 PolarHBondContact O-N 3.26Å; H643-V710 HydrophobicContact CB-CB 4.46Å; H643-V710 HydrophobicContact CB-CG2 3.69Å
644	G	96.9	Very high	94.6	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-62	-41.8	174	0	0	0	0	0	113.4	F503 Y507 A640 V641 I642 A648	F503-G644 VanDerWaalsContact CD2-CA 3.44Å; F503-G644 VanDerWaalsContact CD2-N 3.31Å; F503-G644 VanDerWaalsContact CE2-CA 3.47Å; Y507-G644 WeakPolarHBondContact CA-O 3.08Å; A640-G644 PolarHBondContact O-N 3.38Å; A640-G644 VanDerWaalsContact O-N 3.13Å; V641-G644 WeakPolarHBondContact O-CA 3.46Å; V641-G644 PolarHBondContact O-N 3.2Å; I642-G644 VanDerWaalsContact C-N 3.28Å; I642-G644 PolarHBondContact O-N 3.41Å; G644-A648 WeakPolarHBondContact O-CB 3.39Å; G644-A648 PolarHBondContact O-N 3.47Å
645	M	97.2	Very high	94.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-66.2	-44.6	176.5	-62.8	174.7	73.1	0	0	111.9	F510 I562 T565 L591 L594 V641 I642 A648 F649	F510-M645 HydrophobicContact CB-CB 4.36Å; F510-M645 HydrophobicContact CB-CG 4.15Å; F510-M645 HydrophobicContact CD2-CB 4.03Å; F510-M645 HydrophobicContact CD2-CE 3.79Å; F510-M645 HydrophobicContact CD2-CG 4.29Å; F510-M645 HydrophobicContact CE2-CE 4.46Å; F510-M645 HydrophobicContact CG-CB 4.29Å; I562-M645 HydrophobicContact CG1-SD 3.92Å; I562-M645 HydrophobicContact CG2-CE 4.28Å; T565-M645 HydrophobicContact CG2-CE 4.33Å; L591-M645 HydrophobicContact CD2-CB 3.96Å; L591-M645 HydrophobicContact CD2-CE 3.76Å; L591-M645 HydrophobicContact CD2-SD 4.37Å; L594-M645 HydrophobicContact CD2-CE 4.26Å; L594-M645 HydrophobicContact CD2-SD 3.81Å; V641-M645 HydrophobicContact CG1-SD 4.42Å; V641-M645 WeakPolarHBondContact O-CG 3.32Å; V641-M645 PolarHBondContact O-N 3.28Å; I642-M645 PolarHBondContact O-N 2.95Å; M645-A648 PolarHBondContact O-N 3.31Å; M645-F649 PolarHBondContact O-N 3.47Å
646	V	96.9	Very high	93.9	Very high	51 Å²	51	25.7 Å²	25.7	31%	0.309	13%	0.126	S	C	.	.	H	α-helix	trans	-63.5	-44.8	177	171.2	0	0	0	0	110.5	L591 I642 H643 A648 F649 I650	L591-V646 HydrophobicContact CD1-CG2 4.03Å; I642-V646 HydrophobicContact CG1-CG2 4.27Å; I642-V646 VanDerWaalsContact O-CG2 3.31Å; I642-V646 WeakPolarHBondContact O-CG2 3.38Å; I642-V646 PolarHBondContact O-N 2.78Å; H643-V646 PolarHBondContact O-N 3.39Å; V646-A648 PolarHBondContact O-N 2.57Å; V646-F649 WeakPolarHBondContact O-CB 3.29Å; V646-F649 PolarHBondContact O-N 3.17Å; V646-I650 HydrophobicContact CG1-CD1 3.77Å; V646-I650 HydrophobicContact CG1-CG1 4.42Å; V646-I650 WeakPolarHBondContact O-CG1 3.49Å; V646-I650 PolarHBondContact O-N 3.43Å
647	F	96.6	Very high	93.6	Very high	32 Å²	32	34.4 Å²	34.4	14%	0.14	16%	0.158	C	C	.	.	H	α-helix	trans	-60.9	-44.8	176.4	-179.6	-94.1	0	0	0	111.7	L459 L460 F503 Y507 H643 F649 I650 Y651 L714 I717	L459-F647 HydrophobicContact CD2-CE1 4.01Å; L459-F647 HydrophobicContact CD2-CZ 4.01Å; L460-F647 HydrophobicContact CD1-CE1 3.79Å; F503-F647 HydrophobicContact CE1-CD1 4.18Å; F503-F647 HydrophobicContact CE1-CG 4.45Å; F503-F647 HydrophobicContact CE2-CB 3.94Å; F503-F647 HydrophobicContact CE2-CG 4.41Å; F503-F647 HydrophobicContact CZ-CB 3.54Å; F503-F647 AromaticContact CZ-CD1 3.76Å; F503-F647 HydrophobicContact CZ-CD1 3.76Å; F503-F647 HydrophobicContact CZ-CD2 4.29Å; F503-F647 AromaticContact CZ-CG 3.59Å; F503-F647 HydrophobicContact CZ-CG 3.59Å; Y507-F647 AromaticContact CD2-CD1 3.85Å; Y507-F647 HydrophobicContact CD2-CD1 3.85Å; Y507-F647 HydrophobicContact CD2-CE1 4.28Å; Y507-F647 HydrophobicContact CE2-CD1 4.18Å; Y507-F647 HydrophobicContact CE2-CE1 4.2Å; H643-F647 VanDerWaalsContact O-CB 3.27Å; H643-F647 WeakPolarHBondContact O-CB 3.25Å; H643-F647 PolarHBondContact O-N 3.26Å; F647-F649 VanDerWaalsContact C-N 3.32Å; F647-F649 PolarHBondContact O-N 2.63Å; F647-I650 PolarHBondContact O-N 3.09Å; F647-Y651 VanDerWaalsContact O-CB 3.32Å; F647-Y651 WeakPolarHBondContact O-CB 3.49Å; F647-Y651 PolarHBondContact O-N 3.15Å; F647-L714 HydrophobicContact CD2-CD2 3.52Å; F647-L714 HydrophobicContact CE2-CD2 3.92Å; F647-L714 HydrophobicContact CG-CD2 4.34Å; F647-I717 HydrophobicContact CE1-CD1 4.35Å; F647-I717 HydrophobicContact CE1-CG2 4.48Å; F647-I717 HydrophobicContact CE2-CG2 4.43Å; F647-I717 HydrophobicContact CZ-CD1 4.28Å; F647-I717 HydrophobicContact CZ-CG2 3.79Å
648	A	95.4	Very high	93.2	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-58.3	-44.3	175	0	0	0	0	0	112	Y507 F510 G644 M645 V646 Y651 L652	Y507-A648 HydrophobicContact CD2-CB 3.6Å; Y507-A648 HydrophobicContact CE2-CB 4.18Å; Y507-A648 HydrophobicContact CG-CB 4.39Å; F510-A648 HydrophobicContact CB-CB 4.32Å; F510-A648 HydrophobicContact CD1-CB 3.53Å; F510-A648 HydrophobicContact CE1-CB 4.25Å; F510-A648 HydrophobicContact CG-CB 4.25Å; G644-A648 WeakPolarHBondContact O-CB 3.39Å; G644-A648 PolarHBondContact O-N 3.47Å; M645-A648 PolarHBondContact O-N 3.31Å; V646-A648 PolarHBondContact O-N 2.57Å; A648-Y651 PolarHBondContact O-N 3.35Å; A648-L652 WeakPolarHBondContact O-CB 3.49Å; A648-L652 WeakPolarHBondContact O-CG 3.31Å; A648-L652 PolarHBondContact O-N 3.02Å
649	F	94.9	Very high	92.8	Very high	26 Å²	26	44.3 Å²	44.3	11%	0.114	21%	0.209	C	C	.	.	H	α-helix	trans	-60.8	-49.5	176.5	175.5	-111.8	0	0	0	112.2	F510 W514 Y584 I587 M645 V646 F647 Y651 L652 V653	F510-F649 HydrophobicContact CE1-CB 3.85Å; F510-F649 HydrophobicContact CZ-CB 3.89Å; F510-F649 HydrophobicContact CZ-CD2 4.31Å; W514-F649 HydrophobicContact CH2-CD2 4.31Å; W514-F649 HydrophobicContact CH2-CE2 4.03Å; W514-F649 HydrophobicContact CZ2-CE2 4.37Å; Y584-F649 AromaticContact CD1-CE2 3.73Å; Y584-F649 HydrophobicContact CD1-CE2 3.73Å; Y584-F649 AromaticContact CD1-CZ 3.75Å; Y584-F649 HydrophobicContact CD1-CZ 3.75Å; Y584-F649 HydrophobicContact CE1-CE2 4.29Å; I587-F649 HydrophobicContact CG2-CD2 3.71Å; I587-F649 HydrophobicContact CG2-CE1 4.35Å; I587-F649 HydrophobicContact CG2-CE2 3.27Å; I587-F649 HydrophobicContact CG2-CG 4.41Å; I587-F649 HydrophobicContact CG2-CZ 3.61Å; M645-F649 PolarHBondContact O-N 3.47Å; V646-F649 WeakPolarHBondContact O-CB 3.29Å; V646-F649 PolarHBondContact O-N 3.17Å; F647-F649 VanDerWaalsContact C-N 3.32Å; F647-F649 PolarHBondContact O-N 2.63Å; F649-Y651 PolarHBondContact O-N 3.28Å; F649-L652 PolarHBondContact O-N 2.76Å; F649-V653 HydrophobicContact CD2-CG2 4.22Å; F649-V653 HydrophobicContact CE1-CG2 4.41Å; F649-V653 HydrophobicContact CE2-CG2 3.88Å; F649-V653 HydrophobicContact CZ-CG2 4.01Å; F649-V653 VanDerWaalsContact O-CG2 3.25Å; F649-V653 WeakPolarHBondContact O-CG2 3.14Å; F649-V653 PolarHBondContact O-N 3.27Å
650	I	94.1	Very high	92.3	Very high	85 Å²	85	43.9 Å²	43.9	44%	0.436	21%	0.208	S	C	.	.	H	α-helix	trans	-59.7	-48.2	178.1	-67.4	168.1	0	0	0	110.4	V646 F647 L652 V653 L654	V646-I650 HydrophobicContact CG1-CD1 3.77Å; V646-I650 HydrophobicContact CG1-CG1 4.42Å; V646-I650 WeakPolarHBondContact O-CG1 3.49Å; V646-I650 PolarHBondContact O-N 3.43Å; F647-I650 PolarHBondContact O-N 3.09Å; I650-L652 PolarHBondContact O-N 3.42Å; I650-V653 PolarHBondContact O-N 3.01Å; I650-L654 HydrophobicContact CG2-CD1 3.77Å; I650-L654 HydrophobicContact CG2-CG 4.23Å; I650-L654 WeakPolarHBondContact O-CB 3.18Å; I650-L654 VanDerWaalsContact O-CG 3.31Å; I650-L654 WeakPolarHBondContact O-CG 3.42Å; I650-L654 PolarHBondContact O-N 2.93Å
651	Y	92.7	Very high	91.6	Very high	15 Å²	15	46.3 Å²	46.3	6%	0.059	23%	0.225	C	C	.	.	H	α-helix	trans	-56.1	-50.8	178.1	168.2	-114.5	0	0	0	111.9	L459 Y507 F647 A648 F649 V653 L654 Q655 L660 E662	L459-Y651 HydrophobicContact CB-CD2 4.31Å; L459-Y651 HydrophobicContact CB-CE2 3.65Å; L459-Y651 HydrophobicContact CD2-CD2 3.81Å; L459-Y651 HydrophobicContact CD2-CE2 3.93Å; L459-Y651 HydrophobicContact CD2-CG 4.21Å; L459-Y651 HydrophobicContact CG-CD2 4.46Å; L459-Y651 HydrophobicContact CG-CE2 4.26Å; Y507-Y651 HydrophobicContact CE2-CD1 4.18Å; F647-Y651 VanDerWaalsContact O-CB 3.32Å; F647-Y651 WeakPolarHBondContact O-CB 3.49Å; F647-Y651 PolarHBondContact O-N 3.15Å; A648-Y651 PolarHBondContact O-N 3.35Å; F649-Y651 PolarHBondContact O-N 3.28Å; Y651-V653 VanDerWaalsContact C-N 3.29Å; Y651-V653 PolarHBondContact O-N 3.27Å; Y651-L654 PolarHBondContact O-N 2.93Å; Y651-Q655 HydrophobicContact CE2-CB 4.48Å; Y651-Q655 WeakPolarHBondContact O-CB 3.22Å; Y651-Q655 PolarHBondContact O-N 2.96Å; Y651-Q655 PolarHBondContact OH-NE2 2.88Å; Y651-Q655 VanDerWaalsContact OH-NE2 3.11Å; Y651-L660 HydrophobicContact CD2-CD1 3.69Å; Y651-L660 HydrophobicContact CE2-CD1 3.67Å; Y651-E662 PolarHBondContact OH-OE1 3.46Å
652	L	91	Very high	90.9	Very high	6 Å²	6	48.4 Å²	48.4	3%	0.031	24%	0.235	C	C	.	.	H	α-helix	trans	-66	-31.6	-178.4	-68	171.6	0	0	0	112.6	W514 L515 A648 F649 I650 K656	W514-L652 HydrophobicContact CB-CD1 4.37Å; W514-L652 HydrophobicContact CG-CD1 4.08Å; L515-L652 HydrophobicContact CD1-CD2 4.19Å; L515-L652 HydrophobicContact CD2-CD2 4.15Å; L515-L652 HydrophobicContact CG-CD2 4.4Å; A648-L652 WeakPolarHBondContact O-CB 3.49Å; A648-L652 WeakPolarHBondContact O-CG 3.31Å; A648-L652 PolarHBondContact O-N 3.02Å; F649-L652 PolarHBondContact O-N 2.76Å; I650-L652 PolarHBondContact O-N 3.42Å; L652-K656 WeakPolarHBondContact O-CB 3.31Å; L652-K656 PolarHBondContact O-N 3.22Å; L652-K656 VanDerWaalsContact O-N 3.14Å
653	V	90.4	Very high	89.9	Confident	26 Å²	26	49.3 Å²	49.3	16%	0.158	25%	0.246	C	C	.	.	H	α-helix	trans	-69	-46	172.7	171.3	0	0	0	0	111.1	Y584 F649 I650 Y651 K656 R657	Y584-V653 HydrophobicContact CD1-CG2 4.09Å; Y584-V653 HydrophobicContact CE1-CG2 3.71Å; F649-V653 HydrophobicContact CD2-CG2 4.22Å; F649-V653 HydrophobicContact CE1-CG2 4.41Å; F649-V653 HydrophobicContact CE2-CG2 3.88Å; F649-V653 HydrophobicContact CZ-CG2 4.01Å; F649-V653 VanDerWaalsContact O-CG2 3.25Å; F649-V653 WeakPolarHBondContact O-CG2 3.14Å; F649-V653 PolarHBondContact O-N 3.27Å; I650-V653 PolarHBondContact O-N 3.01Å; Y651-V653 VanDerWaalsContact C-N 3.29Å; Y651-V653 PolarHBondContact O-N 3.27Å; V653-K656 PolarHBondContact O-N 2.85Å; V653-R657 WeakPolarHBondContact O-CG 3.39Å; V653-R657 PolarHBondContact O-N 2.86Å
654	L	90.3	Very high	88.7	Confident	51 Å²	51	54.3 Å²	54.3	27%	0.267	27%	0.267	S	S	.	.	H	α-helix	trans	-64.8	-42.2	179	-70.8	175.5	0	0	0	112	I650 Y651 K656 R657 Q658 V659 L660	I650-L654 HydrophobicContact CG2-CD1 3.77Å; I650-L654 HydrophobicContact CG2-CG 4.23Å; I650-L654 WeakPolarHBondContact O-CB 3.18Å; I650-L654 VanDerWaalsContact O-CG 3.31Å; I650-L654 WeakPolarHBondContact O-CG 3.42Å; I650-L654 PolarHBondContact O-N 2.93Å; Y651-L654 PolarHBondContact O-N 2.93Å; L654-K656 VanDerWaalsContact C-N 3.33Å; L654-K656 PolarHBondContact O-N 2.77Å; L654-R657 PolarHBondContact O-N 3.38Å; L654-Q658 PolarHBondContact O-N 2.89Å; L654-V659 HydrophobicContact CD2-CB 4.24Å; L654-V659 HydrophobicContact CD2-CG1 4.26Å; L654-V659 HydrophobicContact CD2-CG2 4.45Å; L654-V659 PolarHBondContact O-N 2.72Å; L654-L660 HydrophobicContact CB-CD1 3.91Å; L654-L660 HydrophobicContact CB-CD2 4.35Å; L654-L660 HydrophobicContact CB-CG 3.97Å
655	Q	88.7	Confident	87.6	Confident	49 Å²	49	56.8 Å²	56.8	23%	0.229	29%	0.293	C	S	.	.	H	α-helix	trans	-59.8	-44.7	174.7	-172.9	179.4	45.5	0	0	110.9	Y651 R657 Q658 L660 E662	Y651-Q655 HydrophobicContact CE2-CB 4.48Å; Y651-Q655 WeakPolarHBondContact O-CB 3.22Å; Y651-Q655 PolarHBondContact O-N 2.96Å; Y651-Q655 PolarHBondContact OH-NE2 2.88Å; Y651-Q655 VanDerWaalsContact OH-NE2 3.11Å; Q655-R657 PolarHBondContact O-N 3.4Å; Q655-Q658 PolarHBondContact O-N 2.87Å; Q655-Q658 VanDerWaalsContact O-N 3.16Å; Q655-Q658 PolarHBondContact O-NE2 2.97Å; Q655-L660 HydrophobicContact CB-CD1 4.28Å; Q655-E662 PolarHBondContact NE2-OE2 3.34Å
656	K	85.8	Confident	86.9	Confident	85 Å²	85	62 Å²	62	37%	0.37	32%	0.317	S	S	.	.	H	α-helix	trans	-64.4	-38.3	177.2	-176.6	-176.4	168.7	-165.6	0	112.6	N578 Y584 L652 V653 L654 Q658	N578-K656 WeakPolarHBondContact OD1-CE 3.15Å; N578-K656 PolarHBondContact OD1-NZ 2.93Å; Y584-K656 WeakPolarHBondContact OH-CD 3.43Å; Y584-K656 PolarHBondContact OH-NZ 3.25Å; L652-K656 WeakPolarHBondContact O-CB 3.31Å; L652-K656 PolarHBondContact O-N 3.22Å; L652-K656 VanDerWaalsContact O-N 3.14Å; V653-K656 PolarHBondContact O-N 2.85Å; L654-K656 VanDerWaalsContact C-N 3.33Å; L654-K656 PolarHBondContact O-N 2.77Å; K656-Q658 PolarHBondContact O-N 3.32Å
657	R	85.9	Confident	86.3	Confident	190 Å²	190	61.3 Å²	61.3	72%	0.717	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	2.3	177.3	-70.2	-174.7	179.5	-165.5	0.6	113.4	V653 L654 Q655 V659	V653-R657 WeakPolarHBondContact O-CG 3.39Å; V653-R657 PolarHBondContact O-N 2.86Å; L654-R657 PolarHBondContact O-N 3.38Å; Q655-R657 PolarHBondContact O-N 3.4Å; R657-V659 HydrophobicContact CB-CG2 3.79Å; R657-V659 PolarHBondContact O-N 3.17Å; R657-V659 VanDerWaalsContact O-N 3.17Å
658	Q	84	Confident	85.8	Confident	157 Å²	157	59.9 Å²	59.9	73%	0.734	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	31.4	-178.4	-59.5	-64.9	-35.3	0	0	112.9	L654 Q655 K656 L660	L654-Q658 PolarHBondContact O-N 2.89Å; Q655-Q658 PolarHBondContact O-N 2.87Å; Q655-Q658 VanDerWaalsContact O-N 3.16Å; Q655-Q658 PolarHBondContact O-NE2 2.97Å; K656-Q658 PolarHBondContact O-N 3.32Å; Q658-L660 VanDerWaalsContact C-N 3.3Å
659	V	85.9	Confident	85.5	Confident	70 Å²	70	61.5 Å²	61.5	42%	0.424	32%	0.317	S	S	.	.			trans	-80.3	-19.2	176.5	179.5	0	0	0	0	111	L654 R657	L654-V659 HydrophobicContact CD2-CB 4.24Å; L654-V659 HydrophobicContact CD2-CG1 4.26Å; L654-V659 HydrophobicContact CD2-CG2 4.45Å; L654-V659 PolarHBondContact O-N 2.72Å; R657-V659 HydrophobicContact CB-CG2 3.79Å; R657-V659 PolarHBondContact O-N 3.17Å; R657-V659 VanDerWaalsContact O-N 3.17Å
660	L	85.8	Confident	85.2	Confident	12 Å²	12	64.2 Å²	64.2	6%	0.063	34%	0.338	C	S	.	.	S	Bend	trans	-99.8	125.4	-177.5	-57.3	175.2	0	0	0	110.5	Y651 L654 Q655 Q658 E662 L668 F669	Y651-L660 HydrophobicContact CD2-CD1 3.69Å; Y651-L660 HydrophobicContact CE2-CD1 3.67Å; L654-L660 HydrophobicContact CB-CD1 3.91Å; L654-L660 HydrophobicContact CB-CD2 4.35Å; L654-L660 HydrophobicContact CB-CG 3.97Å; Q655-L660 HydrophobicContact CB-CD1 4.28Å; Q658-L660 VanDerWaalsContact C-N 3.3Å; L660-E662 HydrophobicContact CB-CG 4.34Å; L660-E662 PolarHBondContact O-N 3.48Å; L660-L668 HydrophobicContact CB-CD1 4.06Å; L660-L668 HydrophobicContact CD2-CD1 3.97Å; L660-L668 HydrophobicContact CD2-CD2 4.33Å; L660-L668 HydrophobicContact CD2-CG 3.91Å; L660-L668 HydrophobicContact CG-CD1 4.44Å; L660-F669 HydrophobicContact CD2-CD1 4.19Å; L660-F669 HydrophobicContact CD2-CE1 3.4Å; L660-F669 HydrophobicContact CD2-CE2 4.45Å; L660-F669 HydrophobicContact CD2-CZ 3.56Å
661	S	81.5	Confident	84.8	Confident	53 Å²	53	63.4 Å²	63.4	37%	0.371	34%	0.344	S	S	.	.			trans	-87.1	97.5	170.3	-74.2	0	0	0	0	109.9	G663 A667 L668 R727	S661-G663 VanDerWaalsContact C-N 3.32Å; S661-A667 WeakPolarHBondContact CB-O 3.47Å; S661-L668 PolarHBondContact N-O 3.41Å; S661-R727 PolarHBondContact O-NH1 3.09Å; S661-R727 PolarHBondContact O-NH2 3.46Å
662	E	81.7	Confident	84.7	Confident	46 Å²	46	71.8 Å²	71.8	22%	0.215	38%	0.381	C	S	.	.			trans	-93.5	23	179	-63.2	-170.2	132.6	0	0	113	K458 L459 Y651 Q655 L660	K458-E662 WeakPolarHBondContact CA-OE1 3.12Å; L459-E662 PolarHBondContact N-OE1 3.37Å; Y651-E662 PolarHBondContact OH-OE1 3.46Å; Q655-E662 PolarHBondContact NE2-OE2 3.34Å; L660-E662 HydrophobicContact CB-CG 4.34Å; L660-E662 PolarHBondContact O-N 3.48Å
663	G	75.2	Confident	84.7	Confident	26 Å²	26	75.4 Å²	75.4	27%	0.268	40%	0.399	S	S	.	.	S	Bend	trans	-66	156.5	173.5	0	0	0	0	0	113.3	S661 G665 R727	S661-G663 VanDerWaalsContact C-N 3.32Å; G663-G665 PolarHBondContact O-N 3.49Å; G663-R727 PolarHBondContact O-NH2 3.4Å
664	K	72.5	Confident	84.7	Confident	160 Å²	160	74.5 Å²	74.5	70%	0.696	39%	0.394	S	S	*	.	S	Bend	trans	-68.7	122.6	173.3	-73.7	-171.2	176.9	-173	0	109.3	A457 E666	A457-K664 HydrophobicContact CB-CG 4.23Å; K664-E666 PolarHBondContact O-N 2.94Å
665	G	72.5	Confident	84.8	Confident	53 Å²	53	77 Å²	77	55%	0.546	41%	0.408	S	S	.	.	S	Bend	trans	81.2	-13.7	178.9	0	0	0	0	0	115.8	G663	G663-G665 PolarHBondContact O-N 3.49Å
666	E	83.2	Confident	85.1	Confident	109 Å²	109	80.4 Å²	80.4	51%	0.509	43%	0.427	S	S	.	.			trans	-78.9	144.8	176.8	-65.5	-175.7	169.7	0	0	112.3	K664 G724 R727	K664-E666 PolarHBondContact O-N 2.94Å; E666-G724 VanDerWaalsContact O-CA 3.22Å; E666-G724 WeakPolarHBondContact O-CA 3.22Å; E666-R727 PolarHBondContact O-NH2 3.13Å; E666-R727 VanDerWaalsContact O-NH2 3.09Å
667	A	85	Confident	85.5	Confident	37 Å²	37	79 Å²	79	31%	0.306	42%	0.423	S	S	.	.			trans	-65.5	146.5	171.9	0	0	0	0	0	110.7	S661 F669 I722	S661-A667 WeakPolarHBondContact CB-O 3.47Å; A667-F669 PolarHBondContact O-N 2.8Å; A667-I722 WeakPolarHBondContact CA-O 3.43Å
668	L	86.2	Confident	85.9	Confident	2 Å²	2	72.2 Å²	72.2	1%	0.01	40%	0.401	C	S	.	.	S	Bend	trans	-60.3	-31.3	-177.5	-173.7	67.4	0	0	0	113.8	L459 L660 S661 I722	L459-L668 HydrophobicContact CD1-CD1 4.39Å; L459-L668 HydrophobicContact CD1-CD2 3.57Å; L660-L668 HydrophobicContact CB-CD1 4.06Å; L660-L668 HydrophobicContact CD2-CD1 3.97Å; L660-L668 HydrophobicContact CD2-CD2 4.33Å; L660-L668 HydrophobicContact CD2-CG 3.91Å; L660-L668 HydrophobicContact CG-CD1 4.44Å; S661-L668 PolarHBondContact N-O 3.41Å; L668-I722 PolarHBondContact N-O 3.16Å
669	F	88.6	Confident	86.4	Confident	33 Å²	33	71.6 Å²	71.6	15%	0.145	40%	0.396	C	S	.	.	S	Bend	trans	-129.6	166.1	-178.7	-64	-72.9	0	0	0	110	L660 A667 I673 L677	L660-F669 HydrophobicContact CD2-CD1 4.19Å; L660-F669 HydrophobicContact CD2-CE1 3.4Å; L660-F669 HydrophobicContact CD2-CE2 4.45Å; L660-F669 HydrophobicContact CD2-CZ 3.56Å; A667-F669 PolarHBondContact O-N 2.8Å; F669-I673 HydrophobicContact CB-CB 4.17Å; F669-I673 HydrophobicContact CB-CG2 4.03Å; F669-I673 HydrophobicContact CG-CG2 4.22Å; F669-L677 HydrophobicContact CD2-CD1 3.88Å; F669-L677 HydrophobicContact CE2-CD1 3.86Å
670	P	88.3	Confident	86.9	Confident	84 Å²	84	71.6 Å²	71.6	55%	0.545	40%	0.399	S	S	.	.			trans	-50.7	142.9	169.5	-26.5	34.6	0	0	0	111.9	K672 I673 S674	P670-K672 VanDerWaalsContact C-N 3.26Å; P670-K672 PolarHBondContact O-N 2.84Å; P670-I673 HydrophobicContact CG-CD1 4.48Å; P670-I673 PolarHBondContact O-N 3.26Å; P670-S674 PolarHBondContact O-N 3.23Å
671	A	86.7	Confident	87.3	Confident	68 Å²	68	71.3 Å²	71.3	56%	0.562	40%	0.398	S	S	*	.	H	α-helix	trans	-49.4	-40.8	-169.1	0	0	0	0	0	114.6	S674 N675	A671-S674 PolarHBondContact O-N 3.01Å; A671-N675 WeakPolarHBondContact O-CB 3.21Å; A671-N675 VanDerWaalsContact O-CG 3.26Å; A671-N675 PolarHBondContact O-N 3.47Å
672	K	89.7	Confident	88	Confident	190 Å²	190	71.7 Å²	71.7	83%	0.826	40%	0.398	S	S	*	.	H	α-helix	trans	-60.5	-46.6	177.8	-67	-175.6	178.5	-179	0	112.5	P670 L676	P670-K672 VanDerWaalsContact C-N 3.26Å; P670-K672 PolarHBondContact O-N 2.84Å; K672-L676 PolarHBondContact O-N 3Å
673	I	90.9	Very high	88.7	Confident	83 Å²	83	72.4 Å²	72.4	43%	0.426	41%	0.406	S	S	.	.	H	α-helix	trans	-71.8	-43.5	-179.5	-61.7	174.2	0	0	0	109.7	F669 P670 N675 L676 L677	F669-I673 HydrophobicContact CB-CB 4.17Å; F669-I673 HydrophobicContact CB-CG2 4.03Å; F669-I673 HydrophobicContact CG-CG2 4.22Å; P670-I673 HydrophobicContact CG-CD1 4.48Å; P670-I673 PolarHBondContact O-N 3.26Å; I673-N675 PolarHBondContact O-N 3.46Å; I673-L676 PolarHBondContact O-N 2.84Å; I673-L677 HydrophobicContact CG2-CD1 3.72Å; I673-L677 HydrophobicContact CG2-CG 4.12Å; I673-L677 WeakPolarHBondContact O-CB 3.08Å; I673-L677 WeakPolarHBondContact O-CG 3.29Å; I673-L677 PolarHBondContact O-N 3.2Å
674	S	90.9	Very high	89.6	Confident	7 Å²	7	72.6 Å²	72.6	5%	0.049	40%	0.403	C	S	.	.	H	α-helix	trans	-53.8	-50.4	176.4	172.5	0	0	0	0	112	P670 A671 L678 I722	P670-S674 PolarHBondContact O-N 3.23Å; A671-S674 PolarHBondContact O-N 3.01Å; S674-L678 VanDerWaalsContact O-CB 3.23Å; S674-L678 WeakPolarHBondContact O-CB 3.47Å; S674-L678 PolarHBondContact O-N 3.47Å; S674-I722 WeakPolarHBondContact OG-CG2 3.36Å
675	N	91.7	Very high	90.6	Very high	104 Å²	104	68.8 Å²	68.8	56%	0.556	39%	0.386	S	S	*	.	H	α-helix	trans	-67.2	-40.5	-179.2	-69.2	-10.3	0	0	0	112.4	A671 I673 L678 F679	A671-N675 WeakPolarHBondContact O-CB 3.21Å; A671-N675 VanDerWaalsContact O-CG 3.26Å; A671-N675 PolarHBondContact O-N 3.47Å; I673-N675 PolarHBondContact O-N 3.46Å; N675-L678 PolarHBondContact O-N 2.92Å; N675-F679 WeakPolarHBondContact O-CB 3.33Å; N675-F679 PolarHBondContact O-N 3.39Å
676	L	94.7	Very high	91.7	Very high	120 Å²	120	70.6 Å²	70.6	63%	0.628	38%	0.383	S	S	*	.	H	α-helix	trans	-63.1	-48.1	176.9	179.2	64.4	0	0	0	111.7	K672 I673 F679 S680	K672-L676 PolarHBondContact O-N 3Å; I673-L676 PolarHBondContact O-N 2.84Å; L676-F679 PolarHBondContact O-N 2.87Å; L676-S680 WeakPolarHBondContact O-CB 3.25Å; L676-S680 PolarHBondContact O-N 2.78Å
677	L	93.9	Very high	92.2	Very high	54 Å²	54	69.4 Å²	69.4	28%	0.283	38%	0.383	S	S	.	.	H	α-helix	trans	-65.5	-40.1	178.9	-71.4	178.6	0	0	0	111.7	F669 I673 S681 I722	F669-L677 HydrophobicContact CD2-CD1 3.88Å; F669-L677 HydrophobicContact CE2-CD1 3.86Å; I673-L677 HydrophobicContact CG2-CD1 3.72Å; I673-L677 HydrophobicContact CG2-CG 4.12Å; I673-L677 WeakPolarHBondContact O-CB 3.08Å; I673-L677 WeakPolarHBondContact O-CG 3.29Å; I673-L677 PolarHBondContact O-N 3.2Å; L677-S681 VanDerWaalsContact O-CB 3.28Å; L677-S681 WeakPolarHBondContact O-CB 3.29Å; L677-S681 PolarHBondContact O-N 3.45Å; L677-S681 PolarHBondContact O-OG 2.88Å; L677-I722 HydrophobicContact CB-CD1 3.67Å
678	L	94.2	Very high	92.6	Very high	48 Å²	48	68 Å²	68	25%	0.251	37%	0.37	S	S	.	.	H	α-helix	trans	-64.4	-47	176.9	-175.2	63.6	0	0	0	111.2	S674 N675 S681 V682 I719 I722	S674-L678 VanDerWaalsContact O-CB 3.23Å; S674-L678 WeakPolarHBondContact O-CB 3.47Å; S674-L678 PolarHBondContact O-N 3.47Å; N675-L678 PolarHBondContact O-N 2.92Å; L678-S681 PolarHBondContact O-N 3.35Å; L678-V682 WeakPolarHBondContact O-CG2 3.38Å; L678-V682 PolarHBondContact O-N 2.89Å; L678-I719 HydrophobicContact CD1-CB 4.43Å; L678-I719 HydrophobicContact CD1-CG1 4.13Å; L678-I722 HydrophobicContact CB-CD1 4.37Å
679	F	95.4	Very high	92.9	Very high	144 Å²	144	69.5 Å²	69.5	63%	0.632	38%	0.38	S	S	*	.	H	α-helix	trans	-59.6	-49.6	176.3	177.7	-101	0	0	0	111.6	N675 L676 S681 V682 V683	N675-F679 WeakPolarHBondContact O-CB 3.33Å; N675-F679 PolarHBondContact O-N 3.39Å; L676-F679 PolarHBondContact O-N 2.87Å; F679-S681 VanDerWaalsContact C-N 3.28Å; F679-S681 PolarHBondContact O-N 2.84Å; F679-V682 PolarHBondContact O-N 3.36Å; F679-V683 HydrophobicContact CD1-CG2 4.26Å; F679-V683 HydrophobicContact CD2-CG2 4.42Å; F679-V683 HydrophobicContact CE1-CG2 3.85Å; F679-V683 HydrophobicContact CE2-CG2 4.03Å; F679-V683 HydrophobicContact CZ-CG2 3.72Å; F679-V683 WeakPolarHBondContact O-CG2 3.45Å; F679-V683 PolarHBondContact O-N 3.21Å
680	S	95.4	Very high	93.1	Very high	71 Å²	71	72.8 Å²	72.8	50%	0.497	40%	0.398	S	S	.	.	H	α-helix	trans	-59.3	-38.8	177.1	178.7	0	0	0	0	112.1	L676 S684	L676-S680 WeakPolarHBondContact O-CB 3.25Å; L676-S680 PolarHBondContact O-N 2.78Å; S680-S684 WeakPolarHBondContact O-CB 3.43Å; S680-S684 PolarHBondContact O-N 3.37Å
681	S	95.9	Very high	93.3	Very high	5 Å²	5	72.2 Å²	72.2	4%	0.035	39%	0.385	C	S	.	.	H	α-helix	trans	-66.3	-43.1	177.5	-59	0	0	0	0	112.2	L677 L678 F679 S684 F685 L718	L677-S681 VanDerWaalsContact O-CB 3.28Å; L677-S681 WeakPolarHBondContact O-CB 3.29Å; L677-S681 PolarHBondContact O-N 3.45Å; L677-S681 PolarHBondContact O-OG 2.88Å; L678-S681 PolarHBondContact O-N 3.35Å; F679-S681 VanDerWaalsContact C-N 3.28Å; F679-S681 PolarHBondContact O-N 2.84Å; S681-S684 PolarHBondContact O-N 3.19Å; S681-F685 WeakPolarHBondContact O-CB 3.26Å; S681-F685 PolarHBondContact O-N 3.38Å; S681-L718 WeakPolarHBondContact OG-CB 3.24Å; S681-L718 VanDerWaalsContact OG-CD1 3.3Å; S681-L718 WeakPolarHBondContact OG-CD1 3.36Å
682	V	95.8	Very high	93.5	Very high	61 Å²	61	69 Å²	69	37%	0.37	36%	0.358	S	S	.	.	H	α-helix	trans	-65.3	-45.8	177.1	172.1	0	0	0	0	110.9	L678 F679 S684 F685 I686 I719	L678-V682 WeakPolarHBondContact O-CG2 3.38Å; L678-V682 PolarHBondContact O-N 2.89Å; F679-V682 PolarHBondContact O-N 3.36Å; V682-S684 VanDerWaalsContact C-N 3.32Å; V682-S684 PolarHBondContact O-N 3.16Å; V682-F685 PolarHBondContact O-N 3.1Å; V682-I686 HydrophobicContact CG1-CD1 3.92Å; V682-I686 WeakPolarHBondContact O-CG1 3.25Å; V682-I686 PolarHBondContact O-N 3.33Å; V682-I719 HydrophobicContact CG2-CD1 4.11Å; V682-I719 HydrophobicContact CG2-CG1 4.18Å
683	V	96.3	Very high	93.5	Very high	62 Å²	62	63.6 Å²	63.6	38%	0.376	35%	0.345	S	S	.	.	H	α-helix	trans	-58.4	-46	175.4	171.3	0	0	0	0	110.4	F679 F685 I686 T687	F679-V683 HydrophobicContact CD1-CG2 4.26Å; F679-V683 HydrophobicContact CD2-CG2 4.42Å; F679-V683 HydrophobicContact CE1-CG2 3.85Å; F679-V683 HydrophobicContact CE2-CG2 4.03Å; F679-V683 HydrophobicContact CZ-CG2 3.72Å; F679-V683 WeakPolarHBondContact O-CG2 3.45Å; F679-V683 PolarHBondContact O-N 3.21Å; V683-F685 VanDerWaalsContact C-N 3.32Å; V683-F685 PolarHBondContact O-N 3.48Å; V683-I686 PolarHBondContact O-N 3.38Å; V683-T687 WeakPolarHBondContact O-CB 3.45Å; V683-T687 PolarHBondContact O-N 2.67Å; V683-T687 PolarHBondContact O-OG1 3.13Å
684	S	94.5	Very high	93.4	Very high	30 Å²	30	63.9 Å²	63.9	21%	0.21	35%	0.354	C	S	.	.	H	α-helix	trans	-59.9	-42	176.7	-174.2	0	0	0	0	112.6	S680 S681 V682 I686 T687 Y688 V711	S680-S684 WeakPolarHBondContact O-CB 3.43Å; S680-S684 PolarHBondContact O-N 3.37Å; S681-S684 PolarHBondContact O-N 3.19Å; V682-S684 VanDerWaalsContact C-N 3.32Å; V682-S684 PolarHBondContact O-N 3.16Å; S684-I686 VanDerWaalsContact C-N 3.34Å; S684-I686 PolarHBondContact O-N 2.89Å; S684-T687 PolarHBondContact O-N 3.25Å; S684-Y688 WeakPolarHBondContact O-CB 3.27Å; S684-Y688 PolarHBondContact O-N 3Å; S684-V711 WeakPolarHBondContact OG-CG1 3.46Å
685	F	93.4	Very high	93.2	Very high	79 Å²	79	64.4 Å²	64.4	35%	0.346	36%	0.357	S	S	.	.	H	α-helix	trans	-63.1	-41.2	180	-161.2	-75.9	0	0	0	111.8	S681 V682 V683 S689 I719	S681-F685 WeakPolarHBondContact O-CB 3.26Å; S681-F685 PolarHBondContact O-N 3.38Å; V682-F685 PolarHBondContact O-N 3.1Å; V683-F685 VanDerWaalsContact C-N 3.32Å; V683-F685 PolarHBondContact O-N 3.48Å; F685-S689 PolarHBondContact O-N 3.19Å; F685-S689 PolarHBondContact O-OG 3.33Å; F685-I719 HydrophobicContact CB-CD1 4.36Å; F685-I719 HydrophobicContact CD2-CD1 4.28Å
686	I	94.3	Very high	92.9	Very high	92 Å²	92	68.2 Å²	68.2	47%	0.472	37%	0.369	S	S	.	.	H	α-helix	trans	-69.3	-47.9	177.3	-65.5	168.5	0	0	0	110.6	V682 V683 S684 Y688 S689 I690	V682-I686 HydrophobicContact CG1-CD1 3.92Å; V682-I686 WeakPolarHBondContact O-CG1 3.25Å; V682-I686 PolarHBondContact O-N 3.33Å; V683-I686 PolarHBondContact O-N 3.38Å; S684-I686 VanDerWaalsContact C-N 3.34Å; S684-I686 PolarHBondContact O-N 2.89Å; I686-Y688 VanDerWaalsContact C-N 3.29Å; I686-Y688 PolarHBondContact O-N 3.25Å; I686-S689 WeakPolarHBondContact O-CB 3.49Å; I686-S689 PolarHBondContact O-N 3.31Å; I686-I690 HydrophobicContact CG2-CD1 3.85Å; I686-I690 HydrophobicContact CG2-CG1 4.4Å; I686-I690 WeakPolarHBondContact O-CG1 3.23Å; I686-I690 PolarHBondContact O-N 3Å
687	T	93.9	Very high	92.6	Very high	83 Å²	83	65.5 Å²	65.5	51%	0.509	36%	0.357	S	S	.	.	H	α-helix	trans	-59.5	-39.8	179.6	-59.8	0	0	0	0	111.9	V683 S684 S689 I690 W691	V683-T687 WeakPolarHBondContact O-CB 3.45Å; V683-T687 PolarHBondContact O-N 2.67Å; V683-T687 PolarHBondContact O-OG1 3.13Å; S684-T687 PolarHBondContact O-N 3.25Å; T687-S689 VanDerWaalsContact C-N 3.34Å; T687-S689 PolarHBondContact O-N 3.03Å; T687-I690 PolarHBondContact O-N 3.44Å; T687-W691 WeakPolarHBondContact O-CB 2.89Å; T687-W691 PolarHBondContact O-N 2.85Å
688	Y	93.4	Very high	92.4	Very high	9 Å²	9	66.6 Å²	66.6	4%	0.035	36%	0.36	C	S	.	.	H	α-helix	trans	-60.5	-43.8	173.4	-179.2	-92.2	0	0	0	112.1	M492 V496 S684 I686 I690 W691 A692 I708 Q712	M492-Y688 PolarHBondContact O-OH 3.03Å; V496-Y688 HydrophobicContact CG2-CE1 3.89Å; V496-Y688 HydrophobicContact CG2-CE2 4.13Å; V496-Y688 VanDerWaalsContact CG2-CZ 3.44Å; V496-Y688 WeakPolarHBondContact CG2-OH 3.25Å; S684-Y688 WeakPolarHBondContact O-CB 3.27Å; S684-Y688 PolarHBondContact O-N 3Å; I686-Y688 VanDerWaalsContact C-N 3.29Å; I686-Y688 PolarHBondContact O-N 3.25Å; Y688-I690 VanDerWaalsContact C-N 3.33Å; Y688-I690 PolarHBondContact O-N 3.03Å; Y688-W691 HydrophobicContact CD2-CE3 4.08Å; Y688-W691 HydrophobicContact CD2-CZ3 4.38Å; Y688-W691 AromaticContact CE2-CE3 3.8Å; Y688-W691 HydrophobicContact CE2-CE3 3.8Å; Y688-W691 AromaticContact CE2-CZ3 3.66Å; Y688-W691 HydrophobicContact CE2-CZ3 3.66Å; Y688-W691 PolarHBondContact O-N 3.43Å; Y688-A692 HydrophobicContact CE1-CB 4.29Å; Y688-A692 WeakPolarHBondContact O-CB 3.18Å; Y688-A692 PolarHBondContact O-N 2.89Å; Y688-I708 HydrophobicContact CD2-CG2 3.64Å; Y688-I708 HydrophobicContact CE2-CG2 3.83Å; Y688-Q712 VanDerWaalsContact CB-OE1 3.28Å; Y688-Q712 HydrophobicContact CD1-CG 4.14Å; Y688-Q712 HydrophobicContact CG-CB 4.46Å; Y688-Q712 HydrophobicContact CG-CG 4.27Å
689	S	92.9	Very high	92.2	Very high	32 Å²	32	68.9 Å²	68.9	22%	0.224	38%	0.376	C	S	.	.	H	α-helix	trans	-64.9	-38.6	-179.6	-55.5	0	0	0	0	111.9	H493 F685 I686 T687 S693	H493-S689 PolarHBondContact NE2-OG 3.34Å; F685-S689 PolarHBondContact O-N 3.19Å; F685-S689 PolarHBondContact O-OG 3.33Å; I686-S689 WeakPolarHBondContact O-CB 3.49Å; I686-S689 PolarHBondContact O-N 3.31Å; T687-S689 VanDerWaalsContact C-N 3.34Å; T687-S689 PolarHBondContact O-N 3.03Å; S689-S693 WeakPolarHBondContact O-CB 3.33Å; S689-S693 PolarHBondContact O-N 2.98Å; S689-S693 VanDerWaalsContact O-N 3.1Å; S689-S693 PolarHBondContact O-OG 3.43Å
690	I	92.8	Very high	91.9	Very high	103 Å²	103	67.3 Å²	67.3	53%	0.528	37%	0.371	S	S	.	.	H	α-helix	trans	-64.4	-50.4	173.7	-65.2	168.3	0	0	0	109.9	I686 T687 Y688 A692 S693 S694	I686-I690 HydrophobicContact CG2-CD1 3.85Å; I686-I690 HydrophobicContact CG2-CG1 4.4Å; I686-I690 WeakPolarHBondContact O-CG1 3.23Å; I686-I690 PolarHBondContact O-N 3Å; T687-I690 PolarHBondContact O-N 3.44Å; Y688-I690 VanDerWaalsContact C-N 3.33Å; Y688-I690 PolarHBondContact O-N 3.03Å; I690-A692 PolarHBondContact O-N 2.66Å; I690-S693 CarbonylContact O-C 3.21Å; I690-S693 WeakPolarHBondContact O-CA 2.98Å; I690-S693 WeakPolarHBondContact O-CB 2.98Å; I690-S693 PolarHBondContact O-N 3.18Å; I690-S694 PolarHBondContact O-N 2.93Å; I690-S694 PolarHBondContact O-OG 2.88Å
691	W	92.8	Very high	91.7	Very high	72 Å²	72	64 Å²	64	27%	0.273	35%	0.347	S	S	.	.	H	α-helix	trans	-57.5	-46.2	177.7	171.7	77.8	0	0	0	112.4	M492 T687 Y688 S693 S694 C695 C701 M704 I708	M492-W691 HydrophobicContact CE-CH2 3.75Å; M492-W691 HydrophobicContact CE-CZ3 3.84Å; T687-W691 WeakPolarHBondContact O-CB 2.89Å; T687-W691 PolarHBondContact O-N 2.85Å; Y688-W691 HydrophobicContact CD2-CE3 4.08Å; Y688-W691 HydrophobicContact CD2-CZ3 4.38Å; Y688-W691 AromaticContact CE2-CE3 3.8Å; Y688-W691 HydrophobicContact CE2-CE3 3.8Å; Y688-W691 AromaticContact CE2-CZ3 3.66Å; Y688-W691 HydrophobicContact CE2-CZ3 3.66Å; Y688-W691 PolarHBondContact O-N 3.43Å; W691-S693 PolarHBondContact O-N 3.19Å; W691-S694 PolarHBondContact O-N 2.82Å; W691-S694 VanDerWaalsContact O-N 3.13Å; W691-C695 PolarHBondContact O-N 2.83Å; W691-C701 HydrophobicContact CH2-CB 4.32Å; W691-M704 HydrophobicContact CH2-CB 4.1Å; W691-M704 HydrophobicContact CZ2-CB 3.71Å; W691-M704 HydrophobicContact CZ2-CG 4.33Å; W691-I708 HydrophobicContact CD2-CD1 4.48Å; W691-I708 HydrophobicContact CH2-CD1 4.2Å; W691-I708 HydrophobicContact CZ2-CD1 4Å
692	A	90.9	Very high	91.5	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-62.3	-26.9	176.5	0	0	0	0	0	112.8	M492 Y688 I690 C695	M492-A692 HydrophobicContact CB-CB 3.98Å; Y688-A692 HydrophobicContact CE1-CB 4.29Å; Y688-A692 WeakPolarHBondContact O-CB 3.18Å; Y688-A692 PolarHBondContact O-N 2.89Å; I690-A692 PolarHBondContact O-N 2.66Å; A692-C695 WeakPolarHBondContact O-CB 3.45Å
693	S	89.9	Confident	91.3	Very high	77 Å²	77	68.2 Å²	68.2	54%	0.538	36%	0.363	S	S	.	.	H	α-helix	trans	-81.9	-29.6	175.9	-56.6	0	0	0	0	112.9	S689 I690 W691 C695	S689-S693 WeakPolarHBondContact O-CB 3.33Å; S689-S693 PolarHBondContact O-N 2.98Å; S689-S693 VanDerWaalsContact O-N 3.1Å; S689-S693 PolarHBondContact O-OG 3.43Å; I690-S693 CarbonylContact O-C 3.21Å; I690-S693 WeakPolarHBondContact O-CA 2.98Å; I690-S693 WeakPolarHBondContact O-CB 2.98Å; I690-S693 PolarHBondContact O-N 3.18Å; W691-S693 PolarHBondContact O-N 3.19Å; S693-C695 VanDerWaalsContact C-N 3.28Å
694	S	88.9	Confident	91.1	Very high	89 Å²	89	69.5 Å²	69.5	62%	0.622	37%	0.366	S	S	*	.	H	α-helix	trans	-81	-7	175.8	-56.8	0	0	0	0	113.9	I690 W691 K696	I690-S694 PolarHBondContact O-N 2.93Å; I690-S694 PolarHBondContact O-OG 2.88Å; W691-S694 PolarHBondContact O-N 2.82Å; W691-S694 VanDerWaalsContact O-N 3.13Å; S694-K696 PolarHBondContact O-N 3.1Å
695	C	86.6	Confident	91	Very high	18 Å²	18	68.1 Å²	68.1	12%	0.122	36%	0.356	C	S	.	.			trans	-68.8	116.7	-178.2	-109.2	0	0	0	0	112.7	V488 W691 A692 S693 C701	V488-C695 HydrophobicContact CG1-CB 4.05Å; W691-C695 PolarHBondContact O-N 2.83Å; A692-C695 WeakPolarHBondContact O-CB 3.45Å; S693-C695 VanDerWaalsContact C-N 3.28Å; C695-C701 HydrophobicContact CB-CB 4.22Å; C695-C701 WeakPolarHBondContact CB-SG 3.45Å; C695-C701 WeakPolarHBondContact SG-CB 3.41Å; C695-C701 CovalentContact SG-SG 2.02Å; C695-C701 PolarHBondContact SG-SG 3.36Å
696	K	84.4	Confident	91.1	Very high	183 Å²	183	64.4 Å²	64.4	80%	0.796	34%	0.34	S	S	*	.			trans	-82.8	-41	-176.1	-66.2	-175.5	-178.5	179.7	0	113.8	S694	S694-K696 PolarHBondContact O-N 3.1Å
697	T	89.5	Confident	91	Very high	63 Å²	63	66.3 Å²	66.3	39%	0.387	34%	0.342	S	S	.	.			trans	-129.3	146.3	-174.8	67.8	0	0	0	0	112	T699 E700 C701	T697-T699 PolarHBondContact O-N 2.68Å; T697-T699 PolarHBondContact OG1-OG1 2.87Å; T697-E700 WeakPolarHBondContact OG1-CB 3.49Å; T697-E700 PolarHBondContact OG1-N 3.14Å; T697-C701 PolarHBondContact O-N 2.99Å; T697-C701 PolarHBondContact O-SG 2.88Å
698	K	90.3	Very high	91	Very high	78 Å²	78	64.5 Å²	64.5	34%	0.339	33%	0.329	S	S	.	.	H	α-helix	trans	-61.5	-34.2	177.8	-70.2	-179.4	178.8	174.9	0	112.4	S485 V488 N702	S485-K698 WeakPolarHBondContact O-CE 3.49Å; S485-K698 PolarHBondContact O-NZ 2.63Å; V488-K698 HydrophobicContact CG2-CG 4.24Å; K698-N702 WeakPolarHBondContact O-CB 3.47Å; K698-N702 PolarHBondContact O-N 2.98Å; K698-N702 PolarHBondContact O-ND2 2.99Å; K698-N702 VanDerWaalsContact O-ND2 3.1Å
699	T	89.3	Confident	91	Very high	96 Å²	96	64.1 Å²	64.1	59%	0.589	33%	0.328	S	S	*	.	H	α-helix	trans	-64	-52.8	-177.4	42.9	0	0	0	0	111.4	T697 C701 N702 E703	T697-T699 PolarHBondContact O-N 2.68Å; T697-T699 PolarHBondContact OG1-OG1 2.87Å; T699-C701 VanDerWaalsContact C-N 3.33Å; T699-C701 PolarHBondContact O-N 2.96Å; T699-N702 PolarHBondContact O-N 2.82Å; T699-E703 PolarHBondContact O-N 3.46Å
700	E	89.1	Confident	91.1	Very high	111 Å²	111	63.6 Å²	63.6	52%	0.519	32%	0.323	S	S	.	.	H	α-helix	trans	-59.5	-44.1	179.6	-174.8	-178.3	-176.8	0	0	111.6	T697 N702 E703	T697-E700 WeakPolarHBondContact OG1-CB 3.49Å; T697-E700 PolarHBondContact OG1-N 3.14Å; E700-N702 PolarHBondContact O-N 2.01Å; E700-E703 PolarHBondContact O-N 3.3Å
701	C	90.3	Very high	91.2	Very high	1 Å²	1	62 Å²	62	1%	0.007	32%	0.318	C	S	.	.	H	α-helix	trans	-73	-31.7	-177.9	-50.6	0	0	0	0	112.3	M492 W691 C695 T697 T699 E703 M704 H705	M492-C701 HydrophobicContact CE-CB 3.75Å; M492-C701 WeakPolarHBondContact CE-O 3.46Å; M492-C701 HydrophobicContact CG-CB 4.22Å; M492-C701 HydrophobicContact SD-CB 3.48Å; M492-C701 WeakPolarHBondContact SD-CB 3.46Å; W691-C701 HydrophobicContact CH2-CB 4.32Å; C695-C701 HydrophobicContact CB-CB 4.22Å; C695-C701 WeakPolarHBondContact CB-SG 3.45Å; C695-C701 WeakPolarHBondContact SG-CB 3.41Å; C695-C701 CovalentContact SG-SG 2.02Å; C695-C701 PolarHBondContact SG-SG 3.36Å; T697-C701 PolarHBondContact O-N 2.99Å; T697-C701 PolarHBondContact O-SG 2.88Å; T699-C701 VanDerWaalsContact C-N 3.33Å; T699-C701 PolarHBondContact O-N 2.96Å; C701-E703 VanDerWaalsContact C-N 3.28Å; C701-E703 PolarHBondContact O-N 2.76Å; C701-M704 PolarHBondContact O-N 2.81Å; C701-H705 WeakPolarHBondContact O-CB 3.48Å; C701-H705 PolarHBondContact O-N 2.94Å
702	N	92.9	Very high	91.4	Very high	19 Å²	19	59 Å²	59	10%	0.102	31%	0.307	C	S	.	.	H	α-helix	trans	-66.1	-29	173.5	-79.3	-20.5	0	0	0	112.6	Y491 L636 K698 T699 E700 P706	Y491-N702 VanDerWaalsContact CE1-OD1 3.29Å; Y491-N702 WeakPolarHBondContact CE1-OD1 3.46Å; Y491-N702 PolarHBondContact OH-ND2 3.43Å; Y491-N702 PolarHBondContact OH-OD1 3.38Å; L636-N702 HydrophobicContact CD2-CB 3.63Å; K698-N702 WeakPolarHBondContact O-CB 3.47Å; K698-N702 PolarHBondContact O-N 2.98Å; K698-N702 PolarHBondContact O-ND2 2.99Å; K698-N702 VanDerWaalsContact O-ND2 3.1Å; T699-N702 PolarHBondContact O-N 2.82Å; E700-N702 PolarHBondContact O-N 2.01Å; N702-P706 VanDerWaalsContact O-CD 3.32Å; N702-P706 WeakPolarHBondContact O-CD 3.28Å
703	E	91.4	Very high	91.6	Very high	136 Å²	136	59.1 Å²	59.1	64%	0.636	31%	0.308	S	S	*	.	H	α-helix	trans	-69.5	-38.5	176.5	-71.6	176.8	177.8	0	0	112	T699 E700 C701 P706	T699-E703 PolarHBondContact O-N 3.46Å; E700-E703 PolarHBondContact O-N 3.3Å; C701-E703 VanDerWaalsContact C-N 3.28Å; C701-E703 PolarHBondContact O-N 2.76Å; E703-P706 WeakPolarHBondContact O-CD 3.49Å
704	M	91.3	Very high	91.9	Very high	89 Å²	89	58.3 Å²	58.3	44%	0.438	30%	0.297	S	S	.	.	H	α-helix	trans	-83	-27.7	-179.3	-65.4	-56.2	-63.4	0	0	113.9	W691 C701 P706 Y707 I708	W691-M704 HydrophobicContact CH2-CB 4.1Å; W691-M704 HydrophobicContact CZ2-CB 3.71Å; W691-M704 HydrophobicContact CZ2-CG 4.33Å; C701-M704 PolarHBondContact O-N 2.81Å; M704-P706 VanDerWaalsContact C-CD 3.43Å; M704-Y707 PolarHBondContact O-N 2.83Å; M704-Y707 VanDerWaalsContact O-N 3.1Å; M704-I708 HydrophobicContact CB-CD1 3.91Å; M704-I708 HydrophobicContact CE-CD1 4.06Å; M704-I708 PolarHBondContact O-N 3.38Å
705	H	93.5	Very high	92.3	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-49.1	-45.9	-177.6	171	72	0	0	0	115.7	M492 R495 L636 D637 C701 Y707 I708 S709	M492-H705 HydrophobicContact CE-CB 4.02Å; R495-H705 PolarHBondContact O-CE1 3.31Å; L636-H705 PolarHBondContact O-CD2 3.49Å; D637-H705 IonicContact OD1-CD2 2.72Å; D637-H705 IonicContact OD1-CE1 3.6Å; D637-H705 IonicContact OD1-NE2 3.84Å; D637-H705 PolarHBondContact OD1-NE2 3.22Å; C701-H705 WeakPolarHBondContact O-CB 3.48Å; C701-H705 PolarHBondContact O-N 2.94Å; H705-Y707 PolarHBondContact O-N 2.94Å; H705-Y707 VanDerWaalsContact O-N 3.11Å; H705-I708 PolarHBondContact O-N 3.43Å; H705-S709 WeakPolarHBondContact O-CB 3.48Å; H705-S709 PolarHBondContact O-N 3.01Å; H705-S709 PolarHBondContact O-OG 2.92Å
706	P	94.3	Very high	92.7	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-57.8	-29.1	-179.2	-20.2	27.7	0	0	0	113.7	L636 F639 N702 E703 M704	L636-P706 WeakPolarHBondContact O-CG 3.37Å; F639-P706 HydrophobicContact CD2-CB 3.99Å; F639-P706 HydrophobicContact CE2-CB 4.32Å; N702-P706 VanDerWaalsContact O-CD 3.32Å; N702-P706 WeakPolarHBondContact O-CD 3.28Å; E703-P706 WeakPolarHBondContact O-CD 3.49Å; M704-P706 VanDerWaalsContact C-CD 3.43Å
707	Y	92.5	Very high	93.2	Very high	131 Å²	131	46.8 Å²	46.8	51%	0.514	24%	0.235	S	C	.	.	H	α-helix	trans	-90.3	-38.6	-176.6	-54.9	-76.2	0	0	0	112.3	F639 M704 H705	F639-Y707 HydrophobicContact CD2-CE1 4.47Å; F639-Y707 HydrophobicContact CE2-CD1 4.08Å; F639-Y707 AromaticContact CE2-CE1 3.64Å; F639-Y707 HydrophobicContact CE2-CE1 3.64Å; F639-Y707 HydrophobicContact CZ-CE1 4.34Å; M704-Y707 PolarHBondContact O-N 2.83Å; M704-Y707 VanDerWaalsContact O-N 3.1Å; H705-Y707 PolarHBondContact O-N 2.94Å; H705-Y707 VanDerWaalsContact O-N 3.11Å
708	I	93.1	Very high	93.5	Very high	45 Å²	45	45.6 Å²	45.6	23%	0.231	23%	0.226	C	C	.	.	H	α-helix	trans	-87.3	-29.9	-173.2	-58	176.1	0	0	0	111.9	Y688 W691 M704 H705 V710 V711	Y688-I708 HydrophobicContact CD2-CG2 3.64Å; Y688-I708 HydrophobicContact CE2-CG2 3.83Å; W691-I708 HydrophobicContact CD2-CD1 4.48Å; W691-I708 HydrophobicContact CH2-CD1 4.2Å; W691-I708 HydrophobicContact CZ2-CD1 4Å; M704-I708 HydrophobicContact CB-CD1 3.91Å; M704-I708 HydrophobicContact CE-CD1 4.06Å; M704-I708 PolarHBondContact O-N 3.38Å; H705-I708 PolarHBondContact O-N 3.43Å; I708-V710 VanDerWaalsContact C-N 3.27Å; I708-V710 PolarHBondContact O-N 3.43Å; I708-V710 VanDerWaalsContact O-N 3.14Å; I708-V711 WeakPolarHBondContact O-CB 3.37Å; I708-V711 PolarHBondContact O-N 3.08Å
709	S	94.8	Very high	93.7	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.014	22%	0.223	C	C	.	.	H	α-helix	trans	-55.6	-35.8	-173.3	55	0	0	0	0	114.4	H705 V711 Q712 I713	H705-S709 WeakPolarHBondContact O-CB 3.48Å; H705-S709 PolarHBondContact O-N 3.01Å; H705-S709 PolarHBondContact O-OG 2.92Å; S709-V711 VanDerWaalsContact C-N 3.3Å; S709-V711 PolarHBondContact O-N 3.46Å; S709-Q712 PolarHBondContact O-N 3.28Å; S709-I713 VanDerWaalsContact O-CG1 3.31Å; S709-I713 WeakPolarHBondContact O-CG1 3.4Å; S709-I713 PolarHBondContact O-N 3.19Å; S709-I713 VanDerWaalsContact O-N 3.13Å
710	V	95.4	Very high	93.8	Very high	21 Å²	21	42.2 Å²	42.2	13%	0.127	20%	0.203	C	C	.	.	H	α-helix	trans	-62.5	-36.8	178.3	65.6	0	0	0	0	112.4	H643 I708 Q712 I713 L714	H643-V710 HydrophobicContact CB-CB 4.46Å; H643-V710 HydrophobicContact CB-CG2 3.69Å; I708-V710 VanDerWaalsContact C-N 3.27Å; I708-V710 PolarHBondContact O-N 3.43Å; I708-V710 VanDerWaalsContact O-N 3.14Å; V710-Q712 VanDerWaalsContact C-N 3.28Å; V710-Q712 PolarHBondContact O-N 3.35Å; V710-I713 PolarHBondContact O-N 3.32Å; V710-L714 HydrophobicContact CG2-CD1 3.98Å; V710-L714 HydrophobicContact CG2-CG 4.12Å; V710-L714 WeakPolarHBondContact O-CB 3.48Å; V710-L714 VanDerWaalsContact O-CG 3.3Å; V710-L714 WeakPolarHBondContact O-CG 3.36Å; V710-L714 PolarHBondContact O-N 3.33Å
711	V	95	Very high	94	Very high	69 Å²	69	36.9 Å²	36.9	42%	0.418	18%	0.179	S	C	.	.	H	α-helix	trans	-62.1	-43.2	-179.1	-173.9	0	0	0	0	109.4	S684 I708 S709 L714 A715	S684-V711 WeakPolarHBondContact OG-CG1 3.46Å; I708-V711 WeakPolarHBondContact O-CB 3.37Å; I708-V711 PolarHBondContact O-N 3.08Å; S709-V711 VanDerWaalsContact C-N 3.3Å; S709-V711 PolarHBondContact O-N 3.46Å; V711-L714 PolarHBondContact O-N 2.89Å; V711-A715 WeakPolarHBondContact O-CB 3.43Å; V711-A715 PolarHBondContact O-N 3.28Å
712	Q	95.3	Very high	94	Very high	8 Å²	8	36.9 Å²	36.9	4%	0.037	18%	0.179	C	C	.	.	H	α-helix	trans	-67.2	-39.5	178.1	-166.8	65.2	4.5	0	0	112.7	V496 Y688 S709 V710 A715 F716	V496-Q712 HydrophobicContact CG1-CB 3.91Å; V496-Q712 HydrophobicContact CG1-CG 3.78Å; Y688-Q712 VanDerWaalsContact CB-OE1 3.28Å; Y688-Q712 HydrophobicContact CD1-CG 4.14Å; Y688-Q712 HydrophobicContact CG-CB 4.46Å; Y688-Q712 HydrophobicContact CG-CG 4.27Å; S709-Q712 PolarHBondContact O-N 3.28Å; V710-Q712 VanDerWaalsContact C-N 3.28Å; V710-Q712 PolarHBondContact O-N 3.35Å; Q712-A715 PolarHBondContact O-N 3.18Å; Q712-F716 PolarHBondContact O-N 3.48Å
713	I	96.8	Very high	93.9	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.015	18%	0.181	C	C	.	.	H	α-helix	trans	-63.9	-45.9	176.6	-64.7	164.5	0	0	0	110.5	W468 V496 A499 A500 F503 S709 V710 F716 I717	W468-I713 HydrophobicContact CH2-CG2 3.95Å; W468-I713 HydrophobicContact CZ2-CG2 4.28Å; V496-I713 HydrophobicContact CG1-CG1 4.17Å; A499-I713 HydrophobicContact CB-CD1 4.06Å; A500-I713 HydrophobicContact CB-CD1 4.31Å; A500-I713 HydrophobicContact CB-CG1 4.09Å; F503-I713 HydrophobicContact CB-CD1 4.19Å; F503-I713 HydrophobicContact CB-CG2 4.34Å; F503-I713 HydrophobicContact CD1-CG2 3.86Å; F503-I713 HydrophobicContact CD2-CG2 3.99Å; F503-I713 HydrophobicContact CE1-CG2 4.11Å; F503-I713 HydrophobicContact CE2-CG2 4.2Å; F503-I713 HydrophobicContact CG-CG2 3.8Å; F503-I713 HydrophobicContact CZ-CG2 4.26Å; S709-I713 VanDerWaalsContact O-CG1 3.31Å; S709-I713 WeakPolarHBondContact O-CG1 3.4Å; S709-I713 PolarHBondContact O-N 3.19Å; S709-I713 VanDerWaalsContact O-N 3.13Å; V710-I713 PolarHBondContact O-N 3.32Å; I713-F716 PolarHBondContact O-N 3.46Å; I713-I717 HydrophobicContact CG2-CD1 4.02Å; I713-I717 WeakPolarHBondContact O-CG1 3.31Å; I713-I717 PolarHBondContact O-N 3.28Å
714	L	96	Very high	93.6	Very high	61 Å²	61	30.8 Å²	30.8	32%	0.319	15%	0.153	S	C	.	.	H	α-helix	trans	-65.5	-43	178.3	-67.4	177.8	0	0	0	111.6	F503 F647 V710 V711 F716 I717 L718	F503-L714 HydrophobicContact CE2-CD2 4.48Å; F503-L714 HydrophobicContact CZ-CD2 4.38Å; F647-L714 HydrophobicContact CD2-CD2 3.52Å; F647-L714 HydrophobicContact CE2-CD2 3.92Å; F647-L714 HydrophobicContact CG-CD2 4.34Å; V710-L714 HydrophobicContact CG2-CD1 3.98Å; V710-L714 HydrophobicContact CG2-CG 4.12Å; V710-L714 WeakPolarHBondContact O-CB 3.48Å; V710-L714 VanDerWaalsContact O-CG 3.3Å; V710-L714 WeakPolarHBondContact O-CG 3.36Å; V710-L714 PolarHBondContact O-N 3.33Å; V711-L714 PolarHBondContact O-N 2.89Å; L714-F716 VanDerWaalsContact C-N 3.31Å; L714-F716 PolarHBondContact O-N 3.46Å; L714-I717 PolarHBondContact O-N 2.92Å; L714-L718 WeakPolarHBondContact O-CG 3.38Å; L714-L718 PolarHBondContact O-N 2.78Å
715	A	96.3	Very high	93.4	Very high	4 Å²	4	35 Å²	35	3%	0.033	17%	0.165	C	C	.	.	H	α-helix	trans	-57.2	-44.8	174.8	0	0	0	0	0	111.5	V711 Q712 L718 I719	V711-A715 WeakPolarHBondContact O-CB 3.43Å; V711-A715 PolarHBondContact O-N 3.28Å; Q712-A715 PolarHBondContact O-N 3.18Å; A715-L718 PolarHBondContact O-N 2.91Å; A715-I719 WeakPolarHBondContact O-CB 3.22Å; A715-I719 WeakPolarHBondContact O-CD1 3.32Å; A715-I719 VanDerWaalsContact O-CG1 3.24Å; A715-I719 WeakPolarHBondContact O-CG1 3.3Å; A715-I719 PolarHBondContact O-N 3.18Å
716	F	95.7	Very high	93.1	Very high	44 Å²	44	35.6 Å²	35.6	19%	0.193	17%	0.17	C	C	.	.	H	α-helix	trans	-60.9	-45.7	175.5	175.6	-100.2	0	0	0	112.4	W468 W471 Q712 I713 L714 L718 I719 R720	W468-F716 AromaticContact CD1-CE1 3.61Å; W468-F716 AromaticContact CD1-CZ 3.99Å; W468-F716 HydrophobicContact CD2-CD1 4.16Å; W468-F716 AromaticContact CD2-CE1 3.58Å; W468-F716 HydrophobicContact CD2-CE1 3.58Å; W468-F716 AromaticContact CE2-CD1 3.61Å; W468-F716 AromaticContact CE2-CE1 3.41Å; W468-F716 VanDerWaalsContact CE2-CE1 3.41Å; W468-F716 HydrophobicContact CE3-CE1 4.27Å; W468-F716 AromaticContact CG-CE1 3.76Å; W468-F716 HydrophobicContact CG-CE1 3.76Å; W468-F716 HydrophobicContact CG-CZ 4.35Å; W468-F716 HydrophobicContact CH2-CD1 4.35Å; W468-F716 AromaticContact CZ2-CD1 3.71Å; W468-F716 HydrophobicContact CZ2-CD1 3.71Å; W468-F716 HydrophobicContact CZ2-CE1 4Å; W468-F716 AromaticContact NE1-CD1 3.79Å; W468-F716 AromaticContact NE1-CE1 3.37Å; W471-F716 HydrophobicContact CZ2-CE1 4.23Å; W471-F716 AromaticContact CZ2-CE2 3.83Å; W471-F716 HydrophobicContact CZ2-CE2 3.83Å; W471-F716 AromaticContact CZ2-CZ 3.65Å; W471-F716 HydrophobicContact CZ2-CZ 3.65Å; W471-F716 AromaticContact NE1-CZ 3.92Å; Q712-F716 PolarHBondContact O-N 3.48Å; I713-F716 PolarHBondContact O-N 3.46Å; L714-F716 VanDerWaalsContact C-N 3.31Å; L714-F716 PolarHBondContact O-N 3.46Å; F716-L718 VanDerWaalsContact C-N 3.32Å; F716-L718 PolarHBondContact O-N 2.95Å; F716-I719 PolarHBondContact O-N 3.1Å; F716-R720 VanDerWaalsContact O-CB 3.3Å; F716-R720 WeakPolarHBondContact O-CB 3.48Å; F716-R720 PolarHBondContact O-N 2.82Å
717	I	95.4	Very high	92.9	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59.8	-44.6	178.5	-67.2	164.5	0	0	0	110.6	L460 W468 F503 F647 I713 L714 R720 N721	L460-I717 HydrophobicContact CD1-CD1 4.29Å; L460-I717 HydrophobicContact CD1-CG1 4.44Å; L460-I717 HydrophobicContact CD1-CG2 4.26Å; L460-I717 HydrophobicContact CD2-CG1 4.43Å; L460-I717 HydrophobicContact CD2-CG2 4.43Å; L460-I717 HydrophobicContact CG-CG2 4.36Å; W468-I717 HydrophobicContact CH2-CD1 4.08Å; W468-I717 HydrophobicContact CH2-CG1 3.95Å; W468-I717 HydrophobicContact CZ3-CD1 4.31Å; W468-I717 HydrophobicContact CZ3-CG1 4.07Å; F503-I717 HydrophobicContact CD1-CD1 4.46Å; F503-I717 HydrophobicContact CE1-CD1 3.54Å; F503-I717 HydrophobicContact CZ-CD1 3.76Å; F647-I717 HydrophobicContact CE1-CD1 4.35Å; F647-I717 HydrophobicContact CE1-CG2 4.48Å; F647-I717 HydrophobicContact CE2-CG2 4.43Å; F647-I717 HydrophobicContact CZ-CD1 4.28Å; F647-I717 HydrophobicContact CZ-CG2 3.79Å; I713-I717 HydrophobicContact CG2-CD1 4.02Å; I713-I717 WeakPolarHBondContact O-CG1 3.31Å; I713-I717 PolarHBondContact O-N 3.28Å; L714-I717 PolarHBondContact O-N 2.92Å; I717-R720 PolarHBondContact O-N 2.86Å; I717-N721 VanDerWaalsContact O-CB 3.3Å; I717-N721 WeakPolarHBondContact O-CB 3.42Å; I717-N721 PolarHBondContact O-N 3.23Å; I717-N721 PolarHBondContact O-ND2 2.88Å
718	L	94.6	Very high	92.6	Very high	38 Å²	38	30.2 Å²	30.2	20%	0.199	15%	0.151	C	C	.	.	H	α-helix	trans	-66.2	-47.4	179.8	-68.3	176.9	0	0	0	111.8	S681 L714 A715 F716 R720 N721 I722	S681-L718 WeakPolarHBondContact OG-CB 3.24Å; S681-L718 VanDerWaalsContact OG-CD1 3.3Å; S681-L718 WeakPolarHBondContact OG-CD1 3.36Å; L714-L718 WeakPolarHBondContact O-CG 3.38Å; L714-L718 PolarHBondContact O-N 2.78Å; A715-L718 PolarHBondContact O-N 2.91Å; F716-L718 VanDerWaalsContact C-N 3.32Å; F716-L718 PolarHBondContact O-N 2.95Å; L718-R720 VanDerWaalsContact C-N 3.26Å; L718-R720 PolarHBondContact O-N 3.48Å; L718-N721 PolarHBondContact O-N 3.36Å; L718-I722 HydrophobicContact CB-CD1 3.81Å; L718-I722 HydrophobicContact CB-CG1 4.34Å; L718-I722 HydrophobicContact CD2-CD1 4.07Å; L718-I722 HydrophobicContact CD2-CG1 4.3Å; L718-I722 HydrophobicContact CG-CD1 4.43Å; L718-I722 VanDerWaalsContact O-CB 3.22Å; L718-I722 WeakPolarHBondContact O-CB 3.34Å; L718-I722 VanDerWaalsContact O-CG1 3.22Å; L718-I722 WeakPolarHBondContact O-CG1 3.41Å; L718-I722 PolarHBondContact O-N 3.18Å
719	I	94.4	Very high	92.5	Very high	54 Å²	54	30.2 Å²	30.2	28%	0.277	15%	0.154	S	C	.	.	H	α-helix	trans	-57.4	-41.5	176.6	-68.8	164.4	0	0	0	110.9	L678 V682 F685 A715 F716 P723	L678-I719 HydrophobicContact CD1-CB 4.43Å; L678-I719 HydrophobicContact CD1-CG1 4.13Å; V682-I719 HydrophobicContact CG2-CD1 4.11Å; V682-I719 HydrophobicContact CG2-CG1 4.18Å; F685-I719 HydrophobicContact CB-CD1 4.36Å; F685-I719 HydrophobicContact CD2-CD1 4.28Å; A715-I719 WeakPolarHBondContact O-CB 3.22Å; A715-I719 WeakPolarHBondContact O-CD1 3.32Å; A715-I719 VanDerWaalsContact O-CG1 3.24Å; A715-I719 WeakPolarHBondContact O-CG1 3.3Å; A715-I719 PolarHBondContact O-N 3.18Å; F716-I719 PolarHBondContact O-N 3.1Å; I719-P723 VanDerWaalsContact O-CD 3.29Å; I719-P723 WeakPolarHBondContact O-CD 3.33Å
720	R	92.8	Very high	92.4	Very high	48 Å²	48	30.8 Å²	30.8	18%	0.181	16%	0.155	C	C	.	.	H	α-helix	trans	-75.3	-30.3	-177.2	-172.3	69	-179.3	89.9	-1	114	E467 F716 I717 L718 A726 V729	E467-R720 IonicContact OE1-NE 2.78Å; E467-R720 IonicContact OE1-NH2 3.3Å; E467-R720 PolarHBondContact OE1-NH2 2.98Å; E467-R720 IonicContact OE2-CZ 3.19Å; E467-R720 IonicContact OE2-NH2 3.22Å; E467-R720 PolarHBondContact OE2-NH2 3.18Å; F716-R720 VanDerWaalsContact O-CB 3.3Å; F716-R720 WeakPolarHBondContact O-CB 3.48Å; F716-R720 PolarHBondContact O-N 2.82Å; I717-R720 PolarHBondContact O-N 2.86Å; L718-R720 VanDerWaalsContact C-N 3.26Å; L718-R720 PolarHBondContact O-N 3.48Å; R720-A726 PolarHBondContact NH1-O 2.7Å; R720-A726 WeakPolarHBondContact O-CB 3.39Å; R720-V729 PolarHBondContact NH2-O 3.38Å
721	N	91.9	Very high	92.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-114.8	-17.4	-168.3	-69.3	-92.2	0	0	0	115.4	L459 L460 Q464 I717 L718	L459-N721 HydrophobicContact CD1-CB 4.05Å; L459-N721 HydrophobicContact CG-CB 4.19Å; L460-N721 PolarHBondContact N-OD1 2.77Å; Q464-N721 PolarHBondContact OE1-OD1 2.95Å; I717-N721 VanDerWaalsContact O-CB 3.3Å; I717-N721 WeakPolarHBondContact O-CB 3.42Å; I717-N721 PolarHBondContact O-N 3.23Å; I717-N721 PolarHBondContact O-ND2 2.88Å; L718-N721 PolarHBondContact O-N 3.36Å
722	I	91.6	Very high	92	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	14%	0.138	C	C	.	.	S	Bend	trans	-65.3	-50.8	176.5	-74.3	174.1	0	0	0	110.8	A667 L668 S674 L677 L678 L718 G724	A667-I722 WeakPolarHBondContact CA-O 3.43Å; L668-I722 PolarHBondContact N-O 3.16Å; S674-I722 WeakPolarHBondContact OG-CG2 3.36Å; L677-I722 HydrophobicContact CB-CD1 3.67Å; L678-I722 HydrophobicContact CB-CD1 4.37Å; L718-I722 HydrophobicContact CB-CD1 3.81Å; L718-I722 HydrophobicContact CB-CG1 4.34Å; L718-I722 HydrophobicContact CD2-CD1 4.07Å; L718-I722 HydrophobicContact CD2-CG1 4.3Å; L718-I722 HydrophobicContact CG-CD1 4.43Å; L718-I722 VanDerWaalsContact O-CB 3.22Å; L718-I722 WeakPolarHBondContact O-CB 3.34Å; L718-I722 VanDerWaalsContact O-CG1 3.22Å; L718-I722 WeakPolarHBondContact O-CG1 3.41Å; L718-I722 PolarHBondContact O-N 3.18Å; I722-G724 PolarHBondContact O-N 3.22Å
723	P	90.8	Very high	91.8	Very high	23 Å²	23	29.6 Å²	29.6	15%	0.149	15%	0.146	C	C	.	.	S	Bend	trans	-70.9	122.4	176.9	-14.8	30.8	0	0	0	110.7	I719 Y725 A726 R727	I719-P723 VanDerWaalsContact O-CD 3.29Å; I719-P723 WeakPolarHBondContact O-CD 3.33Å; P723-Y725 VanDerWaalsContact C-N 3.26Å; P723-Y725 HydrophobicContact CB-CD1 3.68Å; P723-Y725 HydrophobicContact CB-CE1 3.4Å; P723-Y725 HydrophobicContact CG-CE1 4.28Å; P723-Y725 PolarHBondContact O-N 3.23Å; P723-A726 HydrophobicContact CB-CB 4.16Å; P723-A726 PolarHBondContact O-N 2.69Å; P723-A726 VanDerWaalsContact O-N 3.15Å; P723-R727 PolarHBondContact O-N 3.36Å; P723-R727 VanDerWaalsContact O-N 3.08Å
724	G	84.9	Confident	91.7	Very high	4 Å²	4	30.2 Å²	30.2	4%	0.041	15%	0.149	C	C	.	.	H	α-helix	trans	-61.2	-31.5	-177.7	0	0	0	0	0	114.1	E666 I722 S728	E666-G724 VanDerWaalsContact O-CA 3.22Å; E666-G724 WeakPolarHBondContact O-CA 3.22Å; I722-G724 PolarHBondContact O-N 3.22Å; G724-S728 WeakPolarHBondContact O-CB 3.36Å; G724-S728 PolarHBondContact O-N 3.2Å; G724-S728 PolarHBondContact O-OG 3.31Å
725	Y	86.6	Confident	91.5	Very high	177 Å²	177	27.5 Å²	27.5	69%	0.694	14%	0.135	S	C	*	.	H	α-helix	trans	-65.1	-46.7	175	79.6	-94.1	0	0	0	111.3	P723 R727 S728 V729	P723-Y725 VanDerWaalsContact C-N 3.26Å; P723-Y725 HydrophobicContact CB-CD1 3.68Å; P723-Y725 HydrophobicContact CB-CE1 3.4Å; P723-Y725 HydrophobicContact CG-CE1 4.28Å; P723-Y725 PolarHBondContact O-N 3.23Å; Y725-R727 VanDerWaalsContact C-N 3.32Å; Y725-R727 PolarHBondContact O-N 3.05Å; Y725-S728 PolarHBondContact O-N 2.65Å; Y725-S728 VanDerWaalsContact O-N 3.12Å; Y725-V729 PolarHBondContact O-N 3.34Å
726	A	87.1	Confident	91.3	Very high	13 Å²	13	31.4 Å²	31.4	11%	0.107	15%	0.149	C	C	.	.	H	α-helix	trans	-62.8	-46.3	-179.6	0	0	0	0	0	108.6	R720 P723 S728 V729	R720-A726 PolarHBondContact NH1-O 2.7Å; R720-A726 WeakPolarHBondContact O-CB 3.39Å; P723-A726 HydrophobicContact CB-CB 4.16Å; P723-A726 PolarHBondContact O-N 2.69Å; P723-A726 VanDerWaalsContact O-N 3.15Å; A726-S728 PolarHBondContact O-N 3.44Å; A726-S728 VanDerWaalsContact O-N 3.09Å; A726-V729 PolarHBondContact O-N 3.44Å; A726-V729 VanDerWaalsContact O-N 3.14Å
727	R	89.3	Confident	91.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-59.4	-25.3	178.6	-167.7	173.9	65.5	-152.7	5.9	114	T454 A457 Q464 S661 G663 E666 P723 Y725	T454-R727 PolarHBondContact OG1-O 3.23Å; A457-R727 WeakPolarHBondContact O-CD 3.49Å; A457-R727 PolarHBondContact O-NE 2.63Å; Q464-R727 PolarHBondContact NE2-O 3.08Å; S661-R727 PolarHBondContact O-NH1 3.09Å; S661-R727 PolarHBondContact O-NH2 3.46Å; G663-R727 PolarHBondContact O-NH2 3.4Å; E666-R727 PolarHBondContact O-NH2 3.13Å; E666-R727 VanDerWaalsContact O-NH2 3.09Å; P723-R727 PolarHBondContact O-N 3.36Å; P723-R727 VanDerWaalsContact O-N 3.08Å; Y725-R727 VanDerWaalsContact C-N 3.32Å; Y725-R727 PolarHBondContact O-N 3.05Å
728	S	87.8	Confident	91.1	Very high	19 Å²	19	30.5 Å²	30.5	13%	0.133	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-1.9	-176.9	-53.7	0	0	0	0	114	N453 T454 G724 Y725 A726	N453-S728 CarbonylContact C-O 3.52Å; N453-S728 WeakPolarHBondContact CA-O 3.25Å; T454-S728 PolarHBondContact N-O 2.93Å; T454-S728 WeakPolarHBondContact OG1-CA 3.44Å; T454-S728 PolarHBondContact OG1-O 2.62Å; G724-S728 WeakPolarHBondContact O-CB 3.36Å; G724-S728 PolarHBondContact O-N 3.2Å; G724-S728 PolarHBondContact O-OG 3.31Å; Y725-S728 PolarHBondContact O-N 2.65Å; Y725-S728 VanDerWaalsContact O-N 3.12Å; A726-S728 PolarHBondContact O-N 3.44Å; A726-S728 VanDerWaalsContact O-N 3.09Å
729	V	89.8	Confident	90.9	Very high	46 Å²	46	34.7 Å²	34.7	28%	0.279	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	145.2	-178.6	179	0	0	0	0	109.7	E452 R720 Y725 A726	E452-V729 CarbonylContact O-C 3.59Å; E452-V729 WeakPolarHBondContact O-CA 3.4Å; R720-V729 PolarHBondContact NH2-O 3.38Å; Y725-V729 PolarHBondContact O-N 3.34Å; A726-V729 PolarHBondContact O-N 3.44Å; A726-V729 VanDerWaalsContact O-N 3.14Å
730	Y	92.2	Very high	90.8	Very high	13 Å²	13	32.6 Å²	32.6	5%	0.051	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	156.7	172.7	78.9	-74.2	0	0	0	111.1	S451 E452 T454 E463 E467	S451-Y730 WeakPolarHBondContact CA-O 3.35Å; E452-Y730 HydrophobicContact CB-CE1 4.02Å; E452-Y730 PolarHBondContact N-O 3.4Å; E452-Y730 WeakPolarHBondContact O-CD1 3.38Å; E452-Y730 PolarHBondContact O-N 3.26Å; E452-Y730 PolarHBondContact OE2-OH 3.1Å; T454-Y730 HydrophobicContact CG2-CD1 3.48Å; T454-Y730 VanDerWaalsContact CG2-CD1 3.48Å; T454-Y730 HydrophobicContact CG2-CE1 4.36Å; T454-Y730 HydrophobicContact CG2-CG 4.07Å; E463-Y730 HydrophobicContact CB-CD1 4.22Å; E463-Y730 HydrophobicContact CB-CD2 3.86Å; E463-Y730 HydrophobicContact CB-CE1 4.31Å; E463-Y730 HydrophobicContact CB-CE2 3.96Å; E463-Y730 HydrophobicContact CB-CG 3.98Å; E463-Y730 HydrophobicContact CG-CE1 4.4Å; E463-Y730 HydrophobicContact CG-CE2 4.27Å; E467-Y730 VanDerWaalsContact OE2-CA 3.28Å; E467-Y730 WeakPolarHBondContact OE2-CA 3.42Å; E467-Y730 VanDerWaalsContact OE2-CB 3.25Å; E467-Y730 WeakPolarHBondContact OE2-CB 3.37Å
731	S	92.2	Very high	90.9	Very high	3 Å²	3	31 Å²	31	2%	0.021	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	116.5	173.9	-177.3	0	0	0	0	110.9	G447 Y450 E467 F733 F734 S735	G447-S731 WeakPolarHBondContact O-CB 3.45Å; G447-S731 PolarHBondContact O-OG 3.33Å; Y450-S731 WeakPolarHBondContact O-CA 3.42Å; E467-S731 PolarHBondContact OE2-N 3.41Å; S731-F733 VanDerWaalsContact C-N 3.28Å; S731-F733 PolarHBondContact O-N 3.06Å; S731-F734 PolarHBondContact O-N 3.38Å; S731-F734 PolarHBondContact OG-N 3.07Å; S731-S735 VanDerWaalsContact O-CB 3.31Å; S731-S735 WeakPolarHBondContact O-CB 3.45Å; S731-S735 PolarHBondContact O-N 2.95Å
732	S	90.3	Very high	90.9	Very high	23 Å²	23	32.5 Å²	32.5	16%	0.161	16%	0.156	C	C	.	.	H	α-helix	trans	-64.2	-35.4	176.1	62.1	0	0	0	0	111.7	Y450 S735 W736	Y450-S732 PolarHBondContact O-N 3.19Å; Y450-S732 PolarHBondContact O-OG 3.49Å; S732-S735 PolarHBondContact O-N 2.94Å; S732-W736 WeakPolarHBondContact O-CB 3.34Å; S732-W736 PolarHBondContact O-N 3.21Å
733	F	91.1	Very high	91.1	Very high	47 Å²	47	33.3 Å²	33.3	21%	0.206	16%	0.16	C	C	.	.	H	α-helix	trans	-59.3	-55.7	174.5	174.5	-99.1	0	0	0	111.4	L446 Y450 L474 S731 S735 W736 F737	L446-F733 HydrophobicContact CB-CD1 4.42Å; L446-F733 HydrophobicContact CB-CE1 4.2Å; L446-F733 HydrophobicContact CB-CZ 4.31Å; L446-F733 HydrophobicContact CD1-CE2 4.48Å; L446-F733 HydrophobicContact CD1-CZ 4.14Å; Y450-F733 HydrophobicContact CD2-CB 4.14Å; Y450-F733 HydrophobicContact CG-CB 4.14Å; L474-F733 HydrophobicContact CD1-CE1 3.89Å; L474-F733 HydrophobicContact CD1-CZ 4.41Å; S731-F733 VanDerWaalsContact C-N 3.28Å; S731-F733 PolarHBondContact O-N 3.06Å; F733-S735 PolarHBondContact O-N 3.49Å; F733-W736 PolarHBondContact O-N 2.9Å; F733-F737 HydrophobicContact CD2-CD2 4.42Å; F733-F737 HydrophobicContact CD2-CE2 4.08Å; F733-F737 HydrophobicContact CE1-CD2 4.2Å; F733-F737 HydrophobicContact CE1-CE2 4.14Å; F733-F737 HydrophobicContact CE2-CD2 4.14Å; F733-F737 AromaticContact CE2-CE2 3.46Å; F733-F737 HydrophobicContact CE2-CE2 3.46Å; F733-F737 VanDerWaalsContact CE2-CE2 3.46Å; F733-F737 HydrophobicContact CE2-CZ 4.43Å; F733-F737 HydrophobicContact CZ-CD2 4.01Å; F733-F737 AromaticContact CZ-CE2 3.48Å; F733-F737 HydrophobicContact CZ-CE2 3.48Å; F733-F737 VanDerWaalsContact CZ-CE2 3.48Å; F733-F737 HydrophobicContact CZ-CZ 4.35Å; F733-F737 WeakPolarHBondContact O-CD2 3.37Å; F733-F737 PolarHBondContact O-N 2.84Å
734	F	94.1	Very high	91.3	Very high	16 Å²	16	32.2 Å²	32.2	7%	0.07	15%	0.153	C	C	.	.	H	α-helix	trans	-65.8	-38.9	178.1	-66.9	-43.7	0	0	0	111.9	I443 G447 E467 G470 W471 L474 S731 W736 F737 G738	I443-F734 VanDerWaalsContact O-CZ 3.25Å; I443-F734 WeakPolarHBondContact O-CZ 3.24Å; G447-F734 VanDerWaalsContact CA-CE2 3.45Å; E467-F734 HydrophobicContact CB-CB 4.5Å; E467-F734 HydrophobicContact CG-CB 3.83Å; E467-F734 HydrophobicContact CG-CD2 4.38Å; G470-F734 VanDerWaalsContact CA-O 3.29Å; G470-F734 WeakPolarHBondContact CA-O 3.11Å; W471-F734 HydrophobicContact CB-CB 4.42Å; W471-F734 HydrophobicContact CB-CD1 3.76Å; W471-F734 HydrophobicContact CB-CD2 3.91Å; W471-F734 HydrophobicContact CB-CE1 3.88Å; W471-F734 HydrophobicContact CB-CE2 4.01Å; W471-F734 HydrophobicContact CB-CG 3.79Å; W471-F734 HydrophobicContact CB-CZ 4Å; L474-F734 HydrophobicContact CD1-CD1 3.81Å; L474-F734 HydrophobicContact CD1-CE1 3.79Å; S731-F734 PolarHBondContact O-N 3.38Å; S731-F734 PolarHBondContact OG-N 3.07Å; F734-W736 VanDerWaalsContact C-N 3.26Å; F734-W736 PolarHBondContact O-N 3.17Å; F734-F737 PolarHBondContact O-N 3.03Å; F734-G738 PolarHBondContact O-N 3.31Å
735	S	92.7	Very high	91.8	Very high	4 Å²	4	32.3 Å²	32.3	3%	0.028	15%	0.152	C	C	.	.	H	α-helix	trans	-58.2	-39	176.8	-171.2	0	0	0	0	112.4	D466 S731 S732 F733 G738 K739	D466-S735 WeakPolarHBondContact CB-OG 3.32Å; S731-S735 VanDerWaalsContact O-CB 3.31Å; S731-S735 WeakPolarHBondContact O-CB 3.45Å; S731-S735 PolarHBondContact O-N 2.95Å; S732-S735 PolarHBondContact O-N 2.94Å; F733-S735 PolarHBondContact O-N 3.49Å; S735-G738 PolarHBondContact O-N 3.11Å; S735-K739 PolarHBondContact O-N 3.45Å
736	W	92.1	Very high	92.1	Very high	86 Å²	86	24 Å²	24	33%	0.326	12%	0.119	S	C	.	.	H	α-helix	trans	-61.7	-48.6	175.3	-176.8	87	0	0	0	112.3	S732 F733 F734 G738 K739 I740 V780 H784	S732-W736 WeakPolarHBondContact O-CB 3.34Å; S732-W736 PolarHBondContact O-N 3.21Å; F733-W736 PolarHBondContact O-N 2.9Å; F734-W736 VanDerWaalsContact C-N 3.26Å; F734-W736 PolarHBondContact O-N 3.17Å; W736-G738 PolarHBondContact O-N 3.03Å; W736-K739 PolarHBondContact O-N 3.26Å; W736-I740 HydrophobicContact CE3-CD1 4.32Å; W736-I740 HydrophobicContact CH2-CD1 3.89Å; W736-I740 HydrophobicContact CZ2-CD1 4.39Å; W736-I740 HydrophobicContact CZ3-CD1 3.85Å; W736-V780 HydrophobicContact CH2-CG1 3.42Å; W736-V780 VanDerWaalsContact CH2-CG1 3.42Å; W736-V780 HydrophobicContact CZ3-CG1 3.75Å; W736-H784 AromaticContact CZ2-CD2 3.75Å
737	F	93.1	Very high	92.5	Very high	21 Å²	21	23.3 Å²	23.3	9%	0.092	11%	0.114	C	C	.	.	H	α-helix	trans	-61.9	-33.1	174.4	-82.7	-83.2	0	0	0	112.4	L474 F733 F734 K739 I740 S741 L744 V780	L474-F737 HydrophobicContact CD1-CD2 4.16Å; L474-F737 HydrophobicContact CD1-CG 4.15Å; L474-F737 HydrophobicContact CD2-CD1 3.68Å; L474-F737 HydrophobicContact CD2-CE1 3.85Å; L474-F737 HydrophobicContact CD2-CG 4.13Å; L474-F737 HydrophobicContact CD2-CZ 4.41Å; L474-F737 HydrophobicContact CG-CD1 4.31Å; L474-F737 HydrophobicContact CG-CG 4.3Å; F733-F737 HydrophobicContact CD2-CD2 4.42Å; F733-F737 HydrophobicContact CD2-CE2 4.08Å; F733-F737 HydrophobicContact CE1-CD2 4.2Å; F733-F737 HydrophobicContact CE1-CE2 4.14Å; F733-F737 HydrophobicContact CE2-CD2 4.14Å; F733-F737 AromaticContact CE2-CE2 3.46Å; F733-F737 HydrophobicContact CE2-CE2 3.46Å; F733-F737 VanDerWaalsContact CE2-CE2 3.46Å; F733-F737 HydrophobicContact CE2-CZ 4.43Å; F733-F737 HydrophobicContact CZ-CD2 4.01Å; F733-F737 AromaticContact CZ-CE2 3.48Å; F733-F737 HydrophobicContact CZ-CE2 3.48Å; F733-F737 VanDerWaalsContact CZ-CE2 3.48Å; F733-F737 HydrophobicContact CZ-CZ 4.35Å; F733-F737 WeakPolarHBondContact O-CD2 3.37Å; F733-F737 PolarHBondContact O-N 2.84Å; F734-F737 PolarHBondContact O-N 3.03Å; F737-K739 VanDerWaalsContact C-N 3.3Å; F737-K739 PolarHBondContact O-N 3.4Å; F737-I740 CarbonylContact O-C 3.59Å; F737-I740 PolarHBondContact O-N 3.29Å; F737-S741 WeakPolarHBondContact O-CA 3.35Å; F737-S741 PolarHBondContact O-N 2.9Å; F737-S741 VanDerWaalsContact O-N 3.09Å; F737-L744 HydrophobicContact CD1-CD1 3.52Å; F737-L744 HydrophobicContact CE1-CD1 4.22Å; F737-L744 HydrophobicContact CG-CD1 4.49Å; F737-V780 HydrophobicContact CE1-CG2 4.02Å; F737-V780 HydrophobicContact CZ-CG2 4.32Å
738	G	93.3	Very high	92.8	Very high	4 Å²	4	23.3 Å²	23.3	4%	0.041	11%	0.114	C	C	.	.	H	α-helix	trans	-63.2	-31.6	175.7	0	0	0	0	0	114.5	D466 F734 S735 W736 I740 S741	D466-G738 VanDerWaalsContact O-CA 3.29Å; D466-G738 WeakPolarHBondContact O-CA 3.44Å; F734-G738 PolarHBondContact O-N 3.31Å; S735-G738 PolarHBondContact O-N 3.11Å; W736-G738 PolarHBondContact O-N 3.03Å; G738-I740 VanDerWaalsContact C-N 3.31Å; G738-I740 PolarHBondContact O-N 2.85Å; G738-S741 PolarHBondContact O-OG 3.09Å
739	K	90.5	Very high	93	Very high	127 Å²	127	23.1 Å²	23.1	55%	0.552	11%	0.11	S	C	*	.	H	α-helix	trans	-70.9	-27	177.9	-69	172.7	-174.3	175.5	0	113.1	S735 W736 F737	S735-K739 PolarHBondContact O-N 3.45Å; W736-K739 PolarHBondContact O-N 3.26Å; F737-K739 VanDerWaalsContact C-N 3.3Å; F737-K739 PolarHBondContact O-N 3.4Å
740	I	92.6	Very high	93.1	Very high	10 Å²	10	21 Å²	21	5%	0.051	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.6	20	-179.5	59.5	164.3	0	0	0	112.3	W736 F737 G738 L742 E743 L744	W736-I740 HydrophobicContact CE3-CD1 4.32Å; W736-I740 HydrophobicContact CH2-CD1 3.89Å; W736-I740 HydrophobicContact CZ2-CD1 4.39Å; W736-I740 HydrophobicContact CZ3-CD1 3.85Å; F737-I740 CarbonylContact O-C 3.59Å; F737-I740 PolarHBondContact O-N 3.29Å; G738-I740 VanDerWaalsContact C-N 3.31Å; G738-I740 PolarHBondContact O-N 2.85Å; I740-L742 VanDerWaalsContact C-N 3.31Å; I740-L742 PolarHBondContact O-N 2.96Å; I740-E743 WeakPolarHBondContact CA-OE2 3.08Å; I740-E743 PolarHBondContact O-N 2.8Å; I740-L744 HydrophobicContact CD1-CD1 3.86Å; I740-L744 HydrophobicContact CD1-CD2 4.32Å; I740-L744 HydrophobicContact CD1-CG 4.07Å; I740-L744 HydrophobicContact CG1-CD1 3.71Å; I740-L744 HydrophobicContact CG1-CG 4.16Å; I740-L744 VanDerWaalsContact O-CG 3.3Å; I740-L744 WeakPolarHBondContact O-CG 3.48Å; I740-L744 PolarHBondContact O-N 3.21Å
741	S	94.4	Very high	93.1	Very high	14 Å²	14	20.4 Å²	20.4	10%	0.098	10%	0.095	C	C	.	.	H	α-helix	trans	-64.3	-35.3	-168.1	70	0	0	0	0	113.2	Q473 F737 G738 F745	Q473-S741 VanDerWaalsContact CD-O 3.27Å; Q473-S741 PolarHBondContact OE1-O 3.38Å; F737-S741 WeakPolarHBondContact O-CA 3.35Å; F737-S741 PolarHBondContact O-N 2.9Å; F737-S741 VanDerWaalsContact O-N 3.09Å; G738-S741 PolarHBondContact O-OG 3.09Å; S741-F745 WeakPolarHBondContact O-CB 3.31Å; S741-F745 PolarHBondContact O-N 3.26Å
742	L	92.6	Very high	93	Very high	31 Å²	31	21.8 Å²	21.8	16%	0.162	10%	0.1	C	C	.	.	H	α-helix	trans	-69	-45.8	-179.5	-178	66.5	0	0	0	111.1	L531 F551 V552 I740 L744 F745 I746	L531-L742 HydrophobicContact CD2-CD2 4.07Å; F551-L742 HydrophobicContact CD1-CD1 4.44Å; F551-L742 HydrophobicContact CE1-CD1 4.4Å; V552-L742 HydrophobicContact CG2-CD1 4.01Å; I740-L742 VanDerWaalsContact C-N 3.31Å; I740-L742 PolarHBondContact O-N 2.96Å; L742-L744 VanDerWaalsContact C-N 3.33Å; L742-L744 PolarHBondContact O-N 2.87Å; L742-F745 WeakPolarHBondContact O-CB 3.49Å; L742-F745 PolarHBondContact O-N 2.85Å; L742-I746 HydrophobicContact CD1-CD1 4.05Å; L742-I746 HydrophobicContact CG-CD1 3.89Å; L742-I746 WeakPolarHBondContact O-CD1 3.25Å; L742-I746 WeakPolarHBondContact O-CG1 3.41Å; L742-I746 PolarHBondContact O-N 2.9Å
743	E	95.1	Very high	93.1	Very high	19 Å²	19	20.9 Å²	20.9	9%	0.089	9%	0.093	C	C	.	.	H	α-helix	trans	-64.5	-40.8	178.7	-64.3	85.2	165.3	0	0	110.7	I740 I746 C747 A783 V786 S787	I740-E743 WeakPolarHBondContact CA-OE2 3.08Å; I740-E743 PolarHBondContact O-N 2.8Å; E743-I746 PolarHBondContact O-N 2.97Å; E743-C747 VanDerWaalsContact O-CB 3.25Å; E743-C747 WeakPolarHBondContact O-CB 3.41Å; E743-C747 PolarHBondContact O-N 3.35Å; E743-C747 PolarHBondContact O-SG 2.71Å; E743-A783 HydrophobicContact CB-CB 4.29Å; E743-V786 HydrophobicContact CG-CB 4.43Å; E743-V786 HydrophobicContact CG-CG1 4.01Å; E743-S787 WeakPolarHBondContact OE1-CA 3.4Å; E743-S787 VanDerWaalsContact OE1-CB 3.27Å; E743-S787 WeakPolarHBondContact OE1-CB 3.29Å; E743-S787 PolarHBondContact OE1-OG 2.82Å
744	L	95.6	Very high	92.8	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-60.3	-44.9	172	-70.9	166.1	0	0	0	111.8	Q473 L477 F737 I740 L742 I746 Q748 F779 A783	Q473-L744 HydrophobicContact CG-CB 4.21Å; Q473-L744 HydrophobicContact CG-CD1 4.41Å; L477-L744 HydrophobicContact CD1-CB 4.21Å; F737-L744 HydrophobicContact CD1-CD1 3.52Å; F737-L744 HydrophobicContact CE1-CD1 4.22Å; F737-L744 HydrophobicContact CG-CD1 4.49Å; I740-L744 HydrophobicContact CD1-CD1 3.86Å; I740-L744 HydrophobicContact CD1-CD2 4.32Å; I740-L744 HydrophobicContact CD1-CG 4.07Å; I740-L744 HydrophobicContact CG1-CD1 3.71Å; I740-L744 HydrophobicContact CG1-CG 4.16Å; I740-L744 VanDerWaalsContact O-CG 3.3Å; I740-L744 WeakPolarHBondContact O-CG 3.48Å; I740-L744 PolarHBondContact O-N 3.21Å; L742-L744 VanDerWaalsContact C-N 3.33Å; L742-L744 PolarHBondContact O-N 2.87Å; L744-I746 VanDerWaalsContact C-N 3.29Å; L744-I746 PolarHBondContact O-N 3.28Å; L744-Q748 PolarHBondContact O-N 3.21Å; L744-F779 HydrophobicContact CB-CZ 3.94Å; L744-F779 HydrophobicContact CD2-CD1 4.17Å; L744-F779 HydrophobicContact CD2-CE1 3.45Å; L744-F779 VanDerWaalsContact CD2-CE1 3.45Å; L744-F779 HydrophobicContact CD2-CE2 4.19Å; L744-F779 HydrophobicContact CD2-CZ 3.46Å; L744-F779 VanDerWaalsContact CD2-CZ 3.46Å; L744-F779 HydrophobicContact CG-CZ 4.32Å; L744-F779 WeakPolarHBondContact O-CE2 3.39Å; L744-F779 VanDerWaalsContact O-CZ 3.29Å; L744-F779 WeakPolarHBondContact O-CZ 3.37Å; L744-A783 HydrophobicContact CD2-CB 3.58Å; L744-A783 HydrophobicContact CG-CB 3.95Å
745	F	94.8	Very high	92	Very high	5 Å²	5	18.2 Å²	18.2	2%	0.022	8%	0.083	C	C	.	.	H	α-helix	trans	-59.6	-40.3	178.1	-175.1	-93	0	0	0	112.1	Q473 I476 F551 S741 L742 Q748 Y749	Q473-F745 VanDerWaalsContact NE2-CA 3.28Å; Q473-F745 VanDerWaalsContact NE2-CB 3.31Å; I476-F745 HydrophobicContact CG2-CD2 4.2Å; I476-F745 HydrophobicContact CG2-CE2 4.01Å; F551-F745 HydrophobicContact CB-CD1 4.16Å; F551-F745 HydrophobicContact CB-CE1 3.41Å; F551-F745 VanDerWaalsContact CB-CE1 3.41Å; F551-F745 HydrophobicContact CB-CZ 3.71Å; F551-F745 HydrophobicContact CD1-CD1 4.05Å; F551-F745 HydrophobicContact CD1-CE1 4.13Å; F551-F745 HydrophobicContact CD1-CG 4.45Å; F551-F745 HydrophobicContact CG-CD1 4.39Å; F551-F745 HydrophobicContact CG-CE1 4.01Å; F551-F745 HydrophobicContact CG-CZ 4.18Å; S741-F745 WeakPolarHBondContact O-CB 3.31Å; S741-F745 PolarHBondContact O-N 3.26Å; L742-F745 WeakPolarHBondContact O-CB 3.49Å; L742-F745 PolarHBondContact O-N 2.85Å; F745-Q748 VanDerWaalsContact O-CG 3.27Å; F745-Q748 WeakPolarHBondContact O-CG 3.49Å; F745-Q748 PolarHBondContact O-NE2 2.79Å; F745-Y749 HydrophobicContact CD1-CE2 4.47Å; F745-Y749 HydrophobicContact CE1-CE2 4Å; F745-Y749 HydrophobicContact CZ-CE2 4.41Å; F745-Y749 WeakPolarHBondContact O-CD2 3.4Å
746	I	94.4	Very high	91.5	Very high	2 Å²	2	18.6 Å²	18.6	1%	0.01	9%	0.085	C	C	.	.	H	α-helix	trans	-80.8	-44.1	-176.6	-63.1	160.3	0	0	0	111	L534 V535 L538 Y549 V552 L742 E743 L744 Q748 Y749	L534-I746 HydrophobicContact CB-CD1 4.4Å; L534-I746 HydrophobicContact CD2-CB 3.77Å; L534-I746 HydrophobicContact CD2-CD1 3.85Å; L534-I746 HydrophobicContact CD2-CG1 4.44Å; L534-I746 HydrophobicContact CD2-CG2 3.6Å; L534-I746 HydrophobicContact CG-CD1 4.4Å; L534-I746 HydrophobicContact CG-CG2 3.92Å; V535-I746 HydrophobicContact CG2-CD1 3.66Å; V535-I746 HydrophobicContact CG2-CG1 4.1Å; V535-I746 HydrophobicContact CG2-CG2 4.38Å; L538-I746 HydrophobicContact CD1-CG2 3.21Å; Y549-I746 HydrophobicContact CD1-CG2 4.35Å; Y549-I746 HydrophobicContact CE1-CG2 4.42Å; V552-I746 HydrophobicContact CG2-CD1 3.93Å; V552-I746 HydrophobicContact CG2-CG1 4.18Å; L742-I746 HydrophobicContact CD1-CD1 4.05Å; L742-I746 HydrophobicContact CG-CD1 3.89Å; L742-I746 WeakPolarHBondContact O-CD1 3.25Å; L742-I746 WeakPolarHBondContact O-CG1 3.41Å; L742-I746 PolarHBondContact O-N 2.9Å; E743-I746 PolarHBondContact O-N 2.97Å; L744-I746 VanDerWaalsContact C-N 3.29Å; L744-I746 PolarHBondContact O-N 3.28Å; I746-Q748 PolarHBondContact O-N 2.99Å; I746-Y749 WeakPolarHBondContact O-CB 3.44Å; I746-Y749 WeakPolarHBondContact O-CD2 3.42Å; I746-Y749 PolarHBondContact O-N 2.96Å
747	C	95	Very high	91.2	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-63.8	-24.7	-177.6	-65.8	0	0	0	0	112.7	F415 E743 Y749 H750 I751 F779	F415-C747 HydrophobicContact CZ-CB 4.18Å; E743-C747 VanDerWaalsContact O-CB 3.25Å; E743-C747 WeakPolarHBondContact O-CB 3.41Å; E743-C747 PolarHBondContact O-N 3.35Å; E743-C747 PolarHBondContact O-SG 2.71Å; C747-Y749 PolarHBondContact O-N 3.26Å; C747-Y749 VanDerWaalsContact O-N 3.14Å; C747-H750 PolarHBondContact O-N 3.02Å; C747-I751 HydrophobicContact CB-CD1 4.35Å; C747-I751 PolarHBondContact O-N 2.89Å; C747-I751 VanDerWaalsContact O-N 3.12Å; C747-F779 HydrophobicContact CB-CD2 4.05Å; C747-F779 HydrophobicContact CB-CE2 3.74Å
748	Q	94.8	Very high	90.8	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-57.5	-31.5	178.8	86.3	-174	-74.2	0	0	112	L477 H480 L744 F745 I746 H750 W752 L753 F779	L477-Q748 HydrophobicContact CD2-CB 3.67Å; L477-Q748 HydrophobicContact CD2-CG 4.19Å; H480-Q748 PolarHBondContact ND1-OE1 3.32Å; L744-Q748 PolarHBondContact O-N 3.21Å; F745-Q748 VanDerWaalsContact O-CG 3.27Å; F745-Q748 WeakPolarHBondContact O-CG 3.49Å; F745-Q748 PolarHBondContact O-NE2 2.79Å; I746-Q748 PolarHBondContact O-N 2.99Å; Q748-H750 PolarHBondContact O-N 2.83Å; Q748-W752 PolarHBondContact O-N 2.88Å; Q748-L753 HydrophobicContact CG-CD1 4.17Å; Q748-L753 WeakPolarHBondContact O-CB 3.16Å; Q748-L753 WeakPolarHBondContact O-CG 3.35Å; Q748-L753 PolarHBondContact O-N 3.43Å; Q748-F779 HydrophobicContact CB-CE2 4.24Å; Q748-F779 HydrophobicContact CB-CZ 4.39Å
749	Y	92.6	Very high	90.6	Very high	14 Å²	14	20.9 Å²	20.9	6%	0.055	10%	0.099	C	C	.	.	H	α-helix	trans	-61.6	-25.9	-177	-79.7	-108	0	0	0	113	F548 Y549 F745 I746 C747 L753 T757	F548-Y749 HydrophobicContact CD1-CD1 4.27Å; F548-Y749 HydrophobicContact CD1-CE1 4.35Å; F548-Y749 AromaticContact CE1-CD1 3.47Å; F548-Y749 HydrophobicContact CE1-CD1 3.47Å; F548-Y749 VanDerWaalsContact CE1-CD1 3.47Å; F548-Y749 AromaticContact CE1-CE1 3.87Å; F548-Y749 HydrophobicContact CE1-CE1 3.87Å; F548-Y749 AromaticContact CZ-CD1 3.78Å; F548-Y749 HydrophobicContact CZ-CD1 3.78Å; F548-Y749 HydrophobicContact CZ-CE1 4.06Å; Y549-Y749 HydrophobicContact CD1-CD1 4.25Å; Y549-Y749 HydrophobicContact CD1-CD2 4.35Å; Y549-Y749 HydrophobicContact CD1-CE1 4.34Å; Y549-Y749 HydrophobicContact CD1-CE2 4.48Å; Y549-Y749 HydrophobicContact CD1-CG 4.25Å; Y549-Y749 HydrophobicContact CE1-CD1 4.14Å; Y549-Y749 HydrophobicContact CE1-CG 4.06Å; F745-Y749 HydrophobicContact CD1-CE2 4.47Å; F745-Y749 HydrophobicContact CE1-CE2 4Å; F745-Y749 HydrophobicContact CZ-CE2 4.41Å; F745-Y749 WeakPolarHBondContact O-CD2 3.4Å; I746-Y749 WeakPolarHBondContact O-CB 3.44Å; I746-Y749 WeakPolarHBondContact O-CD2 3.42Å; I746-Y749 PolarHBondContact O-N 2.96Å; C747-Y749 PolarHBondContact O-N 3.26Å; C747-Y749 VanDerWaalsContact O-N 3.14Å; Y749-L753 VanDerWaalsContact O-O 3.08Å; Y749-T757 HydrophobicContact CD1-CG2 3.2Å; Y749-T757 HydrophobicContact CE1-CG2 3.36Å; Y749-T757 HydrophobicContact CG-CG2 4.06Å
750	H	91.6	Very high	90.6	Very high	1 Å²	1	16.5 Å²	16.5	1%	0.005	8%	0.081	C	C	.	.	H	α-helix	trans	-125.6	-7.9	-172.6	-55.7	-62.9	0	0	0	114.5	F415 C418 D419 M542 Y549 C747 Q748	F415-H750 HydrophobicContact CB-CB 3.88Å; F415-H750 HydrophobicContact CD1-CB 4.15Å; F415-H750 HydrophobicContact CD2-CB 4.33Å; F415-H750 HydrophobicContact CG-CB 3.89Å; C418-H750 WeakPolarHBondContact CB-O 3.44Å; D419-H750 IonicContact OD2-CE1 2.63Å; D419-H750 IonicContact OD2-ND1 2.82Å; D419-H750 PolarHBondContact OD2-ND1 2.8Å; D419-H750 VanDerWaalsContact OD2-ND1 3.11Å; M542-H750 HydrophobicContact CE-CB 4.48Å; Y549-H750 AromaticContact CE1-NE2 3.77Å; Y549-H750 AromaticContact CZ-NE2 3.66Å; Y549-H750 PolarHBondContact OH-CE1 3.47Å; Y549-H750 PolarHBondContact OH-NE2 3Å; C747-H750 PolarHBondContact O-N 3.02Å; Q748-H750 PolarHBondContact O-N 2.83Å
751	I	91.8	Very high	90.5	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.005	8%	0.079	C	C	.	.	H	α-helix	trans	-106.7	-46	175.3	-55.7	-175.5	0	0	0	111.9	Y414 F415 C747 L761 F779 V782	Y414-I751 HydrophobicContact CE1-CD1 4.04Å; Y414-I751 HydrophobicContact CE1-CG1 3.95Å; F415-I751 HydrophobicContact CD1-CG1 4.06Å; F415-I751 HydrophobicContact CE1-CD1 3.6Å; F415-I751 HydrophobicContact CE1-CG1 3.55Å; F415-I751 HydrophobicContact CZ-CD1 4.24Å; F415-I751 HydrophobicContact CZ-CG1 4.37Å; C747-I751 HydrophobicContact CB-CD1 4.35Å; C747-I751 PolarHBondContact O-N 2.89Å; C747-I751 VanDerWaalsContact O-N 3.12Å; I751-L761 VanDerWaalsContact O-CD2 3.28Å; I751-L761 WeakPolarHBondContact O-CD2 3.16Å; I751-F779 HydrophobicContact CB-CB 4.46Å; I751-F779 HydrophobicContact CB-CD2 4.24Å; I751-F779 HydrophobicContact CD1-CB 4.29Å; I751-F779 HydrophobicContact CD1-CD2 4.05Å; I751-F779 HydrophobicContact CG2-CB 3.85Å; I751-V782 HydrophobicContact CD1-CB 3.93Å; I751-V782 HydrophobicContact CD1-CG1 3.98Å; I751-V782 HydrophobicContact CD1-CG2 4.27Å
752	W	91.9	Very high	90.3	Very high	32 Å²	32	15.8 Å²	15.8	12%	0.121	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-39	-179.7	-79.3	-9.6	0	0	0	112.4	L477 V481 Q748 I760 L761 S775 T776 F779	L477-W752 HydrophobicContact CB-CZ3 3.76Å; L477-W752 HydrophobicContact CD2-CZ3 4.47Å; L477-W752 HydrophobicContact CG-CZ3 4.5Å; V481-W752 HydrophobicContact CG2-CB 3.77Å; V481-W752 HydrophobicContact CG2-CD2 3.91Å; V481-W752 HydrophobicContact CG2-CE3 3.39Å; V481-W752 HydrophobicContact CG2-CG 4.1Å; V481-W752 HydrophobicContact CG2-CZ3 4.1Å; Q748-W752 PolarHBondContact O-N 2.88Å; W752-I760 WeakPolarHBondContact O-CA 3.38Å; W752-L761 PolarHBondContact O-N 3.43Å; W752-S775 PolarHBondContact NE1-OG 3.09Å; W752-T776 HydrophobicContact CZ2-CG2 3.95Å; W752-T776 VanDerWaalsContact CZ2-OG1 3.25Å; W752-T776 WeakPolarHBondContact CZ2-OG1 3.25Å; W752-F779 HydrophobicContact CD2-CD1 4.27Å; W752-F779 HydrophobicContact CD2-CE1 4.44Å; W752-F779 AromaticContact CE2-CD1 3.7Å; W752-F779 HydrophobicContact CE3-CE1 4.4Å; W752-F779 HydrophobicContact CH2-CD1 4.05Å; W752-F779 AromaticContact CH2-CE1 3.94Å; W752-F779 HydrophobicContact CH2-CE1 3.94Å; W752-F779 AromaticContact CZ2-CD1 3.53Å; W752-F779 HydrophobicContact CZ2-CD1 3.53Å; W752-F779 AromaticContact CZ2-CE1 3.9Å; W752-F779 HydrophobicContact CZ2-CE1 3.9Å; W752-F779 HydrophobicContact CZ2-CG 4.33Å; W752-F779 HydrophobicContact CZ3-CE1 4.24Å
753	L	90.9	Very high	90.2	Very high	4 Å²	4	14.3 Å²	14.3	2%	0.021	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	151.5	179.2	-52.7	-175.6	0	0	0	110.2	K429 H480 V481 Q748 Y749 T757 G759	K429-L753 VanDerWaalsContact NZ-CD2 3.29Å; H480-L753 HydrophobicContact CB-CD1 4.29Å; V481-L753 HydrophobicContact CG2-CD2 4.13Å; Q748-L753 HydrophobicContact CG-CD1 4.17Å; Q748-L753 WeakPolarHBondContact O-CB 3.16Å; Q748-L753 WeakPolarHBondContact O-CG 3.35Å; Q748-L753 PolarHBondContact O-N 3.43Å; Y749-L753 VanDerWaalsContact O-O 3.08Å; L753-T757 HydrophobicContact CD1-CG2 3.89Å; L753-G759 WeakPolarHBondContact CA-O 3.25Å
754	A	84.3	Confident	89.9	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	164.6	177.5	0	0	0	0	0	110.8	K426 D756 T757 K758 G759 L761	K426-A754 HydrophobicContact CB-CB 4.42Å; K426-A754 HydrophobicContact CD-CB 3.97Å; K426-A754 HydrophobicContact CG-CB 3.82Å; A754-D756 PolarHBondContact O-N 3.21Å; A754-T757 PolarHBondContact O-N 3.41Å; A754-K758 PolarHBondContact O-N 2.92Å; A754-G759 PolarHBondContact N-O 2.88Å; A754-G759 PolarHBondContact O-N 3.14Å; A754-L761 HydrophobicContact CB-CB 4.27Å; A754-L761 HydrophobicContact CB-CD1 4.2Å
755	A	79.2	Confident	89.4	Confident	8 Å²	8	16.9 Å²	16.9	7%	0.066	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	50	58.2	-179.5	0	0	0	0	0	111.3	M105 D419 T757 K758	M105-A755 HydrophobicContact CE-CB 3.24Å; D419-A755 PolarHBondContact OD1-N 3.42Å; D419-A755 VanDerWaalsContact OD1-N 3.11Å; A755-T757 VanDerWaalsContact C-N 3.32Å; A755-T757 PolarHBondContact O-N 3.45Å; A755-K758 WeakPolarHBondContact O-CB 3.45Å; A755-K758 WeakPolarHBondContact O-CG 3.29Å; A755-K758 PolarHBondContact O-N 2.88Å; A755-K758 VanDerWaalsContact O-N 3.12Å
756	D	81.9	Confident	88.6	Confident	12 Å²	12	20.6 Å²	20.6	6%	0.064	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	48.2	178	-53.6	-61	0	0	0	113.4	I333 R420 R544 F548 A754 K758	I333-D756 HydrophobicContact CG2-CB 4Å; R420-D756 IonicContact CZ-OD1 3.96Å; R420-D756 IonicContact NH1-OD1 3.18Å; R420-D756 PolarHBondContact NH1-OD1 3.45Å; R420-D756 IonicContact NH1-OD2 3Å; R420-D756 IonicContact NH2-OD1 3.54Å; R420-D756 PolarHBondContact NH2-OD1 3.24Å; R544-D756 IonicContact CZ-OD1 2.63Å; R544-D756 IonicContact CZ-OD2 3.78Å; R544-D756 IonicContact NE-OD1 3.28Å; R544-D756 PolarHBondContact NE-OD1 2.86Å; R544-D756 IonicContact NE-OD2 3.68Å; R544-D756 VanDerWaalsContact NH2-CG 3.33Å; R544-D756 IonicContact NH2-OD1 3.55Å; R544-D756 PolarHBondContact NH2-OD1 3.33Å; R544-D756 IonicContact NH2-OD2 3.85Å; R544-D756 PolarHBondContact NH2-OD2 3.15Å; F548-D756 HydrophobicContact CE2-CB 3.75Å; F548-D756 HydrophobicContact CZ-CB 3.76Å; A754-D756 PolarHBondContact O-N 3.21Å; D756-K758 PolarHBondContact O-N 3.26Å
757	T	84.7	Confident	88.2	Confident	41 Å²	41	24 Å²	24	25%	0.252	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	3.6	178.7	77	0	0	0	0	117.5	K429 F548 Y749 L753 A754 A755	K429-T757 WeakPolarHBondContact CE-O 3.35Å; K429-T757 PolarHBondContact NZ-O 2.95Å; F548-T757 HydrophobicContact CZ-CG2 4.16Å; Y749-T757 HydrophobicContact CD1-CG2 3.2Å; Y749-T757 HydrophobicContact CE1-CG2 3.36Å; Y749-T757 HydrophobicContact CG-CG2 4.06Å; L753-T757 HydrophobicContact CD1-CG2 3.89Å; A754-T757 PolarHBondContact O-N 3.41Å; A755-T757 VanDerWaalsContact C-N 3.32Å; A755-T757 PolarHBondContact O-N 3.45Å
758	K	85.5	Confident	87.7	Confident	117 Å²	117	27.3 Å²	27.3	51%	0.509	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-28.9	179.9	-57.9	-61.4	-176.8	179.8	0	113	D334 K429 A754 A755 D756	D334-K758 HydrophobicContact CB-CB 3.96Å; D334-K758 HydrophobicContact CB-CD 4.32Å; D334-K758 HydrophobicContact CB-CG 3.82Å; K429-K758 WeakPolarHBondContact CG-O 3.26Å; A754-K758 PolarHBondContact O-N 2.92Å; A755-K758 WeakPolarHBondContact O-CB 3.45Å; A755-K758 WeakPolarHBondContact O-CG 3.29Å; A755-K758 PolarHBondContact O-N 2.88Å; A755-K758 VanDerWaalsContact O-N 3.12Å; D756-K758 PolarHBondContact O-N 3.26Å
759	G	88.1	Confident	87.3	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	-179.4	-179	0	0	0	0	0	115.4	M105 E427 K429 L753 A754	M105-G759 WeakPolarHBondContact SD-CA 3.44Å; E427-G759 CarbonylContact O-C 3.58Å; E427-G759 WeakPolarHBondContact O-CA 3.34Å; K429-G759 VanDerWaalsContact CE-O 3.27Å; K429-G759 WeakPolarHBondContact CE-O 3.46Å; L753-G759 WeakPolarHBondContact CA-O 3.25Å; A754-G759 PolarHBondContact N-O 2.88Å; A754-G759 PolarHBondContact O-N 3.14Å
760	I	91.2	Very high	87.1	Confident	35 Å²	35	34.6 Å²	34.6	18%	0.179	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	137.3	168.8	-55.3	176.5	0	0	0	108.1	E427 K429 V481 W752	E427-I760 PolarHBondContact N-O 3.14Å; E427-I760 PolarHBondContact O-N 2.9Å; K429-I760 HydrophobicContact CG-CD1 4.23Å; K429-I760 HydrophobicContact CG-CG1 3.78Å; V481-I760 WeakPolarHBondContact O-CD1 3.43Å; W752-I760 WeakPolarHBondContact O-CA 3.38Å
761	L	91.3	Very high	87.1	Confident	2 Å²	2	35 Å²	35	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	133	174.6	-168.3	70.8	0	0	0	110.7	C418 F424 I751 W752 A754 L763 N771	C418-L761 HydrophobicContact CB-CD1 4.44Å; C418-L761 HydrophobicContact CB-CD2 3.69Å; C418-L761 WeakPolarHBondContact O-CD1 3.47Å; F424-L761 HydrophobicContact CB-CD1 3.85Å; F424-L761 HydrophobicContact CB-CG 4.44Å; I751-L761 VanDerWaalsContact O-CD2 3.28Å; I751-L761 WeakPolarHBondContact O-CD2 3.16Å; W752-L761 PolarHBondContact O-N 3.43Å; A754-L761 HydrophobicContact CB-CB 4.27Å; A754-L761 HydrophobicContact CB-CD1 4.2Å; L761-L763 HydrophobicContact CD2-CD2 3.79Å; L761-L763 HydrophobicContact CD2-CG 4.43Å; L761-L763 HydrophobicContact CG-CD2 4.22Å; L761-N771 PolarHBondContact O-ND2 2.84Å
762	V	90.4	Very high	87	Confident	7 Å²	7	39 Å²	39	4%	0.042	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	101	179	-177	0	0	0	0	109.8	M425 E427	M425-V762 HydrophobicContact CB-CB 4.06Å; M425-V762 PolarHBondContact N-O 2.62Å; M425-V762 PolarHBondContact O-N 3.35Å; E427-V762 HydrophobicContact CB-CG2 3.95Å; E427-V762 HydrophobicContact CG-CG2 3.67Å
763	L	90.1	Very high	86.9	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	26%	0.258	C	S	.	.	S	Bend	trans	-81.1	-33.3	173.5	-59.1	-177.6	0	0	0	111.8	L68 H72 F424 L761 N771 I778	L68-L763 HydrophobicContact CD1-CB 4.2Å; L68-L763 HydrophobicContact CD1-CD1 4.22Å; H72-L763 PolarHBondContact NE2-O 3.46Å; F424-L763 HydrophobicContact CB-CD2 4.47Å; F424-L763 HydrophobicContact CD1-CD2 3.68Å; F424-L763 HydrophobicContact CD2-CD2 4.37Å; F424-L763 HydrophobicContact CE1-CD2 3.92Å; F424-L763 HydrophobicContact CG-CD2 3.92Å; F424-L763 HydrophobicContact CZ-CD2 4.34Å; L761-L763 HydrophobicContact CD2-CD2 3.79Å; L761-L763 HydrophobicContact CD2-CG 4.43Å; L761-L763 HydrophobicContact CG-CD2 4.22Å; L763-N771 WeakPolarHBondContact CA-OD1 3.29Å; L763-N771 PolarHBondContact N-OD1 3.02Å; L763-I778 HydrophobicContact CD1-CD1 4.12Å
764	I	89	Confident	87	Confident	38 Å²	38	44.7 Å²	44.7	20%	0.195	27%	0.267	C	S	.	.	S	Bend	trans	-124.1	103.4	179.5	-59.4	175.1	0	0	0	108.7	L68 L770 N771 V774	L68-I764 HydrophobicContact CD2-CG1 4.05Å; I764-L770 HydrophobicContact CD1-CD2 4.15Å; I764-L770 HydrophobicContact CD1-CG 3.85Å; I764-L770 HydrophobicContact CG2-CD2 4.14Å; I764-N771 HydrophobicContact CB-CB 4.35Å; I764-N771 PolarHBondContact N-OD1 3Å; I764-V774 HydrophobicContact CD1-CB 3.91Å; I764-V774 HydrophobicContact CD1-CG1 4.19Å; I764-V774 HydrophobicContact CD1-CG2 3.69Å
765	P	83.9	Confident	87.5	Confident	35 Å²	35	44.9 Å²	44.9	23%	0.227	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	148.3	-178.8	27.9	-33	0	0	0	111.7	M425 N767	M425-P765 HydrophobicContact SD-CB 3.86Å; M425-P765 HydrophobicContact SD-CG 4.33Å; P765-N767 VanDerWaalsContact C-N 3.33Å; P765-N767 PolarHBondContact O-N 3.41Å
766	G	79.3	Confident	88.2	Confident	82 Å²	82	46.6 Å²	46.6	85%	0.845	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.9	-19	173.2	0	0	0	0	0	116.3
767	N	85.7	Confident	88.8	Confident	74 Å²	74	49.2 Å²	49.2	40%	0.396	29%	0.289	S	S	.	.			trans	-130.5	96.3	177.1	-168.4	-37.9	0	0	0	112	P765 S769 L770 N771	P765-N767 VanDerWaalsContact C-N 3.33Å; P765-N767 PolarHBondContact O-N 3.41Å; N767-S769 VanDerWaalsContact C-N 3.34Å; N767-S769 PolarHBondContact O-N 3.49Å; N767-S769 PolarHBondContact OD1-N 3.02Å; N767-L770 HydrophobicContact CB-CB 4.06Å; N767-L770 PolarHBondContact O-N 3.41Å; N767-L770 PolarHBondContact OD1-N 3.4Å; N767-N771 WeakPolarHBondContact O-CB 3.21Å; N767-N771 PolarHBondContact O-N 3.17Å
768	P	83.5	Confident	89.3	Confident	69 Å²	69	47.2 Å²	47.2	45%	0.448	28%	0.277	S	S	.	.	H	α-helix	trans	-60.2	-38.5	-178	-26	35.2	0	0	0	114.1	N771 I772	P768-N771 PolarHBondContact O-N 2.62Å; P768-I772 WeakPolarHBondContact O-CG1 3.36Å; P768-I772 PolarHBondContact O-N 3.29Å
769	S	85.8	Confident	89.7	Confident	94 Å²	94	41.8 Å²	41.8	66%	0.657	25%	0.253	S	S	*	.	H	α-helix	trans	-67	-44.8	-178.1	-54.9	0	0	0	0	111.5	N767 I772 L773	N767-S769 VanDerWaalsContact C-N 3.34Å; N767-S769 PolarHBondContact O-N 3.49Å; N767-S769 PolarHBondContact OD1-N 3.02Å; S769-I772 PolarHBondContact O-N 3.46Å; S769-L773 WeakPolarHBondContact O-CB 3.46Å; S769-L773 PolarHBondContact O-N 3.18Å
770	L	89.2	Confident	90	Very high	74 Å²	74	43 Å²	43	39%	0.387	26%	0.261	S	S	.	.	H	α-helix	trans	-67.3	-39.1	176.3	-175.6	60.9	0	0	0	111.5	I764 N767 L773 V774	I764-L770 HydrophobicContact CD1-CD2 4.15Å; I764-L770 HydrophobicContact CD1-CG 3.85Å; I764-L770 HydrophobicContact CG2-CD2 4.14Å; N767-L770 HydrophobicContact CB-CB 4.06Å; N767-L770 PolarHBondContact O-N 3.41Å; N767-L770 PolarHBondContact OD1-N 3.4Å; L770-L773 PolarHBondContact O-N 3.04Å; L770-V774 HydrophobicContact CD1-CG2 4.03Å; L770-V774 HydrophobicContact CG-CG2 4.43Å; L770-V774 WeakPolarHBondContact O-CG2 3.42Å; L770-V774 PolarHBondContact O-N 3.28Å
771	N	91.4	Very high	90.2	Very high	9 Å²	9	42 Å²	42	5%	0.048	26%	0.257	C	S	.	.	H	α-helix	trans	-58	-48.8	174.3	-177.1	62.1	0	0	0	111.6	L761 L763 I764 N767 P768 L773 S775	L761-N771 PolarHBondContact O-ND2 2.84Å; L763-N771 WeakPolarHBondContact CA-OD1 3.29Å; L763-N771 PolarHBondContact N-OD1 3.02Å; I764-N771 HydrophobicContact CB-CB 4.35Å; I764-N771 PolarHBondContact N-OD1 3Å; N767-N771 WeakPolarHBondContact O-CB 3.21Å; N767-N771 PolarHBondContact O-N 3.17Å; P768-N771 PolarHBondContact O-N 2.62Å; N771-L773 PolarHBondContact O-N 2.92Å; N771-S775 WeakPolarHBondContact O-CB 3.44Å; N771-S775 PolarHBondContact O-N 3.38Å; N771-S775 PolarHBondContact O-OG 3.38Å
772	I	89	Confident	90.4	Very high	85 Å²	85	42.6 Å²	42.6	44%	0.436	26%	0.26	S	S	.	.	H	α-helix	trans	-63.2	-43.2	177.7	-69.7	172.2	0	0	0	110.6	P768 S769 S775 T776	P768-I772 WeakPolarHBondContact O-CG1 3.36Å; P768-I772 PolarHBondContact O-N 3.29Å; S769-I772 PolarHBondContact O-N 3.46Å; I772-S775 WeakPolarHBondContact CA-OG 3.46Å; I772-S775 PolarHBondContact O-OG 3.48Å; I772-S775 VanDerWaalsContact O-OG 3.12Å; I772-T776 WeakPolarHBondContact O-CB 3.5Å; I772-T776 PolarHBondContact O-N 2.84Å; I772-T776 PolarHBondContact O-OG1 3.07Å
773	L	91.1	Very high	90.6	Very high	119 Å²	119	42.2 Å²	42.2	62%	0.623	26%	0.258	S	S	*	.	H	α-helix	trans	-60.7	-52.6	180	-179.4	64.1	0	0	0	112.3	S769 L770 N771 T776 F777	S769-L773 WeakPolarHBondContact O-CB 3.46Å; S769-L773 PolarHBondContact O-N 3.18Å; L770-L773 PolarHBondContact O-N 3.04Å; N771-L773 PolarHBondContact O-N 2.92Å; L773-T776 PolarHBondContact O-N 3.22Å; L773-F777 PolarHBondContact O-N 3.11Å
774	V	93.4	Very high	90.8	Very high	36 Å²	36	43.2 Å²	43.2	22%	0.218	26%	0.263	C	S	.	.	H	α-helix	trans	-67.7	-44.3	-178	173.9	0	0	0	0	111.1	L68 I764 L770 T776 F777 I778	L68-V774 HydrophobicContact CD1-CG1 4.36Å; I764-V774 HydrophobicContact CD1-CB 3.91Å; I764-V774 HydrophobicContact CD1-CG1 4.19Å; I764-V774 HydrophobicContact CD1-CG2 3.69Å; L770-V774 HydrophobicContact CD1-CG2 4.03Å; L770-V774 HydrophobicContact CG-CG2 4.43Å; L770-V774 WeakPolarHBondContact O-CG2 3.42Å; L770-V774 PolarHBondContact O-N 3.28Å; V774-T776 VanDerWaalsContact C-N 3.32Å; V774-T776 PolarHBondContact O-N 2.9Å; V774-F777 PolarHBondContact O-N 3.35Å; V774-I778 HydrophobicContact CG1-CD1 3.92Å; V774-I778 WeakPolarHBondContact O-CG1 3.31Å; V774-I778 PolarHBondContact O-N 3.04Å
775	S	93.8	Very high	91.1	Very high	4 Å²	4	42.3 Å²	42.3	3%	0.028	26%	0.258	C	S	.	.	H	α-helix	trans	-63.9	-37.3	176.9	64.3	0	0	0	0	112	W752 N771 I772 I778 F779	W752-S775 PolarHBondContact NE1-OG 3.09Å; N771-S775 WeakPolarHBondContact O-CB 3.44Å; N771-S775 PolarHBondContact O-N 3.38Å; N771-S775 PolarHBondContact O-OG 3.38Å; I772-S775 WeakPolarHBondContact CA-OG 3.46Å; I772-S775 PolarHBondContact O-OG 3.48Å; I772-S775 VanDerWaalsContact O-OG 3.12Å; S775-I778 PolarHBondContact O-N 2.91Å; S775-F779 WeakPolarHBondContact O-CB 3.29Å; S775-F779 PolarHBondContact O-N 3.09Å
776	T	93.6	Very high	91.5	Very high	45 Å²	45	40.7 Å²	40.7	28%	0.276	25%	0.247	S	C	.	.	H	α-helix	trans	-62.6	-44.6	174.7	-61.2	0	0	0	0	111.4	W752 I772 L773 V774 F779 V780	W752-T776 HydrophobicContact CZ2-CG2 3.95Å; W752-T776 VanDerWaalsContact CZ2-OG1 3.25Å; W752-T776 WeakPolarHBondContact CZ2-OG1 3.25Å; I772-T776 WeakPolarHBondContact O-CB 3.5Å; I772-T776 PolarHBondContact O-N 2.84Å; I772-T776 PolarHBondContact O-OG1 3.07Å; L773-T776 PolarHBondContact O-N 3.22Å; V774-T776 VanDerWaalsContact C-N 3.32Å; V774-T776 PolarHBondContact O-N 2.9Å; T776-F779 PolarHBondContact O-N 2.83Å; T776-V780 HydrophobicContact CG2-CG2 4.35Å; T776-V780 WeakPolarHBondContact O-CG2 3.44Å; T776-V780 PolarHBondContact O-N 3.25Å
777	F	94.4	Very high	92.1	Very high	66 Å²	66	37.3 Å²	37.3	29%	0.289	21%	0.211	S	C	.	.	H	α-helix	trans	-60.7	-47.8	177.8	177.6	-103.6	0	0	0	111.8	F52 A57 I60 L773 V774 C781	F52-F777 HydrophobicContact CZ-CE2 4.22Å; A57-F777 HydrophobicContact CB-CE2 4.27Å; A57-F777 HydrophobicContact CB-CZ 4.06Å; A57-F777 WeakPolarHBondContact O-CZ 3.41Å; I60-F777 HydrophobicContact CB-CE1 4.29Å; I60-F777 HydrophobicContact CB-CZ 4.4Å; I60-F777 HydrophobicContact CG2-CE1 3.94Å; I60-F777 HydrophobicContact CG2-CZ 4.3Å; L773-F777 PolarHBondContact O-N 3.11Å; V774-F777 PolarHBondContact O-N 3.35Å; F777-C781 PolarHBondContact O-N 2.9Å; F777-C781 VanDerWaalsContact O-N 3.17Å; F777-C781 PolarHBondContact O-SG 3.38Å
778	I	95	Very high	92.3	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.2	-46.3	176.1	-65.1	165.6	0	0	0	110.5	S61 A64 V65 L68 Y414 L763 V774 S775 V780 C781 V782	S61-I778 WeakPolarHBondContact OG-CA 3.47Å; A64-I778 HydrophobicContact CB-CD1 4.38Å; V65-I778 HydrophobicContact CG2-CD1 3.95Å; V65-I778 HydrophobicContact CG2-CG1 4.32Å; V65-I778 HydrophobicContact CG2-CG2 3.8Å; L68-I778 HydrophobicContact CD1-CD1 4.08Å; Y414-I778 HydrophobicContact CE1-CG2 4.03Å; L763-I778 HydrophobicContact CD1-CD1 4.12Å; V774-I778 HydrophobicContact CG1-CD1 3.92Å; V774-I778 WeakPolarHBondContact O-CG1 3.31Å; V774-I778 PolarHBondContact O-N 3.04Å; S775-I778 PolarHBondContact O-N 2.91Å; I778-V780 PolarHBondContact O-N 3.34Å; I778-C781 PolarHBondContact O-N 3.08Å; I778-V782 HydrophobicContact CG2-CG2 4.19Å; I778-V782 WeakPolarHBondContact O-CB 3.43Å; I778-V782 VanDerWaalsContact O-CG2 3.32Å; I778-V782 WeakPolarHBondContact O-CG2 3.32Å; I778-V782 PolarHBondContact O-N 3.23Å
779	F	95.6	Very high	92.6	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.009	18%	0.183	C	C	.	.	H	α-helix	trans	-55.7	-49.5	-179.5	166.3	-116.4	0	0	0	112.5	L477 L744 C747 Q748 I751 W752 S775 T776 V782 A783	L477-F779 HydrophobicContact CD1-CE1 4.02Å; L477-F779 HydrophobicContact CD1-CZ 4.07Å; L477-F779 HydrophobicContact CD2-CZ 3.96Å; L744-F779 HydrophobicContact CB-CZ 3.94Å; L744-F779 HydrophobicContact CD2-CD1 4.17Å; L744-F779 HydrophobicContact CD2-CE1 3.45Å; L744-F779 VanDerWaalsContact CD2-CE1 3.45Å; L744-F779 HydrophobicContact CD2-CE2 4.19Å; L744-F779 HydrophobicContact CD2-CZ 3.46Å; L744-F779 VanDerWaalsContact CD2-CZ 3.46Å; L744-F779 HydrophobicContact CG-CZ 4.32Å; L744-F779 WeakPolarHBondContact O-CE2 3.39Å; L744-F779 VanDerWaalsContact O-CZ 3.29Å; L744-F779 WeakPolarHBondContact O-CZ 3.37Å; C747-F779 HydrophobicContact CB-CD2 4.05Å; C747-F779 HydrophobicContact CB-CE2 3.74Å; Q748-F779 HydrophobicContact CB-CE2 4.24Å; Q748-F779 HydrophobicContact CB-CZ 4.39Å; I751-F779 HydrophobicContact CB-CB 4.46Å; I751-F779 HydrophobicContact CB-CD2 4.24Å; I751-F779 HydrophobicContact CD1-CB 4.29Å; I751-F779 HydrophobicContact CD1-CD2 4.05Å; I751-F779 HydrophobicContact CG2-CB 3.85Å; W752-F779 HydrophobicContact CD2-CD1 4.27Å; W752-F779 HydrophobicContact CD2-CE1 4.44Å; W752-F779 AromaticContact CE2-CD1 3.7Å; W752-F779 HydrophobicContact CE3-CE1 4.4Å; W752-F779 HydrophobicContact CH2-CD1 4.05Å; W752-F779 AromaticContact CH2-CE1 3.94Å; W752-F779 HydrophobicContact CH2-CE1 3.94Å; W752-F779 AromaticContact CZ2-CD1 3.53Å; W752-F779 HydrophobicContact CZ2-CD1 3.53Å; W752-F779 AromaticContact CZ2-CE1 3.9Å; W752-F779 HydrophobicContact CZ2-CE1 3.9Å; W752-F779 HydrophobicContact CZ2-CG 4.33Å; W752-F779 HydrophobicContact CZ3-CE1 4.24Å; S775-F779 WeakPolarHBondContact O-CB 3.29Å; S775-F779 PolarHBondContact O-N 3.09Å; T776-F779 PolarHBondContact O-N 2.83Å; F779-V782 PolarHBondContact O-N 3.29Å; F779-A783 WeakPolarHBondContact O-CB 3.5Å; F779-A783 PolarHBondContact O-N 2.8Å
780	V	94.5	Very high	92.8	Very high	25 Å²	25	28.3 Å²	28.3	15%	0.152	15%	0.153	C	C	.	.	H	α-helix	trans	-66.5	-41	-179.6	172.9	0	0	0	0	111.4	W736 F737 T776 I778 H784	W736-V780 HydrophobicContact CH2-CG1 3.42Å; W736-V780 VanDerWaalsContact CH2-CG1 3.42Å; W736-V780 HydrophobicContact CZ3-CG1 3.75Å; F737-V780 HydrophobicContact CE1-CG2 4.02Å; F737-V780 HydrophobicContact CZ-CG2 4.32Å; T776-V780 HydrophobicContact CG2-CG2 4.35Å; T776-V780 WeakPolarHBondContact O-CG2 3.44Å; T776-V780 PolarHBondContact O-N 3.25Å; I778-V780 PolarHBondContact O-N 3.34Å; V780-H784 WeakPolarHBondContact O-CB 3.15Å; V780-H784 PolarHBondContact O-N 2.75Å
781	C	94.8	Very high	92.7	Very high	15 Å²	15	27 Å²	27	10%	0.101	15%	0.146	C	C	.	.	H	α-helix	trans	-62.2	-44.1	176.5	-70.4	0	0	0	0	112.1	K58 F777 I778 E785	K58-C781 HydrophobicContact CG-CB 4.35Å; F777-C781 PolarHBondContact O-N 2.9Å; F777-C781 VanDerWaalsContact O-N 3.17Å; F777-C781 PolarHBondContact O-SG 3.38Å; I778-C781 PolarHBondContact O-N 3.08Å; C781-E785 PolarHBondContact O-N 2.7Å
782	V	95.1	Very high	92.5	Very high	14 Å²	14	29 Å²	29	9%	0.085	16%	0.157	C	C	.	.	H	α-helix	trans	-66.3	-48.1	178.3	172.2	0	0	0	0	111	I411 F415 I751 I778 F779 H784 E785 V786	I411-V782 HydrophobicContact CD1-CG1 4.43Å; I411-V782 HydrophobicContact CG1-CG1 4.35Å; I411-V782 HydrophobicContact CG2-CG1 3.57Å; F415-V782 HydrophobicContact CE1-CG1 3.8Å; F415-V782 HydrophobicContact CZ-CG1 3.73Å; I751-V782 HydrophobicContact CD1-CB 3.93Å; I751-V782 HydrophobicContact CD1-CG1 3.98Å; I751-V782 HydrophobicContact CD1-CG2 4.27Å; I778-V782 HydrophobicContact CG2-CG2 4.19Å; I778-V782 WeakPolarHBondContact O-CB 3.43Å; I778-V782 VanDerWaalsContact O-CG2 3.32Å; I778-V782 WeakPolarHBondContact O-CG2 3.32Å; I778-V782 PolarHBondContact O-N 3.23Å; F779-V782 PolarHBondContact O-N 3.29Å; V782-H784 VanDerWaalsContact C-N 3.28Å; V782-H784 PolarHBondContact O-N 3.13Å; V782-E785 PolarHBondContact O-N 3.19Å; V782-E785 VanDerWaalsContact O-N 3.07Å; V782-V786 HydrophobicContact CG1-CG2 4.24Å; V782-V786 WeakPolarHBondContact O-CG2 3.43Å; V782-V786 PolarHBondContact O-N 2.84Å
783	A	95.3	Very high	92.4	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-58.8	-41.4	178.8	0	0	0	0	0	111.8	E743 L744 F779 V786 S787	E743-A783 HydrophobicContact CB-CB 4.29Å; L744-A783 HydrophobicContact CD2-CB 3.58Å; L744-A783 HydrophobicContact CG-CB 3.95Å; F779-A783 WeakPolarHBondContact O-CB 3.5Å; F779-A783 PolarHBondContact O-N 2.8Å; A783-V786 PolarHBondContact O-N 3.06Å; A783-S787 PolarHBondContact O-N 3.38Å; A783-S787 VanDerWaalsContact O-N 3.08Å
784	H	94.3	Very high	92.1	Very high	21 Å²	21	19.7 Å²	19.7	10%	0.097	11%	0.109	C	C	.	.	H	α-helix	trans	-62.9	-44.3	173.8	-179.2	-59.7	0	0	0	112	K58 W736 V780 V782 S787 V788	K58-H784 WeakPolarHBondContact CE-ND1 3.4Å; K58-H784 PolarHBondContact NZ-CE1 2.88Å; K58-H784 PolarHBondContact NZ-ND1 3.36Å; K58-H784 VanDerWaalsContact NZ-ND1 3.12Å; W736-H784 AromaticContact CZ2-CD2 3.75Å; V780-H784 WeakPolarHBondContact O-CB 3.15Å; V780-H784 PolarHBondContact O-N 2.75Å; V782-H784 VanDerWaalsContact C-N 3.28Å; V782-H784 PolarHBondContact O-N 3.13Å; H784-S787 PolarHBondContact O-N 3.4Å; H784-V788 WeakPolarHBondContact O-CG2 3.39Å; H784-V788 PolarHBondContact O-N 3.39Å
785	E	93.7	Very high	91.6	Very high	20 Å²	20	22.4 Å²	22.4	9%	0.093	12%	0.119	C	C	.	.	H	α-helix	trans	-64.9	-40.6	179.6	-171.4	62	-163.6	0	0	111.8	K58 R407 I411 C781 V782 S787 V788 I789	K58-E785 WeakPolarHBondContact CD-OE2 3Å; K58-E785 WeakPolarHBondContact CE-OE2 3.41Å; K58-E785 IonicContact NZ-OE2 2.77Å; K58-E785 PolarHBondContact NZ-OE2 3.3Å; R407-E785 WeakPolarHBondContact CD-OE1 3.34Å; R407-E785 IonicContact CZ-OE1 3.71Å; R407-E785 IonicContact NE-OE1 3.63Å; R407-E785 IonicContact NH1-OE1 2.78Å; R407-E785 PolarHBondContact NH1-OE1 2.95Å; I411-E785 HydrophobicContact CD1-CB 4.22Å; I411-E785 HydrophobicContact CD1-CG 4.03Å; C781-E785 PolarHBondContact O-N 2.7Å; V782-E785 PolarHBondContact O-N 3.19Å; V782-E785 VanDerWaalsContact O-N 3.07Å; E785-S787 VanDerWaalsContact C-N 3.3Å; E785-S787 PolarHBondContact O-N 3.44Å; E785-V788 PolarHBondContact O-N 3.41Å; E785-I789 HydrophobicContact CG-CD1 3.94Å; E785-I789 HydrophobicContact CG-CG1 4.48Å; E785-I789 VanDerWaalsContact O-CG1 3.32Å; E785-I789 WeakPolarHBondContact O-CG1 3.32Å; E785-I789 PolarHBondContact O-N 2.93Å
786	V	93.6	Very high	91.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.4	-39.7	174.9	174	0	0	0	0	111.6	I411 L534 E743 V782 A783 V788 I789 T790	I411-V786 HydrophobicContact CD1-CG2 3.88Å; I411-V786 HydrophobicContact CG2-CG2 4.06Å; L534-V786 HydrophobicContact CB-CG1 4.49Å; L534-V786 HydrophobicContact CD1-CG1 3.67Å; L534-V786 HydrophobicContact CD2-CG1 3.66Å; L534-V786 HydrophobicContact CG-CG1 4.13Å; E743-V786 HydrophobicContact CG-CB 4.43Å; E743-V786 HydrophobicContact CG-CG1 4.01Å; V782-V786 HydrophobicContact CG1-CG2 4.24Å; V782-V786 WeakPolarHBondContact O-CG2 3.43Å; V782-V786 PolarHBondContact O-N 2.84Å; A783-V786 PolarHBondContact O-N 3.06Å; V786-V788 PolarHBondContact O-N 3.25Å; V786-I789 PolarHBondContact O-N 2.91Å; V786-T790 WeakPolarHBondContact O-CB 3.28Å; V786-T790 PolarHBondContact O-N 3.37Å; V786-T790 PolarHBondContact O-OG1 2.69Å
787	S	92.1	Very high	90.6	Very high	12 Å²	12	24.9 Å²	24.9	8%	0.084	13%	0.134	C	C	.	.	H	α-helix	trans	-64.5	-40	177.3	-164.9	0	0	0	0	112.2	E743 A783 H784 E785 N791	E743-S787 WeakPolarHBondContact OE1-CA 3.4Å; E743-S787 VanDerWaalsContact OE1-CB 3.27Å; E743-S787 WeakPolarHBondContact OE1-CB 3.29Å; E743-S787 PolarHBondContact OE1-OG 2.82Å; A783-S787 PolarHBondContact O-N 3.38Å; A783-S787 VanDerWaalsContact O-N 3.08Å; H784-S787 PolarHBondContact O-N 3.4Å; E785-S787 VanDerWaalsContact C-N 3.3Å; E785-S787 PolarHBondContact O-N 3.44Å; S787-N791 WeakPolarHBondContact O-CB 3.42Å; S787-N791 PolarHBondContact O-N 3.47Å; S787-N791 VanDerWaalsContact O-N 3.11Å; S787-N791 PolarHBondContact O-ND2 2.96Å
788	V	89.4	Confident	90.1	Very high	42 Å²	42	22.1 Å²	22.1	26%	0.255	12%	0.122	S	C	.	.	H	α-helix	trans	-63.7	-50.7	174.4	175.1	0	0	0	0	110.7	H784 E785 V786 T790 N791 D792	H784-V788 WeakPolarHBondContact O-CG2 3.39Å; H784-V788 PolarHBondContact O-N 3.39Å; E785-V788 PolarHBondContact O-N 3.41Å; V786-V788 PolarHBondContact O-N 3.25Å; V788-T790 VanDerWaalsContact C-N 3.3Å; V788-T790 PolarHBondContact O-N 3.2Å; V788-N791 PolarHBondContact O-N 3.03Å; V788-N791 VanDerWaalsContact O-N 3.11Å; V788-D792 PolarHBondContact O-N 2.88Å
789	I	90.3	Very high	89.6	Confident	1 Å²	1	23.1 Å²	23.1	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-56.4	-45.3	178.9	-69.7	165.4	0	0	0	111.2	A404 R407 M408 I411 E785 V786 N791 D792 L793	A404-I789 HydrophobicContact CB-CG1 4.45Å; A404-I789 HydrophobicContact CB-CG2 4.18Å; R407-I789 HydrophobicContact CB-CD1 3.77Å; M408-I789 HydrophobicContact CB-CD1 4.42Å; M408-I789 HydrophobicContact CB-CG2 4.32Å; M408-I789 HydrophobicContact CE-CG2 3.83Å; I411-I789 HydrophobicContact CD1-CD1 4.01Å; E785-I789 HydrophobicContact CG-CD1 3.94Å; E785-I789 HydrophobicContact CG-CG1 4.48Å; E785-I789 VanDerWaalsContact O-CG1 3.32Å; E785-I789 WeakPolarHBondContact O-CG1 3.32Å; E785-I789 PolarHBondContact O-N 2.93Å; V786-I789 PolarHBondContact O-N 2.91Å; I789-N791 VanDerWaalsContact C-N 3.3Å; I789-N791 PolarHBondContact O-N 2.77Å; I789-D792 PolarHBondContact O-N 3.25Å; I789-L793 HydrophobicContact CG2-CD1 3.68Å; I789-L793 HydrophobicContact CG2-CG 4.3Å; I789-L793 WeakPolarHBondContact O-CB 3.45Å; I789-L793 WeakPolarHBondContact O-CG 3.5Å; I789-L793 PolarHBondContact O-N 3.36Å
790	T	89.7	Confident	88.9	Confident	4 Å²	4	30.1 Å²	30.1	3%	0.025	16%	0.159	C	C	.	.	H	α-helix	trans	-62	-40.5	179.8	-58.6	0	0	0	0	111.3	R530 F533 V786 V788 A794	R530-T790 HydrophobicContact CG-CG2 4.46Å; F533-T790 HydrophobicContact CB-CG2 4.41Å; F533-T790 HydrophobicContact CD1-CG2 3.91Å; V786-T790 WeakPolarHBondContact O-CB 3.28Å; V786-T790 PolarHBondContact O-N 3.37Å; V786-T790 PolarHBondContact O-OG1 2.69Å; V788-T790 VanDerWaalsContact C-N 3.3Å; V788-T790 PolarHBondContact O-N 3.2Å; T790-A794 VanDerWaalsContact O-CB 3.24Å; T790-A794 WeakPolarHBondContact O-CB 3.25Å; T790-A794 PolarHBondContact O-N 3.23Å
791	N	87.3	Confident	88.4	Confident	46 Å²	46	33.6 Å²	33.6	25%	0.246	18%	0.177	C	C	.	.	H	α-helix	trans	-69.5	-40.4	178.2	-77.4	-48.9	0	0	0	113.1	R530 S787 V788 I789 Q795	R530-N791 PolarHBondContact NE-OD1 3.33Å; R530-N791 PolarHBondContact NH2-OD1 2.84Å; S787-N791 WeakPolarHBondContact O-CB 3.42Å; S787-N791 PolarHBondContact O-N 3.47Å; S787-N791 VanDerWaalsContact O-N 3.11Å; S787-N791 PolarHBondContact O-ND2 2.96Å; V788-N791 PolarHBondContact O-N 3.03Å; V788-N791 VanDerWaalsContact O-N 3.11Å; I789-N791 VanDerWaalsContact C-N 3.3Å; I789-N791 PolarHBondContact O-N 2.77Å; N791-Q795 WeakPolarHBondContact O-CG 3.31Å; N791-Q795 PolarHBondContact O-N 3.49Å
792	D	86.5	Confident	87.8	Confident	51 Å²	51	37 Å²	37	27%	0.273	19%	0.194	S	C	.	.	H	α-helix	trans	-66.4	-46.4	177.5	-70.2	-14.9	0	0	0	110.8	V788 I789 A794 Q795 V796	V788-D792 PolarHBondContact O-N 2.88Å; I789-D792 PolarHBondContact O-N 3.25Å; D792-A794 PolarHBondContact O-N 3.15Å; D792-Q795 PolarHBondContact O-N 3Å; D792-V796 PolarHBondContact O-N 3.12Å
793	L	86.4	Confident	87	Confident	9 Å²	9	41.8 Å²	41.8	5%	0.047	22%	0.217	C	C	.	.	H	α-helix	trans	-66.7	-35.5	178.1	-69.4	175.9	0	0	0	112.3	P401 A404 L405 F529 F533 I789 Q795 V796 V797	P401-L793 HydrophobicContact CB-CD2 4.23Å; A404-L793 HydrophobicContact CB-CD2 4.25Å; A404-L793 HydrophobicContact CB-CG 4.25Å; L405-L793 HydrophobicContact CD2-CD1 4.3Å; L405-L793 HydrophobicContact CG-CD2 4.45Å; F529-L793 HydrophobicContact CE1-CB 4.31Å; F529-L793 HydrophobicContact CZ-CB 4.13Å; F533-L793 HydrophobicContact CE1-CD1 3.85Å; F533-L793 HydrophobicContact CE2-CD1 4.12Å; F533-L793 HydrophobicContact CZ-CD1 3.34Å; I789-L793 HydrophobicContact CG2-CD1 3.68Å; I789-L793 HydrophobicContact CG2-CG 4.3Å; I789-L793 WeakPolarHBondContact O-CB 3.45Å; I789-L793 WeakPolarHBondContact O-CG 3.5Å; I789-L793 PolarHBondContact O-N 3.36Å; L793-Q795 VanDerWaalsContact C-N 3.26Å; L793-Q795 PolarHBondContact O-N 3.25Å; L793-V796 PolarHBondContact O-N 3.26Å; L793-V796 VanDerWaalsContact O-N 3.12Å; L793-V797 WeakPolarHBondContact O-CB 3.25Å; L793-V797 VanDerWaalsContact O-CG2 3.29Å; L793-V797 WeakPolarHBondContact O-CG2 3.34Å; L793-V797 PolarHBondContact O-N 3.22Å
794	A	85.8	Confident	86.2	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.008	23%	0.228	C	C	.	.	H	α-helix	trans	-59.3	-37.7	176.6	0	0	0	0	0	112.2	F529 T790 D792 V796 I798	F529-A794 HydrophobicContact CD1-CB 3.64Å; F529-A794 HydrophobicContact CE1-CB 3.81Å; T790-A794 VanDerWaalsContact O-CB 3.24Å; T790-A794 WeakPolarHBondContact O-CB 3.25Å; T790-A794 PolarHBondContact O-N 3.23Å; D792-A794 PolarHBondContact O-N 3.15Å; A794-V796 VanDerWaalsContact C-N 3.33Å; A794-I798 WeakPolarHBondContact O-CB 3.39Å; A794-I798 PolarHBondContact O-N 3.25Å
795	Q	83.1	Confident	85.7	Confident	92 Å²	92	42.4 Å²	42.4	43%	0.43	23%	0.225	S	C	.	.	H	α-helix	trans	-70.5	-29.9	178.4	-65.6	178.8	37	0	0	112.8	N791 D792 L793	N791-Q795 WeakPolarHBondContact O-CG 3.31Å; N791-Q795 PolarHBondContact O-N 3.49Å; D792-Q795 PolarHBondContact O-N 3Å; L793-Q795 VanDerWaalsContact C-N 3.26Å; L793-Q795 PolarHBondContact O-N 3.25Å
796	V	82.4	Confident	85	Confident	53 Å²	53	46.4 Å²	46.4	32%	0.321	25%	0.246	S	C	.	.	H	α-helix	trans	-85.1	-45.9	-179	177.6	0	0	0	0	111.4	P401 D792 L793 A794 R808	P401-V796 HydrophobicContact CB-CG1 4.28Å; P401-V796 HydrophobicContact CB-CG2 4.36Å; P401-V796 HydrophobicContact CG-CG1 4.44Å; D792-V796 PolarHBondContact O-N 3.12Å; L793-V796 PolarHBondContact O-N 3.26Å; L793-V796 VanDerWaalsContact O-N 3.12Å; A794-V796 VanDerWaalsContact C-N 3.33Å; V796-R808 PolarHBondContact O-NH1 3.22Å
797	V	82.2	Confident	84.4	Confident	48 Å²	48	53.7 Å²	53.7	29%	0.291	28%	0.278	S	S	.	.	H	α-helix	trans	-70.6	-38.3	-175	174.5	0	0	0	0	111	F529 L793 P799 R808	F529-V797 HydrophobicContact CD2-CG1 4.3Å; F529-V797 HydrophobicContact CE2-CB 4.15Å; F529-V797 HydrophobicContact CE2-CG1 3.94Å; F529-V797 HydrophobicContact CE2-CG2 4.22Å; F529-V797 HydrophobicContact CZ-CB 4.39Å; F529-V797 HydrophobicContact CZ-CG2 4.22Å; L793-V797 WeakPolarHBondContact O-CB 3.25Å; L793-V797 VanDerWaalsContact O-CG2 3.29Å; L793-V797 WeakPolarHBondContact O-CG2 3.34Å; L793-V797 PolarHBondContact O-N 3.22Å; V797-P799 WeakPolarHBondContact O-CD 3.25Å; V797-R808 PolarHBondContact O-NH1 3.3Å
798	I	85.3	Confident	84	Confident	8 Å²	8	58.4 Å²	58.4	4%	0.041	29%	0.294	C	S	.	.	S	Bend	trans	-105.1	96	-174.7	-54.7	176.6	0	0	0	109	Y522 C525 Q526 F529 A794 L805	Y522-I798 HydrophobicContact CD2-CG2 3.62Å; Y522-I798 HydrophobicContact CE2-CG2 3.74Å; Y522-I798 WeakPolarHBondContact CE2-O 3.38Å; C525-I798 VanDerWaalsContact C-CD1 3.49Å; C525-I798 HydrophobicContact CB-CD1 4.24Å; C525-I798 HydrophobicContact CB-CG2 4.15Å; C525-I798 VanDerWaalsContact O-CD1 3.25Å; C525-I798 WeakPolarHBondContact O-CD1 3.18Å; Q526-I798 HydrophobicContact CB-CD1 4.39Å; F529-I798 HydrophobicContact CB-CD1 3.47Å; F529-I798 VanDerWaalsContact CB-CD1 3.47Å; F529-I798 HydrophobicContact CD2-CD1 4.44Å; F529-I798 HydrophobicContact CG-CD1 3.92Å; A794-I798 WeakPolarHBondContact O-CB 3.39Å; A794-I798 PolarHBondContact O-N 3.25Å; I798-L805 HydrophobicContact CG2-CD1 3.8Å; I798-L805 HydrophobicContact CG2-CD2 4.41Å
799	P	83.4	Confident	83.5	Confident	21 Å²	21	59.1 Å²	59.1	14%	0.136	30%	0.296	C	S	.	.			trans	-70.4	147	176.9	30.9	-35.2	0	0	0	110.2	Y522 V797 D801 A804 L805	Y522-P799 VanDerWaalsContact CD2-O 3.27Å; Y522-P799 WeakPolarHBondContact CD2-O 3.2Å; V797-P799 WeakPolarHBondContact O-CD 3.25Å; P799-D801 PolarHBondContact O-N 2.77Å; P799-A804 HydrophobicContact CB-CB 4.11Å; P799-A804 HydrophobicContact CG-CB 3.78Å; P799-L805 HydrophobicContact CG-CB 3.97Å
800	K	81.4	Confident	82.7	Confident	150 Å²	150	61.3 Å²	61.3	65%	0.652	32%	0.318	S	S	*	.	S	Bend	trans	-65.6	-25.3	174.2	-69.7	-178.8	-179.8	176.3	0	113.1	Y522 N802	Y522-K800 HydrophobicContact CD2-CG 4.41Å; Y522-K800 HydrophobicContact CE1-CG 4.37Å; Y522-K800 HydrophobicContact CE2-CB 4.35Å; Y522-K800 HydrophobicContact CE2-CG 3.77Å; K800-N802 PolarHBondContact O-N 2.97Å
801	D	84.4	Confident	82	Confident	97 Å²	97	63.8 Å²	63.8	52%	0.519	34%	0.339	S	S	.	.	S	Bend	trans	-75	118.9	174.7	174.2	19.1	0	0	0	110.5	P799 M803 A804 L805	P799-D801 PolarHBondContact O-N 2.77Å; D801-M803 VanDerWaalsContact C-N 3.27Å; D801-M803 PolarHBondContact O-N 2.85Å; D801-M803 PolarHBondContact OD1-N 2.56Å; D801-A804 HydrophobicContact CB-CB 4.06Å; D801-A804 PolarHBondContact O-N 3.11Å; D801-A804 PolarHBondContact OD2-N 2.76Å; D801-L805 WeakPolarHBondContact O-CB 3.27Å; D801-L805 PolarHBondContact O-N 3.16Å
802	N	81.3	Confident	81.4	Confident	88 Å²	88	66.1 Å²	66.1	47%	0.471	35%	0.35	S	S	.	.	H	α-helix	trans	-61	-33.4	-179.4	-71.8	-29.6	0	0	0	112.6	K800 L805 L806	K800-N802 PolarHBondContact O-N 2.97Å; N802-L805 PolarHBondContact O-N 3.08Å; N802-L806 WeakPolarHBondContact O-CB 3.43Å; N802-L806 PolarHBondContact O-N 3.22Å
803	M	79.3	Confident	80.7	Confident	114 Å²	114	65.6 Å²	65.6	56%	0.562	36%	0.357	S	S	*	.	H	α-helix	trans	-72.1	-45.8	-179.8	-172.8	62.9	68.7	0	0	110.8	D801 L805 L806 K807	D801-M803 VanDerWaalsContact C-N 3.27Å; D801-M803 PolarHBondContact O-N 2.85Å; D801-M803 PolarHBondContact OD1-N 2.56Å; M803-L805 VanDerWaalsContact C-N 3.29Å; M803-L805 PolarHBondContact O-N 2.77Å; M803-L806 PolarHBondContact O-N 3.18Å; M803-K807 WeakPolarHBondContact O-CG 2.94Å; M803-K807 PolarHBondContact O-N 3.18Å
804	A	78.9	Confident	80	Confident	29 Å²	29	71.4 Å²	71.4	24%	0.24	38%	0.382	C	S	.	.	H	α-helix	trans	-60.8	-39.4	172.2	0	0	0	0	0	112	P799 D801 R808	P799-A804 HydrophobicContact CB-CB 4.11Å; P799-A804 HydrophobicContact CG-CB 3.78Å; D801-A804 HydrophobicContact CB-CB 4.06Å; D801-A804 PolarHBondContact O-N 3.11Å; D801-A804 PolarHBondContact OD2-N 2.76Å; A804-R808 WeakPolarHBondContact O-CG 3.31Å; A804-R808 PolarHBondContact O-N 3.11Å
805	L	82.9	Confident	79.3	Confident	4 Å²	4	75.4 Å²	75.4	2%	0.021	41%	0.406	C	S	.	.	H	α-helix	trans	-63	-48.1	176.7	178.6	60.9	0	0	0	111.1	L521 C525 I798 P799 D801 N802 M803 K807 R808 L809	L521-L805 HydrophobicContact CB-CD2 4.5Å; L521-L805 HydrophobicContact CD2-CD2 4.2Å; L521-L805 HydrophobicContact CG-CD2 4.03Å; C525-L805 HydrophobicContact CB-CD1 4.36Å; C525-L805 HydrophobicContact CB-CD2 4.3Å; I798-L805 HydrophobicContact CG2-CD1 3.8Å; I798-L805 HydrophobicContact CG2-CD2 4.41Å; P799-L805 HydrophobicContact CG-CB 3.97Å; D801-L805 WeakPolarHBondContact O-CB 3.27Å; D801-L805 PolarHBondContact O-N 3.16Å; N802-L805 PolarHBondContact O-N 3.08Å; M803-L805 VanDerWaalsContact C-N 3.29Å; M803-L805 PolarHBondContact O-N 2.77Å; L805-K807 VanDerWaalsContact C-N 3.34Å; L805-K807 PolarHBondContact O-N 3.09Å; L805-R808 PolarHBondContact O-N 3.3Å; L805-L809 HydrophobicContact CD1-CD1 4.06Å; L805-L809 HydrophobicContact CD1-CG 4.13Å; L805-L809 HydrophobicContact CG-CD1 3.87Å; L805-L809 HydrophobicContact CG-CG 4.37Å; L805-L809 WeakPolarHBondContact O-CB 3.35Å; L805-L809 VanDerWaalsContact O-CG 3.32Å; L805-L809 WeakPolarHBondContact O-CG 3.37Å; L805-L809 PolarHBondContact O-N 3.15Å
806	L	80.1	Confident	78.6	Confident	104 Å²	104	74.1 Å²	74.1	55%	0.545	41%	0.407	S	S	.	.	H	α-helix	trans	-63.5	-40.3	-179.8	-168.4	68.1	0	0	0	111.7	N802 M803 R808 L809 G810	N802-L806 WeakPolarHBondContact O-CB 3.43Å; N802-L806 PolarHBondContact O-N 3.22Å; M803-L806 PolarHBondContact O-N 3.18Å; L806-R808 PolarHBondContact O-N 3.43Å; L806-L809 PolarHBondContact O-N 3.41Å; L806-G810 PolarHBondContact O-N 2.85Å
807	K	81.1	Confident	77.8	Confident	153 Å²	153	76.1 Å²	76.1	67%	0.665	42%	0.416	S	S	*	.	H	α-helix	trans	-60	-44.5	173.5	-73.9	178.6	-179.4	-177.9	0	112	M803 L805 G810 A811	M803-K807 WeakPolarHBondContact O-CG 2.94Å; M803-K807 PolarHBondContact O-N 3.18Å; L805-K807 VanDerWaalsContact C-N 3.34Å; L805-K807 PolarHBondContact O-N 3.09Å; K807-G810 PolarHBondContact O-N 3.04Å; K807-A811 WeakPolarHBondContact O-CB 3.43Å; K807-A811 PolarHBondContact O-N 3.03Å
808	R	82	Confident	77.1	Confident	112 Å²	112	78.3 Å²	78.3	42%	0.423	43%	0.425	S	S	.	.	H	α-helix	trans	-67.7	-42.1	177.9	-72.2	179	-178.1	-166.4	0.5	112.5	V796 V797 A804 L805 L806 G810 A811 M812	V796-R808 PolarHBondContact O-NH1 3.22Å; V797-R808 PolarHBondContact O-NH1 3.3Å; A804-R808 WeakPolarHBondContact O-CG 3.31Å; A804-R808 PolarHBondContact O-N 3.11Å; L805-R808 PolarHBondContact O-N 3.3Å; L806-R808 PolarHBondContact O-N 3.43Å; R808-G810 VanDerWaalsContact C-N 3.35Å; R808-A811 PolarHBondContact O-N 2.59Å; R808-M812 WeakPolarHBondContact O-CG 3.44Å; R808-M812 PolarHBondContact O-N 3.5Å
809	L	79.2	Confident	76.2	Confident	57 Å²	57	81.5 Å²	81.5	30%	0.298	45%	0.445	S	S	.	.	H	α-helix	trans	-63	-42.3	174.5	-71.4	170.5	0	0	0	111.3	L521 L805 L806 M812 G813	L521-L809 HydrophobicContact CD2-CD1 4.26Å; L805-L809 HydrophobicContact CD1-CD1 4.06Å; L805-L809 HydrophobicContact CD1-CG 4.13Å; L805-L809 HydrophobicContact CG-CD1 3.87Å; L805-L809 HydrophobicContact CG-CG 4.37Å; L805-L809 WeakPolarHBondContact O-CB 3.35Å; L805-L809 VanDerWaalsContact O-CG 3.32Å; L805-L809 WeakPolarHBondContact O-CG 3.37Å; L805-L809 PolarHBondContact O-N 3.15Å; L806-L809 PolarHBondContact O-N 3.41Å; L809-M812 HydrophobicContact CD2-CE 3.79Å; L809-M812 PolarHBondContact O-N 3.26Å; L809-G813 PolarHBondContact O-N 3Å
810	G	73.5	Confident	75.3	Confident	46 Å²	46	83.3 Å²	83.3	47%	0.474	45%	0.453	S	S	.	.	H	α-helix	trans	-61.3	-44.5	174.5	0	0	0	0	0	112.2	L806 K807 R808 G813 F814	L806-G810 PolarHBondContact O-N 2.85Å; K807-G810 PolarHBondContact O-N 3.04Å; R808-G810 VanDerWaalsContact C-N 3.35Å; G810-G813 PolarHBondContact O-N 3.16Å; G810-F814 VanDerWaalsContact O-CB 3.3Å; G810-F814 WeakPolarHBondContact O-CB 3.39Å; G810-F814 PolarHBondContact O-N 3.4Å
811	A	74.9	Confident	74.2	Confident	56 Å²	56	79.8 Å²	79.8	46%	0.463	44%	0.44	S	S	.	.	H	α-helix	trans	-62.9	-46.5	175.5	0	0	0	0	0	112.3	K807 R808 F814 V815	K807-A811 WeakPolarHBondContact O-CB 3.43Å; K807-A811 PolarHBondContact O-N 3.03Å; R808-A811 PolarHBondContact O-N 2.59Å; A811-F814 PolarHBondContact O-N 3.41Å; A811-V815 WeakPolarHBondContact O-CG2 3.49Å; A811-V815 PolarHBondContact O-N 2.78Å
812	M	75.3	Confident	72.9	Confident	96 Å²	96	78.1 Å²	78.1	47%	0.473	44%	0.435	S	S	.	.	H	α-helix	trans	-64.1	-40.3	176.4	-72.1	-171.9	-59.8	0	0	112.2	R808 L809 S816	R808-M812 WeakPolarHBondContact O-CG 3.44Å; R808-M812 PolarHBondContact O-N 3.5Å; L809-M812 HydrophobicContact CD2-CE 3.79Å; L809-M812 PolarHBondContact O-N 3.26Å; M812-S816 VanDerWaalsContact O-CB 3.3Å; M812-S816 WeakPolarHBondContact O-CB 3.36Å; M812-S816 PolarHBondContact O-N 3.41Å; M812-S816 PolarHBondContact O-OG 3.07Å
813	G	71.8	Confident	71.7	Confident	40 Å²	40	79 Å²	79	41%	0.412	44%	0.437	S	S	.	.	H	α-helix	trans	-63.5	-43.2	175.8	0	0	0	0	0	111.6	L809 G810 S816 L817	L809-G813 PolarHBondContact O-N 3Å; G810-G813 PolarHBondContact O-N 3.16Å; G813-S816 PolarHBondContact O-N 2.91Å; G813-L817 WeakPolarHBondContact O-CB 3.28Å; G813-L817 PolarHBondContact O-N 2.96Å
814	F	71.9	Confident	70.5	Confident	131 Å²	131	78.9 Å²	78.9	58%	0.575	44%	0.438	S	S	*	.	H	α-helix	trans	-63.9	-46.9	176.8	-176.9	-105.2	0	0	0	112.2	G810 A811 S816 L817 L818	G810-F814 VanDerWaalsContact O-CB 3.3Å; G810-F814 WeakPolarHBondContact O-CB 3.39Å; G810-F814 PolarHBondContact O-N 3.4Å; A811-F814 PolarHBondContact O-N 3.41Å; F814-S816 PolarHBondContact O-N 3.28Å; F814-L817 PolarHBondContact O-N 3.37Å; F814-L818 HydrophobicContact CD1-CD1 3.75Å; F814-L818 HydrophobicContact CD1-CG 4.4Å; F814-L818 HydrophobicContact CE1-CD1 3.33Å; F814-L818 HydrophobicContact CE1-CG 4.13Å; F814-L818 HydrophobicContact CZ-CD1 3.79Å; F814-L818 HydrophobicContact CZ-CD2 4.37Å; F814-L818 HydrophobicContact CZ-CG 4.21Å; F814-L818 WeakPolarHBondContact O-CG 3.2Å; F814-L818 PolarHBondContact O-N 2.98Å
815	V	71.1	Confident	68.8	Low	84 Å²	84	84.3 Å²	84.3	51%	0.509	46%	0.462	S	S	.	.	H	α-helix	trans	-61.6	-44	175.3	172.2	0	0	0	0	111.2	A811 L817 L818 V819	A811-V815 WeakPolarHBondContact O-CG2 3.49Å; A811-V815 PolarHBondContact O-N 2.78Å; V815-L817 VanDerWaalsContact C-N 3.32Å; V815-L817 PolarHBondContact O-N 2.81Å; V815-L818 PolarHBondContact O-N 3.04Å; V815-V819 HydrophobicContact CG1-CG2 4.47Å; V815-V819 WeakPolarHBondContact O-CG2 3.5Å; V815-V819 PolarHBondContact O-N 2.91Å
816	S	68.1	Low	66.8	Low	65 Å²	65	88.7 Å²	88.7	46%	0.455	49%	0.489	S	S	.	.	H	α-helix	trans	-62.7	-41	177.7	-56.5	0	0	0	0	111.5	M812 G813 F814 V819 L820	M812-S816 VanDerWaalsContact O-CB 3.3Å; M812-S816 WeakPolarHBondContact O-CB 3.36Å; M812-S816 PolarHBondContact O-N 3.41Å; M812-S816 PolarHBondContact O-OG 3.07Å; G813-S816 PolarHBondContact O-N 2.91Å; F814-S816 PolarHBondContact O-N 3.28Å; S816-V819 PolarHBondContact O-N 3.05Å; S816-L820 WeakPolarHBondContact O-CB 3.3Å; S816-L820 WeakPolarHBondContact O-CD1 3.29Å; S816-L820 PolarHBondContact O-N 3.22Å
817	L	66.6	Low	64.6	Low	96 Å²	96	89.4 Å²	89.4	50%	0.503	50%	0.5	S	S	.	.	H	α-helix	trans	-64.1	-43.5	176.1	-161.3	94.1	0	0	0	111.3	G813 F814 V815 L820 M821	G813-L817 WeakPolarHBondContact O-CB 3.28Å; G813-L817 PolarHBondContact O-N 2.96Å; F814-L817 PolarHBondContact O-N 3.37Å; V815-L817 VanDerWaalsContact C-N 3.32Å; V815-L817 PolarHBondContact O-N 2.81Å; L817-L820 PolarHBondContact O-N 2.94Å; L817-M821 HydrophobicContact CG-CE 4.49Å; L817-M821 WeakPolarHBondContact O-CB 3.47Å; L817-M821 WeakPolarHBondContact O-CG 3.39Å; L817-M821 PolarHBondContact O-N 2.97Å
818	L	66.4	Low	62.4	Low	93 Å²	93	85.9 Å²	85.9	49%	0.487	51%	0.507	S	S	.	.	H	α-helix	trans	-62.1	-43.2	176.3	-74.7	175.5	0	0	0	112	F814 V815 M821 S822	F814-L818 HydrophobicContact CD1-CD1 3.75Å; F814-L818 HydrophobicContact CD1-CG 4.4Å; F814-L818 HydrophobicContact CE1-CD1 3.33Å; F814-L818 HydrophobicContact CE1-CG 4.13Å; F814-L818 HydrophobicContact CZ-CD1 3.79Å; F814-L818 HydrophobicContact CZ-CD2 4.37Å; F814-L818 HydrophobicContact CZ-CG 4.21Å; F814-L818 WeakPolarHBondContact O-CG 3.2Å; F814-L818 PolarHBondContact O-N 2.98Å; V815-L818 PolarHBondContact O-N 3.04Å; L818-M821 PolarHBondContact O-N 3.47Å; L818-S822 WeakPolarHBondContact O-CB 3.36Å; L818-S822 PolarHBondContact O-N 3.02Å; L818-S822 PolarHBondContact O-OG 3.45Å
819	V	65.9	Low	60	Low	76 Å²	76	90.7 Å²	90.7	46%	0.461	55%	0.55	S	S	.	.	H	α-helix	trans	-64.2	-45.3	175.3	173	0	0	0	0	110.6	V815 S816 M821 S822 Q823	V815-V819 HydrophobicContact CG1-CG2 4.47Å; V815-V819 WeakPolarHBondContact O-CG2 3.5Å; V815-V819 PolarHBondContact O-N 2.91Å; S816-V819 PolarHBondContact O-N 3.05Å; V819-M821 PolarHBondContact O-N 2.83Å; V819-S822 PolarHBondContact O-N 2.82Å; V819-S822 PolarHBondContact O-OG 2.65Å; V819-Q823 PolarHBondContact O-N 3.33Å; V819-Q823 VanDerWaalsContact O-N 3.12Å
820	L	64.9	Low	59	Low	58 Å²	58	92.4 Å²	92.4	30%	0.304	56%	0.562	S	S	.	*	H	α-helix	trans	-60.6	-42	176.1	-104.4	124.7	0	0	0	112.5	W615 S816 L817 Q823 L824	W615-L820 HydrophobicContact CZ2-CD2 3.69Å; S816-L820 WeakPolarHBondContact O-CB 3.3Å; S816-L820 WeakPolarHBondContact O-CD1 3.29Å; S816-L820 PolarHBondContact O-N 3.22Å; L817-L820 PolarHBondContact O-N 2.94Å; L820-Q823 PolarHBondContact O-N 2.55Å; L820-L824 PolarHBondContact O-N 2.99Å
821	M	58.5	Low	58.3	Low	77 Å²	77	94.8 Å²	94.8	38%	0.379	57%	0.567	S	S	.	*	H	α-helix	trans	-69	-36.3	177.1	-69.7	-63.3	167.3	0	0	111.7	W615 L817 L818 V819 Q823 L824 L825	W615-M821 HydrophobicContact CH2-CE 3.72Å; W615-M821 HydrophobicContact CZ3-CE 4.45Å; L817-M821 HydrophobicContact CG-CE 4.49Å; L817-M821 WeakPolarHBondContact O-CB 3.47Å; L817-M821 WeakPolarHBondContact O-CG 3.39Å; L817-M821 PolarHBondContact O-N 2.97Å; L818-M821 PolarHBondContact O-N 3.47Å; V819-M821 PolarHBondContact O-N 2.83Å; M821-Q823 VanDerWaalsContact C-N 3.29Å; M821-Q823 PolarHBondContact O-N 3.37Å; M821-L824 WeakPolarHBondContact O-CB 3.32Å; M821-L824 PolarHBondContact O-N 3.18Å; M821-L824 VanDerWaalsContact O-N 3.15Å; M821-L824 HydrophobicContact SD-CD1 4.15Å; M821-L825 WeakPolarHBondContact O-CD1 3.3Å; M821-L825 PolarHBondContact O-N 2.78Å; M821-L825 VanDerWaalsContact O-N 3.13Å
822	S	56.9	Low	57.3	Low	61 Å²	61	97 Å²	97	43%	0.427	57%	0.572	S	S	.	*	H	α-helix	trans	-64.3	-33.1	175.7	73.9	0	0	0	0	113	L818 V819 L825 T826	L818-S822 WeakPolarHBondContact O-CB 3.36Å; L818-S822 PolarHBondContact O-N 3.02Å; L818-S822 PolarHBondContact O-OG 3.45Å; V819-S822 PolarHBondContact O-N 2.82Å; V819-S822 PolarHBondContact O-OG 2.65Å; S822-L825 PolarHBondContact O-N 2.75Å; S822-T826 PolarHBondContact O-N 2.86Å
823	Q	56.3	Low	56.3	Low	108 Å²	108	97.1 Å²	97.1	51%	0.505	58%	0.578	S	S	.	*	H	α-helix	trans	-73.5	-25.1	174.2	-70.7	-176.9	-16.5	0	0	113.2	V819 L820 M821 T826	V819-Q823 PolarHBondContact O-N 3.33Å; V819-Q823 VanDerWaalsContact O-N 3.12Å; L820-Q823 PolarHBondContact O-N 2.55Å; M821-Q823 VanDerWaalsContact C-N 3.29Å; M821-Q823 PolarHBondContact O-N 3.37Å; Q823-T826 PolarHBondContact O-OG1 2.85Å
824	L	54.1	Low	55.3	Low	111 Å²	111	100.6 Å²	100.6	58%	0.581	59%	0.589	S	S	*	*	H	α-helix	trans	-75	-26.9	171.2	-92.9	144.7	0	0	0	112.6	W615 L820 M821	W615-L824 HydrophobicContact CH2-CD1 4.07Å; W615-L824 HydrophobicContact CZ2-CD1 3.5Å; L820-L824 PolarHBondContact O-N 2.99Å; M821-L824 WeakPolarHBondContact O-CB 3.32Å; M821-L824 PolarHBondContact O-N 3.18Å; M821-L824 VanDerWaalsContact O-N 3.15Å; M821-L824 HydrophobicContact SD-CD1 4.15Å
825	L	44	Very low	54.2	Low	143 Å²	143	98.6 Å²	98.6	75%	0.749	59%	0.59	S	S	*	*	H	α-helix	trans	-87	-11.1	-179.7	-85	148	0	0	0	113.7	M821 S822 P827	M821-L825 WeakPolarHBondContact O-CD1 3.3Å; M821-L825 PolarHBondContact O-N 2.78Å; M821-L825 VanDerWaalsContact O-N 3.13Å; S822-L825 PolarHBondContact O-N 2.75Å; L825-P827 WeakPolarHBondContact O-CD 3.2Å
826	T	41.2	Very low	53	Low	95 Å²	95	99.6 Å²	99.6	58%	0.583	60%	0.595	S	S	*	*	S	Bend	trans	-83.4	107.2	167.1	44.4	0	0	0	0	109.1	S822 Q823 G828	S822-T826 PolarHBondContact O-N 2.86Å; Q823-T826 PolarHBondContact O-OG1 2.85Å; T826-G828 PolarHBondContact O-N 2.87Å
827	P	34.2	Very low	51.8	Low	119 Å²	119	102.3 Å²	102.3	77%	0.773	61%	0.606	S	S	*	*			trans	-60.8	126.5	174.3	24.4	-30.8	0	0	0	108.7	L825 T829	L825-P827 WeakPolarHBondContact O-CD 3.2Å; P827-T829 PolarHBondContact O-N 3.45Å
828	G	34.3	Very low	50.6	Low	80 Å²	80	102.8 Å²	102.8	83%	0.825	62%	0.615	S	S	*	*			trans	-59.6	123.1	178.3	0	0	0	0	0	110.7	T826	T826-G828 PolarHBondContact O-N 2.87Å
829	T	30.6	Very low	49.2	Very low	213 Å²	213	103.7 Å²	103.7	100%	1.307	63%	0.627	S	S	*	*			trans	-81.2	0	157.8	50.3	0	0	0	0	110.2	P827	P827-T829 PolarHBondContact O-N 3.45Å

Retrieved 829 of 829 residues in 943.8 ms (Link to these results)

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