G4VTF6_SCHMA Loading...

Putative translation elongation factor G

AlphaFold DB , UniProt , Accession G4VTF6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 911 aa.

						>G4VTF6_SCHMA|G4VTF6
MLIHRNLRVLRSFKWFDLLNLKCDYKRYRYAHTHAQHIDSNLKAKISVNDPPIATIRNVGLIAHIDAGKTTTTERMLYYARRIHYLGEVDNGDTVTDYLPEERERGISIVTASASLSWRNHIIHLLDTPGHVDFTFEVERSLTVLDSVVVILDAVKGVQPQTHTVCRQAHRYCLPCVIYINKMDRPMANVDLCLHSLSNQLPTKAHYIPIHWPVFSHSLNTDNTSSLVNASNTSTSLSNKYHVKNNGTSQFVGLVDLTTMQLKNWISCNGPDDVYTSSDLFEGINTTTVSNCSQPPKSKSSIENTLNPSGIQEALSARMQLLSTLAEIDDEFADEFLQLDRPDLLVPSDIVHKSLKKAILSSQVIPVLVGSSRKNIGIQPLLDFIVDYLPDPSHSNIPISILKVYKSLKSTLPNPSDLLKASGDLDNHRNILSSNFPLMLVFRICFDPHRGPLTLVRLYSGLITPGSQIANWSRYKDINLPEKILNVFQLNGDSLEVVNSAGPGSIIALSGLQSTYTGDILGPVLNSTKSRQAENSKGTGLNDTEEMFDNGSESPSIFQVSEPVVYAAVEPGSRSEINALEHALNCMQREDPSFHVKFDGETGQWIISGMGDLHLDVILSRLKREYKVNVRMGPLLIAYKECPPQDAPSSSGWSRVVGYINGSEKAVAIGVILQPKTMHPLHKPQVIFDRLADHKIVRIRHAITEACLSALEVSGPILRSPIIGVDIHINSIVCGRVEHISNDSGCINDLGDLTLDKLSNTQLSSPSLLALLKTCCISSVKNAVSKIPNWHVMEPMMEIELQLPALKGYDSELSTFLCDLTNRRAEIISVDNAETSANCEDDNRIGVGKYHRICAITPLSELTDYSATIRRLSSGRAEFSIRLSNYHPVSSEQQAKLIDQYRWNRSGSTLH
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.5	Very low	33.1	Very low	248 Å²	248	196 Å²	196	100%	1.222	92%	0.923	S	S	*	*				0	25.5	0	-98.2	-174.4	-167.5	0	0	114
2	L	36.1	Very low	32.9	Very low	173 Å²	173	188.1 Å²	188.1	91%	0.906	91%	0.905	S	S	*	*			trans	-134.1	17.4	176.3	-109.8	139.1	0	0	0	113.5
3	I	38.2	Very low	32.7	Very low	167 Å²	167	188.5 Å²	188.5	86%	0.856	90%	0.9	S	S	*	*			trans	-103.9	9.9	-169.8	-61.9	173.1	0	0	0	113.4
4	H	35.3	Very low	32.8	Very low	191 Å²	191	188.1 Å²	188.1	88%	0.884	89%	0.893	S	S	*	*			trans	-112.8	89.6	176.3	-91.1	-45.2	0	0	0	112
5	R	34.5	Very low	32.7	Very low	237 Å²	237	191.5 Å²	191.5	89%	0.894	89%	0.894	S	S	*	*	S	Bend	trans	-164.7	-11	150.3	-122.4	169	161.6	163.6	-6.2	121.6
6	N	36.3	Very low	32.8	Very low	167 Å²	167	190.8 Å²	190.8	89%	0.893	89%	0.887	S	S	*	*			trans	-116.2	17.5	-167.7	-77.4	-11.7	0	0	0	118.5	R8	N6-R8 PolarHBondContact O-N 3.28Å
7	L	28.9	Very low	33.2	Very low	181 Å²	181	185.6 Å²	185.6	95%	0.948	87%	0.868	S	S	*	*			trans	-94.5	85.7	171	-91.9	142.2	0	0	0	111
8	R	29	Very low	33.3	Very low	242 Å²	242	182.1 Å²	182.1	91%	0.913	86%	0.855	S	S	*	*			trans	-155.5	42.9	171.7	-130	-173.4	-159.2	-176.9	5.4	115.5	N6	N6-R8 PolarHBondContact O-N 3.28Å
9	V	33.9	Very low	33.5	Very low	139 Å²	139	178.9 Å²	178.9	84%	0.842	84%	0.843	S	S	*	*			trans	-148.5	142.1	163.1	-171.1	0	0	0	0	107.8
10	L	29.2	Very low	33.8	Very low	165 Å²	165	176.1 Å²	176.1	86%	0.864	83%	0.834	S	S	*	*			trans	99.7	74.4	-177.3	-55.7	165.8	0	0	0	115.4
11	R	27.7	Very low	34.1	Very low	246 Å²	246	173.6 Å²	173.6	93%	0.928	83%	0.825	S	S	*	*			trans	-78.4	111.9	150.4	-87.4	178.2	165.2	172.8	-4.7	108
12	S	31.2	Very low	34.1	Very low	101 Å²	101	169.2 Å²	169.2	71%	0.706	80%	0.799	S	S	*	*			trans	152.5	75.3	147.7	58.9	0	0	0	0	111.2
13	F	30.3	Very low	34.1	Very low	193 Å²	193	165.1 Å²	165.1	85%	0.846	78%	0.784	S	S	*	*			trans	-140.2	137.3	162.9	-97.1	-83.7	0	0	0	111
14	K	34.6	Very low	34.4	Very low	184 Å²	184	161.5 Å²	161.5	80%	0.8	77%	0.767	S	S	*	*			trans	-59.1	143.5	-174	-74.2	173.3	173.6	175.7	0	111.2	F16	K14-F16 PolarHBondContact O-N 3.35Å
15	W	30.1	Very low	34.6	Very low	239 Å²	239	160.4 Å²	160.4	91%	0.905	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	4.3	-172.8	-113.7	37.8	0	0	0	116.5
16	F	35.6	Very low	34.7	Very low	179 Å²	179	157.3 Å²	157.3	79%	0.785	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	-24.2	-172.8	-115.6	-94.3	0	0	0	114.8	K14 L18	K14-F16 PolarHBondContact O-N 3.35Å; F16-L18 VanDerWaalsContact C-N 3.34Å; F16-L18 PolarHBondContact O-N 3.42Å
17	D	38.9	Very low	34.8	Very low	104 Å²	104	158.7 Å²	158.7	56%	0.556	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	-11.7	-176.6	-64.1	-34.8	0	0	0	114.1	L19	D17-L19 VanDerWaalsContact C-N 3.32Å; D17-L19 PolarHBondContact O-N 3.28Å
18	L	36	Very low	35.3	Very low	122 Å²	122	158.5 Å²	158.5	64%	0.639	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-10.5	-178.4	-107.2	151.5	0	0	0	114.2	F16	F16-L18 VanDerWaalsContact C-N 3.34Å; F16-L18 PolarHBondContact O-N 3.42Å
19	L	35.7	Very low	35.5	Very low	121 Å²	121	155.4 Å²	155.4	63%	0.634	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-31.8	177.5	-93.9	146.3	0	0	0	112.8	D17 K22	D17-L19 VanDerWaalsContact C-N 3.32Å; D17-L19 PolarHBondContact O-N 3.28Å; L19-K22 PolarHBondContact O-N 3.11Å
20	N	40.6	Very low	35.6	Very low	122 Å²	122	157.4 Å²	157.4	65%	0.652	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-33	176.7	-78.5	-16.6	0	0	0	112.7	K22 C23	N20-K22 PolarHBondContact O-N 3.28Å; N20-C23 PolarHBondContact O-N 3.38Å
21	L	38.9	Very low	36.1	Very low	125 Å²	125	152.6 Å²	152.6	65%	0.654	70%	0.695	S	S	*	*	H	α-helix	trans	-67.4	-18.3	173.8	-91.8	128.6	0	0	0	114.3
22	K	35.3	Very low	36.7	Very low	156 Å²	156	146.1 Å²	146.1	68%	0.678	68%	0.675	S	S	*	*	H	α-helix	trans	-79.5	-20.6	174.2	-92.8	-178	175.7	177	0	113.3	L19 N20	L19-K22 PolarHBondContact O-N 3.11Å; N20-K22 PolarHBondContact O-N 3.28Å
23	C	36.7	Very low	37	Very low	87 Å²	87	145.3 Å²	145.3	59%	0.588	67%	0.666	S	S	*	*	H	α-helix	trans	-79.8	-36.9	176.3	-71.8	0	0	0	0	111.8	N20 K26 R27	N20-C23 PolarHBondContact O-N 3.38Å; C23-K26 PolarHBondContact O-N 3.01Å; C23-R27 PolarHBondContact O-N 3.28Å
24	D	43.9	Very low	37.2	Very low	91 Å²	91	143.1 Å²	143.1	49%	0.487	66%	0.658	S	S	.	*	H	α-helix	trans	-72.7	-29.2	177.8	-76.6	-29.8	0	0	0	113.7	K26 R27 Y28	D24-K26 VanDerWaalsContact C-N 3.31Å; D24-K26 PolarHBondContact O-N 2.88Å; D24-R27 PolarHBondContact O-N 3.15Å; D24-Y28 PolarHBondContact O-N 2.82Å; D24-Y28 VanDerWaalsContact O-N 3.08Å
25	Y	38.7	Very low	37.4	Very low	168 Å²	168	136.9 Å²	136.9	66%	0.659	64%	0.641	S	S	*	*	H	α-helix	trans	-72.6	-22.7	177.2	-142.5	-93	0	0	0	113.4	R29	Y25-R29 PolarHBondContact O-N 3.33Å
26	K	37.3	Very low	37.6	Very low	172 Å²	172	132.4 Å²	132.4	75%	0.748	63%	0.63	S	S	*	*	H	α-helix	trans	-80.1	-34.8	170.7	-88.2	-173.8	175.7	-177.6	0	112.1	C23 D24 Y28 R29 Y30	C23-K26 PolarHBondContact O-N 3.01Å; D24-K26 VanDerWaalsContact C-N 3.31Å; D24-K26 PolarHBondContact O-N 2.88Å; K26-Y28 VanDerWaalsContact C-N 3.34Å; K26-R29 PolarHBondContact O-N 3.35Å; K26-Y30 PolarHBondContact O-N 2.82Å
27	R	38.8	Very low	37.6	Very low	196 Å²	196	132.2 Å²	132.2	74%	0.74	63%	0.631	S	S	*	*	H	α-helix	trans	-60.1	-42.5	171.6	-86	179.5	169.1	172.1	-6.4	111.7	C23 D24 R29	C23-R27 PolarHBondContact O-N 3.28Å; D24-R27 PolarHBondContact O-N 3.15Å; R27-R29 PolarHBondContact O-N 2.68Å
28	Y	39.4	Very low	37.5	Very low	177 Å²	177	133.1 Å²	133.1	69%	0.694	64%	0.635	S	S	*	*	H	α-helix	trans	-70.6	-31.8	-179.8	-119.3	-93.3	0	0	0	114.3	D24 K26 H32	D24-Y28 PolarHBondContact O-N 2.82Å; D24-Y28 VanDerWaalsContact O-N 3.08Å; K26-Y28 VanDerWaalsContact C-N 3.34Å; Y28-H32 PolarHBondContact O-N 3Å
29	R	33.3	Very low	37.5	Very low	177 Å²	177	130.8 Å²	130.8	67%	0.668	62%	0.623	S	S	*	*	H	α-helix	trans	-85.1	-25.3	-173.2	-145.4	173.3	-174.7	149.4	0.4	114	Y25 K26 R27 T33	Y25-R29 PolarHBondContact O-N 3.33Å; K26-R29 PolarHBondContact O-N 3.35Å; R27-R29 PolarHBondContact O-N 2.68Å; R29-T33 PolarHBondContact O-OG1 2.88Å
30	Y	36.1	Very low	37.4	Very low	181 Å²	181	129.7 Å²	129.7	71%	0.71	63%	0.626	S	S	*	*	H	α-helix	trans	-77.5	-36.4	173.2	-119.9	-90.8	0	0	0	112.1	K26	K26-Y30 PolarHBondContact O-N 2.82Å
31	A	39.9	Very low	37	Very low	63 Å²	63	130.8 Å²	130.8	52%	0.521	63%	0.632	S	S	.	*	H	α-helix	trans	-65.7	-37.1	174.2	0	0	0	0	0	112.5	A35	A31-A35 WeakPolarHBondContact O-CB 3.28Å; A31-A35 PolarHBondContact O-N 2.75Å
32	H	38.7	Very low	37	Very low	111 Å²	111	131.5 Å²	131.5	51%	0.514	64%	0.635	S	S	.	*	H	α-helix	trans	-79.3	-19.6	-177.9	-102.7	43.9	0	0	0	115.7	Y28 Q36	Y28-H32 PolarHBondContact O-N 3Å; H32-Q36 WeakPolarHBondContact O-CG 3.03Å
33	T	37.5	Very low	36.8	Very low	83 Å²	83	131.2 Å²	131.2	51%	0.509	63%	0.634	S	S	.	*	H	α-helix	trans	-95	-18.8	-177.7	38.2	0	0	0	0	114.1	R29	R29-T33 PolarHBondContact O-OG1 2.88Å
34	H	35.7	Very low	36.3	Very low	147 Å²	147	130.3 Å²	130.3	68%	0.681	63%	0.633	S	S	*	*	H	α-helix	trans	-97.9	-19.8	169.3	-85.7	-5.6	0	0	0	114.2	Q36	H34-Q36 VanDerWaalsContact C-N 3.28Å; H34-Q36 PolarHBondContact O-N 3.23Å
35	A	38.9	Very low	35.5	Very low	54 Å²	54	134.9 Å²	134.9	45%	0.446	65%	0.648	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.6	-18.4	173.3	0	0	0	0	0	113.9	A31 D39	A31-A35 WeakPolarHBondContact O-CB 3.28Å; A31-A35 PolarHBondContact O-N 2.75Å; A35-D39 WeakPolarHBondContact O-CB 3.05Å
36	Q	34.4	Very low	35.1	Very low	144 Å²	144	134 Å²	134	67%	0.673	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-6.1	-173.3	-74.2	-174	-15.6	0	0	115.7	H32 H34	H32-Q36 WeakPolarHBondContact O-CG 3.03Å; H34-Q36 VanDerWaalsContact C-N 3.28Å; H34-Q36 PolarHBondContact O-N 3.23Å
37	H	34.5	Very low	34.6	Very low	175 Å²	175	130.5 Å²	130.5	81%	0.81	65%	0.651	S	S	*	*	S	Bend	trans	-116.6	-0.3	-176.3	-90.5	-74.2	0	0	0	116.1
38	I	36.7	Very low	34.6	Very low	124 Å²	124	124.6 Å²	124.6	64%	0.636	64%	0.636	S	S	*	*	S	Bend	trans	-110.8	-5.4	175.8	-65	170.8	0	0	0	111.8	S40 L42	I38-S40 PolarHBondContact O-N 3.24Å; I38-L42 HydrophobicContact CG2-CD1 4.01Å
39	D	36.2	Very low	34.9	Very low	72 Å²	72	123.4 Å²	123.4	39%	0.385	64%	0.642	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.3	25	-156.9	-145.7	17	0	0	0	115.4	A35 K43	A35-D39 WeakPolarHBondContact O-CB 3.05Å; D39-K43 VanDerWaalsContact CG-CE 3.49Å; D39-K43 WeakPolarHBondContact OD1-CE 3.25Å; D39-K43 IonicContact OD1-NZ 3.84Å; D39-K43 WeakPolarHBondContact OD2-CE 3.22Å; D39-K43 IonicContact OD2-NZ 2.68Å; D39-K43 PolarHBondContact OD2-NZ 2.96Å
40	S	33.9	Very low	36.1	Very low	99 Å²	99	117.9 Å²	117.9	69%	0.692	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.7	-17.7	175.5	53.2	0	0	0	0	114.5	I38	I38-S40 PolarHBondContact O-N 3.24Å
41	N	32.5	Very low	37.6	Very low	144 Å²	144	111 Å²	111	77%	0.77	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.7	-10.3	178	-77.1	-27.8	0	0	0	114.6
42	L	38.1	Very low	39.4	Very low	140 Å²	140	112.1 Å²	112.1	73%	0.733	61%	0.605	S	S	*	*	S	Bend	trans	-95.8	-13.7	173	-95.1	141.1	0	0	0	113.7	I38 A44	I38-L42 HydrophobicContact CG2-CD1 4.01Å; L42-A44 PolarHBondContact O-N 3.19Å
43	K	30.7	Very low	41.6	Very low	150 Å²	150	109.2 Å²	109.2	65%	0.652	59%	0.593	S	S	*	*	S	Bend	trans	-78	2.1	168	-77.4	-178.1	-179.2	155.4	0	113.8	D39	D39-K43 VanDerWaalsContact CG-CE 3.49Å; D39-K43 WeakPolarHBondContact OD1-CE 3.25Å; D39-K43 IonicContact OD1-NZ 3.84Å; D39-K43 WeakPolarHBondContact OD2-CE 3.22Å; D39-K43 IonicContact OD2-NZ 2.68Å; D39-K43 PolarHBondContact OD2-NZ 2.96Å
44	A	26.9	Very low	43.9	Very low	68 Å²	68	107.7 Å²	107.7	56%	0.562	59%	0.589	S	S	*	*	S	Bend	trans	-91.2	110.9	176	0	0	0	0	0	110.4	L42	L42-A44 PolarHBondContact O-N 3.19Å
45	K	26.6	Very low	46.5	Very low	187 Å²	187	102 Å²	102	81%	0.813	57%	0.565	S	S	*	*	S	Bend	trans	80.3	55.1	167.9	-62.8	180	172.7	178.2	0	118.5
46	I	31.7	Very low	49	Very low	150 Å²	150	99.7 Å²	99.7	77%	0.769	54%	0.544	S	S	*	.			trans	-116.1	58.3	132.4	-61.8	175.2	0	0	0	106.7	V48	I46-V48 HydrophobicContact CB-CG2 3.94Å; I46-V48 HydrophobicContact CG1-CG2 4.18Å; I46-V48 HydrophobicContact CG2-CB 3.93Å; I46-V48 HydrophobicContact CG2-CG2 3.23Å; I46-V48 PolarHBondContact O-N 2.99Å
47	S	26.5	Very low	51.8	Low	98 Å²	98	93.4 Å²	93.4	69%	0.685	52%	0.515	S	S	*	.			trans	-81.1	73.2	141.3	62.2	0	0	0	0	104.6	N49	S47-N49 VanDerWaalsContact C-N 3.27Å; S47-N49 PolarHBondContact O-N 3.07Å
48	V	38.8	Very low	54.6	Low	73 Å²	73	85 Å²	85	44%	0.442	48%	0.476	S	S	.	.			trans	-71.6	96.3	180	168.3	0	0	0	0	105.6	I46 D50 P51	I46-V48 HydrophobicContact CB-CG2 3.94Å; I46-V48 HydrophobicContact CG1-CG2 4.18Å; I46-V48 HydrophobicContact CG2-CB 3.93Å; I46-V48 HydrophobicContact CG2-CG2 3.23Å; I46-V48 PolarHBondContact O-N 2.99Å; V48-D50 PolarHBondContact O-N 3.19Å; V48-P51 HydrophobicContact CG1-CB 4.43Å; V48-P51 HydrophobicContact CG1-CG 4.43Å
49	N	45.4	Very low	57.3	Low	151 Å²	151	79.1 Å²	79.1	81%	0.807	45%	0.446	S	S	*	.			trans	-42.1	124.8	144.5	-71.4	-23.3	0	0	0	105.9	S47	S47-N49 VanDerWaalsContact C-N 3.27Å; S47-N49 PolarHBondContact O-N 3.07Å
50	D	58.3	Low	60.1	Low	61 Å²	61	75.7 Å²	75.7	33%	0.326	43%	0.427	S	S	.	.			trans	-40.8	126.7	-168.3	-57.7	-63	0	0	0	110.8	V48 L462 S500	V48-D50 PolarHBondContact O-N 3.19Å; D50-L462 VanDerWaalsContact OD2-CD1 3.22Å; D50-L462 WeakPolarHBondContact OD2-CD1 3.26Å; D50-S500 PolarHBondContact OD1-OG 2.81Å
51	P	68.8	Low	62.9	Low	38 Å²	38	71 Å²	71	25%	0.247	39%	0.394	C	S	.	.			trans	-59.1	139.4	-173.2	27	-33.8	0	0	0	108.7	V48 I53 I56 I122	V48-P51 HydrophobicContact CG1-CB 4.43Å; V48-P51 HydrophobicContact CG1-CG 4.43Å; P51-I53 PolarHBondContact O-N 3.31Å; P51-I56 HydrophobicContact CG-CD1 4.22Å; P51-I56 HydrophobicContact CG-CG1 4.37Å; P51-I122 HydrophobicContact CB-CD1 4Å; P51-I122 HydrophobicContact CG-CD1 3.68Å
52	P	77.7	Confident	65.8	Low	86 Å²	86	64.2 Å²	64.2	56%	0.558	36%	0.358	S	S	*	.			trans	-58.4	137.7	178.7	23.2	-30.8	0	0	0	109.1	A54 T55	P52-A54 PolarHBondContact O-N 3.19Å; P52-T55 HydrophobicContact CG-CG2 3.73Å; P52-T55 PolarHBondContact O-N 3.02Å; P52-T55 PolarHBondContact O-OG1 3.04Å
53	I	83.6	Confident	68.3	Low	49 Å²	49	57.6 Å²	57.6	25%	0.251	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-50.9	-35	-175.3	-164.6	169.2	0	0	0	112.7	P51 T55 I56 P392 P503	P51-I53 PolarHBondContact O-N 3.31Å; I53-T55 PolarHBondContact O-N 3.26Å; I53-T55 VanDerWaalsContact O-N 3.13Å; I53-I56 PolarHBondContact O-N 3.43Å; I53-I56 VanDerWaalsContact O-N 3.09Å; I53-P392 HydrophobicContact CD1-CB 4.08Å; I53-P392 HydrophobicContact CG1-CB 3.85Å; I53-P392 HydrophobicContact CG1-CG 4.23Å; I53-P503 HydrophobicContact CD1-CB 4.15Å; I53-P503 HydrophobicContact CD1-CG 4.27Å
54	A	86	Confident	70.9	Confident	51 Å²	51	52 Å²	52	42%	0.421	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-62.7	-17.6	177.6	0	0	0	0	0	114.6	P52 R57	P52-A54 PolarHBondContact O-N 3.19Å; A54-R57 PolarHBondContact O-NH1 3.45Å
55	T	89.9	Confident	73.6	Confident	29 Å²	29	50.2 Å²	50.2	18%	0.178	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-95.3	-2.1	178.5	60.2	0	0	0	0	113.5	P52 I53 H121 I122	P52-T55 HydrophobicContact CG-CG2 3.73Å; P52-T55 PolarHBondContact O-N 3.02Å; P52-T55 PolarHBondContact O-OG1 3.04Å; I53-T55 PolarHBondContact O-N 3.26Å; I53-T55 VanDerWaalsContact O-N 3.13Å; T55-H121 CarbonylContact O-C 3.59Å; T55-H121 WeakPolarHBondContact O-CA 3.25Å; T55-H121 VanDerWaalsContact O-CB 3.27Å; T55-H121 WeakPolarHBondContact O-CB 3.46Å; T55-I122 PolarHBondContact O-N 2.69Å
56	I	91.4	Very high	76.3	Confident	4 Å²	4	46.2 Å²	46.2	2%	0.021	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	143.3	178.2	-57.5	175	0	0	0	109.2	P51 I53 I122 P392	P51-I56 HydrophobicContact CG-CD1 4.22Å; P51-I56 HydrophobicContact CG-CG1 4.37Å; I53-I56 PolarHBondContact O-N 3.43Å; I53-I56 VanDerWaalsContact O-N 3.09Å; I56-I122 CarbonylContact C-O 3.58Å; I56-I122 WeakPolarHBondContact CA-O 3.36Å; I56-P392 HydrophobicContact CB-CG 4.02Å; I56-P392 HydrophobicContact CG2-CG 3.95Å; I56-P392 VanDerWaalsContact O-CD 3.23Å; I56-P392 WeakPolarHBondContact O-CD 3.43Å
57	R	93.3	Very high	79	Confident	12 Å²	12	39.1 Å²	39.1	5%	0.045	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	123.1	169	-63.3	-66	-179.3	-78.2	-4.4	109.3	A54 V59 I122 I123 H124 I385 V386 L389 P390 D391	A54-R57 PolarHBondContact O-NH1 3.45Å; R57-V59 HydrophobicContact CB-CG2 4.2Å; R57-I122 PolarHBondContact N-O 3.25Å; R57-I123 HydrophobicContact CB-CG1 4.18Å; R57-I123 CarbonylContact O-C 3.46Å; R57-I123 WeakPolarHBondContact O-CA 3.12Å; R57-H124 PolarHBondContact O-N 3.02Å; R57-I385 HydrophobicContact CB-CG2 4.25Å; R57-I385 HydrophobicContact CG-CG2 4.34Å; R57-V386 PolarHBondContact NE-O 3.48Å; R57-V386 PolarHBondContact NH2-O 2.85Å; R57-L389 PolarHBondContact NE-O 3.48Å; R57-P390 WeakPolarHBondContact CD-O 3.3Å; R57-D391 VanDerWaalsContact NH1-CB 3.34Å
58	N	93.7	Very high	81.9	Confident	0 Å²	0	35 Å²	35	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	107.6	173.6	-61.9	-47.6	0	0	0	109.5	H124 L145 D146 S147 G504 I506	N58-H124 WeakPolarHBondContact OD1-CB 3.48Å; N58-H124 PolarHBondContact OD1-CD2 3.49Å; N58-L145 HydrophobicContact CB-CD2 4.35Å; N58-D146 HydrophobicContact CB-CB 4.19Å; N58-D146 WeakPolarHBondContact CB-OD2 3.36Å; N58-D146 PolarHBondContact ND2-OD2 3.45Å; N58-D146 PolarHBondContact O-N 3.38Å; N58-D146 VanDerWaalsContact O-N 3.07Å; N58-S147 PolarHBondContact O-N 3.37Å; N58-S147 PolarHBondContact O-OG 3.21Å; N58-G504 PolarHBondContact ND2-O 2.78Å; N58-G504 PolarHBondContact OD1-O 2.62Å; N58-I506 HydrophobicContact CB-CD1 4.43Å
59	V	94.3	Very high	84.3	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	129	-171.8	-174	0	0	0	0	110.7	R57 I123 H124 L125 L126 S147 V149 I385 L389	R57-V59 HydrophobicContact CB-CG2 4.2Å; V59-I123 HydrophobicContact CG2-CG2 4.19Å; V59-H124 PolarHBondContact N-O 2.95Å; V59-L125 HydrophobicContact CB-CD1 4.39Å; V59-L125 HydrophobicContact CG1-CD1 4.46Å; V59-L125 WeakPolarHBondContact O-CA 3.24Å; V59-L126 PolarHBondContact O-N 2.99Å; V59-S147 WeakPolarHBondContact CA-O 3.28Å; V59-V149 HydrophobicContact CG1-CG2 3.71Å; V59-I385 HydrophobicContact CG2-CG2 3.73Å; V59-L389 HydrophobicContact CG2-CD1 4.09Å
60	G	93.9	Very high	86.3	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	145.1	169.2	0	0	0	0	0	112.5	L126 S147 V148 V149	G60-L126 CarbonylContact C-O 3.58Å; G60-L126 WeakPolarHBondContact CA-O 3.28Å; G60-S147 PolarHBondContact N-O 3.32Å; G60-V148 CarbonylContact O-C 3.56Å; G60-V148 WeakPolarHBondContact O-CA 3.47Å; G60-V149 PolarHBondContact O-N 2.99Å
61	L	93.7	Very high	87.9	Confident	0 Å²	0	24 Å²	24	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	122.9	169.5	-55.9	-178.1	0	0	0	109.4	T73 M76 L125 L126 T128 V149 I151	L61-T73 WeakPolarHBondContact CD1-OG1 3.29Å; L61-M76 HydrophobicContact CD1-SD 4.38Å; L61-L125 HydrophobicContact CD1-CD1 4Å; L61-L125 HydrophobicContact CD1-CD2 4.33Å; L61-L125 HydrophobicContact CD1-CG 4.39Å; L61-L125 HydrophobicContact CD2-CD1 3.99Å; L61-L125 HydrophobicContact CG-CD1 3.73Å; L61-L125 HydrophobicContact CG-CG 4.49Å; L61-L126 PolarHBondContact N-O 3.4Å; L61-T128 PolarHBondContact O-N 3.49Å; L61-T128 PolarHBondContact O-OG1 3.32Å; L61-V149 HydrophobicContact CD2-CB 3.67Å; L61-V149 HydrophobicContact CD2-CG1 4.23Å; L61-V149 HydrophobicContact CD2-CG2 4.2Å; L61-I151 HydrophobicContact CB-CD1 4.43Å
62	I	92	Very high	89	Confident	1 Å²	1	22.2 Å²	22.2	1%	0.005	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	145.5	175.9	67.8	172.2	0	0	0	110.7	V138 L142 V148 V149 V150 I151 V165 A169	I62-V138 HydrophobicContact CG2-CG1 4.38Å; I62-L142 HydrophobicContact CG2-CD2 4.29Å; I62-V148 HydrophobicContact CB-CG1 4.12Å; I62-V148 HydrophobicContact CD1-CG1 3.47Å; I62-V148 VanDerWaalsContact CD1-CG1 3.47Å; I62-V148 HydrophobicContact CG1-CG1 3.4Å; I62-V148 VanDerWaalsContact CG1-CG1 3.4Å; I62-V148 HydrophobicContact CG2-CG1 3.74Å; I62-V149 PolarHBondContact N-O 2.92Å; I62-V150 HydrophobicContact CD1-CB 4.47Å; I62-V150 HydrophobicContact CD1-CG1 4.41Å; I62-V150 HydrophobicContact CD1-CG2 3.75Å; I62-V150 HydrophobicContact CG1-CB 4.17Å; I62-V150 HydrophobicContact CG1-CG1 4.21Å; I62-V150 HydrophobicContact CG1-CG2 3.87Å; I62-V150 CarbonylContact O-C 3.54Å; I62-V150 WeakPolarHBondContact O-CA 3.45Å; I62-I151 PolarHBondContact O-N 2.96Å; I62-V165 HydrophobicContact CB-CB 4.41Å; I62-V165 HydrophobicContact CB-CG1 3.5Å; I62-V165 VanDerWaalsContact CB-CG1 3.5Å; I62-V165 HydrophobicContact CD1-CB 4.17Å; I62-V165 HydrophobicContact CD1-CG1 3.58Å; I62-V165 HydrophobicContact CG1-CG1 4.07Å; I62-V165 HydrophobicContact CG2-CG1 3.56Å; I62-A169 HydrophobicContact CD1-CB 4.28Å
63	A	90.1	Very high	89.6	Confident	2 Å²	2	18.2 Å²	18.2	2%	0.017	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.8	163.1	179.4	0	0	0	0	0	111.5	A67 K69 G130 I151	A63-A67 HydrophobicContact CB-CB 3.63Å; A63-K69 HydrophobicContact CB-CD 3.49Å; A63-K69 VanDerWaalsContact CB-CD 3.49Å; A63-K69 HydrophobicContact CB-CG 3.24Å; A63-K69 PolarHBondContact O-NZ 3.38Å; A63-G130 VanDerWaalsContact O-CA 3.26Å; A63-G130 WeakPolarHBondContact O-CA 3.34Å; A63-I151 HydrophobicContact CB-CB 3.79Å; A63-I151 VanDerWaalsContact CB-O 3.27Å; A63-I151 WeakPolarHBondContact CB-O 3.23Å
64	H	86.1	Confident	89.9	Confident	31 Å²	31	16 Å²	16	14%	0.144	10%	0.095	C	C	.	.			trans	-59.7	161.3	163.3	-169.1	69.3	0	0	0	112.6	A67 K69 Q159 Q161	H64-A67 WeakPolarHBondContact O-CB 3.33Å; H64-A67 PolarHBondContact O-N 2.96Å; H64-K69 PolarHBondContact O-NZ 3.41Å; H64-Q159 HydrophobicContact CB-CB 4.15Å; H64-Q159 PolarHBondContact CD2-NE2 3.25Å; H64-Q159 PolarHBondContact CD2-OE1 3.37Å; H64-Q159 VanDerWaalsContact CG-OE1 3.25Å; H64-Q159 PolarHBondContact NE2-NE2 3.4Å; H64-Q161 PolarHBondContact CE1-OE1 3.27Å; H64-Q161 WeakPolarHBondContact ND1-CB 3.36Å; H64-Q161 WeakPolarHBondContact ND1-CG 3.35Å; H64-Q161 PolarHBondContact ND1-OE1 3.01Å
65	I	83.4	Confident	90.1	Very high	32 Å²	32	14.1 Å²	14.1	16%	0.164	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	142.6	171.7	-56.1	157.8	0	0	0	109.4	A67 I107 H131	I65-A67 PolarHBondContact O-N 3.37Å; I65-I107 HydrophobicContact CG2-CG2 3.94Å; I65-H131 HydrophobicContact CD1-CB 4.25Å; I65-H131 WeakPolarHBondContact CD1-CD2 3.34Å; I65-H131 HydrophobicContact CG1-CB 4.37Å
66	D	84.4	Confident	90.1	Very high	102 Å²	102	12.7 Å²	12.7	55%	0.545	7%	0.069	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	3.5	-176.8	-56.9	-21.5	0	0	0	116.9	G68 K182	D66-G68 PolarHBondContact O-N 3.03Å; D66-K182 WeakPolarHBondContact O-CE 3.09Å; D66-K182 PolarHBondContact O-NZ 2.76Å
67	A	87.5	Confident	90	Very high	1 Å²	1	12.8 Å²	12.8	1%	0.008	7%	0.07	C	C	.	.	S	Bend	trans	-64.3	-13.6	177.1	0	0	0	0	0	113.3	A63 H64 I65 I151 N181	A63-A67 HydrophobicContact CB-CB 3.63Å; H64-A67 WeakPolarHBondContact O-CB 3.33Å; H64-A67 PolarHBondContact O-N 2.96Å; I65-A67 PolarHBondContact O-N 3.37Å; A67-I151 HydrophobicContact CB-CG2 4.19Å; A67-N181 PolarHBondContact O-ND2 3.48Å; A67-N181 VanDerWaalsContact O-ND2 3.09Å
68	G	86.5	Confident	89.8	Confident	12 Å²	12	13.8 Å²	13.8	12%	0.124	7%	0.074	C	C	.	.	S	Bend	trans	95.8	32.6	178.5	0	0	0	0	0	113.8	D66 T72	D66-G68 PolarHBondContact O-N 3.03Å; G68-T72 WeakPolarHBondContact O-CB 3.36Å; G68-T72 PolarHBondContact O-N 3.16Å; G68-T72 PolarHBondContact O-OG1 3.36Å
69	K	89.8	Confident	89.5	Confident	13 Å²	13	14.4 Å²	14.4	6%	0.057	8%	0.076	C	C	.	.	H	α-helix	trans	-55.5	-64.6	175.9	-68.3	-174.3	-70.5	-67.9	0	112.1	A63 H64 T71 T72 T73 T128 G130 I151	A63-K69 HydrophobicContact CB-CD 3.49Å; A63-K69 VanDerWaalsContact CB-CD 3.49Å; A63-K69 HydrophobicContact CB-CG 3.24Å; A63-K69 PolarHBondContact O-NZ 3.38Å; H64-K69 PolarHBondContact O-NZ 3.41Å; K69-T71 VanDerWaalsContact C-N 3.26Å; K69-T71 PolarHBondContact O-N 3.43Å; K69-T72 CarbonylContact O-C 3.59Å; K69-T72 WeakPolarHBondContact O-CA 3.2Å; K69-T72 VanDerWaalsContact O-CB 3.26Å; K69-T72 WeakPolarHBondContact O-CB 3.38Å; K69-T72 PolarHBondContact O-N 3.1Å; K69-T73 PolarHBondContact O-N 3.07Å; K69-T73 PolarHBondContact O-OG1 3.22Å; K69-T73 VanDerWaalsContact O-OG1 3.05Å; K69-T128 WeakPolarHBondContact CE-O 3.49Å; K69-G130 VanDerWaalsContact NZ-CA 3.32Å; K69-I151 HydrophobicContact CB-CD1 4.39Å; K69-I151 HydrophobicContact CG-CD1 4.15Å
70	T	88.2	Confident	89.1	Confident	12 Å²	12	15 Å²	15	7%	0.074	8%	0.081	C	C	.	.	H	α-helix	trans	-52.8	-44	179.4	-39.3	0	0	0	0	112.1	T72 T73 E74 V89 T94 T96 D97 S108 D127	T70-T72 VanDerWaalsContact C-N 3.3Å; T70-T72 PolarHBondContact O-N 3.31Å; T70-T73 WeakPolarHBondContact O-CB 3.48Å; T70-T73 PolarHBondContact O-N 2.71Å; T70-E74 WeakPolarHBondContact O-CB 3.4Å; T70-E74 PolarHBondContact O-N 3.27Å; T70-V89 HydrophobicContact CG2-CG2 4.14Å; T70-T94 HydrophobicContact CG2-CG2 4.37Å; T70-T96 WeakPolarHBondContact CG2-OG1 3.36Å; T70-D97 WeakPolarHBondContact CG2-OD2 3.38Å; T70-S108 PolarHBondContact OG1-OG 3.06Å; T70-S108 VanDerWaalsContact OG1-OG 3.08Å; T70-D127 WeakPolarHBondContact CA-OD2 3.29Å
71	T	90.5	Very high	88.5	Confident	30 Å²	30	22.9 Å²	22.9	18%	0.184	11%	0.111	C	C	.	.	H	α-helix	trans	-61.5	-39.5	176.5	-45.3	0	0	0	0	111.8	K69 R75	K69-T71 VanDerWaalsContact C-N 3.26Å; K69-T71 PolarHBondContact O-N 3.43Å; T71-R75 VanDerWaalsContact O-CG 3.29Å; T71-R75 WeakPolarHBondContact O-CG 3.41Å; T71-R75 PolarHBondContact O-N 3.3Å; T71-R75 VanDerWaalsContact O-N 3.1Å
72	T	92.5	Very high	88	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-67	-46.2	176.6	-51.7	0	0	0	0	110.3	G68 K69 T70 E74 R75 M76 I151 Y179 N181 S372 I378 L381	G68-T72 WeakPolarHBondContact O-CB 3.36Å; G68-T72 PolarHBondContact O-N 3.16Å; G68-T72 PolarHBondContact O-OG1 3.36Å; K69-T72 CarbonylContact O-C 3.59Å; K69-T72 WeakPolarHBondContact O-CA 3.2Å; K69-T72 VanDerWaalsContact O-CB 3.26Å; K69-T72 WeakPolarHBondContact O-CB 3.38Å; K69-T72 PolarHBondContact O-N 3.1Å; T70-T72 VanDerWaalsContact C-N 3.3Å; T70-T72 PolarHBondContact O-N 3.31Å; T72-E74 VanDerWaalsContact C-N 3.32Å; T72-E74 PolarHBondContact O-N 2.87Å; T72-R75 PolarHBondContact O-N 2.93Å; T72-M76 HydrophobicContact CG2-SD 4.31Å; T72-M76 WeakPolarHBondContact O-CG 3.43Å; T72-M76 PolarHBondContact O-N 3.46Å; T72-I151 HydrophobicContact CG2-CD1 4.12Å; T72-Y179 HydrophobicContact CG2-CD1 4.33Å; T72-Y179 HydrophobicContact CG2-CE1 4Å; T72-N181 PolarHBondContact OG1-ND2 3.14Å; T72-S372 PolarHBondContact OG1-OG 2.81Å; T72-I378 HydrophobicContact CG2-CD1 3.91Å; T72-L381 HydrophobicContact CG2-CD2 4.14Å
73	T	91.2	Very high	87.5	Confident	2 Å²	2	28.9 Å²	28.9	1%	0.012	13%	0.134	C	C	.	.	H	α-helix	trans	-53.1	-49.4	174.5	-47.3	0	0	0	0	111.5	L61 K69 T70 R75 M76 L77 T96 L125 D127	L61-T73 WeakPolarHBondContact CD1-OG1 3.29Å; K69-T73 PolarHBondContact O-N 3.07Å; K69-T73 PolarHBondContact O-OG1 3.22Å; K69-T73 VanDerWaalsContact O-OG1 3.05Å; T70-T73 WeakPolarHBondContact O-CB 3.48Å; T70-T73 PolarHBondContact O-N 2.71Å; T73-R75 PolarHBondContact O-N 3.19Å; T73-M76 WeakPolarHBondContact O-CB 3.48Å; T73-M76 PolarHBondContact O-N 3.45Å; T73-L77 HydrophobicContact CG2-CD1 4.26Å; T73-L77 WeakPolarHBondContact O-CG 3.31Å; T73-L77 PolarHBondContact O-N 2.94Å; T73-T96 HydrophobicContact CG2-CG2 3.66Å; T73-L125 HydrophobicContact CG2-CD2 3.72Å; T73-L125 HydrophobicContact CG2-CG 4.49Å; T73-D127 WeakPolarHBondContact CB-OD2 3.21Å; T73-D127 HydrophobicContact CG2-CB 4.13Å; T73-D127 PolarHBondContact OG1-OD2 2.93Å
74	E	88.9	Confident	86.9	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-63.8	-39.6	-179.4	-175.9	160	-143.5	0	0	112.4	T70 T72 L77 Y78 G87 T94	T70-E74 WeakPolarHBondContact O-CB 3.4Å; T70-E74 PolarHBondContact O-N 3.27Å; T72-E74 VanDerWaalsContact C-N 3.32Å; T72-E74 PolarHBondContact O-N 2.87Å; E74-L77 PolarHBondContact O-N 3.3Å; E74-Y78 WeakPolarHBondContact O-CB 3.14Å; E74-Y78 PolarHBondContact O-N 3.42Å; E74-G87 WeakPolarHBondContact OE1-CA 3.44Å; E74-G87 PolarHBondContact OE1-N 2.87Å; E74-T94 WeakPolarHBondContact OE1-CA 3.21Å; E74-T94 WeakPolarHBondContact OE2-CG2 3.47Å
75	R	90.1	Very high	86.6	Confident	12 Å²	12	42.4 Å²	42.4	5%	0.045	19%	0.192	C	C	.	.	H	α-helix	trans	-66.4	-39.9	173.7	-61.9	-31.8	160.7	141.9	-22.3	111.9	T71 T72 T73 L77 Y78 Y79 S372 N375 I378	T71-R75 VanDerWaalsContact O-CG 3.29Å; T71-R75 WeakPolarHBondContact O-CG 3.41Å; T71-R75 PolarHBondContact O-N 3.3Å; T71-R75 VanDerWaalsContact O-N 3.1Å; T72-R75 PolarHBondContact O-N 2.93Å; T73-R75 PolarHBondContact O-N 3.19Å; R75-L77 VanDerWaalsContact C-N 3.32Å; R75-L77 PolarHBondContact O-N 3.32Å; R75-Y78 PolarHBondContact O-N 3.46Å; R75-Y79 WeakPolarHBondContact O-CD2 3.24Å; R75-Y79 PolarHBondContact O-N 3.35Å; R75-S372 WeakPolarHBondContact CG-O 3.39Å; R75-S372 PolarHBondContact NE-O 2.89Å; R75-N375 VanDerWaalsContact CD-OD1 3.25Å; R75-N375 WeakPolarHBondContact CD-OD1 3.33Å; R75-N375 PolarHBondContact NH1-OD1 3.42Å; R75-I378 HydrophobicContact CB-CD1 4.18Å; R75-I378 HydrophobicContact CB-CG1 3.9Å; R75-I378 HydrophobicContact CB-CG2 4.21Å; R75-I378 HydrophobicContact CG-CG1 4.49Å
76	M	91.1	Very high	86.4	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.4	-43.3	175	-68.6	172.2	78	0	0	111.2	L61 T72 T73 A80 L116 L125 I378 L381 L382 I385	L61-M76 HydrophobicContact CD1-SD 4.38Å; T72-M76 HydrophobicContact CG2-SD 4.31Å; T72-M76 WeakPolarHBondContact O-CG 3.43Å; T72-M76 PolarHBondContact O-N 3.46Å; T73-M76 WeakPolarHBondContact O-CB 3.48Å; T73-M76 PolarHBondContact O-N 3.45Å; M76-A80 VanDerWaalsContact O-CB 3.3Å; M76-A80 WeakPolarHBondContact O-CB 3.04Å; M76-A80 PolarHBondContact O-N 3.04Å; M76-L116 HydrophobicContact CB-CD2 4.13Å; M76-L125 HydrophobicContact CB-CD2 4.42Å; M76-L125 HydrophobicContact CE-CD1 4.13Å; M76-L125 HydrophobicContact CE-CD2 4.16Å; M76-L125 HydrophobicContact SD-CD1 4.47Å; M76-L125 HydrophobicContact SD-CD2 4.02Å; M76-I378 HydrophobicContact CG-CG2 3.95Å; M76-L381 HydrophobicContact SD-CD2 4.49Å; M76-L382 HydrophobicContact CB-CD2 4.28Å; M76-L382 HydrophobicContact CE-CD2 3.47Å; M76-L382 VanDerWaalsContact CE-CD2 3.47Å; M76-L382 HydrophobicContact CE-CG 4.38Å; M76-L382 HydrophobicContact CG-CD2 4.15Å; M76-L382 HydrophobicContact CG-CG 4.4Å; M76-I385 HydrophobicContact CE-CD1 3.59Å
77	L	89	Confident	86.1	Confident	6 Å²	6	38.7 Å²	38.7	3%	0.031	17%	0.172	C	C	.	.	H	α-helix	trans	-67.4	-37.2	177.4	-68.8	173.7	0	0	0	113	T73 E74 R75 R81 R82 I83 T96 A114 L116	T73-L77 HydrophobicContact CG2-CD1 4.26Å; T73-L77 WeakPolarHBondContact O-CG 3.31Å; T73-L77 PolarHBondContact O-N 2.94Å; E74-L77 PolarHBondContact O-N 3.3Å; R75-L77 VanDerWaalsContact C-N 3.32Å; R75-L77 PolarHBondContact O-N 3.32Å; L77-R81 PolarHBondContact O-N 2.89Å; L77-R82 HydrophobicContact CB-CB 4.49Å; L77-R82 HydrophobicContact CD2-CB 4.29Å; L77-R82 PolarHBondContact O-N 3.2Å; L77-I83 HydrophobicContact CB-CD1 3.47Å; L77-I83 VanDerWaalsContact CB-CD1 3.47Å; L77-I83 HydrophobicContact CB-CG1 3.88Å; L77-I83 HydrophobicContact CD1-CD1 3.73Å; L77-I83 HydrophobicContact CG-CD1 4.24Å; L77-I83 PolarHBondContact O-N 3.02Å; L77-T96 HydrophobicContact CD1-CG2 4.17Å; L77-A114 HydrophobicContact CD1-CB 4.26Å; L77-A114 HydrophobicContact CD2-CB 3.76Å; L77-L116 HydrophobicContact CD2-CB 4.31Å; L77-L116 HydrophobicContact CD2-CD2 4.19Å
78	Y	88	Confident	85.7	Confident	33 Å²	33	42.1 Å²	42.1	13%	0.129	19%	0.188	C	C	.	.	H	α-helix	trans	-65.1	-48.7	174.9	179.5	-105.7	0	0	0	112.1	E74 R75 A80 R81 I83 L86 P271	E74-Y78 WeakPolarHBondContact O-CB 3.14Å; E74-Y78 PolarHBondContact O-N 3.42Å; R75-Y78 PolarHBondContact O-N 3.46Å; Y78-A80 VanDerWaalsContact C-N 3.29Å; Y78-A80 PolarHBondContact O-N 2.68Å; Y78-R81 WeakPolarHBondContact O-CA 3.26Å; Y78-R81 PolarHBondContact O-N 2.92Å; Y78-I83 WeakPolarHBondContact CD2-O 3.33Å; Y78-L86 VanDerWaalsContact CB-CD2 3.46Å; Y78-L86 HydrophobicContact CD1-CD1 3.99Å; Y78-L86 HydrophobicContact CD1-CD2 3.8Å; Y78-L86 HydrophobicContact CD1-CG 4.05Å; Y78-L86 HydrophobicContact CD2-CD1 4.3Å; Y78-L86 HydrophobicContact CD2-CD2 3.78Å; Y78-L86 HydrophobicContact CD2-CG 3.68Å; Y78-L86 HydrophobicContact CE1-CD1 3.76Å; Y78-L86 HydrophobicContact CE1-CD2 4.43Å; Y78-L86 HydrophobicContact CE1-CG 4.19Å; Y78-L86 HydrophobicContact CE2-CD1 4.1Å; Y78-L86 HydrophobicContact CE2-CD2 4.42Å; Y78-L86 HydrophobicContact CE2-CG 3.84Å; Y78-L86 HydrophobicContact CG-CD1 4.23Å; Y78-L86 HydrophobicContact CG-CD2 3.41Å; Y78-L86 VanDerWaalsContact CG-CD2 3.41Å; Y78-L86 HydrophobicContact CG-CG 3.76Å; Y78-P271 HydrophobicContact CD1-CB 4.22Å; Y78-P271 HydrophobicContact CE1-CB 3.95Å; Y78-P271 HydrophobicContact CE1-CG 4.08Å; Y78-P271 WeakPolarHBondContact OH-CD 3.43Å
79	Y	87.5	Confident	85.2	Confident	12 Å²	12	42.7 Å²	42.7	5%	0.047	19%	0.189	C	C	.	.	H	α-helix	trans	-64.6	-34.3	177.3	-80.1	-62.5	0	0	0	112.5	R75 R81 P271 N375 I378 Q379	R75-Y79 WeakPolarHBondContact O-CD2 3.24Å; R75-Y79 PolarHBondContact O-N 3.35Å; Y79-R81 PolarHBondContact O-N 2.83Å; Y79-R81 VanDerWaalsContact O-N 3.16Å; Y79-P271 HydrophobicContact CD1-CB 4.22Å; Y79-N375 HydrophobicContact CE2-CB 4.43Å; Y79-N375 WeakPolarHBondContact OH-CB 3.02Å; Y79-N375 PolarHBondContact OH-O 3.29Å; Y79-I378 HydrophobicContact CD2-CB 3.89Å; Y79-I378 HydrophobicContact CD2-CG2 3.59Å; Y79-I378 HydrophobicContact CE2-CB 3.75Å; Y79-I378 HydrophobicContact CE2-CG1 4.28Å; Y79-I378 HydrophobicContact CE2-CG2 4.01Å; Y79-Q379 HydrophobicContact CD1-CG 4.09Å; Y79-Q379 HydrophobicContact CE1-CG 4.12Å; Y79-Q379 VanDerWaalsContact CE1-NE2 3.29Å; Y79-Q379 HydrophobicContact CG-CG 4.34Å; Y79-Q379 PolarHBondContact OH-NE2 3.47Å
80	A	86	Confident	84.6	Confident	14 Å²	14	49.1 Å²	49.1	12%	0.116	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	5.6	172.3	0	0	0	0	0	114.2	M76 Y78 R82 L116	M76-A80 VanDerWaalsContact O-CB 3.3Å; M76-A80 WeakPolarHBondContact O-CB 3.04Å; M76-A80 PolarHBondContact O-N 3.04Å; Y78-A80 VanDerWaalsContact C-N 3.29Å; Y78-A80 PolarHBondContact O-N 2.68Å; A80-R82 HydrophobicContact CB-CG 4.39Å; A80-R82 PolarHBondContact O-N 2.88Å; A80-L116 HydrophobicContact CB-CB 3.7Å; A80-L116 HydrophobicContact CB-CD1 4.05Å; A80-L116 HydrophobicContact CB-CD2 4.49Å; A80-L116 HydrophobicContact CB-CG 4.3Å
81	R	83	Confident	84	Confident	165 Å²	165	53.3 Å²	53.3	62%	0.623	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.3	27.7	-179	-57	-179.8	175.9	162.5	-0.4	114.1	L77 Y78 Y79 D272	L77-R81 PolarHBondContact O-N 2.89Å; Y78-R81 WeakPolarHBondContact O-CA 3.26Å; Y78-R81 PolarHBondContact O-N 2.92Å; Y79-R81 PolarHBondContact O-N 2.83Å; Y79-R81 VanDerWaalsContact O-N 3.16Å; R81-D272 IonicContact CZ-OD1 3.63Å; R81-D272 IonicContact NE-OD1 3.28Å; R81-D272 PolarHBondContact NE-OD1 2.82Å; R81-D272 IonicContact NH2-OD1 2.83Å; R81-D272 PolarHBondContact NH2-OD1 2.99Å
82	R	81.8	Confident	83	Confident	111 Å²	111	52.4 Å²	52.4	42%	0.419	24%	0.243	S	C	.	.	S	Bend	trans	-84.8	-31	173.8	-68	-60.7	-165.2	171.4	0.5	112.1	L77 A80 S115 L116	L77-R82 HydrophobicContact CB-CB 4.49Å; L77-R82 HydrophobicContact CD2-CB 4.29Å; L77-R82 PolarHBondContact O-N 3.2Å; A80-R82 HydrophobicContact CB-CG 4.39Å; A80-R82 PolarHBondContact O-N 2.88Å; R82-S115 PolarHBondContact NE-O 2.78Å; R82-L116 HydrophobicContact CG-CB 4.35Å
83	I	81.2	Confident	82.4	Confident	15 Å²	15	57.1 Å²	57.1	8%	0.077	27%	0.268	C	S	.	.			trans	-119.4	137.7	174.8	-48.2	167.5	0	0	0	108.2	L77 Y78 Y85 V95	L77-I83 HydrophobicContact CB-CD1 3.47Å; L77-I83 VanDerWaalsContact CB-CD1 3.47Å; L77-I83 HydrophobicContact CB-CG1 3.88Å; L77-I83 HydrophobicContact CD1-CD1 3.73Å; L77-I83 HydrophobicContact CG-CD1 4.24Å; L77-I83 PolarHBondContact O-N 3.02Å; Y78-I83 WeakPolarHBondContact CD2-O 3.33Å; I83-Y85 HydrophobicContact CG2-CD1 4.39Å; I83-Y85 HydrophobicContact CG2-CD2 4.49Å; I83-Y85 HydrophobicContact CG2-CE1 4.43Å; I83-Y85 HydrophobicContact CG2-CG 4.42Å; I83-Y85 WeakPolarHBondContact CG2-O 3.27Å; I83-V95 HydrophobicContact CD1-CB 3.69Å; I83-V95 HydrophobicContact CD1-CG1 4.15Å; I83-V95 HydrophobicContact CD1-CG2 3.51Å; I83-V95 HydrophobicContact CG1-CB 4.47Å; I83-V95 HydrophobicContact CG1-CG2 4.01Å; I83-V95 HydrophobicContact CG2-CG2 3.97Å
84	H	78.1	Confident	81.6	Confident	167 Å²	167	57.1 Å²	57.1	77%	0.773	27%	0.268	S	S	*	.	S	Bend	trans	-92.5	-18.7	179.8	-64.7	-65.5	0	0	0	113.8
85	Y	79.8	Confident	81	Confident	151 Å²	151	58.4 Å²	58.4	59%	0.592	28%	0.276	S	S	*	.	S	Bend	trans	-124.5	146.4	179.4	59.5	-91.8	0	0	0	109.8	I83	I83-Y85 HydrophobicContact CG2-CD1 4.39Å; I83-Y85 HydrophobicContact CG2-CD2 4.49Å; I83-Y85 HydrophobicContact CG2-CE1 4.43Å; I83-Y85 HydrophobicContact CG2-CG 4.42Å; I83-Y85 WeakPolarHBondContact CG2-O 3.27Å
86	L	80.4	Confident	80.3	Confident	54 Å²	54	58 Å²	58	28%	0.283	28%	0.275	S	S	.	.			trans	-93.3	116.1	176.5	-71.6	160.9	0	0	0	108	Y78	Y78-L86 VanDerWaalsContact CB-CD2 3.46Å; Y78-L86 HydrophobicContact CD1-CD1 3.99Å; Y78-L86 HydrophobicContact CD1-CD2 3.8Å; Y78-L86 HydrophobicContact CD1-CG 4.05Å; Y78-L86 HydrophobicContact CD2-CD1 4.3Å; Y78-L86 HydrophobicContact CD2-CD2 3.78Å; Y78-L86 HydrophobicContact CD2-CG 3.68Å; Y78-L86 HydrophobicContact CE1-CD1 3.76Å; Y78-L86 HydrophobicContact CE1-CD2 4.43Å; Y78-L86 HydrophobicContact CE1-CG 4.19Å; Y78-L86 HydrophobicContact CE2-CD1 4.1Å; Y78-L86 HydrophobicContact CE2-CD2 4.42Å; Y78-L86 HydrophobicContact CE2-CG 3.84Å; Y78-L86 HydrophobicContact CG-CD1 4.23Å; Y78-L86 HydrophobicContact CG-CD2 3.41Å; Y78-L86 VanDerWaalsContact CG-CD2 3.41Å; Y78-L86 HydrophobicContact CG-CG 3.76Å
87	G	76.8	Confident	79.7	Confident	2 Å²	2	58.2 Å²	58.2	2%	0.021	28%	0.276	C	S	.	.			trans	-76.6	167.5	164.6	0	0	0	0	0	111.4	E74	E74-G87 WeakPolarHBondContact OE1-CA 3.44Å; E74-G87 PolarHBondContact OE1-N 2.87Å
88	E	79.1	Confident	79	Confident	72 Å²	72	62.2 Å²	62.2	34%	0.336	29%	0.291	S	S	.	.			trans	-129.7	141.8	167.8	-65.7	-170.8	147.3	0	0	108	D90 N91 G92 D93 T94	E88-D90 VanDerWaalsContact C-N 3.25Å; E88-D90 PolarHBondContact O-N 2.77Å; E88-N91 PolarHBondContact O-N 2.96Å; E88-N91 VanDerWaalsContact O-N 3.11Å; E88-N91 PolarHBondContact OE2-ND2 2.97Å; E88-G92 PolarHBondContact O-N 2.85Å; E88-D93 PolarHBondContact O-N 2.66Å; E88-T94 VanDerWaalsContact C-CG2 3.44Å
89	V	77	Confident	78.4	Confident	25 Å²	25	61.2 Å²	61.2	15%	0.152	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-58.7	-41.2	179.6	-178.6	0	0	0	0	110.4	T70 N91 G92 T94	T70-V89 HydrophobicContact CG2-CG2 4.14Å; V89-N91 PolarHBondContact O-N 3.37Å; V89-G92 PolarHBondContact O-N 3.03Å; V89-T94 HydrophobicContact CB-CG2 4.36Å; V89-T94 HydrophobicContact CG2-CG2 3.84Å
90	D	75.8	Confident	77.8	Confident	148 Å²	148	63.4 Å²	63.4	79%	0.791	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-62.5	-26.3	180	-60.9	-23.8	0	0	0	113.2	E88	E88-D90 VanDerWaalsContact C-N 3.25Å; E88-D90 PolarHBondContact O-N 2.77Å
91	N	75.6	Confident	77.3	Confident	99 Å²	99	63.4 Å²	63.4	53%	0.529	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-92.4	-9.2	177.4	-61.7	-32.8	0	0	0	112.3	E88 V89 D93	E88-N91 PolarHBondContact O-N 2.96Å; E88-N91 VanDerWaalsContact O-N 3.11Å; E88-N91 PolarHBondContact OE2-ND2 2.97Å; V89-N91 PolarHBondContact O-N 3.37Å; N91-D93 HydrophobicContact CB-CB 4.43Å; N91-D93 PolarHBondContact O-N 3.4Å
92	G	71.4	Confident	77.1	Confident	11 Å²	11	55.5 Å²	55.5	11%	0.113	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.2	20.1	-175.4	0	0	0	0	0	114.2	E88 V89 R103	E88-G92 PolarHBondContact O-N 2.85Å; V89-G92 PolarHBondContact O-N 3.03Å; G92-R103 VanDerWaalsContact O-CD 3.22Å; G92-R103 WeakPolarHBondContact O-CD 3.24Å; G92-R103 PolarHBondContact O-NE 3.36Å
93	D	78.4	Confident	77.1	Confident	99 Å²	99	55.6 Å²	55.6	53%	0.529	27%	0.272	S	S	.	.			trans	-97.8	7.3	-173.9	-77.9	-25	0	0	0	113.4	E88 N91	E88-D93 PolarHBondContact O-N 2.66Å; N91-D93 HydrophobicContact CB-CB 4.43Å; N91-D93 PolarHBondContact O-N 3.4Å
94	T	75.1	Confident	77.1	Confident	2 Å²	2	62.7 Å²	62.7	1%	0.012	31%	0.305	C	S	.	.			trans	-72.1	147.7	-177.3	66.7	0	0	0	0	111.6	T70 E74 E88 V89 D97	T70-T94 HydrophobicContact CG2-CG2 4.37Å; E74-T94 WeakPolarHBondContact OE1-CA 3.21Å; E74-T94 WeakPolarHBondContact OE2-CG2 3.47Å; E88-T94 VanDerWaalsContact C-CG2 3.44Å; V89-T94 HydrophobicContact CB-CG2 4.36Å; V89-T94 HydrophobicContact CG2-CG2 3.84Å; T94-D97 WeakPolarHBondContact OG1-CB 3.43Å; T94-D97 PolarHBondContact OG1-OD2 3.13Å
95	V	75	Confident	77.1	Confident	29 Å²	29	59.5 Å²	59.5	18%	0.176	29%	0.286	C	S	.	.	S	Bend	trans	-77.9	-31.6	-177.4	173.3	0	0	0	0	112.5	I83	I83-V95 HydrophobicContact CD1-CB 3.69Å; I83-V95 HydrophobicContact CD1-CG1 4.15Å; I83-V95 HydrophobicContact CD1-CG2 3.51Å; I83-V95 HydrophobicContact CG1-CB 4.47Å; I83-V95 HydrophobicContact CG1-CG2 4.01Å; I83-V95 HydrophobicContact CG2-CG2 3.97Å
96	T	75.5	Confident	76.9	Confident	4 Å²	4	53.5 Å²	53.5	3%	0.025	27%	0.27	C	S	.	.	S	Bend	trans	-81.4	-32.4	-176.6	47.6	0	0	0	0	113.2	T70 T73 L77 Y98 A112	T70-T96 WeakPolarHBondContact CG2-OG1 3.36Å; T73-T96 HydrophobicContact CG2-CG2 3.66Å; L77-T96 HydrophobicContact CD1-CG2 4.17Å; T96-Y98 WeakPolarHBondContact O-CD1 3.07Å; T96-Y98 PolarHBondContact O-N 3.09Å; T96-A112 HydrophobicContact CG2-CB 3.86Å
97	D	78.4	Confident	76.9	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.016	26%	0.263	C	S	.	.			trans	-89.9	79.6	175.7	-54.1	-33.7	0	0	0	108.9	T70 T94 E102 R103 S108	T70-D97 WeakPolarHBondContact CG2-OD2 3.38Å; T94-D97 WeakPolarHBondContact OG1-CB 3.43Å; T94-D97 PolarHBondContact OG1-OD2 3.13Å; D97-E102 WeakPolarHBondContact CA-OE2 3.45Å; D97-E102 HydrophobicContact CB-CB 3.81Å; D97-R103 WeakPolarHBondContact O-CG 3.38Å; D97-R103 PolarHBondContact O-NE 2.9Å; D97-R103 PolarHBondContact O-NH2 3.14Å; D97-S108 PolarHBondContact OD1-OG 2.86Å
98	Y	75.1	Confident	77.1	Confident	90 Å²	90	52.3 Å²	52.3	35%	0.353	26%	0.264	S	S	.	.			trans	-87.6	-16.1	-178.2	60.7	-93.2	0	0	0	112.8	T96 E102 R443	T96-Y98 WeakPolarHBondContact O-CD1 3.07Å; T96-Y98 PolarHBondContact O-N 3.09Å; Y98-E102 PolarHBondContact N-OE2 3.29Å; Y98-R443 PolarHBondContact OH-NH2 2.78Å
99	L	75.8	Confident	77.1	Confident	12 Å²	12	49 Å²	49	6%	0.063	25%	0.249	C	C	.	.	S	Bend	trans	-78.6	133.2	177.8	-58.2	174.8	0	0	0	110.5	E101 E102 R103 V110	L99-E101 PolarHBondContact O-N 3.42Å; L99-E102 HydrophobicContact CB-CB 4.28Å; L99-E102 HydrophobicContact CB-CG 3.82Å; L99-E102 WeakPolarHBondContact CB-OE2 3.47Å; L99-E102 HydrophobicContact CD1-CG 4.22Å; L99-E102 HydrophobicContact CG-CG 4.42Å; L99-E102 PolarHBondContact N-OE2 3.31Å; L99-E102 VanDerWaalsContact N-OE2 3.14Å; L99-E102 WeakPolarHBondContact O-CB 3.45Å; L99-E102 PolarHBondContact O-N 3.29Å; L99-R103 PolarHBondContact O-N 3.31Å; L99-R103 VanDerWaalsContact O-N 3.13Å; L99-V110 HydrophobicContact CD1-CB 4.01Å; L99-V110 HydrophobicContact CD1-CG2 3.49Å; L99-V110 VanDerWaalsContact CD1-CG2 3.49Å
100	P	73.9	Confident	77.4	Confident	58 Å²	58	48.7 Å²	48.7	38%	0.377	25%	0.246	S	C	.	.	H	α-helix	trans	-48.1	-40.1	171.9	-32.3	33	0	0	0	114.5	E102 R103 E104	P100-E102 VanDerWaalsContact C-N 3.31Å; P100-E102 PolarHBondContact O-N 3.14Å; P100-R103 PolarHBondContact O-N 3.11Å; P100-E104 WeakPolarHBondContact O-CB 3.44Å; P100-E104 VanDerWaalsContact O-CG 3.31Å; P100-E104 WeakPolarHBondContact O-CG 3.14Å; P100-E104 PolarHBondContact O-N 2.97Å
101	E	76.4	Confident	77.9	Confident	14 Å²	14	41.8 Å²	41.8	7%	0.065	21%	0.21	C	C	.	.	H	α-helix	trans	-67.1	-33.3	178.9	-61	76.7	-168	0	0	112.4	L99 R105 I109 S620 R624	L99-E101 PolarHBondContact O-N 3.42Å; E101-R105 VanDerWaalsContact O-CB 3.25Å; E101-R105 WeakPolarHBondContact O-CB 3.35Å; E101-R105 WeakPolarHBondContact O-CG 3.23Å; E101-R105 PolarHBondContact O-N 3.35Å; E101-R105 VanDerWaalsContact O-N 3.11Å; E101-I109 HydrophobicContact CB-CD1 3.67Å; E101-S620 VanDerWaalsContact OE1-CB 3.26Å; E101-S620 WeakPolarHBondContact OE1-CB 3.44Å; E101-S620 PolarHBondContact OE1-OG 3.3Å; E101-R624 IonicContact OE1-CZ 3.85Å; E101-R624 IonicContact OE1-NH1 2.78Å; E101-R624 PolarHBondContact OE1-NH1 3.04Å; E101-R624 IonicContact OE1-NH2 2.87Å; E101-R624 IonicContact OE2-CZ 3.39Å; E101-R624 VanDerWaalsContact OE2-CZ 3.26Å; E101-R624 IonicContact OE2-NH1 3.12Å; E101-R624 PolarHBondContact OE2-NH1 2.83Å; E101-R624 IonicContact OE2-NH2 3.88Å; E101-R624 PolarHBondContact OE2-NH2 3.14Å
102	E	79.6	Confident	78.4	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-67.8	-43.6	176.1	-66.1	175	144.9	0	0	110	D97 Y98 L99 P100 G106 I107 I109 V110	D97-E102 WeakPolarHBondContact CA-OE2 3.45Å; D97-E102 HydrophobicContact CB-CB 3.81Å; Y98-E102 PolarHBondContact N-OE2 3.29Å; L99-E102 HydrophobicContact CB-CB 4.28Å; L99-E102 HydrophobicContact CB-CG 3.82Å; L99-E102 WeakPolarHBondContact CB-OE2 3.47Å; L99-E102 HydrophobicContact CD1-CG 4.22Å; L99-E102 HydrophobicContact CG-CG 4.42Å; L99-E102 PolarHBondContact N-OE2 3.31Å; L99-E102 VanDerWaalsContact N-OE2 3.14Å; L99-E102 WeakPolarHBondContact O-CB 3.45Å; L99-E102 PolarHBondContact O-N 3.29Å; P100-E102 VanDerWaalsContact C-N 3.31Å; P100-E102 PolarHBondContact O-N 3.14Å; E102-G106 VanDerWaalsContact O-CA 3.29Å; E102-G106 WeakPolarHBondContact O-CA 3.39Å; E102-G106 PolarHBondContact O-N 2.95Å; E102-I107 WeakPolarHBondContact CA-O 3.33Å; E102-I107 WeakPolarHBondContact CB-O 3.4Å; E102-I107 WeakPolarHBondContact CG-O 3.36Å; E102-I107 PolarHBondContact O-N 3Å; E102-I109 HydrophobicContact CG-CB 3.8Å; E102-I109 HydrophobicContact CG-CD1 3.76Å; E102-I109 HydrophobicContact CG-CG1 3.82Å; E102-I109 PolarHBondContact OE1-N 3.48Å; E102-V110 PolarHBondContact OE1-N 3.03Å
103	R	81.4	Confident	79.2	Confident	113 Å²	113	37.6 Å²	37.6	43%	0.426	19%	0.187	S	C	.	.	H	α-helix	trans	-67.3	-43.3	178	-64.1	176.5	-179.6	-171.3	-2.3	112.7	G92 D97 L99 P100 R105	G92-R103 VanDerWaalsContact O-CD 3.22Å; G92-R103 WeakPolarHBondContact O-CD 3.24Å; G92-R103 PolarHBondContact O-NE 3.36Å; D97-R103 WeakPolarHBondContact O-CG 3.38Å; D97-R103 PolarHBondContact O-NE 2.9Å; D97-R103 PolarHBondContact O-NH2 3.14Å; L99-R103 PolarHBondContact O-N 3.31Å; L99-R103 VanDerWaalsContact O-N 3.13Å; P100-R103 PolarHBondContact O-N 3.11Å; R103-R105 VanDerWaalsContact C-N 3.35Å
104	E	80.1	Confident	79.6	Confident	164 Å²	164	33 Å²	33	77%	0.766	16%	0.163	S	C	*	.	H	α-helix	trans	-67	-36.3	179.7	-76.6	177.4	-171.4	0	0	112.3	P100	P100-E104 WeakPolarHBondContact O-CB 3.44Å; P100-E104 VanDerWaalsContact O-CG 3.31Å; P100-E104 WeakPolarHBondContact O-CG 3.14Å; P100-E104 PolarHBondContact O-N 2.97Å
105	R	78.8	Confident	80.2	Confident	99 Å²	99	33.1 Å²	33.1	37%	0.374	16%	0.164	S	C	.	.	H	α-helix	trans	-95.4	-14.7	-177.1	-65.3	173.6	169.5	172.8	-9.8	113.5	E101 R103 I107 D616	E101-R105 VanDerWaalsContact O-CB 3.25Å; E101-R105 WeakPolarHBondContact O-CB 3.35Å; E101-R105 WeakPolarHBondContact O-CG 3.23Å; E101-R105 PolarHBondContact O-N 3.35Å; E101-R105 VanDerWaalsContact O-N 3.11Å; R103-R105 VanDerWaalsContact C-N 3.35Å; R105-I107 VanDerWaalsContact C-N 3.31Å; R105-I107 HydrophobicContact CB-CD1 4.1Å; R105-I107 HydrophobicContact CB-CG1 3.81Å; R105-D616 IonicContact NH2-OD2 3.53Å; R105-D616 PolarHBondContact NH2-OD2 2.54Å
106	G	75.7	Confident	80.9	Confident	26 Å²	26	31.8 Å²	31.8	27%	0.268	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	28	-175.7	0	0	0	0	0	113.9	E102	E102-G106 VanDerWaalsContact O-CA 3.29Å; E102-G106 WeakPolarHBondContact O-CA 3.39Å; E102-G106 PolarHBondContact O-N 2.95Å
107	I	80.1	Confident	81.6	Confident	24 Å²	24	34.5 Å²	34.5	12%	0.123	18%	0.175	C	C	.	.	S	Bend	trans	-129.6	142.2	-178.6	63.6	178.8	0	0	0	110.2	I65 E102 R105 I109 L613	I65-I107 HydrophobicContact CG2-CG2 3.94Å; E102-I107 WeakPolarHBondContact CA-O 3.33Å; E102-I107 WeakPolarHBondContact CB-O 3.4Å; E102-I107 WeakPolarHBondContact CG-O 3.36Å; E102-I107 PolarHBondContact O-N 3Å; R105-I107 VanDerWaalsContact C-N 3.31Å; R105-I107 HydrophobicContact CB-CD1 4.1Å; R105-I107 HydrophobicContact CB-CG1 3.81Å; I107-I109 HydrophobicContact CD1-CG1 4.45Å; I107-I109 HydrophobicContact CG1-CG1 4.24Å; I107-L613 HydrophobicContact CD1-CD2 3.7Å
108	S	80.1	Confident	82.1	Confident	7 Å²	7	36.5 Å²	36.5	5%	0.049	18%	0.182	C	C	.	.			trans	-78.3	129.3	169.5	-49.4	0	0	0	0	109.6	T70 D97 P129	T70-S108 PolarHBondContact OG1-OG 3.06Å; T70-S108 VanDerWaalsContact OG1-OG 3.08Å; D97-S108 PolarHBondContact OD1-OG 2.86Å; S108-P129 WeakPolarHBondContact O-CB 3.35Å
109	I	79.5	Confident	82.8	Confident	3 Å²	3	38.4 Å²	38.4	2%	0.015	19%	0.189	C	C	.	.			trans	-106.5	-39.9	-178.5	-67.4	164.5	0	0	0	109.7	E101 E102 I107 F134 V617	E101-I109 HydrophobicContact CB-CD1 3.67Å; E102-I109 HydrophobicContact CG-CB 3.8Å; E102-I109 HydrophobicContact CG-CD1 3.76Å; E102-I109 HydrophobicContact CG-CG1 3.82Å; E102-I109 PolarHBondContact OE1-N 3.48Å; I107-I109 HydrophobicContact CD1-CG1 4.45Å; I107-I109 HydrophobicContact CG1-CG1 4.24Å; I109-F134 HydrophobicContact CB-CD2 4.45Å; I109-F134 HydrophobicContact CB-CE2 4.07Å; I109-F134 HydrophobicContact CB-CZ 4.24Å; I109-F134 HydrophobicContact CG1-CE2 3.81Å; I109-F134 HydrophobicContact CG1-CZ 4.13Å; I109-F134 HydrophobicContact CG2-CD1 4.04Å; I109-F134 HydrophobicContact CG2-CD2 4.15Å; I109-F134 HydrophobicContact CG2-CE1 3.55Å; I109-F134 HydrophobicContact CG2-CE2 3.69Å; I109-F134 HydrophobicContact CG2-CG 4.34Å; I109-F134 HydrophobicContact CG2-CZ 3.39Å; I109-V617 HydrophobicContact CD1-CG2 3.65Å; I109-V617 HydrophobicContact CG1-CG2 4.37Å; I109-V617 HydrophobicContact CG2-CB 4.48Å; I109-V617 HydrophobicContact CG2-CG1 3.84Å; I109-V617 HydrophobicContact CG2-CG2 4.13Å
110	V	84.6	Confident	83.3	Confident	17 Å²	17	45 Å²	45	10%	0.103	22%	0.224	C	C	.	.	S	Bend	trans	-115.3	140.6	-174.6	172	0	0	0	0	109.3	L99 E102 A112	L99-V110 HydrophobicContact CD1-CB 4.01Å; L99-V110 HydrophobicContact CD1-CG2 3.49Å; L99-V110 VanDerWaalsContact CD1-CG2 3.49Å; E102-V110 PolarHBondContact OE1-N 3.03Å; V110-A112 PolarHBondContact O-N 3.14Å; V110-A112 VanDerWaalsContact O-N 3.15Å
111	T	85.6	Confident	84.1	Confident	4 Å²	4	44.2 Å²	44.2	3%	0.025	22%	0.215	C	C	.	.			trans	-67	116.9	-179.3	-69.2	0	0	0	0	110.9	L126 D127 T128 P129 E137 S141 R443	T111-L126 HydrophobicContact CG2-CB 3.85Å; T111-L126 HydrophobicContact CG2-CD2 4.32Å; T111-L126 HydrophobicContact CG2-CG 4.48Å; T111-D127 CarbonylContact C-O 3.59Å; T111-D127 WeakPolarHBondContact CA-O 3.47Å; T111-D127 WeakPolarHBondContact CG2-O 3.41Å; T111-T128 HydrophobicContact CG2-CG2 4.29Å; T111-P129 WeakPolarHBondContact OG1-CD 3.15Å; T111-E137 PolarHBondContact N-OE1 3.08Å; T111-E137 VanDerWaalsContact N-OE1 3.09Å; T111-E137 WeakPolarHBondContact OG1-CG 3.16Å; T111-S141 WeakPolarHBondContact CG2-OG 3.43Å; T111-S141 PolarHBondContact OG1-OG 2.94Å; T111-R443 VanDerWaalsContact N-NH1 3.2Å; T111-R443 PolarHBondContact O-NH1 3.27Å
112	A	85.5	Confident	84.8	Confident	10 Å²	10	45.9 Å²	45.9	8%	0.083	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	132.5	174.4	0	0	0	0	0	109.9	T96 V110 L126 D127	T96-A112 HydrophobicContact CG2-CB 3.86Å; V110-A112 PolarHBondContact O-N 3.14Å; V110-A112 VanDerWaalsContact O-N 3.15Å; A112-L126 WeakPolarHBondContact O-CA 3.46Å; A112-D127 HydrophobicContact CB-CB 4.26Å; A112-D127 PolarHBondContact N-O 2.67Å; A112-D127 PolarHBondContact O-N 3.26Å
113	S	87.7	Confident	85.4	Confident	12 Å²	12	45.9 Å²	45.9	8%	0.084	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	126.6	175.1	-175.3	0	0	0	0	110.5	L125 L126 G492	S113-L125 WeakPolarHBondContact CA-O 3.15Å; S113-L126 WeakPolarHBondContact OG-CD2 3.22Å; S113-G492 WeakPolarHBondContact O-CA 3.34Å; S113-G492 PolarHBondContact O-N 3.14Å
114	A	87	Confident	86	Confident	3 Å²	3	40.7 Å²	40.7	3%	0.025	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	142.1	177.7	0	0	0	0	0	111.6	L77 L125 L490	L77-A114 HydrophobicContact CD1-CB 4.26Å; L77-A114 HydrophobicContact CD2-CB 3.76Å; A114-L125 PolarHBondContact N-O 2.97Å; A114-L125 PolarHBondContact O-N 3.46Å; A114-L490 CarbonylContact C-O 3.5Å
115	S	88.5	Confident	86.6	Confident	4 Å²	4	32.9 Å²	32.9	3%	0.028	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	119.1	177.4	-49.7	0	0	0	0	109.9	R82 H124 Q489 L490	R82-S115 PolarHBondContact NE-O 2.78Å; S115-H124 PolarHBondContact OG-ND1 3.04Å; S115-Q489 PolarHBondContact OG-NE2 2.92Å; S115-L490 WeakPolarHBondContact CB-O 3.19Å; S115-L490 PolarHBondContact N-O 3.09Å; S115-L490 PolarHBondContact OG-O 2.91Å
116	L	89.8	Confident	87.3	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	152	-178.7	69	84	0	0	0	111	M76 L77 A80 R82 W118 I123 L125 L382	M76-L116 HydrophobicContact CB-CD2 4.13Å; L77-L116 HydrophobicContact CD2-CB 4.31Å; L77-L116 HydrophobicContact CD2-CD2 4.19Å; A80-L116 HydrophobicContact CB-CB 3.7Å; A80-L116 HydrophobicContact CB-CD1 4.05Å; A80-L116 HydrophobicContact CB-CD2 4.49Å; A80-L116 HydrophobicContact CB-CG 4.3Å; R82-L116 HydrophobicContact CG-CB 4.35Å; L116-W118 HydrophobicContact CD1-CB 4.2Å; L116-I123 HydrophobicContact CD1-CB 3.67Å; L116-I123 HydrophobicContact CD1-CD1 3.71Å; L116-I123 HydrophobicContact CD1-CG1 4.09Å; L116-I123 HydrophobicContact CD1-CG2 4.39Å; L116-I123 HydrophobicContact CG-CB 3.95Å; L116-I123 HydrophobicContact CG-CG2 4.42Å; L116-I123 PolarHBondContact N-O 3.43Å; L116-I123 PolarHBondContact O-N 3.48Å; L116-L125 HydrophobicContact CD2-CD2 4.15Å; L116-L382 HydrophobicContact CD1-CD2 4.14Å
117	S	89.2	Confident	88	Confident	60 Å²	60	27.1 Å²	27.1	42%	0.42	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	123.7	179.2	174.8	0	0	0	0	109	H121	S117-H121 WeakPolarHBondContact CA-O 3.03Å
118	W	90.3	Very high	88.5	Confident	46 Å²	46	26 Å²	26	17%	0.174	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	127.5	178.9	-168.2	-106.5	0	0	0	110.1	L116 N120 H121 I123 Q379 L382 D383	L116-W118 HydrophobicContact CD1-CB 4.2Å; W118-N120 VanDerWaalsContact C-N 3.31Å; W118-N120 PolarHBondContact O-N 2.82Å; W118-H121 PolarHBondContact N-O 2.99Å; W118-H121 WeakPolarHBondContact O-CA 3.26Å; W118-H121 WeakPolarHBondContact O-CB 3.27Å; W118-H121 PolarHBondContact O-N 2.89Å; W118-I123 HydrophobicContact CB-CD1 3.97Å; W118-Q379 HydrophobicContact CH2-CG 4.23Å; W118-Q379 HydrophobicContact CZ2-CB 4.26Å; W118-Q379 HydrophobicContact CZ2-CG 4.48Å; W118-L382 HydrophobicContact CD2-CB 4.03Å; W118-L382 HydrophobicContact CD2-CD1 3.94Å; W118-L382 HydrophobicContact CD2-CG 4.5Å; W118-L382 HydrophobicContact CE3-CD1 3.92Å; W118-L382 HydrophobicContact CG-CB 4.08Å; W118-L382 HydrophobicContact CH2-CD1 4.19Å; W118-L382 HydrophobicContact CZ2-CB 4.25Å; W118-L382 HydrophobicContact CZ2-CD1 4.21Å; W118-L382 HydrophobicContact CZ3-CD1 4.05Å; W118-D383 PolarHBondContact NE1-OD1 3.38Å
119	R	88.7	Confident	88.8	Confident	129 Å²	129	25.7 Å²	25.7	49%	0.487	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.6	47.4	-178.2	-63.4	-178.6	174.8	-168.7	-2.3	114.2	H121 D383 D387	R119-H121 PolarHBondContact O-N 2.61Å; R119-H121 VanDerWaalsContact O-N 3.15Å; R119-H121 PolarHBondContact O-ND1 2.75Å; R119-D383 IonicContact CZ-OD1 3.93Å; R119-D383 IonicContact CZ-OD2 3.11Å; R119-D383 IonicContact NE-OD1 3.14Å; R119-D383 PolarHBondContact NE-OD1 3.32Å; R119-D383 IonicContact NH1-OD1 2.63Å; R119-D383 IonicContact NH2-OD1 2.83Å; R119-D383 PolarHBondContact NH2-OD1 3.29Å; R119-D383 IonicContact NH2-OD2 3.07Å; R119-D383 PolarHBondContact NH2-OD2 3.4Å; R119-D387 IonicContact NH1-OD1 3.97Å; R119-D387 IonicContact NH1-OD2 3.55Å
120	N	87.1	Confident	88.6	Confident	152 Å²	152	25.9 Å²	25.9	81%	0.813	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.4	14.3	-175.2	-61	-12.9	0	0	0	115.8	W118	W118-N120 VanDerWaalsContact C-N 3.31Å; W118-N120 PolarHBondContact O-N 2.82Å
121	H	89.9	Confident	88.3	Confident	41 Å²	41	27.1 Å²	27.1	19%	0.19	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	148.5	171.7	-65.9	69.4	0	0	0	109.9	T55 S117 W118 R119 V386	T55-H121 CarbonylContact O-C 3.59Å; T55-H121 WeakPolarHBondContact O-CA 3.25Å; T55-H121 VanDerWaalsContact O-CB 3.27Å; T55-H121 WeakPolarHBondContact O-CB 3.46Å; S117-H121 WeakPolarHBondContact CA-O 3.03Å; W118-H121 PolarHBondContact N-O 2.99Å; W118-H121 WeakPolarHBondContact O-CA 3.26Å; W118-H121 WeakPolarHBondContact O-CB 3.27Å; W118-H121 PolarHBondContact O-N 2.89Å; R119-H121 PolarHBondContact O-N 2.61Å; R119-H121 VanDerWaalsContact O-N 3.15Å; R119-H121 PolarHBondContact O-ND1 2.75Å; H121-V386 HydrophobicContact CB-CG1 4.32Å; H121-V386 HydrophobicContact CB-CG2 4.06Å; H121-V386 WeakPolarHBondContact ND1-CG1 3.27Å
122	I	91	Very high	87.8	Confident	48 Å²	48	28.3 Å²	28.3	25%	0.246	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	118.8	173.4	-57.9	-176.4	0	0	0	107.9	P51 T55 I56 R57	P51-I122 HydrophobicContact CB-CD1 4Å; P51-I122 HydrophobicContact CG-CD1 3.68Å; T55-I122 PolarHBondContact O-N 2.69Å; I56-I122 CarbonylContact C-O 3.58Å; I56-I122 WeakPolarHBondContact CA-O 3.36Å; R57-I122 PolarHBondContact N-O 3.25Å
123	I	93	Very high	87.3	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	114.4	174.5	-58.8	167.5	0	0	0	107	R57 V59 L116 W118 L382 I385 V386	R57-I123 HydrophobicContact CB-CG1 4.18Å; R57-I123 CarbonylContact O-C 3.46Å; R57-I123 WeakPolarHBondContact O-CA 3.12Å; V59-I123 HydrophobicContact CG2-CG2 4.19Å; L116-I123 HydrophobicContact CD1-CB 3.67Å; L116-I123 HydrophobicContact CD1-CD1 3.71Å; L116-I123 HydrophobicContact CD1-CG1 4.09Å; L116-I123 HydrophobicContact CD1-CG2 4.39Å; L116-I123 HydrophobicContact CG-CB 3.95Å; L116-I123 HydrophobicContact CG-CG2 4.42Å; L116-I123 PolarHBondContact N-O 3.43Å; L116-I123 PolarHBondContact O-N 3.48Å; W118-I123 HydrophobicContact CB-CD1 3.97Å; I123-L382 HydrophobicContact CD1-CD2 4.12Å; I123-I385 HydrophobicContact CD1-CG2 3.78Å; I123-I385 HydrophobicContact CG1-CG2 4.12Å; I123-I385 HydrophobicContact CG2-CG2 4.35Å; I123-V386 HydrophobicContact CD1-CG2 4.04Å
124	H	93.2	Very high	87	Confident	4 Å²	4	28.1 Å²	28.1	2%	0.019	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	112.5	166.4	-61.5	-59.2	0	0	0	107.9	R57 N58 V59 S115 Q489 I506	R57-H124 PolarHBondContact O-N 3.02Å; N58-H124 WeakPolarHBondContact OD1-CB 3.48Å; N58-H124 PolarHBondContact OD1-CD2 3.49Å; V59-H124 PolarHBondContact N-O 2.95Å; S115-H124 PolarHBondContact OG-ND1 3.04Å; H124-Q489 PolarHBondContact CE1-NE2 2.83Å; H124-Q489 PolarHBondContact ND1-NE2 2.83Å; H124-I506 HydrophobicContact CB-CB 4.49Å; H124-I506 HydrophobicContact CB-CD1 4.1Å; H124-I506 HydrophobicContact CB-CG1 4.45Å
125	L	93.2	Very high	86.6	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.005	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	126	-175.8	-170.3	63	0	0	0	109.6	V59 L61 T73 M76 S113 A114 L116	V59-L125 HydrophobicContact CB-CD1 4.39Å; V59-L125 HydrophobicContact CG1-CD1 4.46Å; V59-L125 WeakPolarHBondContact O-CA 3.24Å; L61-L125 HydrophobicContact CD1-CD1 4Å; L61-L125 HydrophobicContact CD1-CD2 4.33Å; L61-L125 HydrophobicContact CD1-CG 4.39Å; L61-L125 HydrophobicContact CD2-CD1 3.99Å; L61-L125 HydrophobicContact CG-CD1 3.73Å; L61-L125 HydrophobicContact CG-CG 4.49Å; T73-L125 HydrophobicContact CG2-CD2 3.72Å; T73-L125 HydrophobicContact CG2-CG 4.49Å; M76-L125 HydrophobicContact CB-CD2 4.42Å; M76-L125 HydrophobicContact CE-CD1 4.13Å; M76-L125 HydrophobicContact CE-CD2 4.16Å; M76-L125 HydrophobicContact SD-CD1 4.47Å; M76-L125 HydrophobicContact SD-CD2 4.02Å; S113-L125 WeakPolarHBondContact CA-O 3.15Å; A114-L125 PolarHBondContact N-O 2.97Å; A114-L125 PolarHBondContact O-N 3.46Å; L116-L125 HydrophobicContact CD2-CD2 4.15Å
126	L	92.7	Very high	86.3	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.005	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	113.6	170.9	-61.5	-172.5	0	0	0	109.6	V59 G60 L61 T111 A112 S113 V144 L145 F442 I506	V59-L126 PolarHBondContact O-N 2.99Å; G60-L126 CarbonylContact C-O 3.58Å; G60-L126 WeakPolarHBondContact CA-O 3.28Å; L61-L126 PolarHBondContact N-O 3.4Å; T111-L126 HydrophobicContact CG2-CB 3.85Å; T111-L126 HydrophobicContact CG2-CD2 4.32Å; T111-L126 HydrophobicContact CG2-CG 4.48Å; A112-L126 WeakPolarHBondContact O-CA 3.46Å; S113-L126 WeakPolarHBondContact OG-CD2 3.22Å; L126-V144 HydrophobicContact CD1-CG2 3.89Å; L126-L145 HydrophobicContact CB-CD1 4.48Å; L126-L145 HydrophobicContact CB-CD2 4.2Å; L126-L145 HydrophobicContact CD1-CD1 4.29Å; L126-L145 HydrophobicContact CD1-CD2 3.7Å; L126-L145 HydrophobicContact CD1-CG 3.96Å; L126-L145 HydrophobicContact CG-CD2 3.9Å; L126-F442 HydrophobicContact CD1-CE2 4.33Å; L126-I506 HydrophobicContact CD1-CD1 4.38Å
127	D	91.2	Very high	86	Confident	2 Å²	2	29.3 Å²	29.3	1%	0.011	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	109.2	174.1	-165.8	0.4	0	0	0	109.3	T70 T73 T111 A112	T70-D127 WeakPolarHBondContact CA-OD2 3.29Å; T73-D127 WeakPolarHBondContact CB-OD2 3.21Å; T73-D127 HydrophobicContact CG2-CB 4.13Å; T73-D127 PolarHBondContact OG1-OD2 2.93Å; T111-D127 CarbonylContact C-O 3.59Å; T111-D127 WeakPolarHBondContact CA-O 3.47Å; T111-D127 WeakPolarHBondContact CG2-O 3.41Å; A112-D127 HydrophobicContact CB-CB 4.26Å; A112-D127 PolarHBondContact N-O 2.67Å; A112-D127 PolarHBondContact O-N 3.26Å
128	T	90.2	Very high	86	Confident	1 Å²	1	26.6 Å²	26.6	1%	0.006	13%	0.127	C	C	.	.			trans	-95.6	149.8	-171.6	68.7	0	0	0	0	112	L61 K69 T111	L61-T128 PolarHBondContact O-N 3.49Å; L61-T128 PolarHBondContact O-OG1 3.32Å; K69-T128 WeakPolarHBondContact CE-O 3.49Å; T111-T128 HydrophobicContact CG2-CG2 4.29Å
129	P	86.2	Confident	85.7	Confident	1 Å²	1	24.6 Å²	24.6	1%	0.006	12%	0.12	C	C	.	.			trans	-63.5	140.1	177	26.5	-33.8	0	0	0	111	S108 T111 F134 E137 V138	S108-P129 WeakPolarHBondContact O-CB 3.35Å; T111-P129 WeakPolarHBondContact OG1-CD 3.15Å; P129-F134 HydrophobicContact CB-CB 3.79Å; P129-F134 HydrophobicContact CB-CD2 4.39Å; P129-F134 HydrophobicContact CB-CG 4.44Å; P129-F134 HydrophobicContact CG-CB 3.59Å; P129-E137 HydrophobicContact CG-CB 3.85Å; P129-E137 HydrophobicContact CG-CG 3.89Å; P129-V138 HydrophobicContact CG-CG2 3.87Å; P129-V138 WeakPolarHBondContact O-CG2 3.19Å
130	G	76.1	Confident	85.6	Confident	6 Å²	6	18.8 Å²	18.8	6%	0.062	10%	0.098	C	C	.	.			trans	-89.4	-9.3	177.2	0	0	0	0	0	114.5	A63 K69 Q161	A63-G130 VanDerWaalsContact O-CA 3.26Å; A63-G130 WeakPolarHBondContact O-CA 3.34Å; K69-G130 VanDerWaalsContact NZ-CA 3.32Å; G130-Q161 PolarHBondContact O-OE1 3.03Å
131	H	79.2	Confident	85.7	Confident	43 Å²	43	11.6 Å²	11.6	20%	0.199	6%	0.06	C	C	.	.	S	Bend	trans	-86.4	142.8	-170.8	-162.9	-77.9	0	0	0	111.2	I65 D133 F134	I65-H131 HydrophobicContact CD1-CB 4.25Å; I65-H131 WeakPolarHBondContact CD1-CD2 3.34Å; I65-H131 HydrophobicContact CG1-CB 4.37Å; H131-D133 IonicContact CE1-OD1 3.38Å; H131-D133 PolarHBondContact CE1-OD1 3.28Å; H131-D133 IonicContact CE1-OD2 3.86Å; H131-D133 WeakPolarHBondContact ND1-CB 3.32Å; H131-D133 PolarHBondContact ND1-N 3.4Å; H131-D133 VanDerWaalsContact ND1-N 3.19Å; H131-D133 IonicContact ND1-OD1 2.8Å; H131-D133 PolarHBondContact ND1-OD1 2.95Å; H131-D133 PolarHBondContact O-N 2.84Å; H131-F134 HydrophobicContact CB-CD2 4.07Å; H131-F134 PolarHBondContact O-N 3.5Å; H131-F134 VanDerWaalsContact O-N 3.12Å
132	V	73.2	Confident	85.6	Confident	30 Å²	30	9.6 Å²	9.6	18%	0.182	5%	0.051	C	C	.	.	G	3₁₀ helix	trans	-59.6	-33.3	-177.4	179.2	0	0	0	0	112.1	F134 T135 Q161	V132-F134 PolarHBondContact O-N 2.68Å; V132-T135 HydrophobicContact CG1-CG2 4.45Å; V132-T135 WeakPolarHBondContact O-CG2 3.45Å; V132-T135 PolarHBondContact O-N 3.28Å; V132-T135 PolarHBondContact O-OG1 3.48Å; V132-Q161 HydrophobicContact CG2-CG 3.65Å
133	D	75.9	Confident	85.4	Confident	5 Å²	5	7.8 Å²	7.8	3%	0.027	4%	0.042	C	C	.	.	G	3₁₀ helix	trans	-65.5	-18.9	-179.2	-63.8	29.3	0	0	0	113.7	H131 M610 G611 L613 H614 R870	H131-D133 IonicContact CE1-OD1 3.38Å; H131-D133 PolarHBondContact CE1-OD1 3.28Å; H131-D133 IonicContact CE1-OD2 3.86Å; H131-D133 WeakPolarHBondContact ND1-CB 3.32Å; H131-D133 PolarHBondContact ND1-N 3.4Å; H131-D133 VanDerWaalsContact ND1-N 3.19Å; H131-D133 IonicContact ND1-OD1 2.8Å; H131-D133 PolarHBondContact ND1-OD1 2.95Å; H131-D133 PolarHBondContact O-N 2.84Å; D133-M610 VanDerWaalsContact O-CB 3.31Å; D133-M610 WeakPolarHBondContact O-CB 3.15Å; D133-G611 WeakPolarHBondContact OD2-CA 3.43Å; D133-L613 HydrophobicContact CB-CB 4.24Å; D133-L613 WeakPolarHBondContact OD2-CB 3.39Å; D133-L613 PolarHBondContact OD2-N 3.03Å; D133-H614 HydrophobicContact CB-CB 4.25Å; D133-R870 IonicContact OD1-CZ 2.68Å; D133-R870 IonicContact OD1-NH1 3.68Å; D133-R870 PolarHBondContact OD1-NH1 3.15Å; D133-R870 IonicContact OD1-NH2 3.87Å; D133-R870 PolarHBondContact OD1-NH2 2.74Å; D133-R870 IonicContact OD2-NH1 3.75Å; D133-R870 PolarHBondContact OD2-NH1 3.32Å; D133-R870 VanDerWaalsContact OD2-NH1 3.14Å; D133-R870 IonicContact OD2-NH2 3.23Å
134	F	81.7	Confident	85.2	Confident	12 Å²	12	7.8 Å²	7.8	5%	0.053	4%	0.042	C	C	.	.	G	3₁₀ helix	trans	-115.5	25.8	180	-53.4	-65.4	0	0	0	111.7	I109 P129 H131 V132 F136 E137 V138 L613 H614 V617	I109-F134 HydrophobicContact CB-CD2 4.45Å; I109-F134 HydrophobicContact CB-CE2 4.07Å; I109-F134 HydrophobicContact CB-CZ 4.24Å; I109-F134 HydrophobicContact CG1-CE2 3.81Å; I109-F134 HydrophobicContact CG1-CZ 4.13Å; I109-F134 HydrophobicContact CG2-CD1 4.04Å; I109-F134 HydrophobicContact CG2-CD2 4.15Å; I109-F134 HydrophobicContact CG2-CE1 3.55Å; I109-F134 HydrophobicContact CG2-CE2 3.69Å; I109-F134 HydrophobicContact CG2-CG 4.34Å; I109-F134 HydrophobicContact CG2-CZ 3.39Å; P129-F134 HydrophobicContact CB-CB 3.79Å; P129-F134 HydrophobicContact CB-CD2 4.39Å; P129-F134 HydrophobicContact CB-CG 4.44Å; P129-F134 HydrophobicContact CG-CB 3.59Å; H131-F134 HydrophobicContact CB-CD2 4.07Å; H131-F134 PolarHBondContact O-N 3.5Å; H131-F134 VanDerWaalsContact O-N 3.12Å; V132-F134 PolarHBondContact O-N 2.68Å; F134-F136 PolarHBondContact O-N 2.74Å; F134-E137 HydrophobicContact CB-CB 4.33Å; F134-E137 WeakPolarHBondContact O-CB 3.48Å; F134-E137 PolarHBondContact O-N 3.31Å; F134-V138 PolarHBondContact O-N 2.91Å; F134-L613 HydrophobicContact CE2-CD2 3.69Å; F134-L613 HydrophobicContact CE2-CG 4.27Å; F134-L613 HydrophobicContact CZ-CD2 4.21Å; F134-L613 HydrophobicContact CZ-CG 4.29Å; F134-H614 HydrophobicContact CE1-CB 4.07Å; F134-H614 AromaticContact CE1-CD2 3.8Å; F134-V617 HydrophobicContact CZ-CB 4.43Å; F134-V617 HydrophobicContact CZ-CG2 3.96Å
135	T	79	Confident	85.2	Confident	15 Å²	15	7.8 Å²	7.8	9%	0.092	4%	0.042	C	C	.	.	H	α-helix	trans	-54.1	-35.4	175.7	45	0	0	0	0	112.4	V132 V138 E139	V132-T135 HydrophobicContact CG1-CG2 4.45Å; V132-T135 WeakPolarHBondContact O-CG2 3.45Å; V132-T135 PolarHBondContact O-N 3.28Å; V132-T135 PolarHBondContact O-OG1 3.48Å; T135-V138 WeakPolarHBondContact O-CB 3.48Å; T135-V138 PolarHBondContact O-N 3.15Å; T135-E139 PolarHBondContact O-N 3.02Å
136	F	81	Confident	85.1	Confident	3 Å²	3	8 Å²	8	1%	0.013	4%	0.043	C	C	.	.	H	α-helix	trans	-65.5	-37.5	177.2	-174.3	-104.6	0	0	0	112.8	F134 V138 E139 R140 F558 V560 D591 P592	F134-F136 PolarHBondContact O-N 2.74Å; F136-V138 VanDerWaalsContact C-N 3.29Å; F136-V138 PolarHBondContact O-N 3.45Å; F136-E139 PolarHBondContact O-N 3.45Å; F136-R140 HydrophobicContact CD1-CG 4.26Å; F136-R140 VanDerWaalsContact CD1-NE 3.28Å; F136-R140 HydrophobicContact CE1-CG 3.83Å; F136-R140 HydrophobicContact CE2-CG 4.46Å; F136-R140 HydrophobicContact CZ-CG 3.92Å; F136-R140 VanDerWaalsContact O-CG 3.3Å; F136-R140 WeakPolarHBondContact O-CG 3.45Å; F136-R140 PolarHBondContact O-N 3.16Å; F136-F558 HydrophobicContact CE2-CB 3.64Å; F136-F558 HydrophobicContact CE2-CD2 4.38Å; F136-F558 HydrophobicContact CE2-CG 4.14Å; F136-F558 HydrophobicContact CZ-CB 4.12Å; F136-F558 AromaticContact CZ-CD2 3.99Å; F136-F558 HydrophobicContact CZ-CD2 3.99Å; F136-F558 HydrophobicContact CZ-CG 4.18Å; F136-V560 HydrophobicContact CE2-CB 4.42Å; F136-V560 HydrophobicContact CE2-CG1 4.49Å; F136-V560 HydrophobicContact CE2-CG2 3.93Å; F136-V560 HydrophobicContact CZ-CG2 4.37Å; F136-D591 WeakPolarHBondContact CD1-OD1 3.37Å; F136-D591 WeakPolarHBondContact CE1-OD1 3.42Å; F136-P592 HydrophobicContact CE1-CB 3.94Å; F136-P592 HydrophobicContact CE1-CG 3.95Å; F136-P592 HydrophobicContact CZ-CB 3.67Å; F136-P592 HydrophobicContact CZ-CG 3.84Å
137	E	84.7	Confident	85	Confident	16 Å²	16	8 Å²	8	8%	0.075	4%	0.043	C	C	.	.	H	α-helix	trans	-63.1	-37.6	172.6	-173.6	79.8	-168.4	0	0	110.9	T111 P129 F134 R140 S141 R443	T111-E137 PolarHBondContact N-OE1 3.08Å; T111-E137 VanDerWaalsContact N-OE1 3.09Å; T111-E137 WeakPolarHBondContact OG1-CG 3.16Å; P129-E137 HydrophobicContact CG-CB 3.85Å; P129-E137 HydrophobicContact CG-CG 3.89Å; F134-E137 HydrophobicContact CB-CB 4.33Å; F134-E137 WeakPolarHBondContact O-CB 3.48Å; F134-E137 PolarHBondContact O-N 3.31Å; E137-R140 IonicContact OE2-CZ 2.69Å; E137-R140 IonicContact OE2-NE 3.18Å; E137-R140 IonicContact OE2-NH1 3.34Å; E137-R140 IonicContact OE2-NH2 2.77Å; E137-R140 PolarHBondContact OE2-NH2 3.44Å; E137-S141 WeakPolarHBondContact O-CB 3.35Å; E137-S141 PolarHBondContact O-N 3.45Å; E137-S141 VanDerWaalsContact O-N 3.12Å; E137-S141 PolarHBondContact O-OG 3.16Å; E137-R443 IonicContact OE1-CZ 3.14Å; E137-R443 IonicContact OE1-NE 3.53Å; E137-R443 IonicContact OE1-NH1 3.71Å; E137-R443 PolarHBondContact OE1-NH1 3.3Å
138	V	87.5	Confident	85.1	Confident	2 Å²	2	7.9 Å²	7.9	1%	0.012	4%	0.043	C	C	.	.	H	α-helix	trans	-64.4	-49.1	173.9	-173.6	0	0	0	0	111	I62 P129 F134 T135 F136 R140 S141 L142 V165	I62-V138 HydrophobicContact CG2-CG1 4.38Å; P129-V138 HydrophobicContact CG-CG2 3.87Å; P129-V138 WeakPolarHBondContact O-CG2 3.19Å; F134-V138 PolarHBondContact O-N 2.91Å; T135-V138 WeakPolarHBondContact O-CB 3.48Å; T135-V138 PolarHBondContact O-N 3.15Å; F136-V138 VanDerWaalsContact C-N 3.29Å; F136-V138 PolarHBondContact O-N 3.45Å; V138-R140 VanDerWaalsContact C-N 3.34Å; V138-R140 PolarHBondContact O-N 2.82Å; V138-S141 WeakPolarHBondContact O-CB 3.3Å; V138-S141 PolarHBondContact O-N 3.34Å; V138-S141 VanDerWaalsContact O-N 3.1Å; V138-L142 HydrophobicContact CG1-CD1 3.95Å; V138-L142 HydrophobicContact CG1-CG 4.2Å; V138-L142 VanDerWaalsContact O-CG 3.31Å; V138-L142 WeakPolarHBondContact O-CG 3.37Å; V138-L142 PolarHBondContact O-N 2.94Å; V138-V165 HydrophobicContact CG1-CG1 3.64Å
139	E	85	Confident	85.4	Confident	5 Å²	5	7.9 Å²	7.9	2%	0.023	4%	0.042	C	C	.	.	H	α-helix	trans	-59.7	-44.5	179.7	-70.1	-164	174.8	0	0	112.2	T135 F136 S141 L142 T143 Q168 R171	T135-E139 PolarHBondContact O-N 3.02Å; F136-E139 PolarHBondContact O-N 3.45Å; E139-S141 VanDerWaalsContact C-N 3.26Å; E139-S141 PolarHBondContact O-N 3.42Å; E139-L142 PolarHBondContact O-N 3.08Å; E139-T143 VanDerWaalsContact O-CG2 3.3Å; E139-T143 WeakPolarHBondContact O-CG2 3.19Å; E139-T143 PolarHBondContact O-N 3.37Å; E139-T143 VanDerWaalsContact O-N 3.16Å; E139-Q168 HydrophobicContact CG-CG 4.22Å; E139-Q168 VanDerWaalsContact CG-NE2 3.26Å; E139-Q168 PolarHBondContact OE1-NE2 3.28Å; E139-R171 IonicContact OE1-NH1 3.66Å
140	R	86.4	Confident	85.8	Confident	6 Å²	6	8 Å²	8	2%	0.023	4%	0.043	C	C	.	.	H	α-helix	trans	-55.5	-44.7	174.6	-73.7	-171.8	-77.6	162	-13.7	111.9	F136 E137 V138 T143 F442 T517 F558 E590 D591	F136-R140 HydrophobicContact CD1-CG 4.26Å; F136-R140 VanDerWaalsContact CD1-NE 3.28Å; F136-R140 HydrophobicContact CE1-CG 3.83Å; F136-R140 HydrophobicContact CE2-CG 4.46Å; F136-R140 HydrophobicContact CZ-CG 3.92Å; F136-R140 VanDerWaalsContact O-CG 3.3Å; F136-R140 WeakPolarHBondContact O-CG 3.45Å; F136-R140 PolarHBondContact O-N 3.16Å; E137-R140 IonicContact OE2-CZ 2.69Å; E137-R140 IonicContact OE2-NE 3.18Å; E137-R140 IonicContact OE2-NH1 3.34Å; E137-R140 IonicContact OE2-NH2 2.77Å; E137-R140 PolarHBondContact OE2-NH2 3.44Å; V138-R140 VanDerWaalsContact C-N 3.34Å; V138-R140 PolarHBondContact O-N 2.82Å; R140-T143 PolarHBondContact O-N 3.46Å; R140-T143 PolarHBondContact O-OG1 3.37Å; R140-F442 WeakPolarHBondContact CD-O 3.18Å; R140-T517 HydrophobicContact CG-CG2 4.27Å; R140-F558 HydrophobicContact CB-CE1 4.14Å; R140-F558 HydrophobicContact CB-CZ 4.37Å; R140-F558 HydrophobicContact CG-CD1 3.94Å; R140-F558 HydrophobicContact CG-CD2 4.24Å; R140-F558 HydrophobicContact CG-CE1 3.78Å; R140-F558 HydrophobicContact CG-CE2 4.03Å; R140-F558 HydrophobicContact CG-CG 4.19Å; R140-F558 HydrophobicContact CG-CZ 3.83Å; R140-E590 PolarHBondContact NH1-O 2.98Å; R140-D591 IonicContact NH2-OD1 2.66Å; R140-D591 IonicContact NH2-OD2 3.36Å
141	S	89.1	Confident	86.6	Confident	1 Å²	1	7.7 Å²	7.7	1%	0.007	4%	0.04	C	C	.	.	H	α-helix	trans	-65.7	-43	178.9	-52.9	0	0	0	0	111.5	T111 E137 V138 E139 T143 V144 L145	T111-S141 WeakPolarHBondContact CG2-OG 3.43Å; T111-S141 PolarHBondContact OG1-OG 2.94Å; E137-S141 WeakPolarHBondContact O-CB 3.35Å; E137-S141 PolarHBondContact O-N 3.45Å; E137-S141 VanDerWaalsContact O-N 3.12Å; E137-S141 PolarHBondContact O-OG 3.16Å; V138-S141 WeakPolarHBondContact O-CB 3.3Å; V138-S141 PolarHBondContact O-N 3.34Å; V138-S141 VanDerWaalsContact O-N 3.1Å; E139-S141 VanDerWaalsContact C-N 3.26Å; E139-S141 PolarHBondContact O-N 3.42Å; S141-T143 VanDerWaalsContact C-N 3.29Å; S141-T143 PolarHBondContact O-N 3.47Å; S141-V144 WeakPolarHBondContact O-CG2 3.37Å; S141-V144 PolarHBondContact O-N 3.44Å; S141-L145 WeakPolarHBondContact O-CD1 3.49Å; S141-L145 VanDerWaalsContact O-CG 3.23Å; S141-L145 WeakPolarHBondContact O-CG 3.36Å
142	L	89.1	Confident	87.3	Confident	0 Å²	0	5.8 Å²	5.8	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-61.6	-34.2	179.6	-67.5	173.3	0	0	0	112.7	I62 V138 E139 V144 L145 V148 Q168 A169 Y172 L174	I62-L142 HydrophobicContact CG2-CD2 4.29Å; V138-L142 HydrophobicContact CG1-CD1 3.95Å; V138-L142 HydrophobicContact CG1-CG 4.2Å; V138-L142 VanDerWaalsContact O-CG 3.31Å; V138-L142 WeakPolarHBondContact O-CG 3.37Å; V138-L142 PolarHBondContact O-N 2.94Å; E139-L142 PolarHBondContact O-N 3.08Å; L142-V144 PolarHBondContact O-N 3.13Å; L142-V144 VanDerWaalsContact O-N 3.15Å; L142-L145 HydrophobicContact CD2-CD1 4.33Å; L142-L145 PolarHBondContact O-N 3.36Å; L142-V148 HydrophobicContact CD2-CG1 4.49Å; L142-V148 HydrophobicContact CD2-CG2 3.57Å; L142-Q168 HydrophobicContact CD1-CB 3.64Å; L142-A169 HydrophobicContact CD2-CB 4.32Å; L142-Y172 HydrophobicContact CB-CD2 3.83Å; L142-Y172 HydrophobicContact CB-CE2 4.21Å; L142-Y172 HydrophobicContact CD1-CD2 4.45Å; L142-L174 HydrophobicContact CB-CD1 4.02Å; L142-L174 HydrophobicContact CD2-CD1 3.81Å; L142-L174 HydrophobicContact CG-CD1 4.49Å; L142-L174 WeakPolarHBondContact O-CD1 3.49Å
143	T	86.2	Confident	88.3	Confident	9 Å²	9	4.4 Å²	4.4	6%	0.055	2%	0.023	C	C	.	.	H	α-helix	trans	-61.6	-24.8	179.7	67.9	0	0	0	0	114.8	E139 R140 S141 Y172 Y459 F558	E139-T143 VanDerWaalsContact O-CG2 3.3Å; E139-T143 WeakPolarHBondContact O-CG2 3.19Å; E139-T143 PolarHBondContact O-N 3.37Å; E139-T143 VanDerWaalsContact O-N 3.16Å; R140-T143 PolarHBondContact O-N 3.46Å; R140-T143 PolarHBondContact O-OG1 3.37Å; S141-T143 VanDerWaalsContact C-N 3.29Å; S141-T143 PolarHBondContact O-N 3.47Å; T143-Y172 HydrophobicContact CG2-CD1 4.31Å; T143-Y172 HydrophobicContact CG2-CE1 3.62Å; T143-Y172 HydrophobicContact CG2-CE2 4.38Å; T143-Y459 PolarHBondContact O-OH 3.47Å; T143-F558 HydrophobicContact CG2-CD1 3.73Å; T143-F558 HydrophobicContact CG2-CE1 3.57Å
144	V	89.3	Confident	89	Confident	0 Å²	0	4.2 Å²	4.2	0%	0	2%	0.022	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	2.1	-177.6	-67.2	0	0	0	0	113.3	L126 S141 L142 L440 F442 R457	L126-V144 HydrophobicContact CD1-CG2 3.89Å; S141-V144 WeakPolarHBondContact O-CG2 3.37Å; S141-V144 PolarHBondContact O-N 3.44Å; L142-V144 PolarHBondContact O-N 3.13Å; L142-V144 VanDerWaalsContact O-N 3.15Å; V144-L440 HydrophobicContact CG1-CD2 3.94Å; V144-L440 HydrophobicContact CG1-CG 4.29Å; V144-F442 HydrophobicContact CB-CB 4.5Å; V144-F442 HydrophobicContact CB-CD1 4.21Å; V144-F442 HydrophobicContact CB-CG 4.29Å; V144-F442 HydrophobicContact CG1-CB 3.54Å; V144-F442 HydrophobicContact CG1-CD1 3.63Å; V144-F442 HydrophobicContact CG1-CE1 4.48Å; V144-F442 HydrophobicContact CG1-CG 3.7Å; V144-F442 HydrophobicContact CG2-CB 4.17Å; V144-F442 HydrophobicContact CG2-CD1 3.91Å; V144-F442 HydrophobicContact CG2-CD2 3.81Å; V144-F442 HydrophobicContact CG2-CE1 4.19Å; V144-F442 HydrophobicContact CG2-CE2 4.12Å; V144-F442 HydrophobicContact CG2-CG 3.69Å; V144-F442 HydrophobicContact CG2-CZ 4.29Å; V144-R457 HydrophobicContact CB-CB 3.96Å; V144-R457 HydrophobicContact CG1-CB 3.74Å; V144-R457 WeakPolarHBondContact O-CD 3.42Å; V144-R457 PolarHBondContact O-NH1 2.93Å
145	L	92	Very high	89.5	Confident	5 Å²	5	6.5 Å²	6.5	3%	0.026	4%	0.037	C	C	.	.			trans	-93.8	159.4	-180	-70.6	167.9	0	0	0	111.7	N58 L126 S141 L142 L174 R457	N58-L145 HydrophobicContact CB-CD2 4.35Å; L126-L145 HydrophobicContact CB-CD1 4.48Å; L126-L145 HydrophobicContact CB-CD2 4.2Å; L126-L145 HydrophobicContact CD1-CD1 4.29Å; L126-L145 HydrophobicContact CD1-CD2 3.7Å; L126-L145 HydrophobicContact CD1-CG 3.96Å; L126-L145 HydrophobicContact CG-CD2 3.9Å; S141-L145 WeakPolarHBondContact O-CD1 3.49Å; S141-L145 VanDerWaalsContact O-CG 3.23Å; S141-L145 WeakPolarHBondContact O-CG 3.36Å; L142-L145 HydrophobicContact CD2-CD1 4.33Å; L142-L145 PolarHBondContact O-N 3.36Å; L145-L174 HydrophobicContact CB-CD1 4.44Å; L145-L174 VanDerWaalsContact O-CD2 3.23Å; L145-L174 WeakPolarHBondContact O-CD2 3.48Å; L145-R457 PolarHBondContact O-NH1 2.78Å
146	D	91.1	Very high	89.9	Confident	6 Å²	6	10.9 Å²	10.9	3%	0.032	5%	0.054	C	C	.	.	S	Bend	trans	-105.2	-22	174.7	-64.9	-37.4	0	0	0	112.1	N58 P175 P390 P392 S395 R457	N58-D146 HydrophobicContact CB-CB 4.19Å; N58-D146 WeakPolarHBondContact CB-OD2 3.36Å; N58-D146 PolarHBondContact ND2-OD2 3.45Å; N58-D146 PolarHBondContact O-N 3.38Å; N58-D146 VanDerWaalsContact O-N 3.07Å; D146-P175 WeakPolarHBondContact O-CD 3.17Å; D146-P390 HydrophobicContact CB-CG 4.4Å; D146-P390 WeakPolarHBondContact O-CG 3.43Å; D146-P392 WeakPolarHBondContact OD2-CG 3.44Å; D146-S395 WeakPolarHBondContact OD1-CB 3.16Å; D146-S395 PolarHBondContact OD1-OG 2.96Å; D146-R457 IonicContact OD1-CZ 2.87Å; D146-R457 IonicContact OD1-NH1 3.81Å; D146-R457 PolarHBondContact OD1-NH1 3.28Å; D146-R457 IonicContact OD1-NH2 2.78Å; D146-R457 PolarHBondContact OD1-NH2 2.98Å; D146-R457 IonicContact OD2-CZ 3.6Å; D146-R457 IonicContact OD2-NH1 2.76Å; D146-R457 IonicContact OD2-NH2 3Å; D146-R457 PolarHBondContact OD2-NH2 2.96Å
147	S	91.9	Very high	90.2	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	160.4	-178.5	55.2	0	0	0	0	110.4	N58 V59 G60 P175 L389	N58-S147 PolarHBondContact O-N 3.37Å; N58-S147 PolarHBondContact O-OG 3.21Å; V59-S147 WeakPolarHBondContact CA-O 3.28Å; G60-S147 PolarHBondContact N-O 3.32Å; S147-P175 WeakPolarHBondContact CA-O 3.37Å; S147-L389 WeakPolarHBondContact OG-CD1 3.4Å
148	V	93.4	Very high	90.3	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	135.6	-175.5	-179.6	0	0	0	0	110.4	G60 I62 L142 A169 L174 P175 C176 V177	G60-V148 CarbonylContact O-C 3.56Å; G60-V148 WeakPolarHBondContact O-CA 3.47Å; I62-V148 HydrophobicContact CB-CG1 4.12Å; I62-V148 HydrophobicContact CD1-CG1 3.47Å; I62-V148 VanDerWaalsContact CD1-CG1 3.47Å; I62-V148 HydrophobicContact CG1-CG1 3.4Å; I62-V148 VanDerWaalsContact CG1-CG1 3.4Å; I62-V148 HydrophobicContact CG2-CG1 3.74Å; L142-V148 HydrophobicContact CD2-CG1 4.49Å; L142-V148 HydrophobicContact CD2-CG2 3.57Å; V148-A169 HydrophobicContact CG2-CB 4.38Å; V148-L174 HydrophobicContact CG2-CB 4.07Å; V148-L174 HydrophobicContact CG2-CD1 3.59Å; V148-L174 HydrophobicContact CG2-CG 4.46Å; V148-P175 PolarHBondContact N-O 3.34Å; V148-C176 CarbonylContact O-C 3.59Å; V148-C176 WeakPolarHBondContact O-CA 3.41Å; V148-V177 PolarHBondContact O-N 2.66Å
149	V	95	Very high	90.2	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	115.3	170.2	-178.2	0	0	0	0	108.8	V59 G60 L61 I62 I151 V177 L381 I385	V59-V149 HydrophobicContact CG1-CG2 3.71Å; G60-V149 PolarHBondContact O-N 2.99Å; L61-V149 HydrophobicContact CD2-CB 3.67Å; L61-V149 HydrophobicContact CD2-CG1 4.23Å; L61-V149 HydrophobicContact CD2-CG2 4.2Å; I62-V149 PolarHBondContact N-O 2.92Å; V149-I151 HydrophobicContact CG1-CG1 4.39Å; V149-V177 CarbonylContact C-O 3.58Å; V149-V177 WeakPolarHBondContact CA-O 3.1Å; V149-V177 HydrophobicContact CG2-CB 4.41Å; V149-L381 HydrophobicContact CG1-CD1 4.27Å; V149-I385 HydrophobicContact CG2-CD1 4.48Å
150	V	94.2	Very high	89.7	Confident	4 Å²	4	14.1 Å²	14.1	2%	0.024	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	111	177.1	-168.2	0	0	0	0	109.3	I62 L152 T162 C176 V177 I178 Y179	I62-V150 HydrophobicContact CD1-CB 4.47Å; I62-V150 HydrophobicContact CD1-CG1 4.41Å; I62-V150 HydrophobicContact CD1-CG2 3.75Å; I62-V150 HydrophobicContact CG1-CB 4.17Å; I62-V150 HydrophobicContact CG1-CG1 4.21Å; I62-V150 HydrophobicContact CG1-CG2 3.87Å; I62-V150 CarbonylContact O-C 3.54Å; I62-V150 WeakPolarHBondContact O-CA 3.45Å; V150-L152 HydrophobicContact CG1-CD2 4.27Å; V150-T162 HydrophobicContact CG1-CG2 4.14Å; V150-C176 HydrophobicContact CG2-CB 4.27Å; V150-V177 PolarHBondContact N-O 2.93Å; V150-I178 HydrophobicContact CB-CG1 4.3Å; V150-I178 CarbonylContact O-C 3.5Å; V150-I178 WeakPolarHBondContact O-CA 3.31Å; V150-Y179 PolarHBondContact O-N 3.36Å
151	I	94.5	Very high	89.3	Confident	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	128.3	179.3	-57.4	173.2	0	0	0	109.2	L61 I62 A63 A67 K69 T72 V149 Y179 N181	L61-I151 HydrophobicContact CB-CD1 4.43Å; I62-I151 PolarHBondContact O-N 2.96Å; A63-I151 HydrophobicContact CB-CB 3.79Å; A63-I151 VanDerWaalsContact CB-O 3.27Å; A63-I151 WeakPolarHBondContact CB-O 3.23Å; A67-I151 HydrophobicContact CB-CG2 4.19Å; K69-I151 HydrophobicContact CB-CD1 4.39Å; K69-I151 HydrophobicContact CG-CD1 4.15Å; T72-I151 HydrophobicContact CG2-CD1 4.12Å; V149-I151 HydrophobicContact CG1-CG1 4.39Å; I151-Y179 WeakPolarHBondContact CA-O 3.48Å; I151-Y179 HydrophobicContact CG1-CD1 4.22Å; I151-Y179 HydrophobicContact CG2-CD1 4.35Å; I151-N181 HydrophobicContact CG2-CB 3.7Å
152	L	93.6	Very high	89.1	Confident	2 Å²	2	15.4 Å²	15.4	1%	0.01	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	147.3	176.6	-60.2	178.5	0	0	0	110.6	V150 T162 I178 Y179 N181 L197	V150-L152 HydrophobicContact CG1-CD2 4.27Å; L152-T162 HydrophobicContact CD2-CG2 3.46Å; L152-T162 VanDerWaalsContact CD2-CG2 3.46Å; L152-I178 HydrophobicContact CD1-CG2 3.47Å; L152-I178 VanDerWaalsContact CD1-CG2 3.47Å; L152-I178 HydrophobicContact CG-CG2 4Å; L152-Y179 PolarHBondContact N-O 3.4Å; L152-N181 PolarHBondContact O-N 3.16Å; L152-L197 HydrophobicContact CD1-CD1 3.82Å; L152-L197 HydrophobicContact CD1-CD2 3.86Å; L152-L197 HydrophobicContact CD1-CG 3.98Å
153	D	92.9	Very high	88.6	Confident	1 Å²	1	18.7 Å²	18.7	1%	0.005	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	119.7	171.2	-172.1	-37.2	0	0	0	109.1	V155 K156 G157 K182 R185	D153-V155 PolarHBondContact O-N 3.4Å; D153-V155 WeakPolarHBondContact OD1-CB 3.35Å; D153-V155 PolarHBondContact OD1-N 3.21Å; D153-K156 HydrophobicContact CB-CB 4.18Å; D153-K156 HydrophobicContact CB-CG 4.42Å; D153-K156 PolarHBondContact O-N 3.47Å; D153-G157 PolarHBondContact O-N 3.35Å; D153-K182 WeakPolarHBondContact OD2-CD 3.46Å; D153-K182 IonicContact OD2-NZ 2.64Å; D153-K182 PolarHBondContact OD2-NZ 2.64Å; D153-R185 IonicContact OD2-NH1 3.65Å
154	A	92.2	Very high	88.2	Confident	1 Å²	1	20.3 Å²	20.3	1%	0.008	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-19.3	-179.1	0	0	0	0	0	115.1	I180 N181 M183 A188 N189	A154-I180 HydrophobicContact CB-CG2 3.6Å; A154-N181 WeakPolarHBondContact CB-O 3.44Å; A154-N181 PolarHBondContact N-O 2.85Å; A154-M183 HydrophobicContact CB-CG 4.4Å; A154-M183 HydrophobicContact CB-SD 3.43Å; A154-M183 WeakPolarHBondContact CB-SD 3.44Å; A154-A188 HydrophobicContact CB-CB 3.7Å; A154-N189 PolarHBondContact O-N 2.83Å; A154-N189 VanDerWaalsContact O-N 3.13Å
155	V	91.1	Very high	87.9	Confident	60 Å²	60	20.8 Å²	20.8	36%	0.364	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-40.7	178.9	-177.4	0	0	0	0	111.4	D153 R185 M187	D153-V155 PolarHBondContact O-N 3.4Å; D153-V155 WeakPolarHBondContact OD1-CB 3.35Å; D153-V155 PolarHBondContact OD1-N 3.21Å; V155-R185 HydrophobicContact CG2-CB 3.59Å; V155-R185 HydrophobicContact CG2-CG 4.39Å; V155-M187 HydrophobicContact CG1-CB 4.36Å
156	K	88	Confident	87.5	Confident	107 Å²	107	20.9 Å²	20.9	47%	0.465	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-24.1	-172.5	-58.2	-175.2	-176.9	176.4	0	113.2	D153 Q159	D153-K156 HydrophobicContact CB-CB 4.18Å; D153-K156 HydrophobicContact CB-CG 4.42Å; D153-K156 PolarHBondContact O-N 3.47Å; K156-Q159 HydrophobicContact CB-CG 4.23Å; K156-Q159 VanDerWaalsContact CD-NE2 3.33Å
157	G	88	Confident	87	Confident	4 Å²	4	23.4 Å²	23.4	4%	0.041	12%	0.121	C	C	.	.	B	Isolated β-bridge	trans	69.5	-146.3	-174.3	0	0	0	0	0	112.8	D153	D153-G157 PolarHBondContact O-N 3.35Å
158	V	86.4	Confident	86.4	Confident	8 Å²	8	23.8 Å²	23.8	5%	0.048	12%	0.122	C	C	.	.	S	Bend	trans	-71.5	133.3	176.4	-180	0	0	0	0	109.6	T162 S196 L197 Q200 L201	V158-T162 HydrophobicContact CG1-CG2 4.21Å; V158-S196 VanDerWaalsContact CB-OG 3.31Å; V158-S196 WeakPolarHBondContact CB-OG 3.44Å; V158-S196 PolarHBondContact N-OG 2.94Å; V158-L197 HydrophobicContact CG2-CB 4.4Å; V158-L197 HydrophobicContact CG2-CD2 3.55Å; V158-L197 HydrophobicContact CG2-CG 3.77Å; V158-Q200 HydrophobicContact CB-CB 4.31Å; V158-Q200 VanDerWaalsContact CB-OE1 3.3Å; V158-Q200 HydrophobicContact CG1-CB 4.06Å; V158-Q200 PolarHBondContact O-OE1 3.25Å; V158-Q200 VanDerWaalsContact O-OE1 3.07Å; V158-L201 HydrophobicContact CG1-CD1 3.8Å; V158-L201 HydrophobicContact CG1-CG 4.2Å; V158-L201 HydrophobicContact CG2-CD1 4.17Å
159	Q	84.4	Confident	86	Confident	25 Å²	25	23.8 Å²	23.8	12%	0.117	12%	0.122	C	C	.	.			trans	-117.7	161.7	-179.8	-60.9	-176.5	-87.2	0	0	109.9	H64 K156 Q161 T162 H163	H64-Q159 HydrophobicContact CB-CB 4.15Å; H64-Q159 PolarHBondContact CD2-NE2 3.25Å; H64-Q159 PolarHBondContact CD2-OE1 3.37Å; H64-Q159 VanDerWaalsContact CG-OE1 3.25Å; H64-Q159 PolarHBondContact NE2-NE2 3.4Å; K156-Q159 HydrophobicContact CB-CG 4.23Å; K156-Q159 VanDerWaalsContact CD-NE2 3.33Å; Q159-Q161 VanDerWaalsContact C-N 3.27Å; Q159-Q161 PolarHBondContact O-N 3.46Å; Q159-Q161 VanDerWaalsContact O-N 3.12Å; Q159-T162 VanDerWaalsContact O-CB 3.24Å; Q159-T162 WeakPolarHBondContact O-CB 3.33Å; Q159-T162 PolarHBondContact O-N 3.15Å; Q159-H163 PolarHBondContact O-N 2.81Å
160	P	75.9	Confident	85.4	Confident	58 Å²	58	26.5 Å²	26.5	38%	0.377	14%	0.135	S	C	.	.	H	α-helix	trans	-53.9	-38.2	-174.5	-29.1	35.8	0	0	0	114.6	H163 R876	P160-H163 WeakPolarHBondContact O-CB 3.48Å; P160-H163 PolarHBondContact O-N 2.99Å; P160-R876 HydrophobicContact CB-CG 4.41Å
161	Q	77	Confident	84.7	Confident	30 Å²	30	30 Å²	30	14%	0.14	15%	0.148	C	C	.	.	H	α-helix	trans	-76.3	-29.4	179.4	-55.4	169.7	-14.1	0	0	112.5	H64 G130 V132 Q159 H163 T164 V165	H64-Q161 PolarHBondContact CE1-OE1 3.27Å; H64-Q161 WeakPolarHBondContact ND1-CB 3.36Å; H64-Q161 WeakPolarHBondContact ND1-CG 3.35Å; H64-Q161 PolarHBondContact ND1-OE1 3.01Å; G130-Q161 PolarHBondContact O-OE1 3.03Å; V132-Q161 HydrophobicContact CG2-CG 3.65Å; Q159-Q161 VanDerWaalsContact C-N 3.27Å; Q159-Q161 PolarHBondContact O-N 3.46Å; Q159-Q161 VanDerWaalsContact O-N 3.12Å; Q161-H163 PolarHBondContact O-N 2.9Å; Q161-T164 PolarHBondContact O-N 3.22Å; Q161-T164 VanDerWaalsContact O-N 3.15Å; Q161-V165 WeakPolarHBondContact O-CG2 3.35Å; Q161-V165 PolarHBondContact O-N 3.06Å
162	T	84.6	Confident	84	Confident	3 Å²	3	33.1 Å²	33.1	2%	0.018	16%	0.16	C	C	.	.	H	α-helix	trans	-56	-40.3	171.9	-53.8	0	0	0	0	110.1	V150 L152 V158 Q159 T164 V165 C166 L201	V150-T162 HydrophobicContact CG1-CG2 4.14Å; L152-T162 HydrophobicContact CD2-CG2 3.46Å; L152-T162 VanDerWaalsContact CD2-CG2 3.46Å; V158-T162 HydrophobicContact CG1-CG2 4.21Å; Q159-T162 VanDerWaalsContact O-CB 3.24Å; Q159-T162 WeakPolarHBondContact O-CB 3.33Å; Q159-T162 PolarHBondContact O-N 3.15Å; T162-T164 PolarHBondContact O-N 3.48Å; T162-V165 PolarHBondContact O-N 2.85Å; T162-C166 VanDerWaalsContact O-CB 3.29Å; T162-C166 WeakPolarHBondContact O-CB 3.46Å; T162-C166 PolarHBondContact O-N 2.87Å; T162-C166 PolarHBondContact O-SG 3.11Å; T162-L201 HydrophobicContact CG2-CD1 4.23Å
163	H	78.8	Confident	83.5	Confident	70 Å²	70	35.2 Å²	35.2	32%	0.324	18%	0.175	S	C	.	.	H	α-helix	trans	-59.8	-48.2	176.8	-178	-87.2	0	0	0	112.1	Q159 P160 Q161 R167 Q200 L201	Q159-H163 PolarHBondContact O-N 2.81Å; P160-H163 WeakPolarHBondContact O-CB 3.48Å; P160-H163 PolarHBondContact O-N 2.99Å; Q161-H163 PolarHBondContact O-N 2.9Å; H163-R167 VanDerWaalsContact O-CB 3.3Å; H163-R167 WeakPolarHBondContact O-CB 3.43Å; H163-R167 PolarHBondContact O-N 3.48Å; H163-Q200 PolarHBondContact CD2-O 3.32Å; H163-L201 HydrophobicContact CB-CD2 4.42Å
164	T	77.5	Confident	83.1	Confident	43 Å²	43	36 Å²	36	26%	0.264	18%	0.179	S	C	.	.	H	α-helix	trans	-59.3	-48.9	179	-51.3	0	0	0	0	111.7	Q161 T162 R167 Q168	Q161-T164 PolarHBondContact O-N 3.22Å; Q161-T164 VanDerWaalsContact O-N 3.15Å; T162-T164 PolarHBondContact O-N 3.48Å; T164-R167 PolarHBondContact O-N 2.93Å; T164-Q168 WeakPolarHBondContact O-CG 3.3Å; T164-Q168 PolarHBondContact O-N 2.83Å
165	V	83	Confident	83	Confident	9 Å²	9	36.9 Å²	36.9	6%	0.055	18%	0.184	C	C	.	.	H	α-helix	trans	-74.1	-35.9	-175.4	-165.8	0	0	0	0	112.3	I62 V138 Q161 T162 R167 Q168 A169	I62-V165 HydrophobicContact CB-CB 4.41Å; I62-V165 HydrophobicContact CB-CG1 3.5Å; I62-V165 VanDerWaalsContact CB-CG1 3.5Å; I62-V165 HydrophobicContact CD1-CB 4.17Å; I62-V165 HydrophobicContact CD1-CG1 3.58Å; I62-V165 HydrophobicContact CG1-CG1 4.07Å; I62-V165 HydrophobicContact CG2-CG1 3.56Å; V138-V165 HydrophobicContact CG1-CG1 3.64Å; Q161-V165 WeakPolarHBondContact O-CG2 3.35Å; Q161-V165 PolarHBondContact O-N 3.06Å; T162-V165 PolarHBondContact O-N 2.85Å; V165-R167 VanDerWaalsContact C-N 3.34Å; V165-Q168 WeakPolarHBondContact O-CB 3.25Å; V165-Q168 PolarHBondContact O-N 3.3Å; V165-A169 PolarHBondContact O-N 3.23Å
166	C	83.8	Confident	82.9	Confident	8 Å²	8	34.5 Å²	34.5	5%	0.054	17%	0.17	C	C	.	.	H	α-helix	trans	-62.3	-42.6	171	-72.1	0	0	0	0	111.3	T162 Q168 A169 H170 L201	T162-C166 VanDerWaalsContact O-CB 3.29Å; T162-C166 WeakPolarHBondContact O-CB 3.46Å; T162-C166 PolarHBondContact O-N 2.87Å; T162-C166 PolarHBondContact O-SG 3.11Å; C166-Q168 VanDerWaalsContact C-N 3.29Å; C166-Q168 PolarHBondContact O-N 2.8Å; C166-A169 PolarHBondContact O-N 3.08Å; C166-H170 PolarHBondContact O-CD2 3.39Å; C166-H170 PolarHBondContact O-N 2.91Å; C166-L201 HydrophobicContact CB-CD1 4.29Å; C166-L201 HydrophobicContact CB-CD2 3.99Å
167	R	80.8	Confident	83.2	Confident	58 Å²	58	29.4 Å²	29.4	22%	0.219	15%	0.148	C	C	.	.	H	α-helix	trans	-60	-40.8	175.6	-173.7	179.8	178.9	-159.4	1.1	111.3	H163 T164 V165 H170 R171 Y850	H163-R167 VanDerWaalsContact O-CB 3.3Å; H163-R167 WeakPolarHBondContact O-CB 3.43Å; H163-R167 PolarHBondContact O-N 3.48Å; T164-R167 PolarHBondContact O-N 2.93Å; V165-R167 VanDerWaalsContact C-N 3.34Å; R167-H170 PolarHBondContact O-N 3.09Å; R167-R171 WeakPolarHBondContact O-CG 3.27Å; R167-R171 PolarHBondContact O-N 3.19Å; R167-Y850 PolarHBondContact NH1-OH 2.92Å; R167-Y850 PolarHBondContact NH2-OH 2.84Å; R167-Y850 VanDerWaalsContact NH2-OH 3.16Å
168	Q	80.4	Confident	83.5	Confident	8 Å²	8	29.5 Å²	29.5	4%	0.037	15%	0.147	C	C	.	.	H	α-helix	trans	-62.7	-45.6	174.5	-70.9	172.6	-36.5	0	0	112	E139 L142 T164 V165 C166 H170 R171 Y172	E139-Q168 HydrophobicContact CG-CG 4.22Å; E139-Q168 VanDerWaalsContact CG-NE2 3.26Å; E139-Q168 PolarHBondContact OE1-NE2 3.28Å; L142-Q168 HydrophobicContact CD1-CB 3.64Å; T164-Q168 WeakPolarHBondContact O-CG 3.3Å; T164-Q168 PolarHBondContact O-N 2.83Å; V165-Q168 WeakPolarHBondContact O-CB 3.25Å; V165-Q168 PolarHBondContact O-N 3.3Å; C166-Q168 VanDerWaalsContact C-N 3.29Å; C166-Q168 PolarHBondContact O-N 2.8Å; Q168-H170 VanDerWaalsContact C-N 3.32Å; Q168-H170 PolarHBondContact O-N 2.94Å; Q168-R171 WeakPolarHBondContact O-CB 3.35Å; Q168-R171 PolarHBondContact O-N 2.83Å; Q168-Y172 VanDerWaalsContact O-CD2 3.26Å; Q168-Y172 WeakPolarHBondContact O-CD2 3.42Å; Q168-Y172 PolarHBondContact O-N 2.85Å
169	A	84.9	Confident	83.9	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.2	-40	176.5	0	0	0	0	0	112.2	I62 L142 V148 V165 C166 Y172 C173 L174	I62-A169 HydrophobicContact CD1-CB 4.28Å; L142-A169 HydrophobicContact CD2-CB 4.32Å; V148-A169 HydrophobicContact CG2-CB 4.38Å; V165-A169 PolarHBondContact O-N 3.23Å; C166-A169 PolarHBondContact O-N 3.08Å; A169-Y172 PolarHBondContact O-N 3.15Å; A169-C173 PolarHBondContact O-N 3.43Å; A169-L174 PolarHBondContact O-N 3Å
170	H	82.2	Confident	84.4	Confident	58 Å²	58	27.9 Å²	27.9	27%	0.269	14%	0.139	S	C	.	.	H	α-helix	trans	-66.1	-36.4	175.7	-76.5	-61.8	0	0	0	113.4	C166 R167 Q168 Y172 C173	C166-H170 PolarHBondContact O-CD2 3.39Å; C166-H170 PolarHBondContact O-N 2.91Å; R167-H170 PolarHBondContact O-N 3.09Å; Q168-H170 VanDerWaalsContact C-N 3.32Å; Q168-H170 PolarHBondContact O-N 2.94Å; H170-Y172 PolarHBondContact O-N 3.22Å; H170-C173 PolarHBondContact O-N 3.38Å
171	R	79.7	Confident	85.3	Confident	76 Å²	76	25.3 Å²	25.3	29%	0.287	12%	0.122	S	C	.	.	H	α-helix	trans	-57.3	-36.9	173.8	-75.7	176.9	-177.8	170.8	0.9	112	E139 R167 Q168 C173	E139-R171 IonicContact OE1-NH1 3.66Å; R167-R171 WeakPolarHBondContact O-CG 3.27Å; R167-R171 PolarHBondContact O-N 3.19Å; Q168-R171 WeakPolarHBondContact O-CB 3.35Å; Q168-R171 PolarHBondContact O-N 2.83Å; R171-C173 VanDerWaalsContact C-N 3.27Å; R171-C173 PolarHBondContact O-N 3.39Å
172	Y	79.4	Confident	86.1	Confident	67 Å²	67	25 Å²	25	26%	0.263	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	8.4	176.5	-65.9	-70.2	0	0	0	113.7	L142 T143 Q168 A169 H170 L174	L142-Y172 HydrophobicContact CB-CD2 3.83Å; L142-Y172 HydrophobicContact CB-CE2 4.21Å; L142-Y172 HydrophobicContact CD1-CD2 4.45Å; T143-Y172 HydrophobicContact CG2-CD1 4.31Å; T143-Y172 HydrophobicContact CG2-CE1 3.62Å; T143-Y172 HydrophobicContact CG2-CE2 4.38Å; Q168-Y172 VanDerWaalsContact O-CD2 3.26Å; Q168-Y172 WeakPolarHBondContact O-CD2 3.42Å; Q168-Y172 PolarHBondContact O-N 2.85Å; A169-Y172 PolarHBondContact O-N 3.15Å; H170-Y172 PolarHBondContact O-N 3.22Å; Y172-L174 PolarHBondContact O-N 3.33Å
173	C	81.8	Confident	86.3	Confident	46 Å²	46	24.9 Å²	24.9	31%	0.311	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	53	34.3	-178.7	-68.5	0	0	0	0	113.7	A169 H170 R171	A169-C173 PolarHBondContact O-N 3.43Å; H170-C173 PolarHBondContact O-N 3.38Å; R171-C173 VanDerWaalsContact C-N 3.27Å; R171-C173 PolarHBondContact O-N 3.39Å
174	L	86.2	Confident	86.8	Confident	17 Å²	17	23.8 Å²	23.8	9%	0.089	12%	0.116	C	C	.	.			trans	-80.8	132.3	180	-61	173.9	0	0	0	110.6	L142 L145 V148 A169 Y172 C176	L142-L174 HydrophobicContact CB-CD1 4.02Å; L142-L174 HydrophobicContact CD2-CD1 3.81Å; L142-L174 HydrophobicContact CG-CD1 4.49Å; L142-L174 WeakPolarHBondContact O-CD1 3.49Å; L145-L174 HydrophobicContact CB-CD1 4.44Å; L145-L174 VanDerWaalsContact O-CD2 3.23Å; L145-L174 WeakPolarHBondContact O-CD2 3.48Å; V148-L174 HydrophobicContact CG2-CB 4.07Å; V148-L174 HydrophobicContact CG2-CD1 3.59Å; V148-L174 HydrophobicContact CG2-CG 4.46Å; A169-L174 PolarHBondContact O-N 3Å; Y172-L174 PolarHBondContact O-N 3.33Å; L174-C176 PolarHBondContact O-N 2.9Å; L174-C176 PolarHBondContact O-SG 2.77Å
175	P	88.3	Confident	87.3	Confident	19 Å²	19	27 Å²	27	12%	0.123	12%	0.124	C	C	.	.			trans	-59.7	125.5	167.3	-26.6	36.9	0	0	0	111.2	D146 S147 V148 P390	D146-P175 WeakPolarHBondContact O-CD 3.17Å; S147-P175 WeakPolarHBondContact CA-O 3.37Å; V148-P175 PolarHBondContact N-O 3.34Å; P175-P390 HydrophobicContact CG-CG 4.18Å
176	C	90	Very high	86.9	Confident	10 Å²	10	32 Å²	32	7%	0.068	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	142	-177.8	-68.5	0	0	0	0	111.1	V148 V150 L174	V148-C176 CarbonylContact O-C 3.59Å; V148-C176 WeakPolarHBondContact O-CA 3.41Å; V150-C176 HydrophobicContact CG2-CB 4.27Å; L174-C176 PolarHBondContact O-N 2.9Å; L174-C176 PolarHBondContact O-SG 2.77Å
177	V	93.4	Very high	86.8	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.006	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	135.8	171.9	176.3	0	0	0	0	107.9	V148 V149 V150 P366 L368 F384 L389	V148-V177 PolarHBondContact O-N 2.66Å; V149-V177 CarbonylContact C-O 3.58Å; V149-V177 WeakPolarHBondContact CA-O 3.1Å; V149-V177 HydrophobicContact CG2-CB 4.41Å; V150-V177 PolarHBondContact N-O 2.93Å; V177-P366 HydrophobicContact CB-CG 4.22Å; V177-P366 HydrophobicContact CG1-CG 4.1Å; V177-P366 HydrophobicContact CG2-CG 3.8Å; V177-L368 HydrophobicContact CG1-CD1 3.21Å; V177-F384 HydrophobicContact CB-CE1 4.41Å; V177-F384 HydrophobicContact CG1-CD1 4.08Å; V177-F384 HydrophobicContact CG1-CE1 3.83Å; V177-F384 HydrophobicContact CG2-CD1 4.33Å; V177-F384 HydrophobicContact CG2-CE1 3.64Å; V177-L389 HydrophobicContact CG2-CD1 4.44Å; V177-L389 HydrophobicContact CG2-CD2 3.45Å; V177-L389 VanDerWaalsContact CG2-CD2 3.45Å; V177-L389 HydrophobicContact CG2-CG 4.32Å
178	I	94.4	Very high	87.1	Confident	5 Å²	5	35.4 Å²	35.4	3%	0.026	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	131.3	178.1	-63.5	177.3	0	0	0	109.3	V150 L152 I180 L197 Y207 I365 P366 V367 L368	V150-I178 HydrophobicContact CB-CG1 4.3Å; V150-I178 CarbonylContact O-C 3.5Å; V150-I178 WeakPolarHBondContact O-CA 3.31Å; L152-I178 HydrophobicContact CD1-CG2 3.47Å; L152-I178 VanDerWaalsContact CD1-CG2 3.47Å; L152-I178 HydrophobicContact CG-CG2 4Å; I178-I180 HydrophobicContact CG2-CG1 4.26Å; I178-L197 HydrophobicContact CD1-CD1 3.55Å; I178-L197 HydrophobicContact CD1-CD2 3.59Å; I178-L197 HydrophobicContact CD1-CG 4.2Å; I178-L197 HydrophobicContact CG2-CD1 4.26Å; I178-Y207 HydrophobicContact CD1-CD1 3.57Å; I178-Y207 HydrophobicContact CD1-CE1 3.55Å; I178-I365 HydrophobicContact CD1-CG2 3.67Å; I178-I365 HydrophobicContact CG1-CG2 3.69Å; I178-P366 PolarHBondContact N-O 2.97Å; I178-V367 HydrophobicContact CB-CG1 4.39Å; I178-V367 HydrophobicContact CB-CG2 4.16Å; I178-V367 HydrophobicContact CD1-CG2 4.38Å; I178-V367 HydrophobicContact CG2-CG1 4.11Å; I178-V367 CarbonylContact O-C 3.58Å; I178-V367 WeakPolarHBondContact O-CA 3.38Å; I178-L368 PolarHBondContact O-N 2.81Å
179	Y	96	Very high	87.4	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	106.9	172.8	-179.7	-117.5	0	0	0	110	T72 V150 I151 L152 N181 L368 G370 L381	T72-Y179 HydrophobicContact CG2-CD1 4.33Å; T72-Y179 HydrophobicContact CG2-CE1 4Å; V150-Y179 PolarHBondContact O-N 3.36Å; I151-Y179 WeakPolarHBondContact CA-O 3.48Å; I151-Y179 HydrophobicContact CG1-CD1 4.22Å; I151-Y179 HydrophobicContact CG2-CD1 4.35Å; L152-Y179 PolarHBondContact N-O 3.4Å; Y179-N181 HydrophobicContact CD1-CB 4.1Å; Y179-N181 HydrophobicContact CE1-CB 3.92Å; Y179-N181 PolarHBondContact O-N 2.94Å; Y179-L368 WeakPolarHBondContact CA-O 3.46Å; Y179-L368 HydrophobicContact CD2-CB 4.04Å; Y179-G370 WeakPolarHBondContact OH-CA 3.07Å; Y179-L381 HydrophobicContact CD1-CD2 4.3Å; Y179-L381 HydrophobicContact CD2-CD1 4.34Å; Y179-L381 HydrophobicContact CD2-CD2 4.26Å; Y179-L381 HydrophobicContact CE1-CD2 4.42Å; Y179-L381 HydrophobicContact CE2-CD2 4.39Å; Y179-L381 HydrophobicContact CG-CD2 4.22Å
180	I	95.3	Very high	87.6	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	106.3	175	-60.7	173.5	0	0	0	108	A154 I178 M183 V190 C193 V367 L368 V369 G370	A154-I180 HydrophobicContact CB-CG2 3.6Å; I178-I180 HydrophobicContact CG2-CG1 4.26Å; I180-M183 HydrophobicContact CG2-SD 3.84Å; I180-V190 HydrophobicContact CD1-CG1 3.98Å; I180-C193 HydrophobicContact CD1-CB 3.77Å; I180-C193 HydrophobicContact CG1-CB 4.39Å; I180-V367 HydrophobicContact CD1-CG1 3.49Å; I180-V367 VanDerWaalsContact CD1-CG1 3.49Å; I180-V367 HydrophobicContact CG1-CG1 3.93Å; I180-L368 PolarHBondContact N-O 2.83Å; I180-V369 HydrophobicContact CB-CG1 4.3Å; I180-V369 HydrophobicContact CD1-CG1 4.45Å; I180-V369 WeakPolarHBondContact O-CA 3.4Å; I180-G370 PolarHBondContact O-N 3.26Å
181	N	94.6	Very high	87.8	Confident	3 Å²	3	38.8 Å²	38.8	2%	0.016	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	168.6	-177.2	-165.4	18	0	0	0	111.1	A67 T72 I151 L152 A154 Y179 G370 S372	A67-N181 PolarHBondContact O-ND2 3.48Å; A67-N181 VanDerWaalsContact O-ND2 3.09Å; T72-N181 PolarHBondContact OG1-ND2 3.14Å; I151-N181 HydrophobicContact CG2-CB 3.7Å; L152-N181 PolarHBondContact O-N 3.16Å; A154-N181 WeakPolarHBondContact CB-O 3.44Å; A154-N181 PolarHBondContact N-O 2.85Å; Y179-N181 HydrophobicContact CD1-CB 4.1Å; Y179-N181 HydrophobicContact CE1-CB 3.92Å; Y179-N181 PolarHBondContact O-N 2.94Å; N181-G370 CarbonylContact C-O 3.58Å; N181-G370 WeakPolarHBondContact CA-O 3.39Å; N181-S372 PolarHBondContact ND2-OG 2.72Å; N181-S372 WeakPolarHBondContact OD1-CB 3.23Å; N181-S372 PolarHBondContact OD1-N 3.46Å; N181-S372 PolarHBondContact OD1-OG 2.81Å
182	K	92.2	Very high	88.2	Confident	23 Å²	23	40.1 Å²	40.1	10%	0.1	21%	0.211	C	C	.	.			trans	63.9	33.9	178.9	-48.9	-174.4	-172.6	172.5	0	114.9	D66 D153 D184 R185 G370	D66-K182 WeakPolarHBondContact O-CE 3.09Å; D66-K182 PolarHBondContact O-NZ 2.76Å; D153-K182 WeakPolarHBondContact OD2-CD 3.46Å; D153-K182 IonicContact OD2-NZ 2.64Å; D153-K182 PolarHBondContact OD2-NZ 2.64Å; K182-D184 VanDerWaalsContact CA-OD1 3.29Å; K182-D184 WeakPolarHBondContact CA-OD1 3.36Å; K182-D184 PolarHBondContact O-N 3.39Å; K182-R185 HydrophobicContact CB-CG 4.23Å; K182-R185 PolarHBondContact O-N 2.79Å; K182-R185 VanDerWaalsContact O-N 3.09Å; K182-G370 PolarHBondContact N-O 3.15Å
183	M	90.3	Very high	88.7	Confident	2 Å²	2	37 Å²	37	1%	0.01	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-10.8	172.5	-69.6	-57.1	-60.8	0	0	114	A154 I180 R185 A188 V190 P213 F215 F251 V369 G370	A154-M183 HydrophobicContact CB-CG 4.4Å; A154-M183 HydrophobicContact CB-SD 3.43Å; A154-M183 WeakPolarHBondContact CB-SD 3.44Å; I180-M183 HydrophobicContact CG2-SD 3.84Å; M183-R185 VanDerWaalsContact C-N 3.32Å; M183-A188 HydrophobicContact CE-CB 4.15Å; M183-A188 HydrophobicContact SD-CB 4.09Å; M183-V190 HydrophobicContact CE-CG2 3.73Å; M183-V190 HydrophobicContact SD-CG2 3.99Å; M183-P213 HydrophobicContact CE-CB 3.71Å; M183-P213 HydrophobicContact CE-CG 3.9Å; M183-F215 HydrophobicContact CE-CE2 4.38Å; M183-F215 HydrophobicContact CE-CZ 3.68Å; M183-F251 HydrophobicContact CB-CB 4.49Å; M183-F251 HydrophobicContact CB-CD1 3.72Å; M183-F251 HydrophobicContact CB-CD2 4.07Å; M183-F251 HydrophobicContact CB-CE1 3.85Å; M183-F251 HydrophobicContact CB-CE2 4.2Å; M183-F251 HydrophobicContact CB-CG 3.84Å; M183-F251 HydrophobicContact CB-CZ 4.1Å; M183-F251 HydrophobicContact CG-CZ 4.47Å; M183-F251 WeakPolarHBondContact O-CB 3.49Å; M183-V369 HydrophobicContact CG-CB 4.34Å; M183-G370 WeakPolarHBondContact CB-O 3.25Å; M183-G370 WeakPolarHBondContact CG-O 3.16Å; M183-G370 PolarHBondContact N-O 3.32Å
184	D	88.7	Confident	89.1	Confident	47 Å²	47	36.2 Å²	36.2	25%	0.251	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-10.7	174.2	60.2	-63.1	0	0	0	114.5	K182 S371 K374	K182-D184 VanDerWaalsContact CA-OD1 3.29Å; K182-D184 WeakPolarHBondContact CA-OD1 3.36Å; K182-D184 PolarHBondContact O-N 3.39Å; D184-S371 WeakPolarHBondContact OD1-CB 3.38Å; D184-S371 PolarHBondContact OD1-OG 2.75Å; D184-K374 HydrophobicContact CB-CG 3.81Å
185	R	87.4	Confident	89.2	Confident	110 Å²	110	40.3 Å²	40.3	42%	0.415	21%	0.21	S	C	.	.	S	Bend	trans	-79.5	142.8	-177.4	-72.4	-170.8	169.9	-163.2	-3.2	112.6	D153 V155 K182 M183 M187 A188	D153-R185 IonicContact OD2-NH1 3.65Å; V155-R185 HydrophobicContact CG2-CB 3.59Å; V155-R185 HydrophobicContact CG2-CG 4.39Å; K182-R185 HydrophobicContact CB-CG 4.23Å; K182-R185 PolarHBondContact O-N 2.79Å; K182-R185 VanDerWaalsContact O-N 3.09Å; M183-R185 VanDerWaalsContact C-N 3.32Å; R185-M187 PolarHBondContact O-N 3.49Å; R185-A188 WeakPolarHBondContact O-CB 3.46Å; R185-A188 PolarHBondContact O-N 3.01Å; R185-A188 VanDerWaalsContact O-N 3.07Å
186	P	74.7	Confident	89.2	Confident	114 Å²	114	40.2 Å²	40.2	74%	0.74	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	123.3	170.3	28.7	-32.4	0	0	0	107.8
187	M	82.7	Confident	89.1	Confident	123 Å²	123	39.8 Å²	39.8	61%	0.606	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	91.8	8.3	-171.4	-48.6	-65.6	91.6	0	0	116.7	V155 R185 N189	V155-M187 HydrophobicContact CG1-CB 4.36Å; R185-M187 PolarHBondContact O-N 3.49Å; M187-N189 PolarHBondContact O-N 3.28Å
188	A	85.8	Confident	88.7	Confident	15 Å²	15	42.5 Å²	42.5	12%	0.124	23%	0.225	C	C	.	.			trans	-62.4	124.7	168.9	0	0	0	0	0	110.9	A154 M183 R185	A154-A188 HydrophobicContact CB-CB 3.7Å; M183-A188 HydrophobicContact CE-CB 4.15Å; M183-A188 HydrophobicContact SD-CB 4.09Å; R185-A188 WeakPolarHBondContact O-CB 3.46Å; R185-A188 PolarHBondContact O-N 3.01Å; R185-A188 VanDerWaalsContact O-N 3.07Å
189	N	87.1	Confident	88.1	Confident	59 Å²	59	48.2 Å²	48.2	32%	0.316	26%	0.256	S	S	.	.			trans	-144.9	121.5	-179.5	-174.2	-34.8	0	0	0	111	A154 M187 D191 L192 C193	A154-N189 PolarHBondContact O-N 2.83Å; A154-N189 VanDerWaalsContact O-N 3.13Å; M187-N189 PolarHBondContact O-N 3.28Å; N189-D191 WeakPolarHBondContact OD1-CB 3.41Å; N189-D191 PolarHBondContact OD1-N 2.91Å; N189-L192 HydrophobicContact CB-CB 4.12Å; N189-L192 HydrophobicContact CB-CD1 3.86Å; N189-L192 HydrophobicContact CB-CG 3.94Å; N189-L192 PolarHBondContact OD1-N 3.47Å; N189-C193 PolarHBondContact O-N 3.4Å; N189-C193 PolarHBondContact O-SG 3.3Å; N189-C193 VanDerWaalsContact O-SG 3.34Å
190	V	88.7	Confident	87.2	Confident	5 Å²	5	53 Å²	53	3%	0.03	28%	0.278	C	S	.	.	H	α-helix	trans	-71.5	-40.6	-178.2	176.3	0	0	0	0	111.6	I180 M183 L192 C193 L194 P213 V369	I180-V190 HydrophobicContact CD1-CG1 3.98Å; M183-V190 HydrophobicContact CE-CG2 3.73Å; M183-V190 HydrophobicContact SD-CG2 3.99Å; V190-L192 VanDerWaalsContact C-N 3.33Å; V190-L192 PolarHBondContact O-N 3.35Å; V190-C193 WeakPolarHBondContact O-CA 3.29Å; V190-C193 WeakPolarHBondContact O-CB 3.23Å; V190-C193 PolarHBondContact O-N 3.32Å; V190-C193 VanDerWaalsContact O-N 3.08Å; V190-L194 HydrophobicContact CG1-CD1 4.04Å; V190-L194 HydrophobicContact CG1-CG 4.28Å; V190-L194 WeakPolarHBondContact O-CG 3.43Å; V190-L194 PolarHBondContact O-N 3.37Å; V190-P213 HydrophobicContact CG2-CG 3.74Å; V190-V369 HydrophobicContact CG1-CG1 4.37Å; V190-V369 HydrophobicContact CG2-CG1 3.8Å
191	D	88	Confident	86.4	Confident	73 Å²	73	53.5 Å²	53.5	39%	0.39	28%	0.281	S	S	.	.	H	α-helix	trans	-62.9	-40.3	179.2	-61.4	-47.2	0	0	0	111.7	N189 C193 L194 H195 W212	N189-D191 WeakPolarHBondContact OD1-CB 3.41Å; N189-D191 PolarHBondContact OD1-N 2.91Å; D191-C193 VanDerWaalsContact C-N 3.28Å; D191-C193 PolarHBondContact O-N 3.3Å; D191-L194 PolarHBondContact O-N 2.89Å; D191-H195 WeakPolarHBondContact O-CB 3.44Å; D191-H195 PolarHBondContact O-CD2 2.91Å; D191-H195 PolarHBondContact O-N 3.3Å; D191-W212 WeakPolarHBondContact OD1-CH2 3.42Å
192	L	87.9	Confident	85.2	Confident	104 Å²	104	57.9 Å²	57.9	55%	0.545	31%	0.31	S	S	.	.	H	α-helix	trans	-61	-39.9	173.9	-70.6	-177.8	0	0	0	111.5	N189 V190 S196	N189-L192 HydrophobicContact CB-CB 4.12Å; N189-L192 HydrophobicContact CB-CD1 3.86Å; N189-L192 HydrophobicContact CB-CG 3.94Å; N189-L192 PolarHBondContact OD1-N 3.47Å; V190-L192 VanDerWaalsContact C-N 3.33Å; V190-L192 PolarHBondContact O-N 3.35Å; L192-S196 WeakPolarHBondContact O-CB 3.41Å; L192-S196 PolarHBondContact O-N 3.38Å
193	C	89.7	Confident	84.3	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.007	32%	0.316	C	S	.	.	H	α-helix	trans	-67.8	-42.3	176.6	-67.4	0	0	0	0	111.9	I180 N189 V190 D191 S196 L197	I180-C193 HydrophobicContact CD1-CB 3.77Å; I180-C193 HydrophobicContact CG1-CB 4.39Å; N189-C193 PolarHBondContact O-N 3.4Å; N189-C193 PolarHBondContact O-SG 3.3Å; N189-C193 VanDerWaalsContact O-SG 3.34Å; V190-C193 WeakPolarHBondContact O-CA 3.29Å; V190-C193 WeakPolarHBondContact O-CB 3.23Å; V190-C193 PolarHBondContact O-N 3.32Å; V190-C193 VanDerWaalsContact O-N 3.08Å; D191-C193 VanDerWaalsContact C-N 3.28Å; D191-C193 PolarHBondContact O-N 3.3Å; C193-S196 WeakPolarHBondContact O-CB 3.42Å; C193-S196 PolarHBondContact O-N 2.54Å; C193-L197 WeakPolarHBondContact O-CB 3.48Å; C193-L197 WeakPolarHBondContact O-CG 3.2Å; C193-L197 PolarHBondContact O-N 2.98Å
194	L	89.8	Confident	83.5	Confident	30 Å²	30	65.8 Å²	65.8	16%	0.157	35%	0.347	C	S	.	.	H	α-helix	trans	-63.3	-43.9	176.4	-70.6	173.5	0	0	0	111.8	V190 D191 S196 L197 S198 V367	V190-L194 HydrophobicContact CG1-CD1 4.04Å; V190-L194 HydrophobicContact CG1-CG 4.28Å; V190-L194 WeakPolarHBondContact O-CG 3.43Å; V190-L194 PolarHBondContact O-N 3.37Å; D191-L194 PolarHBondContact O-N 2.89Å; L194-S196 VanDerWaalsContact C-N 3.33Å; L194-S196 PolarHBondContact O-N 2.95Å; L194-L197 WeakPolarHBondContact O-CB 3.41Å; L194-L197 PolarHBondContact O-N 3.49Å; L194-S198 PolarHBondContact O-N 3.32Å; L194-S198 PolarHBondContact O-OG 3.47Å; L194-V367 HydrophobicContact CD2-CB 4.34Å; L194-V367 HydrophobicContact CD2-CG1 4.18Å; L194-V367 HydrophobicContact CD2-CG2 3.9Å
195	H	89.1	Confident	83.1	Confident	103 Å²	103	64.2 Å²	64.2	48%	0.477	34%	0.341	S	S	.	.	H	α-helix	trans	-64.5	-37.2	173.5	-76.4	-51	0	0	0	112.6	D191 S198 N199	D191-H195 WeakPolarHBondContact O-CB 3.44Å; D191-H195 PolarHBondContact O-CD2 2.91Å; D191-H195 PolarHBondContact O-N 3.3Å; H195-S198 PolarHBondContact O-OG 2.94Å; H195-N199 VanDerWaalsContact O-CB 3.29Å; H195-N199 WeakPolarHBondContact O-CB 3.41Å; H195-N199 PolarHBondContact O-N 3.02Å; H195-N199 VanDerWaalsContact O-N 3.09Å; H195-N199 PolarHBondContact O-ND2 3.4Å
196	S	87.1	Confident	82.9	Confident	16 Å²	16	63.2 Å²	63.2	11%	0.112	34%	0.341	C	S	.	.	H	α-helix	trans	-64.6	-42.2	175.1	-179.1	0	0	0	0	111.1	V158 L192 C193 L194 N199 Q200	V158-S196 VanDerWaalsContact CB-OG 3.31Å; V158-S196 WeakPolarHBondContact CB-OG 3.44Å; V158-S196 PolarHBondContact N-OG 2.94Å; L192-S196 WeakPolarHBondContact O-CB 3.41Å; L192-S196 PolarHBondContact O-N 3.38Å; C193-S196 WeakPolarHBondContact O-CB 3.42Å; C193-S196 PolarHBondContact O-N 2.54Å; L194-S196 VanDerWaalsContact C-N 3.33Å; L194-S196 PolarHBondContact O-N 2.95Å; S196-N199 PolarHBondContact O-N 3.45Å; S196-Q200 VanDerWaalsContact O-CB 3.25Å; S196-Q200 WeakPolarHBondContact O-CB 3.33Å; S196-Q200 WeakPolarHBondContact O-CG 3.42Å; S196-Q200 PolarHBondContact O-N 3.03Å
197	L	87.3	Confident	83.7	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.01	31%	0.313	C	S	.	.	H	α-helix	trans	-61	-50.4	174.1	-77.5	163.6	0	0	0	112.3	L152 V158 I178 C193 L194 N199 L201 Y207	L152-L197 HydrophobicContact CD1-CD1 3.82Å; L152-L197 HydrophobicContact CD1-CD2 3.86Å; L152-L197 HydrophobicContact CD1-CG 3.98Å; V158-L197 HydrophobicContact CG2-CB 4.4Å; V158-L197 HydrophobicContact CG2-CD2 3.55Å; V158-L197 HydrophobicContact CG2-CG 3.77Å; I178-L197 HydrophobicContact CD1-CD1 3.55Å; I178-L197 HydrophobicContact CD1-CD2 3.59Å; I178-L197 HydrophobicContact CD1-CG 4.2Å; I178-L197 HydrophobicContact CG2-CD1 4.26Å; C193-L197 WeakPolarHBondContact O-CB 3.48Å; C193-L197 WeakPolarHBondContact O-CG 3.2Å; C193-L197 PolarHBondContact O-N 2.98Å; L194-L197 WeakPolarHBondContact O-CB 3.41Å; L194-L197 PolarHBondContact O-N 3.49Å; L197-N199 VanDerWaalsContact C-N 3.28Å; L197-N199 PolarHBondContact O-N 3.34Å; L197-L201 HydrophobicContact CD2-CD1 4.04Å; L197-L201 CarbonylContact O-C 3.53Å; L197-L201 WeakPolarHBondContact O-CA 3.36Å; L197-L201 WeakPolarHBondContact O-CB 3.31Å; L197-L201 PolarHBondContact O-N 3.42Å; L197-Y207 HydrophobicContact CB-CD1 4.46Å; L197-Y207 HydrophobicContact CB-CD2 4.03Å; L197-Y207 HydrophobicContact CB-CE1 4.38Å; L197-Y207 HydrophobicContact CB-CE2 3.94Å; L197-Y207 HydrophobicContact CB-CG 4.29Å; L197-Y207 HydrophobicContact CD1-CD1 4.37Å; L197-Y207 HydrophobicContact CD2-CE1 4.1Å
198	S	85.1	Confident	84	Confident	57 Å²	57	54 Å²	54	40%	0.399	29%	0.285	S	S	.	.	H	α-helix	trans	-63	-34.9	-179.1	66.7	0	0	0	0	112.9	L194 H195	L194-S198 PolarHBondContact O-N 3.32Å; L194-S198 PolarHBondContact O-OG 3.47Å; H195-S198 PolarHBondContact O-OG 2.94Å
199	N	82.8	Confident	84.3	Confident	126 Å²	126	53.7 Å²	53.7	67%	0.674	28%	0.282	S	S	*	.	H	α-helix	trans	-85.9	-39.5	-175.7	-68.9	-16.4	0	0	0	113.2	H195 S196 L197	H195-N199 VanDerWaalsContact O-CB 3.29Å; H195-N199 WeakPolarHBondContact O-CB 3.41Å; H195-N199 PolarHBondContact O-N 3.02Å; H195-N199 VanDerWaalsContact O-N 3.09Å; H195-N199 PolarHBondContact O-ND2 3.4Å; S196-N199 PolarHBondContact O-N 3.45Å; L197-N199 VanDerWaalsContact C-N 3.28Å; L197-N199 PolarHBondContact O-N 3.34Å
200	Q	77.5	Confident	84.5	Confident	99 Å²	99	51 Å²	51	46%	0.463	27%	0.267	S	S	.	.	H	α-helix	trans	-99.1	-22.8	-171.7	-59.3	-178	11.1	0	0	113.3	V158 H163 S196 P202	V158-Q200 HydrophobicContact CB-CB 4.31Å; V158-Q200 VanDerWaalsContact CB-OE1 3.3Å; V158-Q200 HydrophobicContact CG1-CB 4.06Å; V158-Q200 PolarHBondContact O-OE1 3.25Å; V158-Q200 VanDerWaalsContact O-OE1 3.07Å; H163-Q200 PolarHBondContact CD2-O 3.32Å; S196-Q200 VanDerWaalsContact O-CB 3.25Å; S196-Q200 WeakPolarHBondContact O-CB 3.33Å; S196-Q200 WeakPolarHBondContact O-CG 3.42Å; S196-Q200 PolarHBondContact O-N 3.03Å; Q200-P202 WeakPolarHBondContact O-CD 3.19Å
201	L	78.9	Confident	84.6	Confident	11 Å²	11	51 Å²	51	6%	0.058	27%	0.267	C	S	.	.	S	Bend	trans	-123.3	69.9	177.3	-84.3	167	0	0	0	109.6	V158 T162 H163 C166 L197 T203 Y207	V158-L201 HydrophobicContact CG1-CD1 3.8Å; V158-L201 HydrophobicContact CG1-CG 4.2Å; V158-L201 HydrophobicContact CG2-CD1 4.17Å; T162-L201 HydrophobicContact CG2-CD1 4.23Å; H163-L201 HydrophobicContact CB-CD2 4.42Å; C166-L201 HydrophobicContact CB-CD1 4.29Å; C166-L201 HydrophobicContact CB-CD2 3.99Å; L197-L201 HydrophobicContact CD2-CD1 4.04Å; L197-L201 CarbonylContact O-C 3.53Å; L197-L201 WeakPolarHBondContact O-CA 3.36Å; L197-L201 WeakPolarHBondContact O-CB 3.31Å; L197-L201 PolarHBondContact O-N 3.42Å; L201-T203 PolarHBondContact O-N 3.31Å; L201-Y207 WeakPolarHBondContact CB-OH 3.4Å; L201-Y207 PolarHBondContact O-OH 3.41Å
202	P	68.4	Low	84.7	Confident	95 Å²	95	48.5 Å²	48.5	62%	0.617	25%	0.252	S	S	*	.			trans	-66.8	105.3	178.8	27.9	-33.7	0	0	0	110	Q200	Q200-P202 WeakPolarHBondContact O-CD 3.19Å
203	T	73	Confident	84.7	Confident	40 Å²	40	44.2 Å²	44.2	25%	0.245	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-111.8	155.1	174.4	52.1	0	0	0	0	110.1	L201 A205 Y207 I365	L201-T203 PolarHBondContact O-N 3.31Å; T203-A205 PolarHBondContact O-N 3.45Å; T203-A205 PolarHBondContact OG1-O 3.38Å; T203-A205 VanDerWaalsContact OG1-O 3.13Å; T203-Y207 PolarHBondContact OG1-OH 3.39Å; T203-I365 HydrophobicContact CG2-CD1 4.47Å
204	K	74	Confident	84.5	Confident	152 Å²	152	44.9 Å²	44.9	66%	0.661	23%	0.234	S	C	*	.	S	Bend	trans	-66.3	-22.4	167.7	-71.9	-173.8	172.7	-176.8	0	112.6	N843	K204-N843 WeakPolarHBondContact CE-O 3.28Å; K204-N843 PolarHBondContact NZ-O 2.93Å
205	A	79.7	Confident	84.1	Confident	14 Å²	14	46.5 Å²	46.5	12%	0.116	24%	0.24	C	C	.	.	S	Bend	trans	-78.7	146.6	179.8	0	0	0	0	0	112	T203 Q363 I365	T203-A205 PolarHBondContact O-N 3.45Å; T203-A205 PolarHBondContact OG1-O 3.38Å; T203-A205 VanDerWaalsContact OG1-O 3.13Å; A205-Q363 CarbonylContact C-O 3.56Å; A205-Q363 WeakPolarHBondContact CA-O 3.49Å; A205-Q363 VanDerWaalsContact CB-O 3.32Å; A205-Q363 WeakPolarHBondContact CB-O 3.13Å; A205-I365 HydrophobicContact CB-CD1 3.9Å; A205-I365 HydrophobicContact CB-CG1 3.85Å
206	H	84.7	Confident	83.3	Confident	88 Å²	88	43.4 Å²	43.4	41%	0.407	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	128.1	175.8	-66.1	-89	0	0	0	110.6	I208 Q363 V364 I365	H206-I208 HydrophobicContact CB-CG1 4.27Å; H206-I208 PolarHBondContact O-N 2.94Å; H206-Q363 PolarHBondContact N-O 2.92Å; H206-V364 WeakPolarHBondContact O-CA 3.47Å; H206-I365 PolarHBondContact O-N 3.03Å
207	Y	89.9	Confident	82.2	Confident	42 Å²	42	47 Å²	47	17%	0.165	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	117.2	169.4	-60.6	-70.8	0	0	0	109.2	I178 L197 L201 T203 I365	I178-Y207 HydrophobicContact CD1-CD1 3.57Å; I178-Y207 HydrophobicContact CD1-CE1 3.55Å; L197-Y207 HydrophobicContact CB-CD1 4.46Å; L197-Y207 HydrophobicContact CB-CD2 4.03Å; L197-Y207 HydrophobicContact CB-CE1 4.38Å; L197-Y207 HydrophobicContact CB-CE2 3.94Å; L197-Y207 HydrophobicContact CB-CG 4.29Å; L197-Y207 HydrophobicContact CD1-CD1 4.37Å; L197-Y207 HydrophobicContact CD2-CE1 4.1Å; L201-Y207 WeakPolarHBondContact CB-OH 3.4Å; L201-Y207 PolarHBondContact O-OH 3.41Å; T203-Y207 PolarHBondContact OG1-OH 3.39Å; Y207-I365 WeakPolarHBondContact CA-O 3.41Å; Y207-I365 HydrophobicContact CD1-CB 3.8Å; Y207-I365 HydrophobicContact CD1-CD1 4.27Å; Y207-I365 HydrophobicContact CD1-CG2 3.83Å; Y207-I365 HydrophobicContact CE1-CB 4.08Å; Y207-I365 HydrophobicContact CE1-CD1 3.69Å; Y207-I365 HydrophobicContact CE1-CG1 4.48Å; Y207-I365 HydrophobicContact CE1-CG2 3.99Å
208	I	89.7	Confident	80.1	Confident	3 Å²	3	50.5 Å²	50.5	2%	0.015	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	121.4	-176.1	-60.8	179.8	0	0	0	110	H206 I210 L321 T324 V364 I365 P366 V367	H206-I208 HydrophobicContact CB-CG1 4.27Å; H206-I208 PolarHBondContact O-N 2.94Å; I208-I210 PolarHBondContact O-N 3.17Å; I208-L321 HydrophobicContact CG2-CB 3.79Å; I208-L321 HydrophobicContact CG2-CD1 3.78Å; I208-L321 HydrophobicContact CG2-CG 3.73Å; I208-T324 HydrophobicContact CD1-CG2 4.49Å; I208-T324 WeakPolarHBondContact CD1-OG1 3.47Å; I208-V364 HydrophobicContact CB-CG1 4.07Å; I208-V364 HydrophobicContact CD1-CB 4.2Å; I208-V364 HydrophobicContact CD1-CG1 3.58Å; I208-V364 HydrophobicContact CD1-CG2 3.55Å; I208-V364 HydrophobicContact CG1-CG1 3.96Å; I208-I365 PolarHBondContact N-O 2.75Å; I208-P366 CarbonylContact O-C 3.45Å; I208-V367 PolarHBondContact O-N 2.95Å
209	P	91.7	Very high	77.7	Confident	8 Å²	8	55.3 Å²	55.3	5%	0.052	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	127.6	172.1	28.8	-32.6	0	0	0	110.9	W212 L257 A317	P209-W212 HydrophobicContact CB-CE3 4.48Å; P209-L257 HydrophobicContact CB-CD1 4.23Å; P209-L257 HydrophobicContact CG-CD1 4.42Å; P209-L257 VanDerWaalsContact O-CD1 3.29Å; P209-L257 WeakPolarHBondContact O-CD1 3.49Å; P209-A317 HydrophobicContact CG-CB 4.45Å
210	I	91.7	Very high	75.1	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.005	30%	0.295	C	S	.	.	S	Bend	trans	-99.6	-34	172.8	-63.4	-169.6	0	0	0	110.7	I208 L257 T258 L355 P366 V367 F384	I208-I210 PolarHBondContact O-N 3.17Å; I210-L257 VanDerWaalsContact O-CB 3.25Å; I210-L257 WeakPolarHBondContact O-CB 3.42Å; I210-L257 WeakPolarHBondContact O-CG 3.48Å; I210-L257 PolarHBondContact O-N 3Å; I210-T258 HydrophobicContact CG2-CG2 4.15Å; I210-L355 HydrophobicContact CD1-CD2 3.85Å; I210-P366 HydrophobicContact CD1-CB 3.3Å; I210-P366 HydrophobicContact CG1-CB 3.99Å; I210-V367 PolarHBondContact N-O 3.16Å; I210-F384 HydrophobicContact CD1-CD2 4.04Å; I210-F384 HydrophobicContact CD1-CE2 3.17Å; I210-F384 HydrophobicContact CD1-CZ 3.68Å
211	H	91.4	Very high	72.9	Confident	5 Å²	5	57.6 Å²	57.6	2%	0.023	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	134.4	178.7	-62.7	156.2	0	0	0	110	L254 V255 L368 V369 P380	H211-L254 HydrophobicContact CB-CB 4.46Å; H211-L254 HydrophobicContact CB-CD1 4.2Å; H211-L254 HydrophobicContact CB-CD2 4.34Å; H211-V255 WeakPolarHBondContact CA-O 3.2Å; H211-L368 WeakPolarHBondContact CE1-CD2 3.34Å; H211-V369 HydrophobicContact CB-CG2 3.76Å; H211-P380 VanDerWaalsContact CE1-CB 3.44Å; H211-P380 WeakPolarHBondContact CE1-CB 3.45Å
212	W	89	Confident	70.5	Confident	21 Å²	21	63.6 Å²	63.6	8%	0.08	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	133.7	172.7	-159.3	-102.1	0	0	0	110.8	D191 P209 L254 V255 L257 E313 A314 A317	D191-W212 WeakPolarHBondContact OD1-CH2 3.42Å; P209-W212 HydrophobicContact CB-CE3 4.48Å; W212-L254 CarbonylContact O-C 3.58Å; W212-L254 VanDerWaalsContact O-CA 3.24Å; W212-L254 WeakPolarHBondContact O-CA 3.39Å; W212-V255 HydrophobicContact CB-CB 4.31Å; W212-V255 PolarHBondContact N-O 3.49Å; W212-V255 PolarHBondContact O-N 3.37Å; W212-L257 HydrophobicContact CB-CD1 4.41Å; W212-L257 HydrophobicContact CB-CD2 4.16Å; W212-L257 HydrophobicContact CB-CG 4.38Å; W212-E313 HydrophobicContact CZ2-CB 4.13Å; W212-A314 HydrophobicContact CB-CB 4.41Å; W212-A314 HydrophobicContact CG-CB 4.36Å; W212-A317 HydrophobicContact CD2-CB 4.31Å; W212-A317 HydrophobicContact CE3-CB 3.73Å; W212-A317 HydrophobicContact CZ3-CB 3.9Å
213	P	89	Confident	68.7	Low	15 Å²	15	66 Å²	66	10%	0.097	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	145.4	-175.3	32.1	-37.3	0	0	0	112.8	M183 V190 F215 F251 V369	M183-P213 HydrophobicContact CE-CB 3.71Å; M183-P213 HydrophobicContact CE-CG 3.9Å; V190-P213 HydrophobicContact CG2-CG 3.74Å; P213-F215 HydrophobicContact CB-CE2 3.89Å; P213-F215 HydrophobicContact CB-CZ 4.27Å; P213-F215 HydrophobicContact CG-CE2 3.99Å; P213-F251 HydrophobicContact CB-CD2 4.07Å; P213-F251 HydrophobicContact CB-CE2 3.57Å; P213-V369 HydrophobicContact CB-CG2 4.34Å
214	V	85.2	Confident	66.7	Low	15 Å²	15	71.1 Å²	71.1	9%	0.091	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	127.4	174.8	-177.8	0	0	0	0	110.2	V252 G253 V255 L262 L306	V214-V252 PolarHBondContact O-N 3.03Å; V214-G253 PolarHBondContact N-O 3.11Å; V214-G253 PolarHBondContact O-N 3.4Å; V214-V255 HydrophobicContact CG2-CG2 3.7Å; V214-L262 HydrophobicContact CB-CD1 4.4Å; V214-L262 HydrophobicContact CG1-CD1 4.39Å; V214-L262 HydrophobicContact CG2-CD1 3.71Å; V214-L306 HydrophobicContact CG1-CD2 3.83Å; V214-L306 HydrophobicContact CG1-CG 4.43Å; V214-L306 HydrophobicContact CG2-CD2 4.07Å
215	F	81.5	Confident	64.6	Low	64 Å²	64	68.8 Å²	68.8	28%	0.281	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	134.3	179.2	-61.1	-87.6	0	0	0	111.1	M183 P213 Q250 F251	M183-F215 HydrophobicContact CE-CE2 4.38Å; M183-F215 HydrophobicContact CE-CZ 3.68Å; P213-F215 HydrophobicContact CB-CE2 3.89Å; P213-F215 HydrophobicContact CB-CZ 4.27Å; P213-F215 HydrophobicContact CG-CE2 3.99Å; F215-Q250 CarbonylContact C-O 3.57Å; F215-Q250 VanDerWaalsContact CA-O 3.24Å; F215-Q250 WeakPolarHBondContact CA-O 3.21Å; F215-F251 HydrophobicContact CD1-CB 4.06Å; F215-F251 HydrophobicContact CD1-CD2 4.43Å; F215-F251 HydrophobicContact CE1-CB 3.93Å; F215-F251 HydrophobicContact CE1-CD2 4.16Å; F215-F251 HydrophobicContact CE1-CG 4.49Å; F215-F251 HydrophobicContact CZ-CD2 4.42Å
216	S	72.5	Confident	62.2	Low	37 Å²	37	73 Å²	73	26%	0.259	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	132.8	167.3	61.3	0	0	0	0	110.6	S249 Q250 V252	S216-S249 WeakPolarHBondContact O-CA 3.2Å; S216-Q250 PolarHBondContact N-O 3.1Å; S216-Q250 PolarHBondContact O-N 2.92Å; S216-V252 VanDerWaalsContact OG-CG2 3.29Å; S216-V252 WeakPolarHBondContact OG-CG2 3.03Å
217	H	62.5	Low	59.6	Low	91 Å²	91	77.3 Å²	77.3	42%	0.421	44%	0.438	S	S	.	.			trans	-96.5	126	163.7	-76	-69.2	0	0	0	110.1	L219 N307	H217-L219 PolarHBondContact O-N 3.35Å; H217-N307 PolarHBondContact CD2-ND2 3.45Å
218	S	44.5	Very low	56.7	Low	77 Å²	77	81.1 Å²	81.1	54%	0.538	47%	0.465	S	S	.	.			trans	-71.1	106.8	160.8	56.8	0	0	0	0	108.2	N220	S218-N220 PolarHBondContact O-N 2.94Å; S218-N220 VanDerWaalsContact O-N 3.09Å
219	L	34.5	Very low	53.7	Low	158 Å²	158	88.3 Å²	88.3	83%	0.827	50%	0.504	S	S	*	.			trans	-65	106.9	163.7	-77.6	162.9	0	0	0	107.3	H217 T221	H217-L219 PolarHBondContact O-N 3.35Å; L219-T221 PolarHBondContact O-N 3.08Å
220	N	29.1	Very low	50.8	Low	143 Å²	143	92.8 Å²	92.8	77%	0.765	54%	0.542	S	S	*	.			trans	-60.6	106.7	162.6	-84.3	-5.6	0	0	0	107.1	S218 D222	S218-N220 PolarHBondContact O-N 2.94Å; S218-N220 VanDerWaalsContact O-N 3.09Å; N220-D222 PolarHBondContact O-N 2.72Å
221	T	29.7	Very low	47.7	Very low	129 Å²	129	97.6 Å²	97.6	79%	0.791	58%	0.576	S	S	*	*	S	Bend	trans	-70.2	71.9	169.3	48.7	0	0	0	0	108.9	L219	L219-T221 PolarHBondContact O-N 3.08Å
222	D	29.3	Very low	44.6	Very low	137 Å²	137	104.3 Å²	104.3	73%	0.733	61%	0.611	S	S	*	*			trans	-161.6	79.6	169.7	-82.1	-35.3	0	0	0	106.6	N220	N220-D222 PolarHBondContact O-N 2.72Å
223	N	29.9	Very low	41.8	Very low	146 Å²	146	110 Å²	110	78%	0.781	65%	0.649	S	S	*	*			trans	-179.3	63.7	159.5	-87.3	-26.2	0	0	0	111	S225	N223-S225 VanDerWaalsContact C-N 3.27Å; N223-S225 PolarHBondContact O-N 2.93Å
224	T	30.8	Very low	38.8	Very low	147 Å²	147	114.5 Å²	114.5	90%	0.902	68%	0.681	S	S	*	*			trans	-81	66.3	162.4	49.8	0	0	0	0	110.1
225	S	30.3	Very low	35.9	Very low	103 Å²	103	120.2 Å²	120.2	72%	0.72	72%	0.716	S	S	*	*	S	Bend	trans	176.7	65.9	167.6	54.1	0	0	0	0	114.4	N223	N223-S225 VanDerWaalsContact C-N 3.27Å; N223-S225 PolarHBondContact O-N 2.93Å
226	S	30.4	Very low	33.3	Very low	103 Å²	103	122.7 Å²	122.7	72%	0.72	74%	0.741	S	S	*	*			trans	-170.9	59	161.8	47.7	0	0	0	0	113.3
227	L	28.5	Very low	31.2	Very low	178 Å²	178	129 Å²	129	93%	0.932	77%	0.771	S	S	*	*			trans	-122.2	66.2	167.6	-84.4	163.3	0	0	0	109.7
228	V	28.8	Very low	29.4	Very low	122 Å²	122	129.8 Å²	129.8	74%	0.739	79%	0.787	S	S	*	*			trans	-148.4	124.7	164	-170.1	0	0	0	0	107.6
229	N	27	Very low	28.5	Very low	154 Å²	154	133.7 Å²	133.7	82%	0.824	80%	0.801	S	S	*	*			trans	85.5	102.8	170.4	-53.1	-30.4	0	0	0	118.1
230	A	31.3	Very low	28.2	Very low	103 Å²	103	135.9 Å²	135.9	85%	0.851	80%	0.804	S	S	*	*				-179.3	83.6	120.6	0	0	0	0	0	110.1
231	S	25.9	Very low	28.1	Very low	102 Å²	102	138.7 Å²	138.7	71%	0.713	81%	0.806	S	S	*	*			trans	-72.7	149.3	151.7	41.9	0	0	0	0	109.4
232	N	26.6	Very low	28	Very low	145 Å²	145	141.2 Å²	141.2	78%	0.775	81%	0.808	S	S	*	*			trans	79.2	107.1	168.8	-50.7	-22.4	0	0	0	116.5
233	T	31	Very low	27.8	Very low	142 Å²	142	140.4 Å²	140.4	87%	0.871	81%	0.808	S	S	*	*				178.2	120.1	109	30	0	0	0	0	111.1
234	S	25	Very low	27.8	Very low	109 Å²	109	142.5 Å²	142.5	76%	0.762	81%	0.81	S	S	*	*			trans	-67.4	122.7	164.9	44.3	0	0	0	0	110.8
235	T	25.4	Very low	27.9	Very low	135 Å²	135	139.9 Å²	139.9	83%	0.828	79%	0.791	S	S	*	*			trans	162.9	110.6	143.2	28.4	0	0	0	0	110.8
236	S	27.3	Very low	28.2	Very low	116 Å²	116	143.7 Å²	143.7	81%	0.811	80%	0.803	S	S	*	*			trans	161.3	95.9	143.4	44.2	0	0	0	0	110.1
237	L	26.8	Very low	28.8	Very low	169 Å²	169	141 Å²	141	89%	0.885	79%	0.791	S	S	*	*			trans	-66.4	145.4	156.4	-69.5	124.8	0	0	0	107.4
238	S	25.8	Very low	30	Very low	107 Å²	107	138.3 Å²	138.3	75%	0.748	78%	0.782	S	S	*	*	S	Bend	trans	79.3	85.3	-172.2	76.6	0	0	0	0	115.5
239	N	25.1	Very low	31.7	Very low	159 Å²	159	134.4 Å²	134.4	85%	0.85	76%	0.76	S	S	*	*			trans	164.1	42.4	152.3	-85.6	-17.1	0	0	0	112.6
240	K	28	Very low	34.1	Very low	205 Å²	205	132.8 Å²	132.8	89%	0.891	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	6.9	-174.6	-104.6	-176	178.4	-176.5	0	116.1
241	Y	28.1	Very low	36.5	Very low	202 Å²	202	128.1 Å²	128.1	79%	0.792	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.1	8.9	-171	-75.8	-73.4	0	0	0	116.7
242	H	25.8	Very low	39.2	Very low	181 Å²	181	124 Å²	124	84%	0.838	68%	0.679	S	S	*	*	S	Bend	trans	-142.4	54.9	-173.9	-90.1	-58.5	0	0	0	114.6
243	V	26.7	Very low	41.9	Very low	121 Å²	121	117.1 Å²	117.1	73%	0.733	64%	0.642	S	S	*	*			trans	-149.1	117.5	170.3	-177.6	0	0	0	0	111.9
244	K	28.9	Very low	44.7	Very low	189 Å²	189	110.3 Å²	110.3	82%	0.822	60%	0.601	S	S	*	*			trans	85.3	90.6	160.2	-67.9	162.4	-173	-175.7	0	119.3
245	N	33.8	Very low	47.7	Very low	93 Å²	93	105.3 Å²	105.3	50%	0.497	57%	0.565	S	S	.	*			trans	-147.2	70.6	138.7	-98.9	-14.2	0	0	0	109.5
246	N	35.8	Very low	50.7	Low	183 Å²	183	99.5 Å²	99.5	98%	0.979	53%	0.529	S	S	*	.			trans	-99.1	22.2	171	-92.3	6.8	0	0	0	112.3
247	G	42.4	Very low	53.6	Low	46 Å²	46	94 Å²	94	47%	0.474	49%	0.491	S	S	.	.	S	Bend	trans	-130.3	135.9	171.8	0	0	0	0	0	109.4	S249	G247-S249 PolarHBondContact O-N 3.42Å
248	T	54.7	Low	56.4	Low	121 Å²	121	86 Å²	86	74%	0.742	45%	0.449	S	S	*	.			trans	-62.3	85.9	-170.7	49	0	0	0	0	112.4	Q250	T248-Q250 PolarHBondContact O-N 3.15Å
249	S	65	Low	59.2	Low	40 Å²	40	82.8 Å²	82.8	28%	0.28	43%	0.425	S	S	.	.			trans	-72.6	113.7	166.7	54.2	0	0	0	0	108.6	S216 G247	S216-S249 WeakPolarHBondContact O-CA 3.2Å; G247-S249 PolarHBondContact O-N 3.42Å
250	Q	76	Confident	61.9	Low	120 Å²	120	75.6 Å²	75.6	56%	0.561	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.2	133	178	-174.9	174.4	-11.6	0	0	109.4	F215 S216 T248 V252	F215-Q250 CarbonylContact C-O 3.57Å; F215-Q250 VanDerWaalsContact CA-O 3.24Å; F215-Q250 WeakPolarHBondContact CA-O 3.21Å; S216-Q250 PolarHBondContact N-O 3.1Å; S216-Q250 PolarHBondContact O-N 2.92Å; T248-Q250 PolarHBondContact O-N 3.15Å; Q250-V252 HydrophobicContact CB-CG2 4.46Å; Q250-V252 HydrophobicContact CG-CG2 4.41Å; Q250-V252 WeakPolarHBondContact O-CG2 3.18Å; Q250-V252 PolarHBondContact O-N 3.29Å
251	F	83.6	Confident	64.6	Low	6 Å²	6	68.8 Å²	68.8	3%	0.026	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	122.5	171	-179.8	-117.5	0	0	0	109.6	M183 P213 F215 G253 I376	M183-F251 HydrophobicContact CB-CB 4.49Å; M183-F251 HydrophobicContact CB-CD1 3.72Å; M183-F251 HydrophobicContact CB-CD2 4.07Å; M183-F251 HydrophobicContact CB-CE1 3.85Å; M183-F251 HydrophobicContact CB-CE2 4.2Å; M183-F251 HydrophobicContact CB-CG 3.84Å; M183-F251 HydrophobicContact CB-CZ 4.1Å; M183-F251 HydrophobicContact CG-CZ 4.47Å; M183-F251 WeakPolarHBondContact O-CB 3.49Å; P213-F251 HydrophobicContact CB-CD2 4.07Å; P213-F251 HydrophobicContact CB-CE2 3.57Å; F215-F251 HydrophobicContact CD1-CB 4.06Å; F215-F251 HydrophobicContact CD1-CD2 4.43Å; F215-F251 HydrophobicContact CE1-CB 3.93Å; F215-F251 HydrophobicContact CE1-CD2 4.16Å; F215-F251 HydrophobicContact CE1-CG 4.49Å; F215-F251 HydrophobicContact CZ-CD2 4.42Å; F251-G253 WeakPolarHBondContact CE2-O 3.43Å; F251-G253 WeakPolarHBondContact CZ-O 3.49Å; F251-I376 HydrophobicContact CD1-CB 4.33Å; F251-I376 HydrophobicContact CD1-CD1 4.01Å; F251-I376 HydrophobicContact CD1-CG2 4.16Å; F251-I376 HydrophobicContact CE1-CB 3.88Å; F251-I376 HydrophobicContact CE1-CD1 4.36Å; F251-I376 HydrophobicContact CE1-CG2 3.46Å; F251-I376 VanDerWaalsContact CE1-CG2 3.46Å; F251-I376 HydrophobicContact CZ-CG2 4.03Å; F251-I376 WeakPolarHBondContact O-CD1 3.37Å
252	V	81.6	Confident	67.2	Low	14 Å²	14	59.4 Å²	59.4	9%	0.085	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	-29.4	-166	170.3	0	0	0	0	112.6	V214 S216 Q250 N264 W265 I266	V214-V252 PolarHBondContact O-N 3.03Å; S216-V252 VanDerWaalsContact OG-CG2 3.29Å; S216-V252 WeakPolarHBondContact OG-CG2 3.03Å; Q250-V252 HydrophobicContact CB-CG2 4.46Å; Q250-V252 HydrophobicContact CG-CG2 4.41Å; Q250-V252 WeakPolarHBondContact O-CG2 3.18Å; Q250-V252 PolarHBondContact O-N 3.29Å; V252-N264 WeakPolarHBondContact CG1-OD1 3.07Å; V252-W265 PolarHBondContact O-N 3Å; V252-I266 HydrophobicContact CG1-CD1 3.68Å; V252-I266 HydrophobicContact CG1-CG1 3.49Å; V252-I266 VanDerWaalsContact CG1-CG1 3.49Å
253	G	84.1	Confident	70	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.01	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.9	-171.8	-177.3	0	0	0	0	0	112	V214 F251 K263	V214-G253 PolarHBondContact N-O 3.11Å; V214-G253 PolarHBondContact O-N 3.4Å; F251-G253 WeakPolarHBondContact CE2-O 3.43Å; F251-G253 WeakPolarHBondContact CZ-O 3.49Å; G253-K263 CarbonylContact C-O 3.32Å; G253-K263 WeakPolarHBondContact CA-O 3.27Å
254	L	89.7	Confident	72.7	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	153.1	177.4	61.4	82.8	0	0	0	110.6	H211 W212 K263 W265 V369 P380	H211-L254 HydrophobicContact CB-CB 4.46Å; H211-L254 HydrophobicContact CB-CD1 4.2Å; H211-L254 HydrophobicContact CB-CD2 4.34Å; W212-L254 CarbonylContact O-C 3.58Å; W212-L254 VanDerWaalsContact O-CA 3.24Å; W212-L254 WeakPolarHBondContact O-CA 3.39Å; L254-K263 HydrophobicContact CD1-CB 4.2Å; L254-K263 HydrophobicContact CD1-CD 4.04Å; L254-K263 HydrophobicContact CD1-CG 4.44Å; L254-K263 PolarHBondContact N-O 3.4Å; L254-K263 PolarHBondContact O-N 3.41Å; L254-W265 HydrophobicContact CD2-CH2 4.26Å; L254-W265 HydrophobicContact CD2-CZ3 4.3Å; L254-W265 HydrophobicContact CG-CH2 4.18Å; L254-W265 HydrophobicContact CG-CZ3 3.91Å; L254-V369 HydrophobicContact CB-CG2 4.29Å; L254-P380 HydrophobicContact CD2-CG 4.39Å
255	V	88.2	Confident	75.2	Confident	3 Å²	3	38 Å²	38	2%	0.018	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	123.7	169	174.1	0	0	0	0	107.4	H211 W212 V214 L257 M260 L262 L280 A314	H211-V255 WeakPolarHBondContact CA-O 3.2Å; W212-V255 HydrophobicContact CB-CB 4.31Å; W212-V255 PolarHBondContact N-O 3.49Å; W212-V255 PolarHBondContact O-N 3.37Å; V214-V255 HydrophobicContact CG2-CG2 3.7Å; V255-L257 HydrophobicContact CG1-CD2 4.23Å; V255-L257 PolarHBondContact O-N 3.3Å; V255-M260 HydrophobicContact CG1-SD 4.44Å; V255-L262 HydrophobicContact CG2-CD1 3.95Å; V255-L280 HydrophobicContact CB-CD1 4.36Å; V255-L280 HydrophobicContact CG1-CD1 3.42Å; V255-L280 VanDerWaalsContact CG1-CD1 3.42Å; V255-L280 HydrophobicContact CG2-CD1 4Å; V255-A314 HydrophobicContact CG1-CB 4.29Å
256	D	87.8	Confident	77	Confident	13 Å²	13	39.1 Å²	39.1	7%	0.07	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	110	169.8	-174.5	-20.8	0	0	0	108.9	T258 T259 M260 Q261 K263	D256-T258 PolarHBondContact O-N 2.86Å; D256-T258 PolarHBondContact OD1-N 3.43Å; D256-T258 PolarHBondContact OD1-OG1 3.23Å; D256-T259 WeakPolarHBondContact CB-OG1 3.45Å; D256-T259 VanDerWaalsContact CG-OG1 3.22Å; D256-T259 PolarHBondContact OD2-OG1 2.87Å; D256-M260 WeakPolarHBondContact O-CA 3.28Å; D256-M260 PolarHBondContact O-N 2.77Å; D256-Q261 PolarHBondContact N-O 3.15Å; D256-K263 IonicContact OD2-NZ 3.56Å; D256-K263 PolarHBondContact OD2-NZ 2.78Å
257	L	87.1	Confident	78.4	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-11.9	-175.3	-62.5	173.1	0	0	0	112.6	P209 I210 W212 V255 A314 A317 R318 L321	P209-L257 HydrophobicContact CB-CD1 4.23Å; P209-L257 HydrophobicContact CG-CD1 4.42Å; P209-L257 VanDerWaalsContact O-CD1 3.29Å; P209-L257 WeakPolarHBondContact O-CD1 3.49Å; I210-L257 VanDerWaalsContact O-CB 3.25Å; I210-L257 WeakPolarHBondContact O-CB 3.42Å; I210-L257 WeakPolarHBondContact O-CG 3.48Å; I210-L257 PolarHBondContact O-N 3Å; W212-L257 HydrophobicContact CB-CD1 4.41Å; W212-L257 HydrophobicContact CB-CD2 4.16Å; W212-L257 HydrophobicContact CB-CG 4.38Å; V255-L257 HydrophobicContact CG1-CD2 4.23Å; V255-L257 PolarHBondContact O-N 3.3Å; L257-A314 HydrophobicContact CD2-CB 4.18Å; L257-A314 VanDerWaalsContact CD2-O 3.3Å; L257-A314 WeakPolarHBondContact CD2-O 3.37Å; L257-A317 HydrophobicContact CD1-CB 3.79Å; L257-A317 HydrophobicContact CD2-CB 4.35Å; L257-R318 HydrophobicContact CD2-CB 4.25Å; L257-R318 PolarHBondContact O-NH1 3.33Å; L257-L321 HydrophobicContact CB-CD1 4.43Å
258	T	85.9	Confident	79.5	Confident	1 Å²	1	32 Å²	32	1%	0.006	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-41.9	176.5	63.2	0	0	0	0	111.8	I210 D256 R318 V351 H352 L355	I210-T258 HydrophobicContact CG2-CG2 4.15Å; D256-T258 PolarHBondContact O-N 2.86Å; D256-T258 PolarHBondContact OD1-N 3.43Å; D256-T258 PolarHBondContact OD1-OG1 3.23Å; T258-R318 VanDerWaalsContact C-NH1 3.34Å; T258-R318 PolarHBondContact O-NH1 2.74Å; T258-V351 HydrophobicContact CG2-CG1 4.32Å; T258-H352 PolarHBondContact OG1-CE1 3.3Å; T258-H352 VanDerWaalsContact OG1-CE1 3.26Å; T258-L355 HydrophobicContact CG2-CD2 3.86Å
259	T	84.3	Confident	79.9	Confident	41 Å²	41	32.9 Å²	32.9	25%	0.252	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-12.7	-178.8	55.3	0	0	0	0	113.7	D256 Q261	D256-T259 WeakPolarHBondContact CB-OG1 3.45Å; D256-T259 VanDerWaalsContact CG-OG1 3.22Å; D256-T259 PolarHBondContact OD2-OG1 2.87Å; T259-Q261 PolarHBondContact O-N 3.36Å
260	M	82.6	Confident	79.9	Confident	8 Å²	8	31.7 Å²	31.7	4%	0.039	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	33.4	-169.9	-69.9	-65.2	-76.4	0	0	113.6	V255 D256 L280 F281 L315 R318	V255-M260 HydrophobicContact CG1-SD 4.44Å; D256-M260 WeakPolarHBondContact O-CA 3.28Å; D256-M260 PolarHBondContact O-N 2.77Å; M260-L280 HydrophobicContact CE-CD1 3.93Å; M260-L280 WeakPolarHBondContact O-CB 3.38Å; M260-L280 WeakPolarHBondContact O-CD1 3.24Å; M260-L280 PolarHBondContact O-N 3.04Å; M260-L280 VanDerWaalsContact O-N 3.14Å; M260-L280 HydrophobicContact SD-CD1 4.45Å; M260-F281 HydrophobicContact CB-CD2 4.37Å; M260-F281 HydrophobicContact CB-CE2 3.82Å; M260-F281 HydrophobicContact CE-CE2 3.56Å; M260-F281 HydrophobicContact CE-CZ 3.52Å; M260-F281 HydrophobicContact CG-CE2 4.09Å; M260-L315 HydrophobicContact CE-CD2 3.74Å; M260-L315 HydrophobicContact CE-CG 4.36Å; M260-R318 HydrophobicContact SD-CB 4.31Å; M260-R318 WeakPolarHBondContact SD-CD 3.47Å; M260-R318 HydrophobicContact SD-CG 4.4Å
261	Q	84.3	Confident	79.3	Confident	61 Å²	61	28 Å²	28	29%	0.285	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	130.4	174.8	-67.6	-168.1	-17.4	0	0	111.3	D256 T259 K263 S277 D279	D256-Q261 PolarHBondContact N-O 3.15Å; T259-Q261 PolarHBondContact O-N 3.36Å; Q261-K263 PolarHBondContact O-N 2.93Å; Q261-S277 PolarHBondContact OE1-OG 2.96Å; Q261-D279 VanDerWaalsContact CG-OD1 3.26Å; Q261-D279 WeakPolarHBondContact CG-OD1 3.23Å; Q261-D279 PolarHBondContact NE2-OD1 3.4Å
262	L	84.2	Confident	78.5	Confident	5 Å²	5	32.7 Å²	32.7	3%	0.026	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	115.6	167	177.5	72.1	0	0	0	108.7	V214 V255 S277 S278 L280 L306	V214-L262 HydrophobicContact CB-CD1 4.4Å; V214-L262 HydrophobicContact CG1-CD1 4.39Å; V214-L262 HydrophobicContact CG2-CD1 3.71Å; V255-L262 HydrophobicContact CG2-CD1 3.95Å; L262-S277 WeakPolarHBondContact O-CA 3.32Å; L262-S278 PolarHBondContact N-O 2.92Å; L262-S278 PolarHBondContact O-N 3.33Å; L262-L280 HydrophobicContact CB-CD2 4.47Å; L262-L280 HydrophobicContact CB-CG 4.35Å; L262-L306 HydrophobicContact CD1-CD1 4.08Å; L262-L306 HydrophobicContact CD1-CD2 4.28Å; L262-L306 HydrophobicContact CD1-CG 4.42Å; L262-L306 HydrophobicContact CD2-CD1 3.55Å; L262-L306 HydrophobicContact CD2-CG 4.29Å; L262-L306 HydrophobicContact CG-CD1 4.27Å
263	K	84.1	Confident	77.6	Confident	14 Å²	14	35 Å²	35	6%	0.061	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	120.2	174.2	-59.2	179.1	-177.8	166.1	0	108.6	G253 L254 D256 Q261 W265 Y275 P380	G253-K263 CarbonylContact C-O 3.32Å; G253-K263 WeakPolarHBondContact CA-O 3.27Å; L254-K263 HydrophobicContact CD1-CB 4.2Å; L254-K263 HydrophobicContact CD1-CD 4.04Å; L254-K263 HydrophobicContact CD1-CG 4.44Å; L254-K263 PolarHBondContact N-O 3.4Å; L254-K263 PolarHBondContact O-N 3.41Å; D256-K263 IonicContact OD2-NZ 3.56Å; D256-K263 PolarHBondContact OD2-NZ 2.78Å; Q261-K263 PolarHBondContact O-N 2.93Å; K263-W265 VanDerWaalsContact C-CZ3 3.47Å; K263-W265 HydrophobicContact CB-CE3 4.38Å; K263-W265 HydrophobicContact CB-CH2 3.54Å; K263-W265 HydrophobicContact CB-CZ3 3.35Å; K263-W265 HydrophobicContact CD-CH2 4.27Å; K263-W265 WeakPolarHBondContact O-CZ3 3.46Å; K263-Y275 HydrophobicContact CB-CD2 3.71Å; K263-Y275 HydrophobicContact CB-CE2 3.9Å; K263-Y275 HydrophobicContact CB-CG 4.44Å; K263-Y275 HydrophobicContact CD-CD2 4.28Å; K263-Y275 HydrophobicContact CD-CE2 3.59Å; K263-Y275 HydrophobicContact CG-CD2 3.89Å; K263-Y275 HydrophobicContact CG-CE2 3.53Å; K263-P380 HydrophobicContact CD-CG 4.21Å
264	N	82.6	Confident	76.7	Confident	15 Å²	15	40.4 Å²	40.4	8%	0.08	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	130.7	-173.5	-173.4	-17.7	0	0	0	111.6	V252 I266 Y275 T276	V252-N264 WeakPolarHBondContact CG1-OD1 3.07Å; N264-I266 VanDerWaalsContact ND2-CD1 3.31Å; N264-I266 WeakPolarHBondContact ND2-CD1 3.45Å; N264-I266 WeakPolarHBondContact OD1-CD1 3.38Å; N264-I266 WeakPolarHBondContact OD1-CG1 3.41Å; N264-I266 PolarHBondContact OD1-N 3.01Å; N264-Y275 WeakPolarHBondContact O-CA 3.46Å; N264-Y275 WeakPolarHBondContact O-CB 3.41Å; N264-T276 PolarHBondContact N-O 3.47Å; N264-T276 PolarHBondContact O-N 3.36Å; N264-T276 PolarHBondContact O-OG1 2.76Å
265	W	80.8	Confident	75.7	Confident	12 Å²	12	42.2 Å²	42.2	5%	0.045	24%	0.236	C	C	.	.			trans	-105.4	11.2	-174.6	-81.8	-103.7	0	0	0	114.4	V252 L254 K263 S267 C268 Y275 I376 P380	V252-W265 PolarHBondContact O-N 3Å; L254-W265 HydrophobicContact CD2-CH2 4.26Å; L254-W265 HydrophobicContact CD2-CZ3 4.3Å; L254-W265 HydrophobicContact CG-CH2 4.18Å; L254-W265 HydrophobicContact CG-CZ3 3.91Å; K263-W265 VanDerWaalsContact C-CZ3 3.47Å; K263-W265 HydrophobicContact CB-CE3 4.38Å; K263-W265 HydrophobicContact CB-CH2 3.54Å; K263-W265 HydrophobicContact CB-CZ3 3.35Å; K263-W265 HydrophobicContact CD-CH2 4.27Å; K263-W265 WeakPolarHBondContact O-CZ3 3.46Å; W265-S267 PolarHBondContact O-N 3.05Å; W265-C268 HydrophobicContact CB-CB 4.32Å; W265-C268 HydrophobicContact CG-CB 4.37Å; W265-C268 PolarHBondContact O-N 3.11Å; W265-Y275 HydrophobicContact CD2-CG 4.43Å; W265-Y275 AromaticContact CE2-CD1 3.79Å; W265-Y275 AromaticContact CE2-CG 3.94Å; W265-Y275 AromaticContact CH2-CD1 4Å; W265-Y275 HydrophobicContact CH2-CD1 4Å; W265-Y275 HydrophobicContact CH2-CD2 4.42Å; W265-Y275 HydrophobicContact CH2-CE1 4.43Å; W265-Y275 AromaticContact CH2-CG 4Å; W265-Y275 HydrophobicContact CH2-CG 4Å; W265-Y275 AromaticContact CZ2-CD1 3.37Å; W265-Y275 HydrophobicContact CZ2-CD1 3.37Å; W265-Y275 AromaticContact CZ2-CE1 3.98Å; W265-Y275 HydrophobicContact CZ2-CE1 3.98Å; W265-Y275 AromaticContact CZ2-CG 3.7Å; W265-Y275 HydrophobicContact CZ2-CG 3.7Å; W265-I376 HydrophobicContact CB-CD1 4.49Å; W265-I376 HydrophobicContact CB-CG1 3.99Å; W265-I376 HydrophobicContact CB-CG2 4.39Å; W265-I376 HydrophobicContact CD2-CG2 3.9Å; W265-I376 HydrophobicContact CE3-CG2 3.76Å; W265-I376 HydrophobicContact CG-CB 4.47Å; W265-I376 HydrophobicContact CG-CG1 4.27Å; W265-I376 HydrophobicContact CG-CG2 4.18Å; W265-I376 HydrophobicContact CZ3-CG2 4.35Å; W265-P380 HydrophobicContact CH2-CG 3.54Å; W265-P380 HydrophobicContact CZ2-CG 3.74Å
266	I	73.1	Confident	74.6	Confident	117 Å²	117	45.5 Å²	45.5	60%	0.6	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.6	-35.1	-177.9	-70.3	161.4	0	0	0	112.9	V252 N264	V252-I266 HydrophobicContact CG1-CD1 3.68Å; V252-I266 HydrophobicContact CG1-CG1 3.49Å; V252-I266 VanDerWaalsContact CG1-CG1 3.49Å; N264-I266 VanDerWaalsContact ND2-CD1 3.31Å; N264-I266 WeakPolarHBondContact ND2-CD1 3.45Å; N264-I266 WeakPolarHBondContact OD1-CD1 3.38Å; N264-I266 WeakPolarHBondContact OD1-CG1 3.41Å; N264-I266 PolarHBondContact OD1-N 3.01Å
267	S	64.4	Low	73.7	Confident	67 Å²	67	47.6 Å²	47.6	47%	0.469	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-1	-176.9	53.4	0	0	0	0	115	W265	W265-S267 PolarHBondContact O-N 3.05Å
268	C	65.7	Low	72.5	Confident	14 Å²	14	49.1 Å²	49.1	10%	0.095	28%	0.282	C	S	.	.			trans	-94.1	115.4	-170.7	-62.1	0	0	0	0	112.2	W265 D273 Y275	W265-C268 HydrophobicContact CB-CB 4.32Å; W265-C268 HydrophobicContact CG-CB 4.37Å; W265-C268 PolarHBondContact O-N 3.11Å; C268-D273 HydrophobicContact CB-CB 4.04Å; C268-Y275 VanDerWaalsContact SG-CA 3.52Å
269	N	63.5	Low	71.4	Confident	139 Å²	139	52.4 Å²	52.4	74%	0.743	30%	0.3	S	S	*	.			trans	-121.7	-21.7	176.3	-67.2	-44.8	0	0	0	113.4	D273	N269-D273 PolarHBondContact N-OD2 2.97Å
270	G	64.9	Low	70.3	Confident	15 Å²	15	51.8 Å²	51.8	16%	0.155	30%	0.295	C	S	.	.	S	Bend	trans	-122.6	174.2	-176.8	0	0	0	0	0	114.3	D272 D273	G270-D272 VanDerWaalsContact C-N 3.26Å; G270-D272 PolarHBondContact O-N 2.8Å; G270-D273 PolarHBondContact N-OD2 2.95Å; G270-D273 PolarHBondContact O-N 2.73Å
271	P	63.1	Low	69.2	Low	42 Å²	42	53.9 Å²	53.9	27%	0.273	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-20.6	178.9	32.2	-32.2	0	0	0	112.2	Y78 Y79 D273	Y78-P271 HydrophobicContact CD1-CB 4.22Å; Y78-P271 HydrophobicContact CE1-CB 3.95Å; Y78-P271 HydrophobicContact CE1-CG 4.08Å; Y78-P271 WeakPolarHBondContact OH-CD 3.43Å; Y79-P271 HydrophobicContact CD1-CB 4.22Å; P271-D273 VanDerWaalsContact C-N 3.35Å
272	D	65.9	Low	67.6	Low	105 Å²	105	58.7 Å²	58.7	56%	0.561	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-11.5	176.7	-62.5	-25.2	0	0	0	112.4	R81 G270 V274	R81-D272 IonicContact CZ-OD1 3.63Å; R81-D272 IonicContact NE-OD1 3.28Å; R81-D272 PolarHBondContact NE-OD1 2.82Å; R81-D272 IonicContact NH2-OD1 2.83Å; R81-D272 PolarHBondContact NH2-OD1 2.99Å; G270-D272 VanDerWaalsContact C-N 3.26Å; G270-D272 PolarHBondContact O-N 2.8Å; D272-V274 PolarHBondContact O-N 3.09Å
273	D	63.9	Low	65.4	Low	62 Å²	62	61.2 Å²	61.2	33%	0.332	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-78.7	119.9	179.3	-63.5	-26.5	0	0	0	109.5	C268 N269 G270 P271	C268-D273 HydrophobicContact CB-CB 4.04Å; N269-D273 PolarHBondContact N-OD2 2.97Å; G270-D273 PolarHBondContact N-OD2 2.95Å; G270-D273 PolarHBondContact O-N 2.73Å; P271-D273 VanDerWaalsContact C-N 3.35Å
274	V	65.1	Low	63.3	Low	115 Å²	115	66 Å²	66	70%	0.697	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-90	131.4	173.6	-172.8	0	0	0	0	108	D272	D272-V274 PolarHBondContact O-N 3.09Å
275	Y	68.4	Low	60.8	Low	38 Å²	38	71.9 Å²	71.9	15%	0.149	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-59.6	147.4	172.9	57.4	-97.2	0	0	0	110.4	K263 N264 W265 C268 S277 Q379	K263-Y275 HydrophobicContact CB-CD2 3.71Å; K263-Y275 HydrophobicContact CB-CE2 3.9Å; K263-Y275 HydrophobicContact CB-CG 4.44Å; K263-Y275 HydrophobicContact CD-CD2 4.28Å; K263-Y275 HydrophobicContact CD-CE2 3.59Å; K263-Y275 HydrophobicContact CG-CD2 3.89Å; K263-Y275 HydrophobicContact CG-CE2 3.53Å; N264-Y275 WeakPolarHBondContact O-CA 3.46Å; N264-Y275 WeakPolarHBondContact O-CB 3.41Å; W265-Y275 HydrophobicContact CD2-CG 4.43Å; W265-Y275 AromaticContact CE2-CD1 3.79Å; W265-Y275 AromaticContact CE2-CG 3.94Å; W265-Y275 AromaticContact CH2-CD1 4Å; W265-Y275 HydrophobicContact CH2-CD1 4Å; W265-Y275 HydrophobicContact CH2-CD2 4.42Å; W265-Y275 HydrophobicContact CH2-CE1 4.43Å; W265-Y275 AromaticContact CH2-CG 4Å; W265-Y275 HydrophobicContact CH2-CG 4Å; W265-Y275 AromaticContact CZ2-CD1 3.37Å; W265-Y275 HydrophobicContact CZ2-CD1 3.37Å; W265-Y275 AromaticContact CZ2-CE1 3.98Å; W265-Y275 HydrophobicContact CZ2-CE1 3.98Å; W265-Y275 AromaticContact CZ2-CG 3.7Å; W265-Y275 HydrophobicContact CZ2-CG 3.7Å; C268-Y275 VanDerWaalsContact SG-CA 3.52Å; Y275-S277 PolarHBondContact O-N 2.99Å; Y275-Q379 HydrophobicContact CE1-CB 4.21Å
276	T	65.8	Low	58.3	Low	72 Å²	72	77.3 Å²	77.3	44%	0.442	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	121	172.7	52.9	0	0	0	0	108.6	N264	N264-T276 PolarHBondContact N-O 3.47Å; N264-T276 PolarHBondContact O-N 3.36Å; N264-T276 PolarHBondContact O-OG1 2.76Å
277	S	67.8	Low	56.2	Low	56 Å²	56	77.9 Å²	77.9	39%	0.392	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	130.1	171	-158.3	0	0	0	0	109	Q261 L262 Y275	Q261-S277 PolarHBondContact OE1-OG 2.96Å; L262-S277 WeakPolarHBondContact O-CA 3.32Å; Y275-S277 PolarHBondContact O-N 2.99Å
278	S	61.5	Low	54.4	Low	32 Å²	32	80.9 Å²	80.9	22%	0.224	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	133.7	172.1	56.6	0	0	0	0	109.8	L262 L280	L262-S278 PolarHBondContact N-O 2.92Å; L262-S278 PolarHBondContact O-N 3.33Å; S278-L280 PolarHBondContact O-N 2.91Å
279	D	64.4	Low	52.6	Low	70 Å²	70	86.7 Å²	86.7	37%	0.374	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	127.5	173.9	-72.2	-9.4	0	0	0	109.1	Q261 F281 E282	Q261-D279 VanDerWaalsContact CG-OD1 3.26Å; Q261-D279 WeakPolarHBondContact CG-OD1 3.23Å; Q261-D279 PolarHBondContact NE2-OD1 3.4Å; D279-F281 PolarHBondContact O-N 3.26Å; D279-E282 HydrophobicContact CB-CB 4.16Å; D279-E282 HydrophobicContact CB-CG 3.96Å; D279-E282 PolarHBondContact O-N 2.87Å
280	L	61.2	Low	51	Low	29 Å²	29	85.5 Å²	85.5	15%	0.152	51%	0.507	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-20	-178.8	-86.3	160.1	0	0	0	113.3	V255 M260 L262 S278 L306	V255-L280 HydrophobicContact CB-CD1 4.36Å; V255-L280 HydrophobicContact CG1-CD1 3.42Å; V255-L280 VanDerWaalsContact CG1-CD1 3.42Å; V255-L280 HydrophobicContact CG2-CD1 4Å; M260-L280 HydrophobicContact CE-CD1 3.93Å; M260-L280 WeakPolarHBondContact O-CB 3.38Å; M260-L280 WeakPolarHBondContact O-CD1 3.24Å; M260-L280 PolarHBondContact O-N 3.04Å; M260-L280 VanDerWaalsContact O-N 3.14Å; M260-L280 HydrophobicContact SD-CD1 4.45Å; L262-L280 HydrophobicContact CB-CD2 4.47Å; L262-L280 HydrophobicContact CB-CG 4.35Å; S278-L280 PolarHBondContact O-N 2.91Å; L280-L306 HydrophobicContact CD2-CD1 3.58Å
281	F	58.5	Low	49.1	Very low	52 Å²	52	92.7 Å²	92.7	23%	0.228	54%	0.542	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-0.1	-174.9	-57.1	-70	0	0	0	114.6	M260 D279 G283 I284 L315 L344	M260-F281 HydrophobicContact CB-CD2 4.37Å; M260-F281 HydrophobicContact CB-CE2 3.82Å; M260-F281 HydrophobicContact CE-CE2 3.56Å; M260-F281 HydrophobicContact CE-CZ 3.52Å; M260-F281 HydrophobicContact CG-CE2 4.09Å; D279-F281 PolarHBondContact O-N 3.26Å; F281-G283 PolarHBondContact O-N 2.8Å; F281-I284 HydrophobicContact CD1-CD1 4.11Å; F281-I284 PolarHBondContact O-N 3.37Å; F281-L315 HydrophobicContact CZ-CD2 4.01Å; F281-L344 HydrophobicContact CD1-CD2 3.91Å; F281-L344 HydrophobicContact CD2-CD2 4.21Å; F281-L344 HydrophobicContact CE1-CD2 3.28Å; F281-L344 HydrophobicContact CE2-CD2 3.59Å; F281-L344 HydrophobicContact CG-CD2 4.35Å; F281-L344 HydrophobicContact CZ-CD2 3.11Å
282	E	49.9	Very low	47.3	Very low	161 Å²	161	96.8 Å²	96.8	75%	0.752	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	74.4	172.3	-94.8	-168.5	142.4	0	0	110.6	D279	D279-E282 HydrophobicContact CB-CB 4.16Å; D279-E282 HydrophobicContact CB-CG 3.96Å; D279-E282 PolarHBondContact O-N 2.87Å
283	G	38.2	Very low	45.5	Very low	59 Å²	59	96.9 Å²	96.9	61%	0.608	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	164.8	-19.9	-179.9	0	0	0	0	0	114.4	F281	F281-G283 PolarHBondContact O-N 2.8Å
284	I	40.8	Very low	43.9	Very low	113 Å²	113	102.5 Å²	102.5	58%	0.579	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	-18	-175.6	-64.2	168.3	0	0	0	112.4	F281	F281-I284 HydrophobicContact CD1-CD1 4.11Å; F281-I284 PolarHBondContact O-N 3.37Å
285	N	29.8	Very low	42.2	Very low	140 Å²	140	102.5 Å²	102.5	75%	0.749	61%	0.606	S	S	*	*	S	Bend	trans	-101.2	19.1	-172.7	-72.7	-16.2	0	0	0	116.1
286	T	28.7	Very low	40.2	Very low	125 Å²	125	105.2 Å²	105.2	77%	0.767	63%	0.628	S	S	*	*			trans	-128	59.7	173.3	51	0	0	0	0	112.8
287	T	28	Very low	38.4	Very low	129 Å²	129	112 Å²	112	79%	0.791	65%	0.652	S	S	*	*			trans	-131.5	62.1	162.6	31	0	0	0	0	109.6
288	T	28.5	Very low	36.6	Very low	130 Å²	130	114.1 Å²	114.1	80%	0.798	67%	0.666	S	S	*	*	S	Bend	trans	-153.1	112.1	158.6	-0	0	0	0	0	108.5
289	V	27	Very low	35.1	Very low	136 Å²	136	119.8 Å²	119.8	82%	0.824	69%	0.687	S	S	*	*	S	Bend	trans	69.6	92.5	160.2	-161.6	0	0	0	0	116.7
290	S	29.2	Very low	33.5	Very low	115 Å²	115	121.1 Å²	121.1	80%	0.804	70%	0.701	S	S	*	*				155.3	136.4	117.9	57.4	0	0	0	0	112.5	C292	S290-C292 PolarHBondContact O-N 2.85Å
291	N	25.1	Very low	32	Very low	165 Å²	165	124 Å²	124	88%	0.882	72%	0.724	S	S	*	*			trans	-59.2	115.6	178.4	-65.9	-36.2	0	0	0	111.6
292	C	25.4	Very low	31.1	Very low	129 Å²	129	126.4 Å²	126.4	87%	0.872	74%	0.738	S	S	*	*			trans	-151.7	132.5	147.7	-111.7	0	0	0	0	112.2	S290	S290-C292 PolarHBondContact O-N 2.85Å
293	S	28.4	Very low	30.5	Very low	107 Å²	107	126.3 Å²	126.3	75%	0.748	74%	0.738	S	S	*	*			trans	-71.4	139.8	-175.1	44.3	0	0	0	0	113.1
294	Q	29.7	Very low	30.7	Very low	180 Å²	180	130.3 Å²	130.3	84%	0.841	75%	0.745	S	S	*	*			trans	92.5	105.2	166.6	-55	-170.3	-6.4	0	0	116.7
295	P	30.1	Very low	31.2	Very low	115 Å²	115	126.4 Å²	126.4	75%	0.747	73%	0.727	S	S	*	*			trans	-82.2	144.4	166.5	32.7	-29.9	0	0	0	111.1
296	P	27.4	Very low	32.6	Very low	95 Å²	95	121.6 Å²	121.6	62%	0.617	70%	0.701	S	S	*	*			trans	-72	134	175	29.2	-31.5	0	0	0	111	S298	P296-S298 VanDerWaalsContact C-N 3.29Å; P296-S298 PolarHBondContact O-N 2.88Å
297	K	26.7	Very low	34.3	Very low	215 Å²	215	119.2 Å²	119.2	94%	0.935	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	36.4	-169.1	-67.8	-179.2	173.5	177.8	0	116
298	S	30	Very low	36	Very low	100 Å²	100	118.3 Å²	118.3	70%	0.699	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.5	13.4	-175.3	64.2	0	0	0	0	116.7	P296	P296-S298 VanDerWaalsContact C-N 3.29Å; P296-S298 PolarHBondContact O-N 2.88Å
299	K	29.6	Very low	38.2	Very low	151 Å²	151	115.2 Å²	115.2	66%	0.657	66%	0.663	S	S	*	*			trans	-94.1	6.4	-174.1	-73.2	-170.3	171.2	-167.3	0	116.7	S301	K299-S301 PolarHBondContact O-N 2.79Å
300	S	31.2	Very low	40.5	Very low	97 Å²	97	109.6 Å²	109.6	68%	0.678	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	11.7	-161.1	63.5	0	0	0	0	118.1
301	S	31.1	Very low	42.7	Very low	90 Å²	90	106.8 Å²	106.8	63%	0.629	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.7	-27.4	-175.1	-25.7	0	0	0	0	114.7	K299	K299-S301 PolarHBondContact O-N 2.79Å
302	I	38.8	Very low	45.4	Very low	103 Å²	103	105 Å²	105	53%	0.528	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.2	-37	-169.7	-62.3	168.5	0	0	0	111	N304 T305	I302-N304 PolarHBondContact O-N 2.91Å; I302-N304 VanDerWaalsContact O-N 3.08Å; I302-T305 PolarHBondContact O-N 3.2Å; I302-T305 PolarHBondContact O-OG1 2.98Å
303	E	36.8	Very low	48.2	Very low	158 Å²	158	103.2 Å²	103.2	74%	0.738	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	-16	-178.7	-69.7	178.3	174.7	0	0	114.1
304	N	43.1	Very low	50.8	Low	143 Å²	143	98.1 Å²	98.1	77%	0.765	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-1.3	-179.7	-71.7	-20	0	0	0	114.6	I302	I302-N304 PolarHBondContact O-N 2.91Å; I302-N304 VanDerWaalsContact O-N 3.08Å
305	T	51.6	Low	53.4	Low	31 Å²	31	90.9 Å²	90.9	19%	0.19	51%	0.505	C	S	.	.	S	Bend	trans	-94.9	-17.8	-171.1	45.6	0	0	0	0	115.6	I302	I302-T305 PolarHBondContact O-N 3.2Å; I302-T305 PolarHBondContact O-OG1 2.98Å
306	L	58.1	Low	56.1	Low	39 Å²	39	88.3 Å²	88.3	20%	0.204	49%	0.49	C	S	.	.			trans	-109.1	116.3	-179.6	-82	155.8	0	0	0	111	V214 L262 L280 I311	V214-L306 HydrophobicContact CG1-CD2 3.83Å; V214-L306 HydrophobicContact CG1-CG 4.43Å; V214-L306 HydrophobicContact CG2-CD2 4.07Å; L262-L306 HydrophobicContact CD1-CD1 4.08Å; L262-L306 HydrophobicContact CD1-CD2 4.28Å; L262-L306 HydrophobicContact CD1-CG 4.42Å; L262-L306 HydrophobicContact CD2-CD1 3.55Å; L262-L306 HydrophobicContact CD2-CG 4.29Å; L262-L306 HydrophobicContact CG-CD1 4.27Å; L280-L306 HydrophobicContact CD2-CD1 3.58Å; L306-I311 HydrophobicContact CB-CD1 4.14Å; L306-I311 HydrophobicContact CB-CG1 4.21Å; L306-I311 HydrophobicContact CD2-CG1 4.31Å
307	N	63.8	Low	58.9	Low	75 Å²	75	83.9 Å²	83.9	40%	0.401	46%	0.461	S	S	.	.			trans	-64.8	141.2	167.1	-81.9	-9.1	0	0	0	109.9	H217 S309 G310 I311	H217-N307 PolarHBondContact CD2-ND2 3.45Å; N307-S309 PolarHBondContact O-N 3.22Å; N307-S309 VanDerWaalsContact O-N 3.11Å; N307-G310 PolarHBondContact O-N 2.97Å; N307-I311 PolarHBondContact O-N 2.87Å
308	P	65.7	Low	61.9	Low	110 Å²	110	74 Å²	74	71%	0.714	42%	0.418	S	S	*	.	H	α-helix	trans	-59.2	-26.4	177.4	22.4	-32.6	0	0	0	112.9	Q312	P308-Q312 PolarHBondContact O-N 2.94Å
309	S	72.9	Confident	64.6	Low	65 Å²	65	72.5 Å²	72.5	46%	0.455	40%	0.401	S	S	.	.	H	α-helix	trans	-64.5	-41.8	173	59.6	0	0	0	0	112.7	N307 I311 Q312 E313	N307-S309 PolarHBondContact O-N 3.22Å; N307-S309 VanDerWaalsContact O-N 3.11Å; S309-I311 VanDerWaalsContact C-N 3.34Å; S309-I311 PolarHBondContact O-N 3.34Å; S309-Q312 PolarHBondContact O-N 2.81Å; S309-E313 WeakPolarHBondContact O-CG 3.43Å; S309-E313 PolarHBondContact O-N 2.82Å
310	G	75.8	Confident	67.4	Low	19 Å²	19	71.3 Å²	71.3	20%	0.196	40%	0.398	C	S	.	.	H	α-helix	trans	-68.8	-31.6	-178.6	0	0	0	0	0	113.1	N307 A314	N307-G310 PolarHBondContact O-N 2.97Å; G310-A314 WeakPolarHBondContact O-CB 3.48Å; G310-A314 PolarHBondContact O-N 3.11Å
311	I	76.4	Confident	70.1	Confident	55 Å²	55	66.7 Å²	66.7	28%	0.282	37%	0.365	S	S	.	.	H	α-helix	trans	-68.4	-43	173.8	-60.2	174.8	0	0	0	110.4	L306 N307 S309 E313 A314 L315	L306-I311 HydrophobicContact CB-CD1 4.14Å; L306-I311 HydrophobicContact CB-CG1 4.21Å; L306-I311 HydrophobicContact CD2-CG1 4.31Å; N307-I311 PolarHBondContact O-N 2.87Å; S309-I311 VanDerWaalsContact C-N 3.34Å; S309-I311 PolarHBondContact O-N 3.34Å; I311-E313 VanDerWaalsContact C-N 3.33Å; I311-E313 PolarHBondContact O-N 3.06Å; I311-A314 PolarHBondContact O-N 2.96Å; I311-L315 HydrophobicContact CG2-CD1 4.18Å; I311-L315 WeakPolarHBondContact O-CB 3.29Å; I311-L315 WeakPolarHBondContact O-CG 3.48Å; I311-L315 PolarHBondContact O-N 2.9Å
312	Q	81	Confident	72.9	Confident	127 Å²	127	62.4 Å²	62.4	59%	0.593	34%	0.335	S	S	*	.	H	α-helix	trans	-63.8	-39.5	177.7	-172.4	63.6	30.7	0	0	111.9	P308 S309 L315 S316	P308-Q312 PolarHBondContact O-N 2.94Å; S309-Q312 PolarHBondContact O-N 2.81Å; Q312-L315 PolarHBondContact O-N 2.97Å; Q312-S316 WeakPolarHBondContact O-CB 3.42Å; Q312-S316 PolarHBondContact O-N 3.02Å
313	E	83.4	Confident	75.3	Confident	92 Å²	92	59.5 Å²	59.5	43%	0.43	32%	0.324	S	S	.	.	H	α-helix	trans	-61.9	-48.6	173.4	-72.6	167.3	-164.4	0	0	111.1	W212 S309 I311 L315 S316 A317	W212-E313 HydrophobicContact CZ2-CB 4.13Å; S309-E313 WeakPolarHBondContact O-CG 3.43Å; S309-E313 PolarHBondContact O-N 2.82Å; I311-E313 VanDerWaalsContact C-N 3.33Å; I311-E313 PolarHBondContact O-N 3.06Å; E313-L315 VanDerWaalsContact C-N 3.35Å; E313-L315 PolarHBondContact O-N 2.91Å; E313-S316 PolarHBondContact O-N 2.9Å; E313-S316 VanDerWaalsContact O-N 3.14Å; E313-S316 PolarHBondContact O-OG 3.01Å; E313-A317 PolarHBondContact O-N 2.73Å
314	A	83.7	Confident	77.8	Confident	1 Å²	1	53 Å²	53	1%	0.008	30%	0.296	C	S	.	.	H	α-helix	trans	-60.3	-41.4	177.2	0	0	0	0	0	112.7	W212 V255 L257 G310 I311 A317 R318	W212-A314 HydrophobicContact CB-CB 4.41Å; W212-A314 HydrophobicContact CG-CB 4.36Å; V255-A314 HydrophobicContact CG1-CB 4.29Å; L257-A314 HydrophobicContact CD2-CB 4.18Å; L257-A314 VanDerWaalsContact CD2-O 3.3Å; L257-A314 WeakPolarHBondContact CD2-O 3.37Å; G310-A314 WeakPolarHBondContact O-CB 3.48Å; G310-A314 PolarHBondContact O-N 3.11Å; I311-A314 PolarHBondContact O-N 2.96Å; A314-A317 PolarHBondContact O-N 3.42Å; A314-R318 PolarHBondContact O-N 3.23Å
315	L	84.9	Confident	79.9	Confident	27 Å²	27	46.2 Å²	46.2	14%	0.141	26%	0.259	C	S	.	.	H	α-helix	trans	-62.3	-41.6	174.2	-78.4	171.6	0	0	0	112.1	M260 F281 I311 Q312 E313 R318 M319 D343 L344	M260-L315 HydrophobicContact CE-CD2 3.74Å; M260-L315 HydrophobicContact CE-CG 4.36Å; F281-L315 HydrophobicContact CZ-CD2 4.01Å; I311-L315 HydrophobicContact CG2-CD1 4.18Å; I311-L315 WeakPolarHBondContact O-CB 3.29Å; I311-L315 WeakPolarHBondContact O-CG 3.48Å; I311-L315 PolarHBondContact O-N 2.9Å; Q312-L315 PolarHBondContact O-N 2.97Å; E313-L315 VanDerWaalsContact C-N 3.35Å; E313-L315 PolarHBondContact O-N 2.91Å; L315-R318 PolarHBondContact O-N 3.22Å; L315-M319 PolarHBondContact O-N 3.42Å; L315-D343 HydrophobicContact CD2-CB 4.32Å; L315-L344 HydrophobicContact CD2-CD2 4.39Å
316	S	86.8	Confident	81.7	Confident	62 Å²	62	45.6 Å²	45.6	43%	0.434	26%	0.257	S	S	.	.	H	α-helix	trans	-64.5	-40.2	176.7	75.1	0	0	0	0	112.2	Q312 E313 M319 Q320	Q312-S316 WeakPolarHBondContact O-CB 3.42Å; Q312-S316 PolarHBondContact O-N 3.02Å; E313-S316 PolarHBondContact O-N 2.9Å; E313-S316 VanDerWaalsContact O-N 3.14Å; E313-S316 PolarHBondContact O-OG 3.01Å; S316-M319 PolarHBondContact O-N 3.06Å; S316-Q320 PolarHBondContact O-N 2.87Å; S316-Q320 VanDerWaalsContact O-N 3.11Å
317	A	86.2	Confident	83.2	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.008	28%	0.277	C	S	.	.	H	α-helix	trans	-67.2	-39.9	175.8	0	0	0	0	0	111.8	P209 W212 L257 E313 A314 Q320 L321	P209-A317 HydrophobicContact CG-CB 4.45Å; W212-A317 HydrophobicContact CD2-CB 4.31Å; W212-A317 HydrophobicContact CE3-CB 3.73Å; W212-A317 HydrophobicContact CZ3-CB 3.9Å; L257-A317 HydrophobicContact CD1-CB 3.79Å; L257-A317 HydrophobicContact CD2-CB 4.35Å; E313-A317 PolarHBondContact O-N 2.73Å; A314-A317 PolarHBondContact O-N 3.42Å; A317-Q320 PolarHBondContact O-N 3.26Å; A317-L321 PolarHBondContact O-N 2.78Å
318	R	88.3	Confident	84.2	Confident	9 Å²	9	48.5 Å²	48.5	3%	0.034	27%	0.268	C	S	.	.	H	α-helix	trans	-62.1	-43.5	173.1	177.8	165.5	171.1	103.7	-6.2	111.7	L257 T258 M260 A314 L315 Q320 L321 L322 D343 V346	L257-R318 HydrophobicContact CD2-CB 4.25Å; L257-R318 PolarHBondContact O-NH1 3.33Å; T258-R318 VanDerWaalsContact C-NH1 3.34Å; T258-R318 PolarHBondContact O-NH1 2.74Å; M260-R318 HydrophobicContact SD-CB 4.31Å; M260-R318 WeakPolarHBondContact SD-CD 3.47Å; M260-R318 HydrophobicContact SD-CG 4.4Å; A314-R318 PolarHBondContact O-N 3.23Å; L315-R318 PolarHBondContact O-N 3.22Å; R318-Q320 VanDerWaalsContact C-N 3.3Å; R318-Q320 PolarHBondContact O-N 3.07Å; R318-L321 WeakPolarHBondContact O-CB 3.32Å; R318-L321 PolarHBondContact O-N 3.29Å; R318-L321 VanDerWaalsContact O-N 3.15Å; R318-L322 HydrophobicContact CG-CD1 3.96Å; R318-L322 HydrophobicContact CG-CG 4.25Å; R318-L322 WeakPolarHBondContact O-CG 3.26Å; R318-L322 PolarHBondContact O-N 3.01Å; R318-D343 PolarHBondContact NE-O 2.95Å; R318-D343 PolarHBondContact NH2-O 3Å; R318-V346 PolarHBondContact NH2-O 3.08Å
319	M	87.6	Confident	85.3	Confident	68 Å²	68	43.8 Å²	43.8	34%	0.335	24%	0.237	S	C	.	.	H	α-helix	trans	-60.5	-39.5	176	-79.4	-60.6	-63.9	0	0	112.4	L315 S316 L322 S323 F336 P342 D343	L315-M319 PolarHBondContact O-N 3.42Å; S316-M319 PolarHBondContact O-N 3.06Å; M319-L322 PolarHBondContact O-N 2.83Å; M319-S323 WeakPolarHBondContact O-CB 3.5Å; M319-S323 PolarHBondContact O-N 3.03Å; M319-S323 PolarHBondContact O-OG 2.79Å; M319-F336 HydrophobicContact CE-CZ 4.28Å; M319-P342 HydrophobicContact CE-CG 3.96Å; M319-P342 HydrophobicContact SD-CG 3.98Å; M319-D343 HydrophobicContact CG-CB 4.01Å; M319-D343 HydrophobicContact SD-CB 3.63Å
320	Q	88	Confident	86	Confident	125 Å²	125	46.9 Å²	46.9	58%	0.584	25%	0.248	S	C	*	.	H	α-helix	trans	-64.6	-39.7	173.4	-75.6	-178.9	-24.5	0	0	112.8	S316 A317 R318 S323 T324	S316-Q320 PolarHBondContact O-N 2.87Å; S316-Q320 VanDerWaalsContact O-N 3.11Å; A317-Q320 PolarHBondContact O-N 3.26Å; R318-Q320 VanDerWaalsContact C-N 3.3Å; R318-Q320 PolarHBondContact O-N 3.07Å; Q320-S323 PolarHBondContact O-OG 3.01Å; Q320-T324 WeakPolarHBondContact O-CB 3.39Å; Q320-T324 WeakPolarHBondContact O-CG2 3.43Å; Q320-T324 PolarHBondContact O-N 3.27Å; Q320-T324 VanDerWaalsContact O-N 3.1Å; Q320-T324 PolarHBondContact O-OG1 3.43Å
321	L	89	Confident	86.4	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61.5	-46.9	174.3	175.3	151.8	0	0	0	111.1	I208 L257 A317 R318 T324 L325 V351	I208-L321 HydrophobicContact CG2-CB 3.79Å; I208-L321 HydrophobicContact CG2-CD1 3.78Å; I208-L321 HydrophobicContact CG2-CG 3.73Å; L257-L321 HydrophobicContact CB-CD1 4.43Å; A317-L321 PolarHBondContact O-N 2.78Å; R318-L321 WeakPolarHBondContact O-CB 3.32Å; R318-L321 PolarHBondContact O-N 3.29Å; R318-L321 VanDerWaalsContact O-N 3.15Å; L321-T324 PolarHBondContact O-OG1 2.93Å; L321-L325 HydrophobicContact CD2-CD1 3.72Å; L321-L325 HydrophobicContact CG-CD1 4.38Å; L321-L325 WeakPolarHBondContact O-CG 3.36Å; L321-L325 PolarHBondContact O-N 3.45Å; L321-L325 VanDerWaalsContact O-N 3.08Å; L321-V351 HydrophobicContact CD2-CG1 3.97Å
322	L	90	Very high	86.9	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-68.9	-40.2	-178.5	-60.7	171.5	0	0	0	111.5	R318 M319 T324 L325 A326 F332 F336 P342 V351	R318-L322 HydrophobicContact CG-CD1 3.96Å; R318-L322 HydrophobicContact CG-CG 4.25Å; R318-L322 WeakPolarHBondContact O-CG 3.26Å; R318-L322 PolarHBondContact O-N 3.01Å; M319-L322 PolarHBondContact O-N 2.83Å; L322-T324 VanDerWaalsContact C-N 3.35Å; L322-T324 PolarHBondContact O-N 3.43Å; L322-L325 PolarHBondContact O-N 3.34Å; L322-A326 WeakPolarHBondContact O-CB 3.13Å; L322-A326 PolarHBondContact O-N 2.79Å; L322-F332 HydrophobicContact CD2-CE1 4.43Å; L322-F332 HydrophobicContact CD2-CZ 3.75Å; L322-F336 HydrophobicContact CB-CD2 3.96Å; L322-F336 HydrophobicContact CB-CE2 3.61Å; L322-P342 HydrophobicContact CD1-CB 4.45Å; L322-P342 WeakPolarHBondContact CD1-O 3.27Å; L322-V351 HydrophobicContact CD2-CG1 4.43Å; L322-V351 HydrophobicContact CD2-CG2 3.84Å
323	S	88.7	Confident	87.2	Confident	43 Å²	43	43.8 Å²	43.8	30%	0.301	23%	0.23	S	C	.	.	H	α-helix	trans	-63.8	-40.6	178.3	68.2	0	0	0	0	112.2	M319 Q320 A326 E327	M319-S323 WeakPolarHBondContact O-CB 3.5Å; M319-S323 PolarHBondContact O-N 3.03Å; M319-S323 PolarHBondContact O-OG 2.79Å; Q320-S323 PolarHBondContact O-OG 3.01Å; S323-A326 PolarHBondContact O-N 2.67Å; S323-E327 WeakPolarHBondContact O-CG 3Å; S323-E327 PolarHBondContact O-N 3.14Å; S323-E327 VanDerWaalsContact O-N 3.13Å
324	T	88.2	Confident	87.3	Confident	22 Å²	22	44.4 Å²	44.4	14%	0.135	24%	0.237	C	C	.	.	H	α-helix	trans	-71.3	-33.3	178.5	46.7	0	0	0	0	112.7	I208 Q320 L321 L322 E327 I328	I208-T324 HydrophobicContact CD1-CG2 4.49Å; I208-T324 WeakPolarHBondContact CD1-OG1 3.47Å; Q320-T324 WeakPolarHBondContact O-CB 3.39Å; Q320-T324 WeakPolarHBondContact O-CG2 3.43Å; Q320-T324 PolarHBondContact O-N 3.27Å; Q320-T324 VanDerWaalsContact O-N 3.1Å; Q320-T324 PolarHBondContact O-OG1 3.43Å; L321-T324 PolarHBondContact O-OG1 2.93Å; L322-T324 VanDerWaalsContact C-N 3.35Å; L322-T324 PolarHBondContact O-N 3.43Å; T324-E327 PolarHBondContact O-N 2.98Å; T324-I328 WeakPolarHBondContact O-CG1 3.45Å
325	L	88.8	Confident	87.2	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-67.3	-39.3	170.9	-70.4	177.1	0	0	0	111.9	L321 L322 E327 I328 D329 F332 V351 L355 A358	L321-L325 HydrophobicContact CD2-CD1 3.72Å; L321-L325 HydrophobicContact CG-CD1 4.38Å; L321-L325 WeakPolarHBondContact O-CG 3.36Å; L321-L325 PolarHBondContact O-N 3.45Å; L321-L325 VanDerWaalsContact O-N 3.08Å; L322-L325 PolarHBondContact O-N 3.34Å; L325-E327 VanDerWaalsContact C-N 3.26Å; L325-E327 PolarHBondContact O-N 3.46Å; L325-I328 PolarHBondContact O-N 2.83Å; L325-I328 VanDerWaalsContact O-N 3.08Å; L325-D329 PolarHBondContact O-N 3.26Å; L325-F332 HydrophobicContact CB-CD1 3.89Å; L325-F332 HydrophobicContact CB-CE1 3.85Å; L325-V351 HydrophobicContact CD1-CG1 4.06Å; L325-L355 HydrophobicContact CD1-CB 4.33Å; L325-L355 HydrophobicContact CD2-CB 4.41Å; L325-L355 HydrophobicContact CD2-CD1 4.24Å; L325-A358 HydrophobicContact CD2-CB 3.99Å
326	A	89.1	Confident	87	Confident	17 Å²	17	48.5 Å²	48.5	14%	0.14	25%	0.254	C	S	.	.	H	α-helix	trans	-65.1	-26.9	176	0	0	0	0	0	113.2	L322 S323 I328 F332 A333 F336	L322-A326 WeakPolarHBondContact O-CB 3.13Å; L322-A326 PolarHBondContact O-N 2.79Å; S323-A326 PolarHBondContact O-N 2.67Å; A326-I328 VanDerWaalsContact C-N 3.29Å; A326-F332 HydrophobicContact CB-CD1 4.11Å; A326-F332 HydrophobicContact CB-CE1 4.41Å; A326-A333 HydrophobicContact CB-CB 4.21Å; A326-A333 VanDerWaalsContact O-CB 3.31Å; A326-A333 WeakPolarHBondContact O-CB 3.46Å; A326-F336 HydrophobicContact CB-CB 4.27Å; A326-F336 HydrophobicContact CB-CD1 3.93Å; A326-F336 HydrophobicContact CB-CG 4.11Å
327	E	88.6	Confident	86.8	Confident	136 Å²	136	52 Å²	52	64%	0.636	27%	0.268	S	S	*	.	H	α-helix	trans	-72.4	-21.7	172.9	-74	174.8	-172.9	0	0	113.3	S323 T324 L325	S323-E327 WeakPolarHBondContact O-CG 3Å; S323-E327 PolarHBondContact O-N 3.14Å; S323-E327 VanDerWaalsContact O-N 3.13Å; T324-E327 PolarHBondContact O-N 2.98Å; L325-E327 VanDerWaalsContact C-N 3.26Å; L325-E327 PolarHBondContact O-N 3.46Å
328	I	85.9	Confident	86.7	Confident	39 Å²	39	59.3 Å²	59.3	20%	0.2	30%	0.302	C	S	.	.	H	α-helix	trans	-103.6	-38.3	-172.2	-65.4	170.2	0	0	0	112.2	T324 L325 A326 A358 Q363 V364	T324-I328 WeakPolarHBondContact O-CG1 3.45Å; L325-I328 PolarHBondContact O-N 2.83Å; L325-I328 VanDerWaalsContact O-N 3.08Å; A326-I328 VanDerWaalsContact C-N 3.29Å; I328-A358 HydrophobicContact CG2-CB 4.27Å; I328-Q363 HydrophobicContact CD1-CB 4.07Å; I328-Q363 HydrophobicContact CG2-CB 4.45Å; I328-V364 HydrophobicContact CD1-CG2 3.46Å; I328-V364 VanDerWaalsContact CD1-CG2 3.46Å
329	D	87.6	Confident	86.2	Confident	11 Å²	11	61.7 Å²	61.7	6%	0.059	32%	0.315	C	S	.	.			trans	-115.8	99.6	-173.3	-169.4	14.2	0	0	0	110.9	L325 E331 F332 A333 S354 K357	L325-D329 PolarHBondContact O-N 3.26Å; D329-E331 PolarHBondContact O-N 3.01Å; D329-F332 HydrophobicContact CB-CB 3.93Å; D329-F332 WeakPolarHBondContact O-CA 3.25Å; D329-F332 WeakPolarHBondContact O-CB 3.21Å; D329-F332 PolarHBondContact O-N 3.45Å; D329-A333 PolarHBondContact O-N 3.24Å; D329-S354 VanDerWaalsContact CB-OG 3.29Å; D329-S354 WeakPolarHBondContact CB-OG 3.41Å; D329-S354 WeakPolarHBondContact OD2-CB 3.44Å; D329-S354 PolarHBondContact OD2-OG 2.92Å; D329-K357 IonicContact OD1-NZ 2.71Å; D329-K357 PolarHBondContact OD1-NZ 2.91Å
330	D	87.4	Confident	85.3	Confident	130 Å²	130	66.3 Å²	66.3	70%	0.695	34%	0.341	S	S	*	.	H	α-helix	trans	-54	-37.7	-178.2	-60.8	-33.7	0	0	0	112.5	F332 A333 D334	D330-F332 VanDerWaalsContact C-N 3.3Å; D330-F332 PolarHBondContact O-N 2.97Å; D330-A333 WeakPolarHBondContact O-CB 3.44Å; D330-A333 PolarHBondContact O-N 3.43Å; D330-D334 PolarHBondContact O-N 2.99Å
331	E	85.9	Confident	84.3	Confident	117 Å²	117	67.8 Å²	67.8	55%	0.547	34%	0.341	S	S	.	.	H	α-helix	trans	-61.8	-39.8	176.5	-70.4	-179.8	-166.4	0	0	111.7	D329 K353	D329-E331 PolarHBondContact O-N 3.01Å; E331-K353 IonicContact OE2-NZ 3.35Å; E331-K353 PolarHBondContact OE2-NZ 2.83Å
332	F	86.7	Confident	83.3	Confident	2 Å²	2	68.4 Å²	68.4	1%	0.009	35%	0.345	C	S	.	.	H	α-helix	trans	-75.3	-34	178.6	-176.8	-97.9	0	0	0	111.6	L322 L325 A326 D329 D330 D334 E335 F336 V346 I350 V351	L322-F332 HydrophobicContact CD2-CE1 4.43Å; L322-F332 HydrophobicContact CD2-CZ 3.75Å; L325-F332 HydrophobicContact CB-CD1 3.89Å; L325-F332 HydrophobicContact CB-CE1 3.85Å; A326-F332 HydrophobicContact CB-CD1 4.11Å; A326-F332 HydrophobicContact CB-CE1 4.41Å; D329-F332 HydrophobicContact CB-CB 3.93Å; D329-F332 WeakPolarHBondContact O-CA 3.25Å; D329-F332 WeakPolarHBondContact O-CB 3.21Å; D329-F332 PolarHBondContact O-N 3.45Å; D330-F332 VanDerWaalsContact C-N 3.3Å; D330-F332 PolarHBondContact O-N 2.97Å; F332-D334 VanDerWaalsContact C-N 3.33Å; F332-D334 PolarHBondContact O-N 3.24Å; F332-E335 PolarHBondContact O-N 3.48Å; F332-F336 HydrophobicContact CD1-CB 4.45Å; F332-F336 HydrophobicContact CE1-CB 4.23Å; F332-F336 HydrophobicContact CE1-CD2 4.43Å; F332-F336 VanDerWaalsContact O-CB 3.29Å; F332-F336 WeakPolarHBondContact O-CB 3.29Å; F332-F336 PolarHBondContact O-N 3.22Å; F332-V346 HydrophobicContact CE2-CG1 3.83Å; F332-V346 HydrophobicContact CZ-CG1 4.1Å; F332-I350 HydrophobicContact CD2-CG2 3.76Å; F332-I350 HydrophobicContact CE2-CG2 4.08Å; F332-V351 HydrophobicContact CE2-CG2 4.25Å; F332-V351 HydrophobicContact CZ-CG2 4.44Å
333	A	85.7	Confident	82	Confident	17 Å²	17	69.8 Å²	69.8	14%	0.14	35%	0.352	C	S	.	.	H	α-helix	trans	-59.3	-43.7	177.4	0	0	0	0	0	111.9	A326 D329 D330 E335 F336 L337	A326-A333 HydrophobicContact CB-CB 4.21Å; A326-A333 VanDerWaalsContact O-CB 3.31Å; A326-A333 WeakPolarHBondContact O-CB 3.46Å; D329-A333 PolarHBondContact O-N 3.24Å; D330-A333 WeakPolarHBondContact O-CB 3.44Å; D330-A333 PolarHBondContact O-N 3.43Å; A333-E335 VanDerWaalsContact C-N 3.33Å; A333-E335 PolarHBondContact O-N 3.14Å; A333-F336 PolarHBondContact O-N 3.2Å; A333-L337 WeakPolarHBondContact O-CB 3.39Å; A333-L337 VanDerWaalsContact O-CG 3.24Å; A333-L337 WeakPolarHBondContact O-CG 3.29Å; A333-L337 PolarHBondContact O-N 3.18Å
334	D	85.5	Confident	80.9	Confident	105 Å²	105	71 Å²	71	56%	0.561	36%	0.355	S	S	*	.	H	α-helix	trans	-61.5	-40.2	178.6	-77.1	-21.2	0	0	0	112.3	D330 F332 Q338	D330-D334 PolarHBondContact O-N 2.99Å; F332-D334 VanDerWaalsContact C-N 3.33Å; F332-D334 PolarHBondContact O-N 3.24Å; D334-Q338 VanDerWaalsContact O-CG 3.25Å; D334-Q338 WeakPolarHBondContact O-CG 3.43Å; D334-Q338 PolarHBondContact O-NE2 3.18Å; D334-Q338 VanDerWaalsContact O-NE2 3.11Å
335	E	81.3	Confident	79.8	Confident	82 Å²	82	74.6 Å²	74.6	38%	0.383	37%	0.373	S	S	.	.	H	α-helix	trans	-73.1	-40	176.3	-67.6	-174	175.3	0	0	112.1	F332 A333 L337 Q338 I350	F332-E335 PolarHBondContact O-N 3.48Å; A333-E335 VanDerWaalsContact C-N 3.33Å; A333-E335 PolarHBondContact O-N 3.14Å; E335-L337 VanDerWaalsContact C-N 3.35Å; E335-L337 PolarHBondContact O-N 2.88Å; E335-Q338 PolarHBondContact O-N 3.41Å; E335-I350 WeakPolarHBondContact OE2-CD1 3.26Å; E335-I350 WeakPolarHBondContact OE2-CG2 3.41Å
336	F	82.3	Confident	78.9	Confident	32 Å²	32	75 Å²	75	14%	0.14	38%	0.375	C	S	.	.	H	α-helix	trans	-61.5	-41.2	177.5	175.8	-97.8	0	0	0	112.1	M319 L322 A326 F332 A333 Q338 P342	M319-F336 HydrophobicContact CE-CZ 4.28Å; L322-F336 HydrophobicContact CB-CD2 3.96Å; L322-F336 HydrophobicContact CB-CE2 3.61Å; A326-F336 HydrophobicContact CB-CB 4.27Å; A326-F336 HydrophobicContact CB-CD1 3.93Å; A326-F336 HydrophobicContact CB-CG 4.11Å; F332-F336 HydrophobicContact CD1-CB 4.45Å; F332-F336 HydrophobicContact CE1-CB 4.23Å; F332-F336 HydrophobicContact CE1-CD2 4.43Å; F332-F336 VanDerWaalsContact O-CB 3.29Å; F332-F336 WeakPolarHBondContact O-CB 3.29Å; F332-F336 PolarHBondContact O-N 3.22Å; A333-F336 PolarHBondContact O-N 3.2Å; F336-Q338 VanDerWaalsContact C-N 3.32Å; F336-Q338 PolarHBondContact O-N 3.48Å; F336-P342 HydrophobicContact CD2-CB 3.45Å; F336-P342 VanDerWaalsContact CD2-CB 3.45Å; F336-P342 HydrophobicContact CD2-CG 3.94Å; F336-P342 HydrophobicContact CE2-CB 3.4Å; F336-P342 VanDerWaalsContact CE2-CB 3.4Å; F336-P342 HydrophobicContact CE2-CG 3.4Å; F336-P342 VanDerWaalsContact CE2-CG 3.4Å; F336-P342 HydrophobicContact CG-CB 4.4Å; F336-P342 HydrophobicContact CZ-CB 4.32Å; F336-P342 HydrophobicContact CZ-CG 3.88Å
337	L	83	Confident	78.3	Confident	137 Å²	137	77.4 Å²	77.4	72%	0.717	39%	0.39	S	S	*	.	H	α-helix	trans	-72.6	-20.8	-179.6	-70.9	171.7	0	0	0	113.8	A333 E335	A333-L337 WeakPolarHBondContact O-CB 3.39Å; A333-L337 VanDerWaalsContact O-CG 3.24Å; A333-L337 WeakPolarHBondContact O-CG 3.29Å; A333-L337 PolarHBondContact O-N 3.18Å; E335-L337 VanDerWaalsContact C-N 3.35Å; E335-L337 PolarHBondContact O-N 2.88Å
338	Q	82.1	Confident	77.9	Confident	154 Å²	154	72.9 Å²	72.9	72%	0.72	37%	0.373	S	S	*	.	H	α-helix	trans	-80.2	-17.3	179.1	-75	171.3	39.2	0	0	113.5	D334 E335 F336	D334-Q338 VanDerWaalsContact O-CG 3.25Å; D334-Q338 WeakPolarHBondContact O-CG 3.43Å; D334-Q338 PolarHBondContact O-NE2 3.18Å; D334-Q338 VanDerWaalsContact O-NE2 3.11Å; E335-Q338 PolarHBondContact O-N 3.41Å; F336-Q338 VanDerWaalsContact C-N 3.32Å; F336-Q338 PolarHBondContact O-N 3.48Å
339	L	78.1	Confident	77.7	Confident	58 Å²	58	76.9 Å²	76.9	30%	0.304	40%	0.395	S	S	.	.			trans	-97.9	128.5	-173.4	-64.8	171.1	0	0	0	111.4	R341 P342 L345 V346	L339-R341 VanDerWaalsContact C-N 3.26Å; L339-R341 PolarHBondContact O-N 3.02Å; L339-P342 HydrophobicContact CB-CB 4.4Å; L339-L345 HydrophobicContact CD1-CB 4.1Å; L339-L345 HydrophobicContact CD2-CB 3.97Å; L339-L345 HydrophobicContact CD2-CD1 4.31Å; L339-L345 HydrophobicContact CG-CB 4.43Å; L339-V346 HydrophobicContact CD1-CB 4.4Å; L339-V346 HydrophobicContact CD1-CG2 3.52Å
340	D	68.5	Low	77.6	Confident	165 Å²	165	78.7 Å²	78.7	88%	0.882	40%	0.404	S	S	*	.	S	Bend	trans	-66.5	-28.4	176.6	-71.6	-30.7	0	0	0	113
341	R	68.9	Low	77.5	Confident	156 Å²	156	72.5 Å²	72.5	59%	0.589	37%	0.371	S	S	*	.			trans	-135.2	77	178.6	-74.1	-159.6	-175.9	179.1	2.1	110.9	L339 D343 L344 L345	L339-R341 VanDerWaalsContact C-N 3.26Å; L339-R341 PolarHBondContact O-N 3.02Å; R341-D343 WeakPolarHBondContact CA-OD1 3.4Å; R341-D343 WeakPolarHBondContact CB-OD1 3.33Å; R341-D343 PolarHBondContact O-N 2.86Å; R341-L344 PolarHBondContact O-N 3.32Å; R341-L344 VanDerWaalsContact O-N 3.15Å; R341-L345 HydrophobicContact CB-CD1 4.08Å; R341-L345 HydrophobicContact CB-CG 4.4Å; R341-L345 VanDerWaalsContact O-CB 3.28Å; R341-L345 WeakPolarHBondContact O-CB 3.5Å; R341-L345 WeakPolarHBondContact O-CG 3.42Å; R341-L345 PolarHBondContact O-N 3.5Å
342	P	66.6	Low	77.7	Confident	13 Å²	13	69.6 Å²	69.6	8%	0.084	36%	0.357	C	S	.	.	H	α-helix	trans	-66.5	-25.9	-175.9	26.4	-33	0	0	0	112.5	M319 L322 F336 L339 L344 V346	M319-P342 HydrophobicContact CE-CG 3.96Å; M319-P342 HydrophobicContact SD-CG 3.98Å; L322-P342 HydrophobicContact CD1-CB 4.45Å; L322-P342 WeakPolarHBondContact CD1-O 3.27Å; F336-P342 HydrophobicContact CD2-CB 3.45Å; F336-P342 VanDerWaalsContact CD2-CB 3.45Å; F336-P342 HydrophobicContact CD2-CG 3.94Å; F336-P342 HydrophobicContact CE2-CB 3.4Å; F336-P342 VanDerWaalsContact CE2-CB 3.4Å; F336-P342 HydrophobicContact CE2-CG 3.4Å; F336-P342 VanDerWaalsContact CE2-CG 3.4Å; F336-P342 HydrophobicContact CG-CB 4.4Å; F336-P342 HydrophobicContact CZ-CB 4.32Å; F336-P342 HydrophobicContact CZ-CG 3.88Å; L339-P342 HydrophobicContact CB-CB 4.4Å; P342-L344 PolarHBondContact O-N 3.38Å; P342-V346 HydrophobicContact CB-CG2 3.92Å; P342-V346 WeakPolarHBondContact O-CG2 3.17Å; P342-V346 PolarHBondContact O-N 3.44Å
343	D	64	Low	77.7	Confident	29 Å²	29	76.1 Å²	76.1	16%	0.155	39%	0.386	C	S	.	.	H	α-helix	trans	-54.5	-37.8	171.4	53.8	-29.7	0	0	0	113	L315 R318 M319 R341	L315-D343 HydrophobicContact CD2-CB 4.32Å; R318-D343 PolarHBondContact NE-O 2.95Å; R318-D343 PolarHBondContact NH2-O 3Å; M319-D343 HydrophobicContact CG-CB 4.01Å; M319-D343 HydrophobicContact SD-CB 3.63Å; R341-D343 WeakPolarHBondContact CA-OD1 3.4Å; R341-D343 WeakPolarHBondContact CB-OD1 3.33Å; R341-D343 PolarHBondContact O-N 2.86Å
344	L	65.6	Low	77.9	Confident	68 Å²	68	75.3 Å²	75.3	36%	0.356	38%	0.379	S	S	.	.	H	α-helix	trans	-104.2	-28.8	-175.5	-60.2	176.8	0	0	0	113.5	F281 L315 R341 P342	F281-L344 HydrophobicContact CD1-CD2 3.91Å; F281-L344 HydrophobicContact CD2-CD2 4.21Å; F281-L344 HydrophobicContact CE1-CD2 3.28Å; F281-L344 HydrophobicContact CE2-CD2 3.59Å; F281-L344 HydrophobicContact CG-CD2 4.35Å; F281-L344 HydrophobicContact CZ-CD2 3.11Å; L315-L344 HydrophobicContact CD2-CD2 4.39Å; R341-L344 PolarHBondContact O-N 3.32Å; R341-L344 VanDerWaalsContact O-N 3.15Å; P342-L344 PolarHBondContact O-N 3.38Å
345	L	63.2	Low	78.2	Confident	98 Å²	98	70.3 Å²	70.3	51%	0.513	35%	0.353	S	S	.	.	H	α-helix	trans	-101.1	-15.7	-165.2	-64.1	170.6	0	0	0	114.5	L339 R341 P347	L339-L345 HydrophobicContact CD1-CB 4.1Å; L339-L345 HydrophobicContact CD2-CB 3.97Å; L339-L345 HydrophobicContact CD2-CD1 4.31Å; L339-L345 HydrophobicContact CG-CB 4.43Å; R341-L345 HydrophobicContact CB-CD1 4.08Å; R341-L345 HydrophobicContact CB-CG 4.4Å; R341-L345 VanDerWaalsContact O-CB 3.28Å; R341-L345 WeakPolarHBondContact O-CB 3.5Å; R341-L345 WeakPolarHBondContact O-CG 3.42Å; R341-L345 PolarHBondContact O-N 3.5Å; L345-P347 VanDerWaalsContact O-CD 3.28Å; L345-P347 WeakPolarHBondContact O-CD 3.46Å
346	V	70.9	Confident	78.6	Confident	8 Å²	8	70.4 Å²	70.4	5%	0.048	35%	0.352	C	S	.	.	S	Bend	trans	-73.2	120.2	179.2	-178.8	0	0	0	0	109.7	R318 F332 L339 P342 V351	R318-V346 PolarHBondContact NH2-O 3.08Å; F332-V346 HydrophobicContact CE2-CG1 3.83Å; F332-V346 HydrophobicContact CZ-CG1 4.1Å; L339-V346 HydrophobicContact CD1-CB 4.4Å; L339-V346 HydrophobicContact CD1-CG2 3.52Å; P342-V346 HydrophobicContact CB-CG2 3.92Å; P342-V346 WeakPolarHBondContact O-CG2 3.17Å; P342-V346 PolarHBondContact O-N 3.44Å; V346-V351 HydrophobicContact CB-CG2 4.39Å; V346-V351 HydrophobicContact CG1-CG2 3.5Å; V346-V351 VanDerWaalsContact CG1-CG2 3.5Å
347	P	76.7	Confident	78.8	Confident	68 Å²	68	74 Å²	74	44%	0.442	37%	0.367	S	S	.	.			trans	-61.7	140	176	-20.7	33.1	0	0	0	111.7	L345 D349 I350 V351	L345-P347 VanDerWaalsContact O-CD 3.28Å; L345-P347 WeakPolarHBondContact O-CD 3.46Å; P347-D349 PolarHBondContact O-N 2.73Å; P347-I350 HydrophobicContact CB-CD1 4.29Å; P347-I350 HydrophobicContact CB-CG1 4.27Å; P347-I350 HydrophobicContact CG-CD1 3.95Å; P347-I350 HydrophobicContact CG-CG1 4.47Å; P347-I350 PolarHBondContact O-N 3.41Å; P347-V351 PolarHBondContact O-N 3.44Å
348	S	79.5	Confident	79.1	Confident	42 Å²	42	67.6 Å²	67.6	29%	0.294	33%	0.334	S	S	.	.	H	α-helix	trans	-55.8	-36.4	-179.2	50.8	0	0	0	0	113	I350 V351 H352	S348-I350 VanDerWaalsContact C-N 3.29Å; S348-I350 PolarHBondContact O-N 3.23Å; S348-V351 WeakPolarHBondContact O-CB 3.37Å; S348-V351 PolarHBondContact O-N 2.93Å; S348-H352 VanDerWaalsContact C-CD2 3.5Å; S348-H352 PolarHBondContact O-CD2 3.4Å; S348-H352 VanDerWaalsContact O-CG 3.27Å; S348-H352 PolarHBondContact O-N 2.87Å
349	D	82.3	Confident	79.4	Confident	123 Å²	123	60.3 Å²	60.3	66%	0.658	30%	0.3	S	S	*	.	H	α-helix	trans	-62.6	-36.8	-175.7	-61.7	-17.3	0	0	0	112.7	P347 H352 K353	P347-D349 PolarHBondContact O-N 2.73Å; D349-H352 PolarHBondContact O-N 3.4Å; D349-K353 PolarHBondContact O-N 2.97Å
350	I	85	Confident	79.8	Confident	49 Å²	49	60.6 Å²	60.6	25%	0.251	30%	0.301	S	S	.	.	H	α-helix	trans	-72.5	-43	179.4	-50.8	-177	0	0	0	109.3	F332 E335 P347 S348 H352 K353 S354	F332-I350 HydrophobicContact CD2-CG2 3.76Å; F332-I350 HydrophobicContact CE2-CG2 4.08Å; E335-I350 WeakPolarHBondContact OE2-CD1 3.26Å; E335-I350 WeakPolarHBondContact OE2-CG2 3.41Å; P347-I350 HydrophobicContact CB-CD1 4.29Å; P347-I350 HydrophobicContact CB-CG1 4.27Å; P347-I350 HydrophobicContact CG-CD1 3.95Å; P347-I350 HydrophobicContact CG-CG1 4.47Å; P347-I350 PolarHBondContact O-N 3.41Å; S348-I350 VanDerWaalsContact C-N 3.29Å; S348-I350 PolarHBondContact O-N 3.23Å; I350-H352 VanDerWaalsContact C-N 3.32Å; I350-H352 PolarHBondContact O-N 3.45Å; I350-K353 PolarHBondContact O-N 3.07Å; I350-S354 PolarHBondContact O-N 3.19Å
351	V	86.6	Confident	80.6	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-58.6	-45.7	173.6	-176.4	0	0	0	0	110.5	T258 L321 L322 L325 F332 V346 P347 S348 K353 S354 L355	T258-V351 HydrophobicContact CG2-CG1 4.32Å; L321-V351 HydrophobicContact CD2-CG1 3.97Å; L322-V351 HydrophobicContact CD2-CG1 4.43Å; L322-V351 HydrophobicContact CD2-CG2 3.84Å; L325-V351 HydrophobicContact CD1-CG1 4.06Å; F332-V351 HydrophobicContact CE2-CG2 4.25Å; F332-V351 HydrophobicContact CZ-CG2 4.44Å; V346-V351 HydrophobicContact CB-CG2 4.39Å; V346-V351 HydrophobicContact CG1-CG2 3.5Å; V346-V351 VanDerWaalsContact CG1-CG2 3.5Å; P347-V351 PolarHBondContact O-N 3.44Å; S348-V351 WeakPolarHBondContact O-CB 3.37Å; S348-V351 PolarHBondContact O-N 2.93Å; V351-K353 PolarHBondContact O-N 3.2Å; V351-S354 PolarHBondContact O-N 3.1Å; V351-L355 WeakPolarHBondContact O-CB 3.43Å; V351-L355 PolarHBondContact O-N 3.2Å
352	H	89.2	Confident	81.2	Confident	55 Å²	55	49.7 Å²	49.7	26%	0.255	26%	0.262	S	S	.	.	H	α-helix	trans	-60.5	-43.4	178.2	-71.4	-52.3	0	0	0	112.2	T258 S348 D349 I350 K356 Y388	T258-H352 PolarHBondContact OG1-CE1 3.3Å; T258-H352 VanDerWaalsContact OG1-CE1 3.26Å; S348-H352 VanDerWaalsContact C-CD2 3.5Å; S348-H352 PolarHBondContact O-CD2 3.4Å; S348-H352 VanDerWaalsContact O-CG 3.27Å; S348-H352 PolarHBondContact O-N 2.87Å; D349-H352 PolarHBondContact O-N 3.4Å; I350-H352 VanDerWaalsContact C-N 3.32Å; I350-H352 PolarHBondContact O-N 3.45Å; H352-K356 VanDerWaalsContact O-CB 3.27Å; H352-K356 WeakPolarHBondContact O-CB 3.24Å; H352-K356 PolarHBondContact O-N 3.27Å; H352-Y388 PolarHBondContact CE1-OH 3.4Å; H352-Y388 AromaticContact ND1-CE1 3.99Å; H352-Y388 AromaticContact ND1-CZ 3.55Å; H352-Y388 PolarHBondContact ND1-OH 2.91Å
353	K	87.7	Confident	82.1	Confident	139 Å²	139	53.4 Å²	53.4	60%	0.604	28%	0.278	S	S	*	.	H	α-helix	trans	-63	-48.4	177.9	-173.6	-170.1	173.6	-151.8	0	111.4	E331 D349 I350 V351 K356 K357	E331-K353 IonicContact OE2-NZ 3.35Å; E331-K353 PolarHBondContact OE2-NZ 2.83Å; D349-K353 PolarHBondContact O-N 2.97Å; I350-K353 PolarHBondContact O-N 3.07Å; V351-K353 PolarHBondContact O-N 3.2Å; K353-K356 PolarHBondContact O-N 2.9Å; K353-K357 PolarHBondContact O-N 3.35Å; K353-K357 VanDerWaalsContact O-N 3.1Å
354	S	89.4	Confident	83.3	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.007	27%	0.272	C	S	.	.	H	α-helix	trans	-67.1	-44.5	-179.3	-169.7	0	0	0	0	111.8	D329 I350 V351 K356 K357 A358	D329-S354 VanDerWaalsContact CB-OG 3.29Å; D329-S354 WeakPolarHBondContact CB-OG 3.41Å; D329-S354 WeakPolarHBondContact OD2-CB 3.44Å; D329-S354 PolarHBondContact OD2-OG 2.92Å; I350-S354 PolarHBondContact O-N 3.19Å; V351-S354 PolarHBondContact O-N 3.1Å; S354-K356 PolarHBondContact O-N 2.82Å; S354-K357 WeakPolarHBondContact O-CB 3.38Å; S354-K357 PolarHBondContact O-N 2.96Å; S354-K357 VanDerWaalsContact O-N 3.16Å; S354-A358 WeakPolarHBondContact O-CB 3.35Å; S354-A358 PolarHBondContact O-N 2.98Å
355	L	90.8	Very high	84.5	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.4	-43.3	176.5	-179.8	61.1	0	0	0	111.9	I210 T258 L325 V351 K357 A358 I359 V364 Y388	I210-L355 HydrophobicContact CD1-CD2 3.85Å; T258-L355 HydrophobicContact CG2-CD2 3.86Å; L325-L355 HydrophobicContact CD1-CB 4.33Å; L325-L355 HydrophobicContact CD2-CB 4.41Å; L325-L355 HydrophobicContact CD2-CD1 4.24Å; V351-L355 WeakPolarHBondContact O-CB 3.43Å; V351-L355 PolarHBondContact O-N 3.2Å; L355-K357 VanDerWaalsContact C-N 3.35Å; L355-K357 PolarHBondContact O-N 2.89Å; L355-A358 PolarHBondContact O-N 2.72Å; L355-I359 HydrophobicContact CD1-CD1 3.92Å; L355-I359 HydrophobicContact CD1-CG1 4.24Å; L355-I359 HydrophobicContact CG-CD1 3.83Å; L355-I359 VanDerWaalsContact O-CG1 3.27Å; L355-I359 WeakPolarHBondContact O-CG1 3.49Å; L355-I359 PolarHBondContact O-N 3.05Å; L355-V364 HydrophobicContact CD1-CG1 4.36Å; L355-Y388 HydrophobicContact CB-CE1 4.17Å; L355-Y388 HydrophobicContact CD2-CD1 4.22Å; L355-Y388 HydrophobicContact CD2-CE1 3.52Å; L355-Y388 HydrophobicContact CG-CD1 4.18Å; L355-Y388 HydrophobicContact CG-CE1 3.85Å
356	K	89.5	Confident	85.9	Confident	84 Å²	84	44.8 Å²	44.8	37%	0.365	23%	0.233	S	C	.	.	H	α-helix	trans	-61.3	-43.1	175.3	-174.5	168.6	-174.5	153.4	0	111.9	H352 K353 S354 I359 L360 D387 Y388	H352-K356 VanDerWaalsContact O-CB 3.27Å; H352-K356 WeakPolarHBondContact O-CB 3.24Å; H352-K356 PolarHBondContact O-N 3.27Å; K353-K356 PolarHBondContact O-N 2.9Å; S354-K356 PolarHBondContact O-N 2.82Å; K356-I359 PolarHBondContact O-N 3.33Å; K356-L360 HydrophobicContact CG-CD1 4.07Å; K356-L360 WeakPolarHBondContact O-CB 3.28Å; K356-L360 VanDerWaalsContact O-CG 3.26Å; K356-L360 WeakPolarHBondContact O-CG 3.34Å; K356-L360 PolarHBondContact O-N 2.95Å; K356-D387 PolarHBondContact NZ-O 2.91Å; K356-Y388 HydrophobicContact CB-CD1 4.21Å
357	K	87.8	Confident	87.1	Confident	107 Å²	107	44.4 Å²	44.4	47%	0.465	23%	0.231	S	C	.	.	H	α-helix	trans	-60.8	-44.1	175.7	-174.2	-179.2	174	-173.1	0	111.3	D329 K353 S354 L355 L360 S361	D329-K357 IonicContact OD1-NZ 2.71Å; D329-K357 PolarHBondContact OD1-NZ 2.91Å; K353-K357 PolarHBondContact O-N 3.35Å; K353-K357 VanDerWaalsContact O-N 3.1Å; S354-K357 WeakPolarHBondContact O-CB 3.38Å; S354-K357 PolarHBondContact O-N 2.96Å; S354-K357 VanDerWaalsContact O-N 3.16Å; L355-K357 VanDerWaalsContact C-N 3.35Å; L355-K357 PolarHBondContact O-N 2.89Å; K357-L360 PolarHBondContact O-N 2.84Å; K357-S361 PolarHBondContact O-N 3.47Å; K357-S361 PolarHBondContact O-OG 3Å
358	A	89.2	Confident	87.9	Confident	2 Å²	2	41.2 Å²	41.2	2%	0.017	21%	0.21	C	C	.	.	H	α-helix	trans	-69.1	-33.3	-179.7	0	0	0	0	0	114.1	L325 I328 S354 L355 S361 S362 Q363 V364	L325-A358 HydrophobicContact CD2-CB 3.99Å; I328-A358 HydrophobicContact CG2-CB 4.27Å; S354-A358 WeakPolarHBondContact O-CB 3.35Å; S354-A358 PolarHBondContact O-N 2.98Å; L355-A358 PolarHBondContact O-N 2.72Å; A358-S361 WeakPolarHBondContact CA-OG 3.34Å; A358-S361 PolarHBondContact O-OG 2.83Å; A358-S362 PolarHBondContact O-N 2.88Å; A358-Q363 PolarHBondContact O-N 2.83Å; A358-Q363 VanDerWaalsContact O-N 3.17Å; A358-V364 HydrophobicContact CB-CB 4.14Å; A358-V364 HydrophobicContact CB-CG2 3.76Å; A358-V364 PolarHBondContact O-N 2.78Å
359	I	88.9	Confident	88.6	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-71.9	-44.7	174.4	-67.7	164.1	0	0	0	110.3	L355 K356 S361 S362 P366 F384 Y388	L355-I359 HydrophobicContact CD1-CD1 3.92Å; L355-I359 HydrophobicContact CD1-CG1 4.24Å; L355-I359 HydrophobicContact CG-CD1 3.83Å; L355-I359 VanDerWaalsContact O-CG1 3.27Å; L355-I359 WeakPolarHBondContact O-CG1 3.49Å; L355-I359 PolarHBondContact O-N 3.05Å; K356-I359 PolarHBondContact O-N 3.33Å; I359-S361 VanDerWaalsContact C-N 3.29Å; I359-S361 PolarHBondContact O-N 3.21Å; I359-S362 WeakPolarHBondContact O-CA 3.44Å; I359-S362 PolarHBondContact O-N 3.29Å; I359-P366 HydrophobicContact CD1-CB 4.39Å; I359-P366 HydrophobicContact CD1-CG 4.08Å; I359-P366 HydrophobicContact CG1-CG 4.25Å; I359-F384 HydrophobicContact CD1-CE2 4.36Å; I359-F384 HydrophobicContact CD1-CZ 3.69Å; I359-Y388 HydrophobicContact CD1-CD1 4.02Å; I359-Y388 HydrophobicContact CD1-CG 4.16Å
360	L	86.1	Confident	89.1	Confident	63 Å²	63	33.4 Å²	33.4	33%	0.33	17%	0.165	S	C	.	.	H	α-helix	trans	-64.7	-33	178.6	-69.9	173.6	0	0	0	112.2	K356 K357 S362 P390	K356-L360 HydrophobicContact CG-CD1 4.07Å; K356-L360 WeakPolarHBondContact O-CB 3.28Å; K356-L360 VanDerWaalsContact O-CG 3.26Å; K356-L360 WeakPolarHBondContact O-CG 3.34Å; K356-L360 PolarHBondContact O-N 2.95Å; K357-L360 PolarHBondContact O-N 2.84Å; L360-S362 PolarHBondContact O-N 2.77Å; L360-P390 HydrophobicContact CD2-CB 3.89Å
361	S	84.5	Confident	89.4	Confident	49 Å²	49	31 Å²	31	34%	0.343	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-3.7	172	67.6	0	0	0	0	113.8	K357 A358 I359 Q363	K357-S361 PolarHBondContact O-N 3.47Å; K357-S361 PolarHBondContact O-OG 3Å; A358-S361 WeakPolarHBondContact CA-OG 3.34Å; A358-S361 PolarHBondContact O-OG 2.83Å; I359-S361 VanDerWaalsContact C-N 3.29Å; I359-S361 PolarHBondContact O-N 3.21Å; S361-Q363 PolarHBondContact O-N 3.34Å; S361-Q363 PolarHBondContact OG-OE1 3.38Å
362	S	81.5	Confident	89.6	Confident	43 Å²	43	31 Å²	31	30%	0.301	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	26.1	-176.5	-56.9	0	0	0	0	114.4	A358 I359 L360	A358-S362 PolarHBondContact O-N 2.88Å; I359-S362 WeakPolarHBondContact O-CA 3.44Å; I359-S362 PolarHBondContact O-N 3.29Å; L360-S362 PolarHBondContact O-N 2.77Å
363	Q	85.3	Confident	89.5	Confident	92 Å²	92	35.9 Å²	35.9	43%	0.43	17%	0.169	S	C	.	.			trans	-87.8	-21.7	175.9	-71.3	169.2	-50.2	0	0	112.3	A205 H206 I328 A358 S361	A205-Q363 CarbonylContact C-O 3.56Å; A205-Q363 WeakPolarHBondContact CA-O 3.49Å; A205-Q363 VanDerWaalsContact CB-O 3.32Å; A205-Q363 WeakPolarHBondContact CB-O 3.13Å; H206-Q363 PolarHBondContact N-O 2.92Å; I328-Q363 HydrophobicContact CD1-CB 4.07Å; I328-Q363 HydrophobicContact CG2-CB 4.45Å; A358-Q363 PolarHBondContact O-N 2.83Å; A358-Q363 VanDerWaalsContact O-N 3.17Å; S361-Q363 PolarHBondContact O-N 3.34Å; S361-Q363 PolarHBondContact OG-OE1 3.38Å
364	V	88.9	Confident	89.4	Confident	3 Å²	3	34.7 Å²	34.7	2%	0.018	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	134	177.6	168.6	0	0	0	0	109.8	H206 I208 I328 L355 A358	H206-V364 WeakPolarHBondContact O-CA 3.47Å; I208-V364 HydrophobicContact CB-CG1 4.07Å; I208-V364 HydrophobicContact CD1-CB 4.2Å; I208-V364 HydrophobicContact CD1-CG1 3.58Å; I208-V364 HydrophobicContact CD1-CG2 3.55Å; I208-V364 HydrophobicContact CG1-CG1 3.96Å; I328-V364 HydrophobicContact CD1-CG2 3.46Å; I328-V364 VanDerWaalsContact CD1-CG2 3.46Å; L355-V364 HydrophobicContact CD1-CG1 4.36Å; A358-V364 HydrophobicContact CB-CB 4.14Å; A358-V364 HydrophobicContact CB-CG2 3.76Å; A358-V364 PolarHBondContact O-N 2.78Å
365	I	91.3	Very high	89.3	Confident	10 Å²	10	35.9 Å²	35.9	5%	0.051	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	106.6	167.9	-63.3	171.9	0	0	0	107.7	I178 T203 A205 H206 Y207 I208	I178-I365 HydrophobicContact CD1-CG2 3.67Å; I178-I365 HydrophobicContact CG1-CG2 3.69Å; T203-I365 HydrophobicContact CG2-CD1 4.47Å; A205-I365 HydrophobicContact CB-CD1 3.9Å; A205-I365 HydrophobicContact CB-CG1 3.85Å; H206-I365 PolarHBondContact O-N 3.03Å; Y207-I365 WeakPolarHBondContact CA-O 3.41Å; Y207-I365 HydrophobicContact CD1-CB 3.8Å; Y207-I365 HydrophobicContact CD1-CD1 4.27Å; Y207-I365 HydrophobicContact CD1-CG2 3.83Å; Y207-I365 HydrophobicContact CE1-CB 4.08Å; Y207-I365 HydrophobicContact CE1-CD1 3.69Å; Y207-I365 HydrophobicContact CE1-CG1 4.48Å; Y207-I365 HydrophobicContact CE1-CG2 3.99Å; I208-I365 PolarHBondContact N-O 2.75Å
366	P	93.7	Very high	89.1	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	138.5	-178.6	29.7	-36.1	0	0	0	111.6	V177 I178 I208 I210 I359 F384	V177-P366 HydrophobicContact CB-CG 4.22Å; V177-P366 HydrophobicContact CG1-CG 4.1Å; V177-P366 HydrophobicContact CG2-CG 3.8Å; I178-P366 PolarHBondContact N-O 2.97Å; I208-P366 CarbonylContact O-C 3.45Å; I210-P366 HydrophobicContact CD1-CB 3.3Å; I210-P366 HydrophobicContact CG1-CB 3.99Å; I359-P366 HydrophobicContact CD1-CB 4.39Å; I359-P366 HydrophobicContact CD1-CG 4.08Å; I359-P366 HydrophobicContact CG1-CG 4.25Å; P366-F384 HydrophobicContact CB-CE1 4.25Å; P366-F384 HydrophobicContact CB-CE2 4.3Å; P366-F384 HydrophobicContact CB-CZ 3.59Å; P366-F384 HydrophobicContact CG-CE1 3.8Å; P366-F384 HydrophobicContact CG-CZ 3.51Å
367	V	94.5	Very high	89	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.006	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	113.4	-179.7	-173.9	0	0	0	0	109.8	I178 I180 L194 I208 I210	I178-V367 HydrophobicContact CB-CG1 4.39Å; I178-V367 HydrophobicContact CB-CG2 4.16Å; I178-V367 HydrophobicContact CD1-CG2 4.38Å; I178-V367 HydrophobicContact CG2-CG1 4.11Å; I178-V367 CarbonylContact O-C 3.58Å; I178-V367 WeakPolarHBondContact O-CA 3.38Å; I180-V367 HydrophobicContact CD1-CG1 3.49Å; I180-V367 VanDerWaalsContact CD1-CG1 3.49Å; I180-V367 HydrophobicContact CG1-CG1 3.93Å; L194-V367 HydrophobicContact CD2-CB 4.34Å; L194-V367 HydrophobicContact CD2-CG1 4.18Å; L194-V367 HydrophobicContact CD2-CG2 3.9Å; I208-V367 PolarHBondContact O-N 2.95Å; I210-V367 PolarHBondContact N-O 3.16Å
368	L	95	Very high	89.2	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.005	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	157	174.6	-64.1	93.4	0	0	0	110.1	V177 I178 Y179 I180 H211 L381 F384	V177-L368 HydrophobicContact CG1-CD1 3.21Å; I178-L368 PolarHBondContact O-N 2.81Å; Y179-L368 WeakPolarHBondContact CA-O 3.46Å; Y179-L368 HydrophobicContact CD2-CB 4.04Å; I180-L368 PolarHBondContact N-O 2.83Å; H211-L368 WeakPolarHBondContact CE1-CD2 3.34Å; L368-L381 HydrophobicContact CD2-CD1 4.3Å; L368-F384 HydrophobicContact CD1-CD1 3.97Å; L368-F384 HydrophobicContact CD1-CD2 4.43Å; L368-F384 HydrophobicContact CD1-CE1 4.14Å; L368-F384 HydrophobicContact CD1-CG 4.13Å; L368-F384 HydrophobicContact CD1-CZ 4.46Å; L368-F384 HydrophobicContact CD2-CB 3.71Å; L368-F384 HydrophobicContact CD2-CD1 4.3Å; L368-F384 HydrophobicContact CD2-CD2 4.08Å; L368-F384 HydrophobicContact CD2-CG 3.74Å
369	V	93.8	Very high	89.2	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	149.1	178.6	-51.7	0	0	0	0	111	I180 M183 V190 H211 P213 L254	I180-V369 HydrophobicContact CB-CG1 4.3Å; I180-V369 HydrophobicContact CD1-CG1 4.45Å; I180-V369 WeakPolarHBondContact O-CA 3.4Å; M183-V369 HydrophobicContact CG-CB 4.34Å; V190-V369 HydrophobicContact CG1-CG1 4.37Å; V190-V369 HydrophobicContact CG2-CG1 3.8Å; H211-V369 HydrophobicContact CB-CG2 3.76Å; P213-V369 HydrophobicContact CB-CG2 4.34Å; L254-V369 HydrophobicContact CB-CG2 4.29Å
370	G	92.5	Very high	89.4	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.136	C	C	.	.			trans	-176.5	-177.9	174.2	0	0	0	0	0	114.5	Y179 I180 N181 K182 M183 I376	Y179-G370 WeakPolarHBondContact OH-CA 3.07Å; I180-G370 PolarHBondContact O-N 3.26Å; N181-G370 CarbonylContact C-O 3.58Å; N181-G370 WeakPolarHBondContact CA-O 3.39Å; K182-G370 PolarHBondContact N-O 3.15Å; M183-G370 WeakPolarHBondContact CB-O 3.25Å; M183-G370 WeakPolarHBondContact CG-O 3.16Å; M183-G370 PolarHBondContact N-O 3.32Å; G370-I376 WeakPolarHBondContact CA-O 3.4Å
371	S	92	Very high	89.7	Confident	0 Å²	0	25 Å²	25	0%	0	12%	0.12	C	C	.	.	B	Isolated β-bridge	trans	-135.9	105.5	171.6	173.4	0	0	0	0	109.2	D184 R373 K374 N375 I376	D184-S371 WeakPolarHBondContact OD1-CB 3.38Å; D184-S371 PolarHBondContact OD1-OG 2.75Å; S371-R373 VanDerWaalsContact C-N 3.27Å; S371-R373 PolarHBondContact O-N 2.95Å; S371-K374 PolarHBondContact O-N 2.86Å; S371-K374 PolarHBondContact OG-N 2.81Å; S371-N375 PolarHBondContact O-N 2.84Å; S371-N375 VanDerWaalsContact O-N 3.07Å; S371-I376 CarbonylContact C-O 3.49Å; S371-I376 PolarHBondContact N-O 2.87Å; S371-I376 PolarHBondContact O-N 3.29Å
372	S	90.3	Very high	90.1	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-31.3	-179.9	-51.1	0	0	0	0	112	T72 R75 N181 N375	T72-S372 PolarHBondContact OG1-OG 2.81Å; R75-S372 WeakPolarHBondContact CG-O 3.39Å; R75-S372 PolarHBondContact NE-O 2.89Å; N181-S372 PolarHBondContact ND2-OG 2.72Å; N181-S372 WeakPolarHBondContact OD1-CB 3.23Å; N181-S372 PolarHBondContact OD1-N 3.46Å; N181-S372 PolarHBondContact OD1-OG 2.81Å; S372-N375 PolarHBondContact O-N 3.19Å
373	R	87.2	Confident	90.7	Very high	156 Å²	156	21.2 Å²	21.2	59%	0.589	9%	0.093	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-38.2	176.5	-170.4	-179.8	-175	-176	7.1	112.4	S371 N375	S371-R373 VanDerWaalsContact C-N 3.27Å; S371-R373 PolarHBondContact O-N 2.95Å; R373-N375 VanDerWaalsContact C-N 3.32Å
374	K	85.2	Confident	91.1	Very high	115 Å²	115	17 Å²	17	50%	0.5	7%	0.074	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	3.9	178.2	-65.7	-65.5	-174.1	177.8	0	113.4	D184 S371 I376	D184-K374 HydrophobicContact CB-CG 3.81Å; S371-K374 PolarHBondContact O-N 2.86Å; S371-K374 PolarHBondContact OG-N 2.81Å; K374-I376 HydrophobicContact CB-CD1 3.97Å; K374-I376 HydrophobicContact CB-CG1 3.96Å; K374-I376 WeakPolarHBondContact O-CG1 3.36Å; K374-I376 PolarHBondContact O-N 3.44Å
375	N	86.3	Confident	91.3	Very high	25 Å²	25	16.9 Å²	16.9	13%	0.134	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	23.5	-176.5	-56.9	-37.6	0	0	0	114.7	R75 Y79 S371 S372 R373	R75-N375 VanDerWaalsContact CD-OD1 3.25Å; R75-N375 WeakPolarHBondContact CD-OD1 3.33Å; R75-N375 PolarHBondContact NH1-OD1 3.42Å; Y79-N375 HydrophobicContact CE2-CB 4.43Å; Y79-N375 WeakPolarHBondContact OH-CB 3.02Å; Y79-N375 PolarHBondContact OH-O 3.29Å; S371-N375 PolarHBondContact O-N 2.84Å; S371-N375 VanDerWaalsContact O-N 3.07Å; S372-N375 PolarHBondContact O-N 3.19Å; R373-N375 VanDerWaalsContact C-N 3.32Å
376	I	87.9	Confident	91.3	Very high	13 Å²	13	16.7 Å²	16.7	7%	0.067	7%	0.072	C	C	.	.	B	Isolated β-bridge	trans	-99.9	129.6	-177.5	-54	178.4	0	0	0	109.3	F251 W265 G370 S371 K374	F251-I376 HydrophobicContact CD1-CB 4.33Å; F251-I376 HydrophobicContact CD1-CD1 4.01Å; F251-I376 HydrophobicContact CD1-CG2 4.16Å; F251-I376 HydrophobicContact CE1-CB 3.88Å; F251-I376 HydrophobicContact CE1-CD1 4.36Å; F251-I376 HydrophobicContact CE1-CG2 3.46Å; F251-I376 VanDerWaalsContact CE1-CG2 3.46Å; F251-I376 HydrophobicContact CZ-CG2 4.03Å; F251-I376 WeakPolarHBondContact O-CD1 3.37Å; W265-I376 HydrophobicContact CB-CD1 4.49Å; W265-I376 HydrophobicContact CB-CG1 3.99Å; W265-I376 HydrophobicContact CB-CG2 4.39Å; W265-I376 HydrophobicContact CD2-CG2 3.9Å; W265-I376 HydrophobicContact CE3-CG2 3.76Å; W265-I376 HydrophobicContact CG-CB 4.47Å; W265-I376 HydrophobicContact CG-CG1 4.27Å; W265-I376 HydrophobicContact CG-CG2 4.18Å; W265-I376 HydrophobicContact CZ3-CG2 4.35Å; G370-I376 WeakPolarHBondContact CA-O 3.4Å; S371-I376 CarbonylContact C-O 3.49Å; S371-I376 PolarHBondContact N-O 2.87Å; S371-I376 PolarHBondContact O-N 3.29Å; K374-I376 HydrophobicContact CB-CD1 3.97Å; K374-I376 HydrophobicContact CB-CG1 3.96Å; K374-I376 WeakPolarHBondContact O-CG1 3.36Å; K374-I376 PolarHBondContact O-N 3.44Å
377	G	87.9	Confident	91.2	Very high	1 Å²	1	20 Å²	20	1%	0.01	9%	0.089	C	C	.	.	S	Bend	trans	89	-1.7	173.7	0	0	0	0	0	116.1	L381	G377-L381 PolarHBondContact O-N 3.07Å
378	I	90.9	Very high	91	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-73.8	-41.7	179.4	-57.6	-66.8	0	0	0	112.4	T72 R75 M76 Y79 L381 L382	T72-I378 HydrophobicContact CG2-CD1 3.91Å; R75-I378 HydrophobicContact CB-CD1 4.18Å; R75-I378 HydrophobicContact CB-CG1 3.9Å; R75-I378 HydrophobicContact CB-CG2 4.21Å; R75-I378 HydrophobicContact CG-CG1 4.49Å; M76-I378 HydrophobicContact CG-CG2 3.95Å; Y79-I378 HydrophobicContact CD2-CB 3.89Å; Y79-I378 HydrophobicContact CD2-CG2 3.59Å; Y79-I378 HydrophobicContact CE2-CB 3.75Å; Y79-I378 HydrophobicContact CE2-CG1 4.28Å; Y79-I378 HydrophobicContact CE2-CG2 4.01Å; I378-L381 WeakPolarHBondContact O-CB 3.49Å; I378-L381 PolarHBondContact O-N 3.46Å; I378-L382 HydrophobicContact CG2-CD1 4.35Å; I378-L382 PolarHBondContact O-N 2.9Å
379	Q	90.5	Very high	90.8	Very high	12 Å²	12	20.6 Å²	20.6	6%	0.056	9%	0.092	C	C	.	.	H	α-helix	trans	-62.4	-45.8	176.5	-53.7	98.6	-48.1	0	0	112.1	Y79 W118 Y275 L381 L382 D383	Y79-Q379 HydrophobicContact CD1-CG 4.09Å; Y79-Q379 HydrophobicContact CE1-CG 4.12Å; Y79-Q379 VanDerWaalsContact CE1-NE2 3.29Å; Y79-Q379 HydrophobicContact CG-CG 4.34Å; Y79-Q379 PolarHBondContact OH-NE2 3.47Å; W118-Q379 HydrophobicContact CH2-CG 4.23Å; W118-Q379 HydrophobicContact CZ2-CB 4.26Å; W118-Q379 HydrophobicContact CZ2-CG 4.48Å; Y275-Q379 HydrophobicContact CE1-CB 4.21Å; Q379-L381 VanDerWaalsContact C-N 3.26Å; Q379-L381 PolarHBondContact O-N 3.03Å; Q379-L382 PolarHBondContact O-N 3.16Å; Q379-L382 VanDerWaalsContact O-N 3.11Å; Q379-D383 PolarHBondContact O-N 3.48Å
380	P	91.4	Very high	90.6	Very high	3 Å²	3	21 Å²	21	2%	0.019	10%	0.095	C	C	.	.	H	α-helix	trans	-58.3	-34.2	172.1	-26.5	32.8	0	0	0	114	H211 L254 K263 W265 F384	H211-P380 VanDerWaalsContact CE1-CB 3.44Å; H211-P380 WeakPolarHBondContact CE1-CB 3.45Å; L254-P380 HydrophobicContact CD2-CG 4.39Å; K263-P380 HydrophobicContact CD-CG 4.21Å; W265-P380 HydrophobicContact CH2-CG 3.54Å; W265-P380 HydrophobicContact CZ2-CG 3.74Å; P380-F384 VanDerWaalsContact O-CB 3.23Å; P380-F384 WeakPolarHBondContact O-CB 3.43Å; P380-F384 PolarHBondContact O-N 3.23Å
381	L	93.7	Very high	90.4	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-65.9	-44.4	173.8	176.4	67.4	0	0	0	111.5	T72 M76 V149 Y179 L368 G377 I378 Q379 F384 I385	T72-L381 HydrophobicContact CG2-CD2 4.14Å; M76-L381 HydrophobicContact SD-CD2 4.49Å; V149-L381 HydrophobicContact CG1-CD1 4.27Å; Y179-L381 HydrophobicContact CD1-CD2 4.3Å; Y179-L381 HydrophobicContact CD2-CD1 4.34Å; Y179-L381 HydrophobicContact CD2-CD2 4.26Å; Y179-L381 HydrophobicContact CE1-CD2 4.42Å; Y179-L381 HydrophobicContact CE2-CD2 4.39Å; Y179-L381 HydrophobicContact CG-CD2 4.22Å; L368-L381 HydrophobicContact CD2-CD1 4.3Å; G377-L381 PolarHBondContact O-N 3.07Å; I378-L381 WeakPolarHBondContact O-CB 3.49Å; I378-L381 PolarHBondContact O-N 3.46Å; Q379-L381 VanDerWaalsContact C-N 3.26Å; Q379-L381 PolarHBondContact O-N 3.03Å; L381-F384 WeakPolarHBondContact O-CB 3.46Å; L381-F384 PolarHBondContact O-N 2.95Å; L381-I385 HydrophobicContact CG-CD1 4.29Å; L381-I385 VanDerWaalsContact O-CG1 3.31Å; L381-I385 WeakPolarHBondContact O-CG1 3.5Å; L381-I385 PolarHBondContact O-N 3Å
382	L	92.8	Very high	90.1	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-64	-40.9	175.9	-74.5	168.9	0	0	0	112.2	M76 L116 W118 I123 I378 Q379 I385 V386	M76-L382 HydrophobicContact CB-CD2 4.28Å; M76-L382 HydrophobicContact CE-CD2 3.47Å; M76-L382 VanDerWaalsContact CE-CD2 3.47Å; M76-L382 HydrophobicContact CE-CG 4.38Å; M76-L382 HydrophobicContact CG-CD2 4.15Å; M76-L382 HydrophobicContact CG-CG 4.4Å; L116-L382 HydrophobicContact CD1-CD2 4.14Å; W118-L382 HydrophobicContact CD2-CB 4.03Å; W118-L382 HydrophobicContact CD2-CD1 3.94Å; W118-L382 HydrophobicContact CD2-CG 4.5Å; W118-L382 HydrophobicContact CE3-CD1 3.92Å; W118-L382 HydrophobicContact CG-CB 4.08Å; W118-L382 HydrophobicContact CH2-CD1 4.19Å; W118-L382 HydrophobicContact CZ2-CB 4.25Å; W118-L382 HydrophobicContact CZ2-CD1 4.21Å; W118-L382 HydrophobicContact CZ3-CD1 4.05Å; I123-L382 HydrophobicContact CD1-CD2 4.12Å; I378-L382 HydrophobicContact CG2-CD1 4.35Å; I378-L382 PolarHBondContact O-N 2.9Å; Q379-L382 PolarHBondContact O-N 3.16Å; Q379-L382 VanDerWaalsContact O-N 3.11Å; L382-I385 PolarHBondContact O-N 3.05Å; L382-V386 PolarHBondContact O-N 2.92Å
383	D	92.9	Very high	89.6	Confident	13 Å²	13	24.6 Å²	24.6	7%	0.07	12%	0.118	C	C	.	.	H	α-helix	trans	-62.2	-45.2	174.6	-66	-20	0	0	0	110.6	W118 R119 Q379 I385 V386 D387	W118-D383 PolarHBondContact NE1-OD1 3.38Å; R119-D383 IonicContact CZ-OD1 3.93Å; R119-D383 IonicContact CZ-OD2 3.11Å; R119-D383 IonicContact NE-OD1 3.14Å; R119-D383 PolarHBondContact NE-OD1 3.32Å; R119-D383 IonicContact NH1-OD1 2.63Å; R119-D383 IonicContact NH2-OD1 2.83Å; R119-D383 PolarHBondContact NH2-OD1 3.29Å; R119-D383 IonicContact NH2-OD2 3.07Å; R119-D383 PolarHBondContact NH2-OD2 3.4Å; Q379-D383 PolarHBondContact O-N 3.48Å; D383-I385 VanDerWaalsContact C-N 3.33Å; D383-I385 PolarHBondContact O-N 3.4Å; D383-V386 PolarHBondContact O-N 3.41Å; D383-V386 VanDerWaalsContact O-N 3.15Å; D383-D387 WeakPolarHBondContact O-CB 3.03Å; D383-D387 VanDerWaalsContact O-CG 3.24Å; D383-D387 PolarHBondContact O-N 3.39Å
384	F	93.6	Very high	89	Confident	5 Å²	5	23 Å²	23	2%	0.022	12%	0.117	C	C	.	.	H	α-helix	trans	-59.3	-42.3	177	-171.8	-89.3	0	0	0	112.7	V177 I210 I359 P366 L368 P380 L381 V386 D387 Y388	V177-F384 HydrophobicContact CB-CE1 4.41Å; V177-F384 HydrophobicContact CG1-CD1 4.08Å; V177-F384 HydrophobicContact CG1-CE1 3.83Å; V177-F384 HydrophobicContact CG2-CD1 4.33Å; V177-F384 HydrophobicContact CG2-CE1 3.64Å; I210-F384 HydrophobicContact CD1-CD2 4.04Å; I210-F384 HydrophobicContact CD1-CE2 3.17Å; I210-F384 HydrophobicContact CD1-CZ 3.68Å; I359-F384 HydrophobicContact CD1-CE2 4.36Å; I359-F384 HydrophobicContact CD1-CZ 3.69Å; P366-F384 HydrophobicContact CB-CE1 4.25Å; P366-F384 HydrophobicContact CB-CE2 4.3Å; P366-F384 HydrophobicContact CB-CZ 3.59Å; P366-F384 HydrophobicContact CG-CE1 3.8Å; P366-F384 HydrophobicContact CG-CZ 3.51Å; L368-F384 HydrophobicContact CD1-CD1 3.97Å; L368-F384 HydrophobicContact CD1-CD2 4.43Å; L368-F384 HydrophobicContact CD1-CE1 4.14Å; L368-F384 HydrophobicContact CD1-CG 4.13Å; L368-F384 HydrophobicContact CD1-CZ 4.46Å; L368-F384 HydrophobicContact CD2-CB 3.71Å; L368-F384 HydrophobicContact CD2-CD1 4.3Å; L368-F384 HydrophobicContact CD2-CD2 4.08Å; L368-F384 HydrophobicContact CD2-CG 3.74Å; P380-F384 VanDerWaalsContact O-CB 3.23Å; P380-F384 WeakPolarHBondContact O-CB 3.43Å; P380-F384 PolarHBondContact O-N 3.23Å; L381-F384 WeakPolarHBondContact O-CB 3.46Å; L381-F384 PolarHBondContact O-N 2.95Å; F384-V386 VanDerWaalsContact C-N 3.32Å; F384-V386 PolarHBondContact O-N 3.13Å; F384-D387 PolarHBondContact O-N 3.24Å; F384-Y388 HydrophobicContact CB-CD2 4.4Å; F384-Y388 HydrophobicContact CD1-CD2 4.37Å; F384-Y388 AromaticContact CD2-CD2 3.18Å; F384-Y388 HydrophobicContact CD2-CD2 3.18Å; F384-Y388 AromaticContact CD2-CE2 3.36Å; F384-Y388 HydrophobicContact CD2-CE2 3.36Å; F384-Y388 HydrophobicContact CD2-CG 4.07Å; F384-Y388 HydrophobicContact CE1-CD2 4.4Å; F384-Y388 HydrophobicContact CE2-CD1 4.34Å; F384-Y388 AromaticContact CE2-CD2 3.18Å; F384-Y388 HydrophobicContact CE2-CD2 3.18Å; F384-Y388 AromaticContact CE2-CE2 3.48Å; F384-Y388 HydrophobicContact CE2-CE2 3.48Å; F384-Y388 VanDerWaalsContact CE2-CE2 3.48Å; F384-Y388 AromaticContact CE2-CG 3.62Å; F384-Y388 HydrophobicContact CE2-CG 3.62Å; F384-Y388 AromaticContact CG-CD2 3.79Å; F384-Y388 HydrophobicContact CG-CD2 3.79Å; F384-Y388 HydrophobicContact CG-CE2 4.29Å; F384-Y388 AromaticContact CZ-CD2 3.86Å; F384-Y388 HydrophobicContact CZ-CD2 3.86Å; F384-Y388 AromaticContact CZ-CG 3.91Å; F384-Y388 HydrophobicContact CZ-CG 3.91Å; F384-Y388 WeakPolarHBondContact O-CD2 3.38Å; F384-Y388 PolarHBondContact O-N 2.67Å
385	I	93.3	Very high	88.3	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-59	-43.4	176.4	-73.5	164.4	0	0	0	111.1	R57 V59 M76 I123 V149 L381 L382 D383 L389	R57-I385 HydrophobicContact CB-CG2 4.25Å; R57-I385 HydrophobicContact CG-CG2 4.34Å; V59-I385 HydrophobicContact CG2-CG2 3.73Å; M76-I385 HydrophobicContact CE-CD1 3.59Å; I123-I385 HydrophobicContact CD1-CG2 3.78Å; I123-I385 HydrophobicContact CG1-CG2 4.12Å; I123-I385 HydrophobicContact CG2-CG2 4.35Å; V149-I385 HydrophobicContact CG2-CD1 4.48Å; L381-I385 HydrophobicContact CG-CD1 4.29Å; L381-I385 VanDerWaalsContact O-CG1 3.31Å; L381-I385 WeakPolarHBondContact O-CG1 3.5Å; L381-I385 PolarHBondContact O-N 3Å; L382-I385 PolarHBondContact O-N 3.05Å; D383-I385 VanDerWaalsContact C-N 3.33Å; D383-I385 PolarHBondContact O-N 3.4Å; I385-L389 HydrophobicContact CB-CD1 4.04Å; I385-L389 HydrophobicContact CG1-CD1 3.7Å; I385-L389 HydrophobicContact CG2-CD1 4.1Å; I385-L389 WeakPolarHBondContact O-CB 3.4Å; I385-L389 PolarHBondContact O-N 3.41Å
386	V	92.5	Very high	87.5	Confident	5 Å²	5	22.4 Å²	22.4	3%	0.03	12%	0.121	C	C	.	.	H	α-helix	trans	-70.4	-44	-179.3	171.9	0	0	0	0	111.4	R57 H121 I123 L382 D383 F384	R57-V386 PolarHBondContact NE-O 3.48Å; R57-V386 PolarHBondContact NH2-O 2.85Å; H121-V386 HydrophobicContact CB-CG1 4.32Å; H121-V386 HydrophobicContact CB-CG2 4.06Å; H121-V386 WeakPolarHBondContact ND1-CG1 3.27Å; I123-V386 HydrophobicContact CD1-CG2 4.04Å; L382-V386 PolarHBondContact O-N 2.92Å; D383-V386 PolarHBondContact O-N 3.41Å; D383-V386 VanDerWaalsContact O-N 3.15Å; F384-V386 VanDerWaalsContact C-N 3.32Å; F384-V386 PolarHBondContact O-N 3.13Å
387	D	90.6	Very high	86.8	Confident	69 Å²	69	22 Å²	22	37%	0.369	12%	0.119	S	C	.	.	H	α-helix	trans	-79	-39.8	-168.1	-64.4	-21.3	0	0	0	112.7	R119 K356 D383 F384	R119-D387 IonicContact NH1-OD1 3.97Å; R119-D387 IonicContact NH1-OD2 3.55Å; K356-D387 PolarHBondContact NZ-O 2.91Å; D383-D387 WeakPolarHBondContact O-CB 3.03Å; D383-D387 VanDerWaalsContact O-CG 3.24Å; D383-D387 PolarHBondContact O-N 3.39Å; F384-D387 PolarHBondContact O-N 3.24Å
388	Y	91.1	Very high	86.1	Confident	14 Å²	14	23.1 Å²	23.1	6%	0.055	13%	0.126	C	C	.	.	H	α-helix	trans	-113	-29.5	-168.9	-58.5	-85.5	0	0	0	116	H352 L355 K356 I359 F384	H352-Y388 PolarHBondContact CE1-OH 3.4Å; H352-Y388 AromaticContact ND1-CE1 3.99Å; H352-Y388 AromaticContact ND1-CZ 3.55Å; H352-Y388 PolarHBondContact ND1-OH 2.91Å; L355-Y388 HydrophobicContact CB-CE1 4.17Å; L355-Y388 HydrophobicContact CD2-CD1 4.22Å; L355-Y388 HydrophobicContact CD2-CE1 3.52Å; L355-Y388 HydrophobicContact CG-CD1 4.18Å; L355-Y388 HydrophobicContact CG-CE1 3.85Å; K356-Y388 HydrophobicContact CB-CD1 4.21Å; I359-Y388 HydrophobicContact CD1-CD1 4.02Å; I359-Y388 HydrophobicContact CD1-CG 4.16Å; F384-Y388 HydrophobicContact CB-CD2 4.4Å; F384-Y388 HydrophobicContact CD1-CD2 4.37Å; F384-Y388 AromaticContact CD2-CD2 3.18Å; F384-Y388 HydrophobicContact CD2-CD2 3.18Å; F384-Y388 AromaticContact CD2-CE2 3.36Å; F384-Y388 HydrophobicContact CD2-CE2 3.36Å; F384-Y388 HydrophobicContact CD2-CG 4.07Å; F384-Y388 HydrophobicContact CE1-CD2 4.4Å; F384-Y388 HydrophobicContact CE2-CD1 4.34Å; F384-Y388 AromaticContact CE2-CD2 3.18Å; F384-Y388 HydrophobicContact CE2-CD2 3.18Å; F384-Y388 AromaticContact CE2-CE2 3.48Å; F384-Y388 HydrophobicContact CE2-CE2 3.48Å; F384-Y388 VanDerWaalsContact CE2-CE2 3.48Å; F384-Y388 AromaticContact CE2-CG 3.62Å; F384-Y388 HydrophobicContact CE2-CG 3.62Å; F384-Y388 AromaticContact CG-CD2 3.79Å; F384-Y388 HydrophobicContact CG-CD2 3.79Å; F384-Y388 HydrophobicContact CG-CE2 4.29Å; F384-Y388 AromaticContact CZ-CD2 3.86Å; F384-Y388 HydrophobicContact CZ-CD2 3.86Å; F384-Y388 AromaticContact CZ-CG 3.91Å; F384-Y388 HydrophobicContact CZ-CG 3.91Å; F384-Y388 WeakPolarHBondContact O-CD2 3.38Å; F384-Y388 PolarHBondContact O-N 2.67Å
389	L	90.6	Very high	85.1	Confident	2 Å²	2	28.9 Å²	28.9	1%	0.01	16%	0.155	C	C	.	.	S	Bend	trans	-73.4	149.4	-178	-66.9	-178.8	0	0	0	111.7	R57 V59 S147 V177 I385	R57-L389 PolarHBondContact NE-O 3.48Å; V59-L389 HydrophobicContact CG2-CD1 4.09Å; S147-L389 WeakPolarHBondContact OG-CD1 3.4Å; V177-L389 HydrophobicContact CG2-CD1 4.44Å; V177-L389 HydrophobicContact CG2-CD2 3.45Å; V177-L389 VanDerWaalsContact CG2-CD2 3.45Å; V177-L389 HydrophobicContact CG2-CG 4.32Å; I385-L389 HydrophobicContact CB-CD1 4.04Å; I385-L389 HydrophobicContact CG1-CD1 3.7Å; I385-L389 HydrophobicContact CG2-CD1 4.1Å; I385-L389 WeakPolarHBondContact O-CB 3.4Å; I385-L389 PolarHBondContact O-N 3.41Å
390	P	88.7	Confident	84	Confident	9 Å²	9	29 Å²	29	6%	0.058	16%	0.157	C	C	.	.	P	Polyproline II helix	trans	-64.5	144.5	-178.8	28.1	-36.8	0	0	0	111.7	R57 D146 P175 L360 H394	R57-P390 WeakPolarHBondContact CD-O 3.3Å; D146-P390 HydrophobicContact CB-CG 4.4Å; D146-P390 WeakPolarHBondContact O-CG 3.43Å; P175-P390 HydrophobicContact CG-CG 4.18Å; L360-P390 HydrophobicContact CD2-CB 3.89Å; P390-H394 HydrophobicContact CB-CB 4.16Å
391	D	88.3	Confident	83.1	Confident	18 Å²	18	29 Å²	29	10%	0.096	16%	0.157	C	C	.	.	P	Polyproline II helix	trans	-84.5	163.1	162.5	71.3	86.4	0	0	0	110.9	R57 S393 H394 S395	R57-D391 VanDerWaalsContact NH1-CB 3.34Å; D391-S393 PolarHBondContact O-N 2.77Å; D391-S393 WeakPolarHBondContact OD1-CB 3.26Å; D391-S393 PolarHBondContact OD1-N 3.34Å; D391-S393 PolarHBondContact OD1-OG 3.29Å; D391-H394 PolarHBondContact O-N 2.81Å; D391-H394 IonicContact OD2-CD2 3.42Å; D391-H394 PolarHBondContact OD2-CD2 2.9Å; D391-H394 IonicContact OD2-NE2 2.63Å; D391-S395 PolarHBondContact O-OG 3.29Å
392	P	85.6	Confident	82.1	Confident	4 Å²	4	30 Å²	30	3%	0.026	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-16	-175.5	-25.4	32.3	0	0	0	115.8	I53 I56 D146 H394 S395	I53-P392 HydrophobicContact CD1-CB 4.08Å; I53-P392 HydrophobicContact CG1-CB 3.85Å; I53-P392 HydrophobicContact CG1-CG 4.23Å; I56-P392 HydrophobicContact CB-CG 4.02Å; I56-P392 HydrophobicContact CG2-CG 3.95Å; I56-P392 VanDerWaalsContact O-CD 3.23Å; I56-P392 WeakPolarHBondContact O-CD 3.43Å; D146-P392 WeakPolarHBondContact OD2-CG 3.44Å; P392-H394 VanDerWaalsContact C-N 3.35Å; P392-S395 WeakPolarHBondContact CA-OG 3.44Å; P392-S395 PolarHBondContact O-OG 3.03Å
393	S	80.2	Confident	81.1	Confident	52 Å²	52	36.1 Å²	36.1	36%	0.364	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-22.6	177.1	77.3	0	0	0	0	113.6	D391	D391-S393 PolarHBondContact O-N 2.77Å; D391-S393 WeakPolarHBondContact OD1-CB 3.26Å; D391-S393 PolarHBondContact OD1-N 3.34Å; D391-S393 PolarHBondContact OD1-OG 3.29Å
394	H	75.4	Confident	80.1	Confident	123 Å²	123	35.8 Å²	35.8	57%	0.569	19%	0.187	S	C	*	.	S	Bend	trans	-88.5	-7.7	175.6	-71.5	-62.5	0	0	0	113.2	P390 D391 P392	P390-H394 HydrophobicContact CB-CB 4.16Å; D391-H394 PolarHBondContact O-N 2.81Å; D391-H394 IonicContact OD2-CD2 3.42Å; D391-H394 PolarHBondContact OD2-CD2 2.9Å; D391-H394 IonicContact OD2-NE2 2.63Å; P392-H394 VanDerWaalsContact C-N 3.35Å
395	S	71.2	Confident	79.1	Confident	18 Å²	18	36 Å²	36	13%	0.126	19%	0.188	C	C	.	.	S	Bend	trans	-76.1	142	-172.3	-51.1	0	0	0	0	113.2	D146 D391 P392 I397	D146-S395 WeakPolarHBondContact OD1-CB 3.16Å; D146-S395 PolarHBondContact OD1-OG 2.96Å; D391-S395 PolarHBondContact O-OG 3.29Å; P392-S395 WeakPolarHBondContact CA-OG 3.44Å; P392-S395 PolarHBondContact O-OG 3.03Å; S395-I397 PolarHBondContact O-N 3.39Å
396	N	68.8	Low	78	Confident	110 Å²	110	41.3 Å²	41.3	59%	0.588	21%	0.211	S	C	*	.	P	Polyproline II helix	trans	-69.1	131.6	169.5	-69.5	-29.9	0	0	0	109.6
397	I	72.1	Confident	76.9	Confident	5 Å²	5	44.5 Å²	44.5	3%	0.026	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-73.8	130.4	169.8	-59.5	174.8	0	0	0	107	S395 I399 I401 L402 I431 L432	S395-I397 PolarHBondContact O-N 3.39Å; I397-I399 PolarHBondContact O-N 3.36Å; I397-I401 HydrophobicContact CG2-CB 3.76Å; I397-I401 HydrophobicContact CG2-CD1 4.19Å; I397-I401 HydrophobicContact CG2-CG2 3.74Å; I397-L402 HydrophobicContact CG2-CD2 4.41Å; I397-L402 HydrophobicContact CG2-CG 4.41Å; I397-I431 HydrophobicContact CD1-CB 3.58Å; I397-I431 HydrophobicContact CD1-CD1 3.99Å; I397-I431 HydrophobicContact CD1-CG1 4.4Å; I397-I431 HydrophobicContact CD1-CG2 3.64Å; I397-L432 HydrophobicContact CD1-CD2 4.41Å; I397-L432 HydrophobicContact CD1-CG 4.22Å
398	P	73.6	Confident	76	Confident	24 Å²	24	41.7 Å²	41.7	16%	0.156	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-49.1	136.6	175.9	-29.4	33.4	0	0	0	112.7	S400 I401 L402 L440 Y459	P398-S400 PolarHBondContact O-N 3.21Å; P398-S400 VanDerWaalsContact O-N 3.14Å; P398-I401 HydrophobicContact CB-CD1 4.3Å; P398-I401 HydrophobicContact CB-CG1 4.25Å; P398-I401 HydrophobicContact CG-CD1 4.09Å; P398-I401 WeakPolarHBondContact O-CB 3.47Å; P398-I401 PolarHBondContact O-N 3.33Å; P398-L402 PolarHBondContact O-N 3.09Å; P398-L440 HydrophobicContact CG-CD2 4.23Å; P398-Y459 WeakPolarHBondContact CD-OH 3.35Å; P398-Y459 HydrophobicContact CG-CE1 4.49Å; P398-Y459 VanDerWaalsContact CG-OH 3.32Å; P398-Y459 WeakPolarHBondContact CG-OH 3.27Å
399	I	71.3	Confident	74.7	Confident	120 Å²	120	44.8 Å²	44.8	62%	0.615	23%	0.232	S	C	*	.	H	α-helix	trans	-57.5	-32.9	-177.1	-63.9	162.4	0	0	0	111.5	I397 L402 K403	I397-I399 PolarHBondContact O-N 3.36Å; I399-L402 WeakPolarHBondContact O-CB 2.99Å; I399-L402 PolarHBondContact O-N 2.97Å; I399-K403 HydrophobicContact CG2-CD 4.24Å; I399-K403 HydrophobicContact CG2-CG 4.31Å; I399-K403 WeakPolarHBondContact O-CG 3.33Å; I399-K403 PolarHBondContact O-N 2.82Å
400	S	65.8	Low	73.3	Confident	15 Å²	15	50 Å²	50	11%	0.105	27%	0.269	C	S	.	.	H	α-helix	trans	-59.2	-44.6	175	48.3	0	0	0	0	112.8	P398 L402 K403 V404 I557	P398-S400 PolarHBondContact O-N 3.21Å; P398-S400 VanDerWaalsContact O-N 3.14Å; S400-L402 VanDerWaalsContact C-N 3.32Å; S400-L402 PolarHBondContact O-N 2.87Å; S400-K403 PolarHBondContact O-N 3.39Å; S400-V404 WeakPolarHBondContact O-CG2 3.35Å; S400-V404 PolarHBondContact O-N 2.74Å; S400-I557 VanDerWaalsContact CB-CG1 3.49Å; S400-I557 WeakPolarHBondContact OG-CD1 3.32Å; S400-I557 WeakPolarHBondContact OG-CG2 3.4Å
401	I	73.4	Confident	72	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.01	29%	0.286	C	S	.	.	H	α-helix	trans	-62.5	-43.7	175.5	-61.1	-179.7	0	0	0	109.5	I397 P398 K403 V404 Y405 L438 L440 Y459 I520	I397-I401 HydrophobicContact CG2-CB 3.76Å; I397-I401 HydrophobicContact CG2-CD1 4.19Å; I397-I401 HydrophobicContact CG2-CG2 3.74Å; P398-I401 HydrophobicContact CB-CD1 4.3Å; P398-I401 HydrophobicContact CB-CG1 4.25Å; P398-I401 HydrophobicContact CG-CD1 4.09Å; P398-I401 WeakPolarHBondContact O-CB 3.47Å; P398-I401 PolarHBondContact O-N 3.33Å; I401-K403 VanDerWaalsContact C-N 3.34Å; I401-K403 PolarHBondContact O-N 3.28Å; I401-V404 PolarHBondContact O-N 2.89Å; I401-Y405 WeakPolarHBondContact O-CB 3.1Å; I401-Y405 PolarHBondContact O-N 2.63Å; I401-L438 HydrophobicContact CG2-CD1 4.48Å; I401-L438 HydrophobicContact CG2-CD2 3.46Å; I401-L438 VanDerWaalsContact CG2-CD2 3.46Å; I401-L438 HydrophobicContact CG2-CG 4.13Å; I401-L440 HydrophobicContact CD1-CB 4.19Å; I401-Y459 HydrophobicContact CD1-CD2 3.67Å; I401-Y459 HydrophobicContact CD1-CE2 3.47Å; I401-Y459 VanDerWaalsContact CD1-CE2 3.47Å; I401-Y459 HydrophobicContact CD1-CG 4.34Å; I401-I520 HydrophobicContact CB-CD1 4.47Å; I401-I520 HydrophobicContact CG1-CD1 3.99Å; I401-I520 HydrophobicContact CG1-CG1 4.15Å
402	L	73	Confident	70.9	Confident	23 Å²	23	52.4 Å²	52.4	12%	0.12	28%	0.284	C	S	.	.	H	α-helix	trans	-60.9	-41.3	175.9	-64.5	174.4	0	0	0	112.4	I397 P398 I399 S400 K406 I431	I397-L402 HydrophobicContact CG2-CD2 4.41Å; I397-L402 HydrophobicContact CG2-CG 4.41Å; P398-L402 PolarHBondContact O-N 3.09Å; I399-L402 WeakPolarHBondContact O-CB 2.99Å; I399-L402 PolarHBondContact O-N 2.97Å; S400-L402 VanDerWaalsContact C-N 3.32Å; S400-L402 PolarHBondContact O-N 2.87Å; L402-K406 VanDerWaalsContact O-CB 3.29Å; L402-K406 WeakPolarHBondContact O-CB 3.18Å; L402-K406 VanDerWaalsContact O-CG 3.23Å; L402-K406 WeakPolarHBondContact O-CG 3.34Å; L402-K406 PolarHBondContact O-N 3.44Å; L402-I431 HydrophobicContact CD2-CD1 3.42Å; L402-I431 VanDerWaalsContact CD2-CD1 3.42Å
403	K	71.9	Confident	69.4	Low	128 Å²	128	56.3 Å²	56.3	56%	0.557	31%	0.309	S	S	*	.	H	α-helix	trans	-63.4	-51.7	177.9	-75.9	176.1	178	178	0	111.3	I399 S400 I401 Y405 K406 S407	I399-K403 HydrophobicContact CG2-CD 4.24Å; I399-K403 HydrophobicContact CG2-CG 4.31Å; I399-K403 WeakPolarHBondContact O-CG 3.33Å; I399-K403 PolarHBondContact O-N 2.82Å; S400-K403 PolarHBondContact O-N 3.39Å; I401-K403 VanDerWaalsContact C-N 3.34Å; I401-K403 PolarHBondContact O-N 3.28Å; K403-Y405 VanDerWaalsContact C-N 3.32Å; K403-Y405 PolarHBondContact O-N 2.8Å; K403-K406 PolarHBondContact O-N 3.38Å; K403-S407 PolarHBondContact O-N 3Å; K403-S407 PolarHBondContact O-OG 3.22Å
404	V	72.1	Confident	68.1	Low	5 Å²	5	59 Å²	59	3%	0.03	32%	0.32	C	S	.	.	H	α-helix	trans	-64	-40.6	179.1	174.1	0	0	0	0	110.9	S400 I401 S407 L408 W472 I520 P555	S400-V404 WeakPolarHBondContact O-CG2 3.35Å; S400-V404 PolarHBondContact O-N 2.74Å; I401-V404 PolarHBondContact O-N 2.89Å; V404-S407 PolarHBondContact O-N 3.09Å; V404-L408 HydrophobicContact CG1-CD1 3.88Å; V404-L408 PolarHBondContact O-N 3.34Å; V404-W472 HydrophobicContact CG1-CB 3.9Å; V404-W472 HydrophobicContact CG1-CE3 4.48Å; V404-I520 HydrophobicContact CB-CD1 3.93Å; V404-I520 HydrophobicContact CG1-CD1 4.42Å; V404-I520 HydrophobicContact CG2-CD1 3.7Å; V404-P555 HydrophobicContact CG2-CG 4.26Å
405	Y	70.7	Confident	67	Low	11 Å²	11	56.7 Å²	56.7	4%	0.043	32%	0.316	C	S	.	.	H	α-helix	trans	-62.4	-44.2	175.7	-173.3	-105.2	0	0	0	112.5	I401 K403 S407 L408 K409 L412 L418 I431 F436 W472	I401-Y405 WeakPolarHBondContact O-CB 3.1Å; I401-Y405 PolarHBondContact O-N 2.63Å; K403-Y405 VanDerWaalsContact C-N 3.32Å; K403-Y405 PolarHBondContact O-N 2.8Å; Y405-S407 VanDerWaalsContact C-N 3.32Å; Y405-S407 PolarHBondContact O-N 3.15Å; Y405-L408 PolarHBondContact O-N 3.01Å; Y405-K409 PolarHBondContact O-N 2.66Å; Y405-L412 HydrophobicContact CD2-CD1 4.15Å; Y405-L412 HydrophobicContact CE2-CD1 3.43Å; Y405-L412 VanDerWaalsContact CE2-CD1 3.43Å; Y405-L418 HydrophobicContact CE1-CD2 4.38Å; Y405-L418 VanDerWaalsContact OH-CD2 3.24Å; Y405-L418 WeakPolarHBondContact OH-CD2 3.06Å; Y405-I431 HydrophobicContact CD1-CD1 3.81Å; Y405-I431 HydrophobicContact CD1-CG1 3.93Å; Y405-I431 HydrophobicContact CE1-CD1 4.16Å; Y405-I431 HydrophobicContact CE1-CG1 3.79Å; Y405-I431 HydrophobicContact CG-CD1 4.2Å; Y405-I431 HydrophobicContact CG-CG1 4.35Å; Y405-F436 HydrophobicContact CD2-CZ 4.37Å; Y405-F436 HydrophobicContact CE2-CE1 4.32Å; Y405-F436 HydrophobicContact CE2-CE2 4.48Å; Y405-F436 AromaticContact CE2-CZ 3.59Å; Y405-F436 HydrophobicContact CE2-CZ 3.59Å; Y405-W472 HydrophobicContact CD2-CZ3 4.4Å
406	K	72	Confident	65.7	Low	111 Å²	111	59.6 Å²	59.6	48%	0.483	34%	0.336	S	S	.	.	H	α-helix	trans	-60.1	-41.7	174.9	-78.6	178.5	178.7	-172.1	0	111	L402 K403 K409 D424	L402-K406 VanDerWaalsContact O-CB 3.29Å; L402-K406 WeakPolarHBondContact O-CB 3.18Å; L402-K406 VanDerWaalsContact O-CG 3.23Å; L402-K406 WeakPolarHBondContact O-CG 3.34Å; L402-K406 PolarHBondContact O-N 3.44Å; K403-K406 PolarHBondContact O-N 3.38Å; K406-K409 WeakPolarHBondContact O-CB 3.39Å; K406-D424 IonicContact NZ-OD1 3.02Å; K406-D424 PolarHBondContact NZ-OD1 2.85Å
407	S	69.2	Low	64.5	Low	71 Å²	71	60 Å²	60	50%	0.497	34%	0.338	S	S	.	.	H	α-helix	trans	-66.7	-34.8	177.8	-62.4	0	0	0	0	113.7	K403 V404 Y405	K403-S407 PolarHBondContact O-N 3Å; K403-S407 PolarHBondContact O-OG 3.22Å; V404-S407 PolarHBondContact O-N 3.09Å; Y405-S407 VanDerWaalsContact C-N 3.32Å; Y405-S407 PolarHBondContact O-N 3.15Å
408	L	70.4	Confident	63.1	Low	10 Å²	10	60.6 Å²	60.6	5%	0.052	34%	0.341	C	S	.	.	H	α-helix	trans	-93.3	-0.8	-178.1	-66.4	173.8	0	0	0	114	V404 Y405 S410 T411 L412 W472 I478 L525	V404-L408 HydrophobicContact CG1-CD1 3.88Å; V404-L408 PolarHBondContact O-N 3.34Å; Y405-L408 PolarHBondContact O-N 3.01Å; L408-S410 PolarHBondContact O-N 3.09Å; L408-T411 PolarHBondContact O-N 2.63Å; L408-T411 PolarHBondContact O-OG1 3.01Å; L408-L412 PolarHBondContact O-N 3.37Å; L408-W472 HydrophobicContact CD1-CB 3.74Å; L408-W472 HydrophobicContact CD1-CD2 3.53Å; L408-W472 HydrophobicContact CD1-CE3 3.66Å; L408-W472 HydrophobicContact CD1-CG 3.61Å; L408-W472 HydrophobicContact CD1-CZ3 4.44Å; L408-I478 HydrophobicContact CD2-CD1 4.4Å; L408-L525 HydrophobicContact CD1-CD1 4.41Å; L408-L525 HydrophobicContact CD2-CD1 4.11Å
409	K	65.3	Low	61.4	Low	79 Å²	79	66.6 Å²	66.6	34%	0.343	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-32.7	-174.2	-167.7	175.1	179.8	176	0	113.8	Y405 K406 L418	Y405-K409 PolarHBondContact O-N 2.66Å; K406-K409 WeakPolarHBondContact O-CB 3.39Å; K409-L418 HydrophobicContact CG-CD1 4.18Å
410	S	59.6	Low	59.8	Low	113 Å²	113	70.4 Å²	70.4	79%	0.79	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-18.9	-178.8	61	0	0	0	0	114.4	L408	L408-S410 PolarHBondContact O-N 3.09Å
411	T	62.7	Low	58.4	Low	67 Å²	67	70.7 Å²	70.7	41%	0.411	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	-7.7	-172.2	-17.2	0	0	0	0	113	L408	L408-T411 PolarHBondContact O-N 2.63Å; L408-T411 PolarHBondContact O-OG1 3.01Å
412	L	63.8	Low	56.6	Low	10 Å²	10	76.3 Å²	76.3	5%	0.052	43%	0.426	C	S	.	.	S	Bend	trans	-68.2	145.1	-176.7	-73.2	162.5	0	0	0	112.1	Y405 L408 N414 L418 F436 W472 L525	Y405-L412 HydrophobicContact CD2-CD1 4.15Å; Y405-L412 HydrophobicContact CE2-CD1 3.43Å; Y405-L412 VanDerWaalsContact CE2-CD1 3.43Å; L408-L412 PolarHBondContact O-N 3.37Å; L412-N414 PolarHBondContact O-N 3.2Å; L412-L418 HydrophobicContact CD1-CD1 4.46Å; L412-F436 HydrophobicContact CD2-CZ 4.48Å; L412-W472 HydrophobicContact CD2-CH2 3.45Å; L412-W472 VanDerWaalsContact CD2-CH2 3.45Å; L412-W472 HydrophobicContact CD2-CZ2 3.9Å; L412-W472 HydrophobicContact CD2-CZ3 4.35Å; L412-L525 HydrophobicContact CD2-CD2 4.14Å
413	P	55	Low	55.1	Low	86 Å²	86	76.9 Å²	76.9	56%	0.558	44%	0.437	S	S	*	.	S	Bend	trans	-62.3	-16.6	-170.8	14.2	-24.2	0	0	0	115.8
414	N	53.2	Low	54	Low	108 Å²	108	76 Å²	76	58%	0.578	44%	0.439	S	S	*	.			trans	-142.3	90.2	175.6	-77.7	-29.6	0	0	0	111.5	L412 S416	L412-N414 PolarHBondContact O-N 3.2Å; N414-S416 PolarHBondContact O-N 2.82Å
415	P	51	Low	52.9	Low	75 Å²	75	82.9 Å²	82.9	49%	0.487	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-72	-15.3	174.2	27.6	-32.4	0	0	0	113	D417 L418	P415-D417 VanDerWaalsContact C-N 3.34Å; P415-D417 PolarHBondContact O-N 2.7Å; P415-L418 WeakPolarHBondContact O-CB 3.36Å; P415-L418 PolarHBondContact O-N 3.48Å; P415-L418 VanDerWaalsContact O-N 3.14Å
416	S	44.5	Very low	52.1	Low	78 Å²	78	85.4 Å²	85.4	55%	0.545	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-67.6	-28.1	-173.3	48.4	0	0	0	0	114.4	N414 L418	N414-S416 PolarHBondContact O-N 2.82Å; S416-L418 PolarHBondContact O-N 3.2Å
417	D	43.2	Very low	51.2	Low	118 Å²	118	81.2 Å²	81.2	63%	0.631	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-76.8	-14.5	176.5	-67.5	-19.5	0	0	0	112.2	P415	P415-D417 VanDerWaalsContact C-N 3.34Å; P415-D417 PolarHBondContact O-N 2.7Å
418	L	44.2	Very low	50.7	Low	18 Å²	18	80.3 Å²	80.3	9%	0.094	46%	0.459	C	S	.	.	G	3₁₀ helix	trans	-92.9	-7.4	-175.5	-68.2	162.3	0	0	0	114.2	Y405 K409 L412 P415 S416 K420	Y405-L418 HydrophobicContact CE1-CD2 4.38Å; Y405-L418 VanDerWaalsContact OH-CD2 3.24Å; Y405-L418 WeakPolarHBondContact OH-CD2 3.06Å; K409-L418 HydrophobicContact CG-CD1 4.18Å; L412-L418 HydrophobicContact CD1-CD1 4.46Å; P415-L418 WeakPolarHBondContact O-CB 3.36Å; P415-L418 PolarHBondContact O-N 3.48Å; P415-L418 VanDerWaalsContact O-N 3.14Å; S416-L418 PolarHBondContact O-N 3.2Å; L418-K420 VanDerWaalsContact C-N 3.27Å; L418-K420 PolarHBondContact O-N 3Å
419	L	37.8	Very low	50.1	Low	150 Å²	150	89.2 Å²	89.2	79%	0.785	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	1.6	-173	-86.2	160.4	0	0	0	115
420	K	37.7	Very low	49.7	Very low	200 Å²	200	87.8 Å²	87.8	87%	0.87	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	2.6	179.7	-69.7	-174.4	180	177.9	0	115.5	L418	L418-K420 VanDerWaalsContact C-N 3.27Å; L418-K420 PolarHBondContact O-N 3Å
421	A	36.7	Very low	49.8	Very low	22 Å²	22	82.4 Å²	82.4	18%	0.182	45%	0.451	C	S	.	.			trans	-110.5	95.9	-172.2	0	0	0	0	0	112.6	D426 N430	A421-D426 HydrophobicContact CB-CB 3.55Å; A421-N430 WeakPolarHBondContact CB-ND2 3.43Å
422	S	35.1	Very low	49.7	Very low	120 Å²	120	81.2 Å²	81.2	84%	0.839	44%	0.441	S	S	*	.			trans	-103.2	71.7	169.7	54.5	0	0	0	0	109.1
423	G	41.4	Very low	49.6	Very low	34 Å²	34	84.4 Å²	84.4	35%	0.351	47%	0.465	S	S	.	.	S	Bend	trans	175.6	142.3	175.4	0	0	0	0	0	111.8	L425 D426	G423-L425 VanDerWaalsContact C-N 3.26Å; G423-L425 PolarHBondContact O-N 3.09Å; G423-D426 WeakPolarHBondContact O-CB 3.43Å; G423-D426 PolarHBondContact O-N 3.29Å; G423-D426 VanDerWaalsContact O-N 3.16Å
424	D	49.4	Very low	50.1	Low	111 Å²	111	81.1 Å²	81.1	59%	0.594	44%	0.444	S	S	*	.	H	α-helix	trans	-64.7	-30.6	178.4	-87.2	-48.2	0	0	0	112.7	K406 D426 N427	K406-D424 IonicContact NZ-OD1 3.02Å; K406-D424 PolarHBondContact NZ-OD1 2.85Å; D424-D426 VanDerWaalsContact C-N 3.32Å; D424-D426 PolarHBondContact O-N 2.87Å; D424-N427 WeakPolarHBondContact O-CB 3.47Å; D424-N427 PolarHBondContact O-N 2.67Å
425	L	48.1	Very low	51	Low	149 Å²	149	83.4 Å²	83.4	78%	0.78	46%	0.456	S	S	*	.	H	α-helix	trans	-65.1	-32.4	173	-80.1	146.4	0	0	0	113	G423 N427 H428	G423-L425 VanDerWaalsContact C-N 3.26Å; G423-L425 PolarHBondContact O-N 3.09Å; L425-N427 VanDerWaalsContact C-N 3.27Å; L425-N427 PolarHBondContact O-N 2.81Å; L425-H428 PolarHBondContact O-N 2.91Å
426	D	52.8	Low	52.3	Low	64 Å²	64	81.5 Å²	81.5	34%	0.342	44%	0.44	S	S	.	.	H	α-helix	trans	-71.4	-26	-179.9	-66.3	-24.3	0	0	0	111.6	A421 G423 D424 H428 N430	A421-D426 HydrophobicContact CB-CB 3.55Å; G423-D426 WeakPolarHBondContact O-CB 3.43Å; G423-D426 PolarHBondContact O-N 3.29Å; G423-D426 VanDerWaalsContact O-N 3.16Å; D424-D426 VanDerWaalsContact C-N 3.32Å; D424-D426 PolarHBondContact O-N 2.87Å; D426-H428 VanDerWaalsContact C-N 3.34Å; D426-H428 PolarHBondContact O-N 3.28Å; D426-N430 WeakPolarHBondContact O-CB 3.47Å; D426-N430 PolarHBondContact O-N 2.83Å; D426-N430 VanDerWaalsContact O-N 3.16Å; D426-N430 PolarHBondContact O-ND2 3.12Å
427	N	54.8	Low	54.2	Low	23 Å²	23	78.9 Å²	78.9	12%	0.123	42%	0.421	C	S	.	.	H	α-helix	trans	-64.8	-37.2	178.3	-68	-38.9	0	0	0	112	D424 L425 N430 I431	D424-N427 WeakPolarHBondContact O-CB 3.47Å; D424-N427 PolarHBondContact O-N 2.67Å; L425-N427 VanDerWaalsContact C-N 3.27Å; L425-N427 PolarHBondContact O-N 2.81Å; N427-N430 PolarHBondContact O-N 3.26Å; N427-I431 WeakPolarHBondContact O-CD1 3.29Å; N427-I431 VanDerWaalsContact O-CG1 3.28Å; N427-I431 WeakPolarHBondContact O-CG1 3.06Å; N427-I431 PolarHBondContact O-N 3.34Å; N427-I431 VanDerWaalsContact O-N 3.08Å
428	H	58.4	Low	56.4	Low	51 Å²	51	73.3 Å²	73.3	24%	0.236	39%	0.392	C	S	.	.	H	α-helix	trans	-63.2	-50.5	-179.5	-78.9	-84.9	0	0	0	112.4	L425 D426 N430 I431 L432	L425-H428 PolarHBondContact O-N 2.91Å; D426-H428 VanDerWaalsContact C-N 3.34Å; D426-H428 PolarHBondContact O-N 3.28Å; H428-N430 VanDerWaalsContact C-N 3.29Å; H428-N430 PolarHBondContact O-N 2.73Å; H428-I431 PolarHBondContact O-N 3.1Å; H428-L432 PolarHBondContact O-N 3Å
429	R	58.2	Low	58.6	Low	198 Å²	198	72.5 Å²	72.5	75%	0.747	39%	0.387	S	S	*	.	H	α-helix	trans	-64.7	-36.5	179.4	-71.5	-177.5	174.7	163.5	-0.8	111.8	L432 S433	R429-L432 PolarHBondContact O-N 3.4Å; R429-S433 WeakPolarHBondContact O-CB 3.42Å; R429-S433 PolarHBondContact O-N 3.36Å; R429-S433 PolarHBondContact O-OG 2.82Å; R429-S433 VanDerWaalsContact O-OG 3.07Å
430	N	56.4	Low	61.1	Low	48 Å²	48	65.3 Å²	65.3	26%	0.257	35%	0.35	S	S	.	.	H	α-helix	trans	-68.9	-31.2	178.6	-74	-23	0	0	0	113.8	A421 D426 N427 H428 S433 S434	A421-N430 WeakPolarHBondContact CB-ND2 3.43Å; D426-N430 WeakPolarHBondContact O-CB 3.47Å; D426-N430 PolarHBondContact O-N 2.83Å; D426-N430 VanDerWaalsContact O-N 3.16Å; D426-N430 PolarHBondContact O-ND2 3.12Å; N427-N430 PolarHBondContact O-N 3.26Å; H428-N430 VanDerWaalsContact C-N 3.29Å; H428-N430 PolarHBondContact O-N 2.73Å; N430-S433 WeakPolarHBondContact CA-OG 3.43Å; N430-S433 PolarHBondContact O-OG 2.91Å; N430-S434 PolarHBondContact O-N 3.34Å
431	I	61.1	Low	63.7	Low	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-72.1	-46.2	175.9	-67.3	162.2	0	0	0	109.6	I397 L402 Y405 N427 H428 S433 S434 L438 S460	I397-I431 HydrophobicContact CD1-CB 3.58Å; I397-I431 HydrophobicContact CD1-CD1 3.99Å; I397-I431 HydrophobicContact CD1-CG1 4.4Å; I397-I431 HydrophobicContact CD1-CG2 3.64Å; L402-I431 HydrophobicContact CD2-CD1 3.42Å; L402-I431 VanDerWaalsContact CD2-CD1 3.42Å; Y405-I431 HydrophobicContact CD1-CD1 3.81Å; Y405-I431 HydrophobicContact CD1-CG1 3.93Å; Y405-I431 HydrophobicContact CE1-CD1 4.16Å; Y405-I431 HydrophobicContact CE1-CG1 3.79Å; Y405-I431 HydrophobicContact CG-CD1 4.2Å; Y405-I431 HydrophobicContact CG-CG1 4.35Å; N427-I431 WeakPolarHBondContact O-CD1 3.29Å; N427-I431 VanDerWaalsContact O-CG1 3.28Å; N427-I431 WeakPolarHBondContact O-CG1 3.06Å; N427-I431 PolarHBondContact O-N 3.34Å; N427-I431 VanDerWaalsContact O-N 3.08Å; H428-I431 PolarHBondContact O-N 3.1Å; I431-S433 PolarHBondContact O-N 2.91Å; I431-S434 VanDerWaalsContact O-CB 3.25Å; I431-S434 WeakPolarHBondContact O-CB 3.17Å; I431-S434 PolarHBondContact O-N 3.37Å; I431-S434 PolarHBondContact O-OG 3.3Å; I431-L438 HydrophobicContact CG2-CD2 3.58Å; I431-S460 WeakPolarHBondContact O-CB 3.41Å
432	L	61.3	Low	66.3	Low	42 Å²	42	54.9 Å²	54.9	22%	0.22	30%	0.3	C	S	.	.	H	α-helix	trans	-61.3	-33.7	177.5	-66.4	173.8	0	0	0	112.5	I397 H428 R429 S434 Y459	I397-L432 HydrophobicContact CD1-CD2 4.41Å; I397-L432 HydrophobicContact CD1-CG 4.22Å; H428-L432 PolarHBondContact O-N 3Å; R429-L432 PolarHBondContact O-N 3.4Å; L432-S434 VanDerWaalsContact C-N 3.3Å; L432-Y459 WeakPolarHBondContact CD2-O 3.31Å
433	S	61.4	Low	68.8	Low	78 Å²	78	50.1 Å²	50.1	55%	0.545	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-1.3	175.8	67.4	0	0	0	0	114.1	R429 N430 I431	R429-S433 WeakPolarHBondContact O-CB 3.42Å; R429-S433 PolarHBondContact O-N 3.36Å; R429-S433 PolarHBondContact O-OG 2.82Å; R429-S433 VanDerWaalsContact O-OG 3.07Å; N430-S433 WeakPolarHBondContact CA-OG 3.43Å; N430-S433 PolarHBondContact O-OG 2.91Å; I431-S433 PolarHBondContact O-N 2.91Å
434	S	64.4	Low	71.1	Confident	16 Å²	16	48.7 Å²	48.7	11%	0.112	25%	0.248	C	C	.	.			trans	-70.5	135.9	-178.8	74.1	0	0	0	0	111.4	N430 I431 L432 F436 S460 G461	N430-S434 PolarHBondContact O-N 3.34Å; I431-S434 VanDerWaalsContact O-CB 3.25Å; I431-S434 WeakPolarHBondContact O-CB 3.17Å; I431-S434 PolarHBondContact O-N 3.37Å; I431-S434 PolarHBondContact O-OG 3.3Å; L432-S434 VanDerWaalsContact C-N 3.3Å; S434-F436 VanDerWaalsContact CB-CE1 3.42Å; S434-F436 PolarHBondContact O-N 3.13Å; S434-F436 WeakPolarHBondContact OG-CZ 3.43Å; S434-S460 VanDerWaalsContact OG-CB 3.22Å; S434-S460 WeakPolarHBondContact OG-CB 3.5Å; S434-S460 PolarHBondContact OG-OG 3.48Å; S434-G461 PolarHBondContact O-N 3.02Å
435	N	72.3	Confident	72.8	Confident	156 Å²	156	44.8 Å²	44.8	83%	0.834	23%	0.229	S	C	*	.	S	Bend	trans	-77.2	-2.2	-177	-74.9	-29.4	0	0	0	113.9
436	F	79.1	Confident	74.3	Confident	36 Å²	36	41.2 Å²	41.2	16%	0.158	21%	0.207	C	C	.	.	S	Bend	trans	-103.5	148.5	-179	65.6	-97.6	0	0	0	111.6	Y405 L412 S434 L438 S460 G461 W472 P523	Y405-F436 HydrophobicContact CD2-CZ 4.37Å; Y405-F436 HydrophobicContact CE2-CE1 4.32Å; Y405-F436 HydrophobicContact CE2-CE2 4.48Å; Y405-F436 AromaticContact CE2-CZ 3.59Å; Y405-F436 HydrophobicContact CE2-CZ 3.59Å; L412-F436 HydrophobicContact CD2-CZ 4.48Å; S434-F436 VanDerWaalsContact CB-CE1 3.42Å; S434-F436 PolarHBondContact O-N 3.13Å; S434-F436 WeakPolarHBondContact OG-CZ 3.43Å; F436-L438 HydrophobicContact CE2-CB 4.16Å; F436-L438 PolarHBondContact O-N 3.18Å; F436-S460 CarbonylContact O-C 3.52Å; F436-S460 PolarHBondContact O-OG 2.88Å; F436-G461 WeakPolarHBondContact O-CA 3.48Å; F436-G461 PolarHBondContact O-N 2.95Å; F436-W472 HydrophobicContact CD2-CH2 4.22Å; F436-W472 AromaticContact CE2-CH2 3.81Å; F436-W472 HydrophobicContact CE2-CH2 3.81Å; F436-W472 HydrophobicContact CE2-CZ3 4.3Å; F436-W472 HydrophobicContact CZ-CH2 4.48Å; F436-P523 HydrophobicContact CB-CG 3.91Å; F436-P523 HydrophobicContact CD2-CG 3.97Å; F436-P523 HydrophobicContact CG-CG 4.11Å
437	P	85.2	Confident	75.6	Confident	23 Å²	23	39.9 Å²	39.9	15%	0.149	20%	0.2	C	C	.	.			trans	-69.7	122.9	-179.4	27.9	-33.5	0	0	0	110.8	L458 S460 I463 G522 P523	P437-L458 HydrophobicContact CB-CD1 4.24Å; P437-S460 VanDerWaalsContact CA-O 3.24Å; P437-S460 WeakPolarHBondContact CA-O 3.29Å; P437-I463 HydrophobicContact CB-CD1 4.08Å; P437-I463 HydrophobicContact CG-CD1 4.33Å; P437-G522 WeakPolarHBondContact O-CA 3.25Å; P437-P523 WeakPolarHBondContact O-CD 3.29Å
438	L	88.3	Confident	76.5	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	122	171.7	-172.8	63.5	0	0	0	109.3	I401 I431 F436 Y459 S460 W472 I520	I401-L438 HydrophobicContact CG2-CD1 4.48Å; I401-L438 HydrophobicContact CG2-CD2 3.46Å; I401-L438 VanDerWaalsContact CG2-CD2 3.46Å; I401-L438 HydrophobicContact CG2-CG 4.13Å; I431-L438 HydrophobicContact CG2-CD2 3.58Å; F436-L438 HydrophobicContact CE2-CB 4.16Å; F436-L438 PolarHBondContact O-N 3.18Å; L438-Y459 PolarHBondContact O-N 2.96Å; L438-S460 WeakPolarHBondContact CB-OG 3.45Å; L438-S460 PolarHBondContact N-O 3.09Å; L438-S460 VanDerWaalsContact N-O 3.11Å; L438-S460 PolarHBondContact N-OG 3.3Å; L438-W472 HydrophobicContact CD1-CE3 3.99Å; L438-W472 HydrophobicContact CD1-CZ3 3.72Å; L438-I520 HydrophobicContact CD1-CG2 3.81Å
439	M	90.5	Very high	77.4	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	142.6	-171.2	-64	175	-66.6	0	0	111.5	V456 R457 L458 I463 I469 L509 I520 L521	M439-V456 HydrophobicContact CB-CB 4.19Å; M439-V456 HydrophobicContact CB-CG2 4.42Å; M439-V456 HydrophobicContact CG-CG2 4.37Å; M439-V456 HydrophobicContact SD-CG2 3.88Å; M439-R457 VanDerWaalsContact CA-O 3.27Å; M439-R457 WeakPolarHBondContact CA-O 3.35Å; M439-L458 HydrophobicContact CG-CB 4.31Å; M439-L458 HydrophobicContact CG-CD1 3.31Å; M439-L458 HydrophobicContact CG-CG 4.4Å; M439-L458 HydrophobicContact SD-CD1 3.95Å; M439-I463 HydrophobicContact CE-CD1 4.03Å; M439-I463 HydrophobicContact SD-CD1 4.36Å; M439-I463 HydrophobicContact SD-CG1 4.4Å; M439-I469 HydrophobicContact CE-CD1 4.28Å; M439-I469 HydrophobicContact CE-CG2 3.96Å; M439-L509 HydrophobicContact CE-CD1 4.16Å; M439-L509 HydrophobicContact SD-CD1 3.95Å; M439-I520 WeakPolarHBondContact O-CA 3.43Å; M439-L521 HydrophobicContact CB-CB 4.26Å; M439-L521 HydrophobicContact CE-CB 4.02Å; M439-L521 HydrophobicContact CE-CD1 4.5Å; M439-L521 PolarHBondContact N-O 3.22Å; M439-L521 PolarHBondContact O-N 3.31Å
440	L	91.4	Very high	78.4	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	124.9	169	176.1	57.6	0	0	0	109.5	V144 P398 I401 V456 R457 Y459 I520 I557	V144-L440 HydrophobicContact CG1-CD2 3.94Å; V144-L440 HydrophobicContact CG1-CG 4.29Å; P398-L440 HydrophobicContact CG-CD2 4.23Å; I401-L440 HydrophobicContact CD1-CB 4.19Å; L440-V456 CarbonylContact O-C 3.54Å; L440-V456 WeakPolarHBondContact O-CA 3.48Å; L440-R457 PolarHBondContact N-O 2.93Å; L440-R457 PolarHBondContact O-N 3.4Å; L440-Y459 HydrophobicContact CB-CD2 4.46Å; L440-Y459 HydrophobicContact CB-CE2 3.7Å; L440-Y459 HydrophobicContact CD2-CE2 4.46Å; L440-I520 HydrophobicContact CD1-CG1 4.37Å; L440-I557 HydrophobicContact CD1-CD1 3.29Å; L440-I557 HydrophobicContact CD1-CG2 4.38Å
441	V	91.7	Very high	79.6	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	117	171	-177.9	0	0	0	0	108.5	I444 T454 V456 T515 G518 D519 L521	V441-I444 HydrophobicContact CG1-CG1 4.18Å; V441-T454 HydrophobicContact CB-CG2 4.19Å; V441-T454 HydrophobicContact CG1-CG2 3.39Å; V441-T454 HydrophobicContact CG2-CG2 3.75Å; V441-V456 HydrophobicContact CB-CG1 4.41Å; V441-V456 HydrophobicContact CG2-CG1 3.79Å; V441-T515 HydrophobicContact CB-CG2 4.33Å; V441-T515 HydrophobicContact CG1-CG2 4.2Å; V441-T515 HydrophobicContact CG2-CG2 3.59Å; V441-G518 VanDerWaalsContact O-CA 3.25Å; V441-G518 WeakPolarHBondContact O-CA 3.21Å; V441-G518 PolarHBondContact O-N 3.27Å; V441-D519 WeakPolarHBondContact CB-O 3.42Å; V441-D519 WeakPolarHBondContact CG2-O 3.41Å; V441-D519 PolarHBondContact N-O 3.01Å; V441-L521 HydrophobicContact CG2-CD1 3.42Å; V441-L521 VanDerWaalsContact CG2-CD1 3.42Å; V441-L521 HydrophobicContact CG2-CD2 4.44Å; V441-L521 HydrophobicContact CG2-CG 3.72Å
442	F	90.3	Very high	80.9	Confident	3 Å²	3	45.4 Å²	45.4	1%	0.013	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	-16	177.5	71.2	-82.9	0	0	0	112.9	L126 R140 V144 L455 I506 T517	L126-F442 HydrophobicContact CD1-CE2 4.33Å; R140-F442 WeakPolarHBondContact CD-O 3.18Å; V144-F442 HydrophobicContact CB-CB 4.5Å; V144-F442 HydrophobicContact CB-CD1 4.21Å; V144-F442 HydrophobicContact CB-CG 4.29Å; V144-F442 HydrophobicContact CG1-CB 3.54Å; V144-F442 HydrophobicContact CG1-CD1 3.63Å; V144-F442 HydrophobicContact CG1-CE1 4.48Å; V144-F442 HydrophobicContact CG1-CG 3.7Å; V144-F442 HydrophobicContact CG2-CB 4.17Å; V144-F442 HydrophobicContact CG2-CD1 3.91Å; V144-F442 HydrophobicContact CG2-CD2 3.81Å; V144-F442 HydrophobicContact CG2-CE1 4.19Å; V144-F442 HydrophobicContact CG2-CE2 4.12Å; V144-F442 HydrophobicContact CG2-CG 3.69Å; V144-F442 HydrophobicContact CG2-CZ 4.29Å; F442-L455 HydrophobicContact CD1-CB 4.35Å; F442-L455 WeakPolarHBondContact CD1-O 3.3Å; F442-L455 HydrophobicContact CE1-CB 3.69Å; F442-L455 HydrophobicContact CE2-CB 4.3Å; F442-L455 HydrophobicContact CE2-CD2 4.34Å; F442-L455 HydrophobicContact CZ-CB 3.67Å; F442-L455 HydrophobicContact CZ-CD2 3.98Å; F442-L455 HydrophobicContact CZ-CG 4.43Å; F442-L455 PolarHBondContact N-O 2.9Å; F442-I506 HydrophobicContact CE1-CG2 3.87Å; F442-I506 HydrophobicContact CZ-CG2 3.84Å; F442-T517 WeakPolarHBondContact O-CG2 3.21Å
443	R	89.1	Confident	82.3	Confident	19 Å²	19	43.9 Å²	43.9	7%	0.072	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	149.2	177.8	176.3	164.5	163.1	-169.4	-21.7	112.9	Y98 T111 E137 C445 L455	Y98-R443 PolarHBondContact OH-NH2 2.78Å; T111-R443 VanDerWaalsContact N-NH1 3.2Å; T111-R443 PolarHBondContact O-NH1 3.27Å; E137-R443 IonicContact OE1-CZ 3.14Å; E137-R443 IonicContact OE1-NE 3.53Å; E137-R443 IonicContact OE1-NH1 3.71Å; E137-R443 PolarHBondContact OE1-NH1 3.3Å; R443-C445 PolarHBondContact NE-SG 2.88Å; R443-C445 PolarHBondContact NH2-SG 3.26Å; R443-L455 HydrophobicContact CB-CB 4.17Å; R443-L455 PolarHBondContact O-N 3.5Å
444	I	89.1	Confident	83.7	Confident	5 Å²	5	40.2 Å²	40.2	3%	0.026	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	133.9	169.6	-60	173.9	0	0	0	107.6	V441 P452 L453 T454 T515 R589 E590	V441-I444 HydrophobicContact CG1-CG1 4.18Å; I444-P452 HydrophobicContact CG2-CB 4.33Å; I444-L453 CarbonylContact C-O 3.6Å; I444-L453 WeakPolarHBondContact CA-O 3.45Å; I444-T454 HydrophobicContact CG1-CG2 4.24Å; I444-T515 WeakPolarHBondContact CD1-O 3.31Å; I444-R589 HydrophobicContact CD1-CG 4.16Å; I444-E590 HydrophobicContact CB-CG 4.33Å; I444-E590 HydrophobicContact CG2-CG 4.21Å; I444-E590 WeakPolarHBondContact O-CG 3.43Å
445	C	84.9	Confident	85.1	Confident	28 Å²	28	39.8 Å²	39.8	19%	0.189	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	133.6	175.4	-59	0	0	0	0	109	R443 L453 L455	R443-C445 PolarHBondContact NE-SG 2.88Å; R443-C445 PolarHBondContact NH2-SG 3.26Å; C445-L453 HydrophobicContact CB-CB 4.49Å; C445-L453 PolarHBondContact N-O 3.08Å; C445-L453 PolarHBondContact O-N 3.14Å; C445-L455 HydrophobicContact CB-CD1 4.46Å
446	F	80.6	Confident	86.1	Confident	74 Å²	74	32.4 Å²	32.4	33%	0.325	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	117.8	169.7	-170.1	-99.1	0	0	0	111.7	E590	F446-E590 WeakPolarHBondContact CB-OE1 3.39Å; F446-E590 PolarHBondContact N-OE1 2.87Å
447	D	78.6	Confident	86.7	Confident	36 Å²	36	30.9 Å²	30.9	19%	0.193	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	123.4	168	177.8	-13	0	0	0	108.8	H449 R450 G451 L453	D447-H449 PolarHBondContact O-N 3.41Å; D447-H449 PolarHBondContact OD1-N 3.08Å; D447-R450 HydrophobicContact CB-CB 4.1Å; D447-R450 PolarHBondContact O-N 3.42Å; D447-R450 VanDerWaalsContact OD2-CD 3.26Å; D447-R450 WeakPolarHBondContact OD2-CD 3.49Å; D447-R450 VanDerWaalsContact OD2-CG 3.27Å; D447-R450 WeakPolarHBondContact OD2-CG 3.27Å; D447-R450 IonicContact OD2-NE 3.96Å; D447-G451 PolarHBondContact N-O 2.88Å; D447-G451 WeakPolarHBondContact O-CA 3.2Å; D447-G451 PolarHBondContact O-N 3.17Å; D447-L453 HydrophobicContact CB-CD1 3.99Å; D447-L453 HydrophobicContact CB-CG 4.35Å
448	P	73.5	Confident	87	Confident	97 Å²	97	29.8 Å²	29.8	63%	0.63	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-28.5	177.8	-27.5	34.6	0	0	0	115.1
449	H	78.2	Confident	87	Confident	178 Å²	178	30 Å²	30	82%	0.824	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-31.9	-177.3	-68.5	-69.6	0	0	0	113.9	D447	D447-H449 PolarHBondContact O-N 3.41Å; D447-H449 PolarHBondContact OD1-N 3.08Å
450	R	79.9	Confident	86.7	Confident	117 Å²	117	30 Å²	30	44%	0.442	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-11	-174.4	-58.6	179.3	-171.7	-157.6	1.8	113.3	D447 L453 F488	D447-R450 HydrophobicContact CB-CB 4.1Å; D447-R450 PolarHBondContact O-N 3.42Å; D447-R450 VanDerWaalsContact OD2-CD 3.26Å; D447-R450 WeakPolarHBondContact OD2-CD 3.49Å; D447-R450 VanDerWaalsContact OD2-CG 3.27Å; D447-R450 WeakPolarHBondContact OD2-CG 3.27Å; D447-R450 IonicContact OD2-NE 3.96Å; R450-L453 HydrophobicContact CB-CD2 4.32Å; R450-F488 VanDerWaalsContact NH1-CZ 3.31Å
451	G	81.5	Confident	86.4	Confident	17 Å²	17	30.6 Å²	30.6	18%	0.175	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	77.5	-155.1	-170.8	0	0	0	0	0	111.6	D447 L453	D447-G451 PolarHBondContact N-O 2.88Å; D447-G451 WeakPolarHBondContact O-CA 3.2Å; D447-G451 PolarHBondContact O-N 3.17Å; G451-L453 PolarHBondContact O-N 2.66Å
452	P	86.8	Confident	86.2	Confident	28 Å²	28	34.7 Å²	34.7	18%	0.182	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	127	-178.1	28.2	-33.3	0	0	0	112	I444 L512	I444-P452 HydrophobicContact CG2-CB 4.33Å; P452-L512 WeakPolarHBondContact CG-O 3.38Å
453	L	90.6	Very high	86.1	Confident	10 Å²	10	34.6 Å²	34.6	5%	0.052	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	120.4	170.1	-61.5	176.8	0	0	0	108.7	I444 C445 D447 R450 G451 F488 L495 L509	I444-L453 CarbonylContact C-O 3.6Å; I444-L453 WeakPolarHBondContact CA-O 3.45Å; C445-L453 HydrophobicContact CB-CB 4.49Å; C445-L453 PolarHBondContact N-O 3.08Å; C445-L453 PolarHBondContact O-N 3.14Å; D447-L453 HydrophobicContact CB-CD1 3.99Å; D447-L453 HydrophobicContact CB-CG 4.35Å; R450-L453 HydrophobicContact CB-CD2 4.32Å; G451-L453 PolarHBondContact O-N 2.66Å; L453-F488 HydrophobicContact CD2-CD2 4.22Å; L453-F488 HydrophobicContact CD2-CE2 4.05Å; L453-L495 HydrophobicContact CD1-CD1 3.53Å; L453-L509 CarbonylContact C-O 3.59Å; L453-L509 WeakPolarHBondContact CA-O 3.35Å
454	T	92.4	Very high	86.2	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	111.5	179.8	-57.2	0	0	0	0	108.8	V441 I444 V456 A508 L509 L512 T515	V441-T454 HydrophobicContact CB-CG2 4.19Å; V441-T454 HydrophobicContact CG1-CG2 3.39Å; V441-T454 HydrophobicContact CG2-CG2 3.75Å; I444-T454 HydrophobicContact CG1-CG2 4.24Å; T454-V456 HydrophobicContact CG2-CG1 3.91Å; T454-A508 WeakPolarHBondContact O-CA 3.12Å; T454-L509 PolarHBondContact N-O 3.03Å; T454-L509 PolarHBondContact O-N 2.9Å; T454-L512 HydrophobicContact CG2-CD1 4.02Å; T454-T515 HydrophobicContact CG2-CG2 4.09Å
455	L	92.8	Very high	86.3	Confident	8 Å²	8	38.8 Å²	38.8	4%	0.042	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	126.5	176.6	-77.4	69.7	0	0	0	109.2	F442 R443 C445 L490 I507 A508	F442-L455 HydrophobicContact CD1-CB 4.35Å; F442-L455 WeakPolarHBondContact CD1-O 3.3Å; F442-L455 HydrophobicContact CE1-CB 3.69Å; F442-L455 HydrophobicContact CE2-CB 4.3Å; F442-L455 HydrophobicContact CE2-CD2 4.34Å; F442-L455 HydrophobicContact CZ-CB 3.67Å; F442-L455 HydrophobicContact CZ-CD2 3.98Å; F442-L455 HydrophobicContact CZ-CG 4.43Å; F442-L455 PolarHBondContact N-O 2.9Å; R443-L455 HydrophobicContact CB-CB 4.17Å; R443-L455 PolarHBondContact O-N 3.5Å; C445-L455 HydrophobicContact CB-CD1 4.46Å; L455-L490 HydrophobicContact CD2-CD1 3.62Å; L455-L490 HydrophobicContact CD2-CD2 4.4Å; L455-L490 HydrophobicContact CG-CD1 3.83Å; L455-I507 WeakPolarHBondContact CA-O 3.39Å; L455-A508 HydrophobicContact CD1-CB 4.2Å; L455-A508 HydrophobicContact CG-CB 4.28Å
456	V	93.3	Very high	86.4	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	150.2	-175.5	-56.2	0	0	0	0	111.6	M439 L440 V441 T454 I507 L509 L521	M439-V456 HydrophobicContact CB-CB 4.19Å; M439-V456 HydrophobicContact CB-CG2 4.42Å; M439-V456 HydrophobicContact CG-CG2 4.37Å; M439-V456 HydrophobicContact SD-CG2 3.88Å; L440-V456 CarbonylContact O-C 3.54Å; L440-V456 WeakPolarHBondContact O-CA 3.48Å; V441-V456 HydrophobicContact CB-CG1 4.41Å; V441-V456 HydrophobicContact CG2-CG1 3.79Å; T454-V456 HydrophobicContact CG2-CG1 3.91Å; V456-I507 HydrophobicContact CG2-CD1 3.98Å; V456-I507 HydrophobicContact CG2-CG1 3.54Å; V456-I507 PolarHBondContact N-O 3.24Å; V456-I507 PolarHBondContact O-N 3.07Å; V456-L509 HydrophobicContact CG1-CD1 4.04Å; V456-L509 HydrophobicContact CG2-CD1 3.77Å; V456-L509 HydrophobicContact CG2-CG 3.92Å; V456-L521 HydrophobicContact CG1-CD1 4.25Å
457	R	92.5	Very high	86.8	Confident	5 Å²	5	36.9 Å²	36.9	2%	0.019	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	124.2	163.2	173.4	166.6	173.2	177.5	1.3	109.4	V144 L145 D146 M439 L440 Y459	V144-R457 HydrophobicContact CB-CB 3.96Å; V144-R457 HydrophobicContact CG1-CB 3.74Å; V144-R457 WeakPolarHBondContact O-CD 3.42Å; V144-R457 PolarHBondContact O-NH1 2.93Å; L145-R457 PolarHBondContact O-NH1 2.78Å; D146-R457 IonicContact OD1-CZ 2.87Å; D146-R457 IonicContact OD1-NH1 3.81Å; D146-R457 PolarHBondContact OD1-NH1 3.28Å; D146-R457 IonicContact OD1-NH2 2.78Å; D146-R457 PolarHBondContact OD1-NH2 2.98Å; D146-R457 IonicContact OD2-CZ 3.6Å; D146-R457 IonicContact OD2-NH1 2.76Å; D146-R457 IonicContact OD2-NH2 3Å; D146-R457 PolarHBondContact OD2-NH2 2.96Å; M439-R457 VanDerWaalsContact CA-O 3.27Å; M439-R457 WeakPolarHBondContact CA-O 3.35Å; L440-R457 PolarHBondContact N-O 2.93Å; L440-R457 PolarHBondContact O-N 3.4Å; R457-Y459 HydrophobicContact CB-CE2 4.19Å; R457-Y459 HydrophobicContact CG-CD2 4.25Å; R457-Y459 HydrophobicContact CG-CE1 4.49Å; R457-Y459 HydrophobicContact CG-CE2 3.82Å
458	L	90.9	Very high	87.3	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	119.7	176.1	-173.9	62	0	0	0	109.6	P437 M439 S460 I463 A501 G502 G504 S505	P437-L458 HydrophobicContact CB-CD1 4.24Å; M439-L458 HydrophobicContact CG-CB 4.31Å; M439-L458 HydrophobicContact CG-CD1 3.31Å; M439-L458 HydrophobicContact CG-CG 4.4Å; M439-L458 HydrophobicContact SD-CD1 3.95Å; L458-S460 WeakPolarHBondContact CD1-O 3.35Å; L458-I463 HydrophobicContact CD2-CB 4.49Å; L458-I463 HydrophobicContact CD2-CG2 4.27Å; L458-A501 WeakPolarHBondContact CD2-O 3.48Å; L458-G502 VanDerWaalsContact CD2-C 3.47Å; L458-G502 WeakPolarHBondContact CD2-O 3.15Å; L458-G504 PolarHBondContact O-N 3.32Å; L458-S505 PolarHBondContact N-O 2.98Å; L458-S505 VanDerWaalsContact N-O 3.09Å
459	Y	87.7	Confident	88	Confident	5 Å²	5	36.4 Å²	36.4	2%	0.02	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	-35.5	179.6	-73.8	-87.8	0	0	0	112.8	T143 P398 I401 L432 L438 L440 R457 P503	T143-Y459 PolarHBondContact O-OH 3.47Å; P398-Y459 WeakPolarHBondContact CD-OH 3.35Å; P398-Y459 HydrophobicContact CG-CE1 4.49Å; P398-Y459 VanDerWaalsContact CG-OH 3.32Å; P398-Y459 WeakPolarHBondContact CG-OH 3.27Å; I401-Y459 HydrophobicContact CD1-CD2 3.67Å; I401-Y459 HydrophobicContact CD1-CE2 3.47Å; I401-Y459 VanDerWaalsContact CD1-CE2 3.47Å; I401-Y459 HydrophobicContact CD1-CG 4.34Å; L432-Y459 WeakPolarHBondContact CD2-O 3.31Å; L438-Y459 PolarHBondContact O-N 2.96Å; L440-Y459 HydrophobicContact CB-CD2 4.46Å; L440-Y459 HydrophobicContact CB-CE2 3.7Å; L440-Y459 HydrophobicContact CD2-CE2 4.46Å; R457-Y459 HydrophobicContact CB-CE2 4.19Å; R457-Y459 HydrophobicContact CG-CD2 4.25Å; R457-Y459 HydrophobicContact CG-CE1 4.49Å; R457-Y459 HydrophobicContact CG-CE2 3.82Å; Y459-P503 WeakPolarHBondContact O-CB 3.41Å
460	S	85.1	Confident	88.4	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	162.9	-179.1	68.4	0	0	0	0	110.8	I431 S434 F436 P437 L438 L458	I431-S460 WeakPolarHBondContact O-CB 3.41Å; S434-S460 VanDerWaalsContact OG-CB 3.22Å; S434-S460 WeakPolarHBondContact OG-CB 3.5Å; S434-S460 PolarHBondContact OG-OG 3.48Å; F436-S460 CarbonylContact O-C 3.52Å; F436-S460 PolarHBondContact O-OG 2.88Å; P437-S460 VanDerWaalsContact CA-O 3.24Å; P437-S460 WeakPolarHBondContact CA-O 3.29Å; L438-S460 WeakPolarHBondContact CB-OG 3.45Å; L438-S460 PolarHBondContact N-O 3.09Å; L438-S460 VanDerWaalsContact N-O 3.11Å; L438-S460 PolarHBondContact N-OG 3.3Å; L458-S460 WeakPolarHBondContact CD1-O 3.35Å
461	G	84.1	Confident	88.7	Confident	13 Å²	13	22.5 Å²	22.5	13%	0.134	14%	0.139	C	C	.	.	S	Bend	trans	71.9	-174.2	178.1	0	0	0	0	0	115.2	S434 F436 P503	S434-G461 PolarHBondContact O-N 3.02Å; F436-G461 WeakPolarHBondContact O-CA 3.48Å; F436-G461 PolarHBondContact O-N 2.95Å; G461-P503 WeakPolarHBondContact O-CD 3.4Å
462	L	87.4	Confident	88.8	Confident	85 Å²	85	21.8 Å²	21.8	45%	0.445	13%	0.131	S	C	.	.			trans	-122.6	134.4	180	-170.8	78.2	0	0	0	109.2	D50 T464 A501	D50-L462 VanDerWaalsContact OD2-CD1 3.22Å; D50-L462 WeakPolarHBondContact OD2-CD1 3.26Å; L462-T464 HydrophobicContact CD2-CG2 4.31Å; L462-A501 WeakPolarHBondContact CD1-O 3.38Å
463	I	89	Confident	88.4	Confident	1 Å²	1	20.9 Å²	20.9	1%	0.005	13%	0.125	C	C	.	.	B	Isolated β-bridge	trans	-108.8	138.1	174.5	-155.8	69.4	0	0	0	110.6	P437 M439 L458 S467 I469 I484 V487 S500 A501 I507	P437-I463 HydrophobicContact CB-CD1 4.08Å; P437-I463 HydrophobicContact CG-CD1 4.33Å; M439-I463 HydrophobicContact CE-CD1 4.03Å; M439-I463 HydrophobicContact SD-CD1 4.36Å; M439-I463 HydrophobicContact SD-CG1 4.4Å; L458-I463 HydrophobicContact CD2-CB 4.49Å; L458-I463 HydrophobicContact CD2-CG2 4.27Å; I463-S467 WeakPolarHBondContact CD1-OG 3.4Å; I463-I469 HydrophobicContact CD1-CG2 4.22Å; I463-I484 HydrophobicContact CD1-CD1 3.59Å; I463-I484 HydrophobicContact CG1-CD1 3.74Å; I463-V487 HydrophobicContact CG2-CG1 4.39Å; I463-V487 HydrophobicContact CG2-CG2 4.25Å; I463-S500 CarbonylContact O-C 3.43Å; I463-S500 VanDerWaalsContact O-CA 3.26Å; I463-S500 WeakPolarHBondContact O-CA 3.49Å; I463-A501 HydrophobicContact CG2-CB 3.86Å; I463-A501 PolarHBondContact N-O 3.05Å; I463-A501 PolarHBondContact O-N 2.92Å; I463-I507 HydrophobicContact CG2-CD1 3.58Å
464	T	90.5	Very high	87.5	Confident	63 Å²	63	24.2 Å²	24.2	39%	0.387	14%	0.137	S	C	.	.			trans	-133.6	147.9	177.9	53	0	0	0	0	109.4	L462 G466 S467	L462-T464 HydrophobicContact CD2-CG2 4.31Å; T464-G466 PolarHBondContact O-N 3.31Å; T464-S467 WeakPolarHBondContact O-CB 3.5Å; T464-S467 PolarHBondContact O-N 3.49Å; T464-S467 VanDerWaalsContact O-N 3.15Å; T464-S467 PolarHBondContact O-OG 3.29Å
465	P	91.1	Very high	86	Confident	50 Å²	50	30.7 Å²	30.7	33%	0.325	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	131.8	174.3	-25.8	34.2	0	0	0	111.5	V487 N499	P465-V487 HydrophobicContact CG-CB 4.48Å; P465-V487 HydrophobicContact CG-CG2 4.19Å; P465-N499 WeakPolarHBondContact CD-O 3.32Å
466	G	88.9	Confident	84.4	Confident	33 Å²	33	39.3 Å²	39.3	34%	0.34	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.3	-8.2	-177.4	0	0	0	0	0	115.4	T464 I484	T464-G466 PolarHBondContact O-N 3.31Å; G466-I484 WeakPolarHBondContact CA-O 3.43Å; G466-I484 PolarHBondContact N-O 3.17Å
467	S	87.8	Confident	82.8	Confident	28 Å²	28	41 Å²	41	20%	0.196	21%	0.209	C	C	.	.			trans	-61.7	142.2	176	59.9	0	0	0	0	112.1	I463 T464 I484	I463-S467 WeakPolarHBondContact CD1-OG 3.4Å; T464-S467 WeakPolarHBondContact O-CB 3.5Å; T464-S467 PolarHBondContact O-N 3.49Å; T464-S467 VanDerWaalsContact O-N 3.15Å; T464-S467 PolarHBondContact O-OG 3.29Å; S467-I484 PolarHBondContact O-N 3.11Å; S467-I484 WeakPolarHBondContact OG-CD1 3.41Å
468	Q	89.1	Confident	81.2	Confident	122 Å²	122	41.7 Å²	41.7	57%	0.57	21%	0.213	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	130.8	173.2	-67.2	-175.9	-33.7	0	0	110.1	P481 E482 V524	Q468-P481 HydrophobicContact CB-CB 4.45Å; Q468-E482 WeakPolarHBondContact CA-O 3.46Å; Q468-V524 HydrophobicContact CB-CG2 3.98Å
469	I	88.9	Confident	79.6	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.01	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	156.6	179	53	156	0	0	0	110	M439 I463 P481 E482 I484 L512 L521 G522	M439-I469 HydrophobicContact CE-CD1 4.28Å; M439-I469 HydrophobicContact CE-CG2 3.96Å; I463-I469 HydrophobicContact CD1-CG2 4.22Å; I469-P481 CarbonylContact O-C 3.59Å; I469-P481 WeakPolarHBondContact O-CA 3.17Å; I469-E482 HydrophobicContact CG1-CB 4.47Å; I469-E482 WeakPolarHBondContact CG1-O 3.38Å; I469-E482 PolarHBondContact N-O 2.8Å; I469-E482 PolarHBondContact O-N 3.11Å; I469-I484 HydrophobicContact CD1-CD1 3.87Å; I469-I484 HydrophobicContact CD1-CG1 4.06Å; I469-I484 HydrophobicContact CG1-CD1 3.95Å; I469-I484 HydrophobicContact CG1-CG1 4.1Å; I469-I484 HydrophobicContact CG2-CD1 3.87Å; I469-L512 HydrophobicContact CD1-CD1 3.94Å; I469-L512 HydrophobicContact CD1-CD2 3.75Å; I469-L512 HydrophobicContact CG1-CD2 4.25Å; I469-L521 HydrophobicContact CD1-CB 4.16Å; I469-L521 HydrophobicContact CD1-CD1 3.71Å; I469-L521 HydrophobicContact CD1-CD2 4.33Å; I469-L521 HydrophobicContact CD1-CG 4.28Å; I469-G522 CarbonylContact C-O 3.59Å; I469-G522 WeakPolarHBondContact CA-O 3.4Å
470	A	86.1	Confident	78.9	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.008	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	147.2	174.6	0	0	0	0	0	109.7	W472 G522 V524	A470-W472 PolarHBondContact O-N 3.29Å; A470-G522 PolarHBondContact N-O 3.15Å; A470-G522 PolarHBondContact O-N 2.8Å; A470-V524 HydrophobicContact CB-CG2 4.33Å
471	N	86.4	Confident	78.7	Confident	2 Å²	2	54.7 Å²	54.7	1%	0.011	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	112.5	172.8	-172.3	-21.4	0	0	0	109.2	S473 R474 I478 D519 L521	N471-S473 WeakPolarHBondContact OD1-CB 3.47Å; N471-S473 PolarHBondContact OD1-N 3.38Å; N471-R474 PolarHBondContact OD1-N 3.17Å; N471-I478 WeakPolarHBondContact O-CG1 3.22Å; N471-D519 VanDerWaalsContact ND2-CG 3.28Å; N471-D519 PolarHBondContact ND2-OD2 3.32Å; N471-L521 HydrophobicContact CB-CD2 4.15Å
472	W	83.3	Confident	78.8	Confident	1 Å²	1	55.1 Å²	55.1	0%	0.004	28%	0.284	C	S	.	.	S	Bend	trans	-85.1	-16.8	-178.3	-73.3	9.5	0	0	0	113	V404 Y405 L408 L412 F436 L438 A470 I520 P523 L525	V404-W472 HydrophobicContact CG1-CB 3.9Å; V404-W472 HydrophobicContact CG1-CE3 4.48Å; Y405-W472 HydrophobicContact CD2-CZ3 4.4Å; L408-W472 HydrophobicContact CD1-CB 3.74Å; L408-W472 HydrophobicContact CD1-CD2 3.53Å; L408-W472 HydrophobicContact CD1-CE3 3.66Å; L408-W472 HydrophobicContact CD1-CG 3.61Å; L408-W472 HydrophobicContact CD1-CZ3 4.44Å; L412-W472 HydrophobicContact CD2-CH2 3.45Å; L412-W472 VanDerWaalsContact CD2-CH2 3.45Å; L412-W472 HydrophobicContact CD2-CZ2 3.9Å; L412-W472 HydrophobicContact CD2-CZ3 4.35Å; F436-W472 HydrophobicContact CD2-CH2 4.22Å; F436-W472 AromaticContact CE2-CH2 3.81Å; F436-W472 HydrophobicContact CE2-CH2 3.81Å; F436-W472 HydrophobicContact CE2-CZ3 4.3Å; F436-W472 HydrophobicContact CZ-CH2 4.48Å; L438-W472 HydrophobicContact CD1-CE3 3.99Å; L438-W472 HydrophobicContact CD1-CZ3 3.72Å; A470-W472 PolarHBondContact O-N 3.29Å; W472-I520 HydrophobicContact CB-CG2 4.49Å; W472-I520 PolarHBondContact N-O 3Å; W472-P523 HydrophobicContact CH2-CG 4.3Å; W472-P523 HydrophobicContact CZ2-CG 3.72Å; W472-P523 PolarHBondContact NE1-O 3.49Å; W472-L525 HydrophobicContact CZ2-CD2 4.2Å
473	S	78.8	Confident	78.9	Confident	9 Å²	9	56.8 Å²	56.8	6%	0.063	29%	0.287	C	S	.	.	S	Bend	trans	-74.2	-31.2	177	-66.7	0	0	0	0	112.5	N471 D519 I520	N471-S473 WeakPolarHBondContact OD1-CB 3.47Å; N471-S473 PolarHBondContact OD1-N 3.38Å; S473-D519 WeakPolarHBondContact CB-OD1 3.4Å; S473-I520 PolarHBondContact OG-N 3.25Å
474	R	71.5	Confident	79	Confident	80 Å²	80	56.7 Å²	56.7	30%	0.302	29%	0.287	S	S	.	.			trans	-107.4	97.9	-175.6	-65.3	-177	177.8	-150.4	-9.8	111	N471 K476 D477 I478 Y516 D519	N471-R474 PolarHBondContact OD1-N 3.17Å; R474-K476 PolarHBondContact O-N 3.5Å; R474-K476 VanDerWaalsContact O-N 3.07Å; R474-D477 HydrophobicContact CB-CB 4.16Å; R474-D477 WeakPolarHBondContact CD-OD2 3.46Å; R474-D477 PolarHBondContact O-N 2.82Å; R474-I478 PolarHBondContact O-N 3.44Å; R474-Y516 VanDerWaalsContact NH1-CD2 3.26Å; R474-Y516 VanDerWaalsContact NH2-CE2 3.34Å; R474-D519 IonicContact NE-OD1 3.58Å; R474-D519 IonicContact NE-OD2 3.58Å
475	Y	60.7	Low	79	Confident	137 Å²	137	58.6 Å²	58.6	54%	0.537	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-31.7	-176.8	-69.5	-81	0	0	0	114.7	D477 I478	Y475-D477 VanDerWaalsContact C-N 3.28Å; Y475-D477 PolarHBondContact O-N 3.31Å; Y475-I478 HydrophobicContact CD1-CD1 3.5Å; Y475-I478 VanDerWaalsContact CD1-CD1 3.5Å; Y475-I478 HydrophobicContact CE1-CD1 4.17Å; Y475-I478 HydrophobicContact CG-CD1 4.15Å
476	K	59.6	Low	79	Confident	189 Å²	189	59.7 Å²	59.7	82%	0.822	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-31.9	176.1	-64.3	-173.8	-178.9	179.3	0	112.4	R474	R474-K476 PolarHBondContact O-N 3.5Å; R474-K476 VanDerWaalsContact O-N 3.07Å
477	D	58.6	Low	79.1	Confident	36 Å²	36	58.1 Å²	58.1	19%	0.193	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-1.2	-173	-59.5	-33.2	0	0	0	113.4	R474 Y475 N479 L480	R474-D477 HydrophobicContact CB-CB 4.16Å; R474-D477 WeakPolarHBondContact CD-OD2 3.46Å; R474-D477 PolarHBondContact O-N 2.82Å; Y475-D477 VanDerWaalsContact C-N 3.28Å; Y475-D477 PolarHBondContact O-N 3.31Å; D477-N479 PolarHBondContact O-N 3.37Å; D477-L480 PolarHBondContact O-N 3.29Å
478	I	58.7	Low	79.2	Confident	19 Å²	19	57.1 Å²	57.1	10%	0.097	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-29	179.8	-68.9	175.7	0	0	0	111.9	L408 N471 R474 Y475 L525	L408-I478 HydrophobicContact CD2-CD1 4.4Å; N471-I478 WeakPolarHBondContact O-CG1 3.22Å; R474-I478 PolarHBondContact O-N 3.44Å; Y475-I478 HydrophobicContact CD1-CD1 3.5Å; Y475-I478 VanDerWaalsContact CD1-CD1 3.5Å; Y475-I478 HydrophobicContact CE1-CD1 4.17Å; Y475-I478 HydrophobicContact CG-CD1 4.15Å; I478-L525 HydrophobicContact CG2-CD1 4.32Å
479	N	57.9	Low	79.3	Confident	107 Å²	107	52.8 Å²	52.8	57%	0.572	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-0.6	179.9	-65.2	-42.3	0	0	0	114.3	D477 P481	D477-N479 PolarHBondContact O-N 3.37Å; N479-P481 WeakPolarHBondContact O-CD 3.38Å
480	L	73.6	Confident	79.1	Confident	108 Å²	108	53.4 Å²	53.4	57%	0.565	26%	0.256	S	S	*	.	S	Bend	trans	-104.4	93.1	179.5	-70.7	168.4	0	0	0	109.2	D477 E482	D477-L480 PolarHBondContact O-N 3.29Å; L480-E482 PolarHBondContact O-N 3.36Å
481	P	81	Confident	78.7	Confident	62 Å²	62	54.4 Å²	54.4	40%	0.403	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-67.9	126.4	179.8	28.7	-35.3	0	0	0	110.7	Q468 I469 N479 V524	Q468-P481 HydrophobicContact CB-CB 4.45Å; I469-P481 CarbonylContact O-C 3.59Å; I469-P481 WeakPolarHBondContact O-CA 3.17Å; N479-P481 WeakPolarHBondContact O-CD 3.38Å; P481-V524 HydrophobicContact CB-CG1 4.38Å; P481-V524 HydrophobicContact CB-CG2 3.66Å
482	E	86.7	Confident	77.9	Confident	23 Å²	23	55.5 Å²	55.5	11%	0.107	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	139.4	167.4	-59.5	-155.3	124.3	0	0	109.7	Q468 I469 L480 L512 Q513 S514 T515	Q468-E482 WeakPolarHBondContact CA-O 3.46Å; I469-E482 HydrophobicContact CG1-CB 4.47Å; I469-E482 WeakPolarHBondContact CG1-O 3.38Å; I469-E482 PolarHBondContact N-O 2.8Å; I469-E482 PolarHBondContact O-N 3.11Å; L480-E482 PolarHBondContact O-N 3.36Å; E482-L512 HydrophobicContact CB-CD2 3.62Å; E482-L512 HydrophobicContact CG-CD2 4.5Å; E482-L512 WeakPolarHBondContact OE2-CA 3.12Å; E482-L512 VanDerWaalsContact OE2-CB 3.28Å; E482-L512 WeakPolarHBondContact OE2-CB 3.34Å; E482-L512 WeakPolarHBondContact OE2-CD2 3.42Å; E482-Q513 PolarHBondContact OE1-N 3.26Å; E482-S514 VanDerWaalsContact CD-OG 3.28Å; E482-S514 PolarHBondContact OE1-N 3.24Å; E482-S514 PolarHBondContact OE1-OG 3.17Å; E482-T515 PolarHBondContact OE2-OG1 3.14Å
483	K	89.2	Confident	77.1	Confident	119 Å²	119	61.8 Å²	61.8	52%	0.517	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	124.2	179.5	-173	178.7	-179.9	-179.9	0	110.1	L485	K483-L485 PolarHBondContact O-N 3.39Å
484	I	91	Very high	77	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-73.2	120.9	172.9	-68	160.9	0	0	0	108.5	I463 G466 S467 I469 V487 L509 L512	I463-I484 HydrophobicContact CD1-CD1 3.59Å; I463-I484 HydrophobicContact CG1-CD1 3.74Å; G466-I484 WeakPolarHBondContact CA-O 3.43Å; G466-I484 PolarHBondContact N-O 3.17Å; S467-I484 PolarHBondContact O-N 3.11Å; S467-I484 WeakPolarHBondContact OG-CD1 3.41Å; I469-I484 HydrophobicContact CD1-CD1 3.87Å; I469-I484 HydrophobicContact CD1-CG1 4.06Å; I469-I484 HydrophobicContact CG1-CD1 3.95Å; I469-I484 HydrophobicContact CG1-CG1 4.1Å; I469-I484 HydrophobicContact CG2-CD1 3.87Å; I484-V487 HydrophobicContact CG2-CG2 3.97Å; I484-L509 HydrophobicContact CD1-CD1 3.86Å; I484-L509 HydrophobicContact CD1-CD2 4.2Å; I484-L509 HydrophobicContact CG1-CD1 4.24Å; I484-L509 HydrophobicContact CG1-CD2 4.48Å; I484-L509 HydrophobicContact CG2-CD2 3.97Å; I484-L512 HydrophobicContact CG1-CD2 4.28Å
485	L	90.4	Very high	77.5	Confident	103 Å²	103	62.3 Å²	62.3	54%	0.539	32%	0.32	S	S	.	.			trans	-80.7	-54.1	179.1	-65.1	176.9	0	0	0	110.9	K483 S510	K483-L485 PolarHBondContact O-N 3.39Å; L485-S510 PolarHBondContact N-O 3.46Å
486	N	89.9	Confident	78.7	Confident	72 Å²	72	60.5 Å²	60.5	39%	0.385	32%	0.316	S	S	.	.			trans	-140.2	151.4	178.4	-58.9	-60.2	0	0	0	110.8	F488 S510	N486-F488 HydrophobicContact CB-CD2 4.45Å; N486-F488 HydrophobicContact CB-CE1 4.21Å; N486-F488 HydrophobicContact CB-CE2 3.7Å; N486-F488 HydrophobicContact CB-CZ 3.55Å; N486-S510 WeakPolarHBondContact CB-OG 3.37Å; N486-S510 PolarHBondContact N-OG 3.19Å; N486-S510 PolarHBondContact O-N 3.33Å; N486-S510 VanDerWaalsContact O-N 3.09Å; N486-S510 PolarHBondContact O-OG 3.18Å; N486-S510 VanDerWaalsContact O-OG 3.11Å
487	V	92	Very high	80.1	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	131.2	172.6	-178.7	0	0	0	0	108.3	I463 P465 I484 V498 A501 I507 L509	I463-V487 HydrophobicContact CG2-CG1 4.39Å; I463-V487 HydrophobicContact CG2-CG2 4.25Å; P465-V487 HydrophobicContact CG-CB 4.48Å; P465-V487 HydrophobicContact CG-CG2 4.19Å; I484-V487 HydrophobicContact CG2-CG2 3.97Å; V487-V498 PolarHBondContact O-N 2.68Å; V487-A501 HydrophobicContact CG1-CB 4.39Å; V487-I507 HydrophobicContact CG1-CB 4.27Å; V487-I507 HydrophobicContact CG1-CD1 3.84Å; V487-I507 HydrophobicContact CG1-CG2 4.42Å; V487-L509 HydrophobicContact CB-CD2 4.43Å; V487-L509 HydrophobicContact CG1-CD2 4.3Å; V487-L509 HydrophobicContact CG2-CD2 3.86Å
488	F	90.7	Very high	81.6	Confident	8 Å²	8	56.2 Å²	56.2	4%	0.035	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	140.1	-178.1	-57	-79.2	0	0	0	111.9	R450 L453 N486 L495 E496 V497 I507 A508	R450-F488 VanDerWaalsContact NH1-CZ 3.31Å; L453-F488 HydrophobicContact CD2-CD2 4.22Å; L453-F488 HydrophobicContact CD2-CE2 4.05Å; N486-F488 HydrophobicContact CB-CD2 4.45Å; N486-F488 HydrophobicContact CB-CE1 4.21Å; N486-F488 HydrophobicContact CB-CE2 3.7Å; N486-F488 HydrophobicContact CB-CZ 3.55Å; F488-L495 HydrophobicContact CB-CB 4.3Å; F488-L495 HydrophobicContact CB-CD2 4.04Å; F488-L495 HydrophobicContact CD1-CB 4.14Å; F488-L495 HydrophobicContact CG-CB 4.36Å; F488-E496 CarbonylContact C-O 3.51Å; F488-E496 WeakPolarHBondContact CA-O 3.02Å; F488-V497 HydrophobicContact CD1-CB 4.47Å; F488-V497 HydrophobicContact CD1-CG2 3.8Å; F488-V497 HydrophobicContact CE1-CG2 3.46Å; F488-V497 VanDerWaalsContact CE1-CG2 3.46Å; F488-I507 WeakPolarHBondContact O-CA 3.5Å; F488-A508 HydrophobicContact CB-CB 4.24Å; F488-A508 PolarHBondContact N-O 3.23Å; F488-A508 PolarHBondContact O-N 2.64Å
489	Q	89.3	Confident	83	Confident	30 Å²	30	61.9 Å²	61.9	14%	0.14	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	134.6	164.6	-167.4	60.2	53.8	0	0	109.7	S115 H124 E496 V498 I506	S115-Q489 PolarHBondContact OG-NE2 2.92Å; H124-Q489 PolarHBondContact CE1-NE2 2.83Å; H124-Q489 PolarHBondContact ND1-NE2 2.83Å; Q489-E496 PolarHBondContact N-O 3.12Å; Q489-E496 PolarHBondContact O-N 3.32Å; Q489-E496 VanDerWaalsContact O-N 3.15Å; Q489-V498 HydrophobicContact CB-CG2 3.65Å; Q489-I506 PolarHBondContact NE2-O 3.08Å
490	L	84.8	Confident	84.4	Confident	16 Å²	16	58.1 Å²	58.1	8%	0.084	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	111.7	-179.8	-64.5	151.9	0	0	0	109.8	A114 S115 L455 L495 I506 A508	A114-L490 CarbonylContact C-O 3.5Å; S115-L490 WeakPolarHBondContact CB-O 3.19Å; S115-L490 PolarHBondContact N-O 3.09Å; S115-L490 PolarHBondContact OG-O 2.91Å; L455-L490 HydrophobicContact CD2-CD1 3.62Å; L455-L490 HydrophobicContact CD2-CD2 4.4Å; L455-L490 HydrophobicContact CG-CD1 3.83Å; L490-L495 HydrophobicContact CD2-CD2 3.45Å; L490-L495 VanDerWaalsContact CD2-CD2 3.45Å; L490-L495 HydrophobicContact CG-CD2 4.27Å; L490-I506 HydrophobicContact CD1-CG2 4.4Å; L490-A508 HydrophobicContact CD1-CB 4.38Å; L490-A508 HydrophobicContact CD2-CB 4.16Å; L490-A508 HydrophobicContact CG-CB 4.26Å
491	N	78.1	Confident	85.1	Confident	22 Å²	22	53.3 Å²	53.3	12%	0.118	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	50.5	178	-68	-10.7	0	0	0	110.2	D493 S494 E496	N491-D493 PolarHBondContact O-N 3.13Å; N491-S494 PolarHBondContact N-O 3.44Å; N491-S494 PolarHBondContact O-OG 3.19Å; N491-E496 PolarHBondContact ND2-OE1 2.91Å; N491-E496 PolarHBondContact ND2-OE2 2.6Å
492	G	70.3	Confident	85.4	Confident	25 Å²	25	50.8 Å²	50.8	26%	0.258	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	-115.5	-173.2	0	0	0	0	0	110.9	S113 S494	S113-G492 WeakPolarHBondContact O-CA 3.34Å; S113-G492 PolarHBondContact O-N 3.14Å; G492-S494 VanDerWaalsContact C-N 3.31Å
493	D	67.3	Low	85.4	Confident	132 Å²	132	51.7 Å²	51.7	71%	0.706	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-18.8	179.7	-169.4	30.9	0	0	0	113.2	N491	N491-D493 PolarHBondContact O-N 3.13Å
494	S	76.1	Confident	85.3	Confident	61 Å²	61	46.1 Å²	46.1	43%	0.427	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	137.1	-178.2	67.3	0	0	0	0	112.9	N491 G492	N491-S494 PolarHBondContact N-O 3.44Å; N491-S494 PolarHBondContact O-OG 3.19Å; G492-S494 VanDerWaalsContact C-N 3.31Å
495	L	82.1	Confident	85.2	Confident	40 Å²	40	46.6 Å²	46.6	21%	0.209	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	108.4	174.5	-69.7	168.6	0	0	0	109.7	L453 F488 L490	L453-L495 HydrophobicContact CD1-CD1 3.53Å; F488-L495 HydrophobicContact CB-CB 4.3Å; F488-L495 HydrophobicContact CB-CD2 4.04Å; F488-L495 HydrophobicContact CD1-CB 4.14Å; F488-L495 HydrophobicContact CG-CB 4.36Å; L490-L495 HydrophobicContact CD2-CD2 3.45Å; L490-L495 VanDerWaalsContact CD2-CD2 3.45Å; L490-L495 HydrophobicContact CG-CD2 4.27Å
496	E	86.2	Confident	85.3	Confident	99 Å²	99	41.7 Å²	41.7	46%	0.463	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	130.2	176.1	-73.3	177.8	-170.2	0	0	110.2	F488 Q489 N491	F488-E496 CarbonylContact C-O 3.51Å; F488-E496 WeakPolarHBondContact CA-O 3.02Å; Q489-E496 PolarHBondContact N-O 3.12Å; Q489-E496 PolarHBondContact O-N 3.32Å; Q489-E496 VanDerWaalsContact O-N 3.15Å; N491-E496 PolarHBondContact ND2-OE1 2.91Å; N491-E496 PolarHBondContact ND2-OE2 2.6Å
497	V	89.1	Confident	85.5	Confident	91 Å²	91	38.2 Å²	38.2	55%	0.552	22%	0.224	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-73.2	128.9	176.2	179.7	0	0	0	0	109.2	F488	F488-V497 HydrophobicContact CD1-CB 4.47Å; F488-V497 HydrophobicContact CD1-CG2 3.8Å; F488-V497 HydrophobicContact CE1-CG2 3.46Å; F488-V497 VanDerWaalsContact CE1-CG2 3.46Å
498	V	88.7	Confident	85.5	Confident	44 Å²	44	38.2 Å²	38.2	27%	0.267	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	142.5	177	-161.4	0	0	0	0	110.3	V487 Q489 S500	V487-V498 PolarHBondContact O-N 2.68Å; Q489-V498 HydrophobicContact CB-CG2 3.65Å; V498-S500 WeakPolarHBondContact CG1-O 3.44Å
499	N	88.2	Confident	85.6	Confident	137 Å²	137	37.9 Å²	37.9	73%	0.733	22%	0.222	S	C	*	.	S	Bend	trans	-78	-29.2	-179.6	-64.9	-32.7	0	0	0	113.2	P465	P465-N499 WeakPolarHBondContact CD-O 3.32Å
500	S	87.7	Confident	85.8	Confident	29 Å²	29	36.6 Å²	36.6	20%	0.203	22%	0.217	C	C	.	.			trans	-150.9	153.1	178.6	58.7	0	0	0	0	110.2	D50 I463 V498	D50-S500 PolarHBondContact OD1-OG 2.81Å; I463-S500 CarbonylContact O-C 3.43Å; I463-S500 VanDerWaalsContact O-CA 3.26Å; I463-S500 WeakPolarHBondContact O-CA 3.49Å; V498-S500 WeakPolarHBondContact CG1-O 3.44Å
501	A	87.8	Confident	85.9	Confident	7 Å²	7	37.1 Å²	37.1	6%	0.058	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-138	136.4	166.9	0	0	0	0	0	110.1	L458 L462 I463 V487 I507	L458-A501 WeakPolarHBondContact CD2-O 3.48Å; L462-A501 WeakPolarHBondContact CD1-O 3.38Å; I463-A501 HydrophobicContact CG2-CB 3.86Å; I463-A501 PolarHBondContact N-O 3.05Å; I463-A501 PolarHBondContact O-N 2.92Å; V487-A501 HydrophobicContact CG1-CB 4.39Å; A501-I507 HydrophobicContact CB-CD1 3.97Å; A501-I507 HydrophobicContact CB-CG2 3.75Å
502	G	87.4	Confident	86.4	Confident	8 Å²	8	36 Å²	36	8%	0.082	22%	0.22	C	C	.	.			trans	-102.2	176.8	-178.3	0	0	0	0	0	114	L458 S505	L458-G502 VanDerWaalsContact CD2-C 3.47Å; L458-G502 WeakPolarHBondContact CD2-O 3.15Å; G502-S505 WeakPolarHBondContact O-CB 3.26Å; G502-S505 PolarHBondContact O-N 3.28Å; G502-S505 PolarHBondContact O-OG 3.04Å
503	P	87.8	Confident	86.9	Confident	42 Å²	42	42.3 Å²	42.3	27%	0.273	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	143.9	-175.5	28.1	-35.6	0	0	0	112.1	I53 Y459 G461 S505	I53-P503 HydrophobicContact CD1-CB 4.15Å; I53-P503 HydrophobicContact CD1-CG 4.27Å; Y459-P503 WeakPolarHBondContact O-CB 3.41Å; G461-P503 WeakPolarHBondContact O-CD 3.4Å; P503-S505 VanDerWaalsContact C-N 3.34Å
504	G	86.5	Confident	87.7	Confident	3 Å²	3	37.6 Å²	37.6	3%	0.031	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.8	-14.1	-176.7	0	0	0	0	0	114.7	N58 L458	N58-G504 PolarHBondContact ND2-O 2.78Å; N58-G504 PolarHBondContact OD1-O 2.62Å; L458-G504 PolarHBondContact O-N 3.32Å
505	S	90.1	Very high	88.2	Confident	9 Å²	9	34.7 Å²	34.7	6%	0.063	20%	0.2	C	C	.	.			trans	-79.1	147.2	-179.1	63.3	0	0	0	0	113.2	L458 G502 P503	L458-S505 PolarHBondContact N-O 2.98Å; L458-S505 VanDerWaalsContact N-O 3.09Å; G502-S505 WeakPolarHBondContact O-CB 3.26Å; G502-S505 PolarHBondContact O-N 3.28Å; G502-S505 PolarHBondContact O-OG 3.04Å; P503-S505 VanDerWaalsContact C-N 3.34Å
506	I	92.2	Very high	88.4	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	119.4	169.3	-61	179.2	0	0	0	108	N58 H124 L126 F442 Q489 L490	N58-I506 HydrophobicContact CB-CD1 4.43Å; H124-I506 HydrophobicContact CB-CB 4.49Å; H124-I506 HydrophobicContact CB-CD1 4.1Å; H124-I506 HydrophobicContact CB-CG1 4.45Å; L126-I506 HydrophobicContact CD1-CD1 4.38Å; F442-I506 HydrophobicContact CE1-CG2 3.87Å; F442-I506 HydrophobicContact CZ-CG2 3.84Å; Q489-I506 PolarHBondContact NE2-O 3.08Å; L490-I506 HydrophobicContact CD1-CG2 4.4Å
507	I	92.6	Very high	88.4	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	161.1	-172.7	57.1	169.5	0	0	0	111.2	L455 V456 I463 V487 F488 A501 L509	L455-I507 WeakPolarHBondContact CA-O 3.39Å; V456-I507 HydrophobicContact CG2-CD1 3.98Å; V456-I507 HydrophobicContact CG2-CG1 3.54Å; V456-I507 PolarHBondContact N-O 3.24Å; V456-I507 PolarHBondContact O-N 3.07Å; I463-I507 HydrophobicContact CG2-CD1 3.58Å; V487-I507 HydrophobicContact CG1-CB 4.27Å; V487-I507 HydrophobicContact CG1-CD1 3.84Å; V487-I507 HydrophobicContact CG1-CG2 4.42Å; F488-I507 WeakPolarHBondContact O-CA 3.5Å; A501-I507 HydrophobicContact CB-CD1 3.97Å; A501-I507 HydrophobicContact CB-CG2 3.75Å; I507-L509 HydrophobicContact CD1-CD2 3.84Å; I507-L509 HydrophobicContact CD1-CG 4.49Å
508	A	92.9	Very high	88.2	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	130.1	170.5	0	0	0	0	0	111	T454 L455 F488 L490	T454-A508 WeakPolarHBondContact O-CA 3.12Å; L455-A508 HydrophobicContact CD1-CB 4.2Å; L455-A508 HydrophobicContact CG-CB 4.28Å; F488-A508 HydrophobicContact CB-CB 4.24Å; F488-A508 PolarHBondContact N-O 3.23Å; F488-A508 PolarHBondContact O-N 2.64Å; L490-A508 HydrophobicContact CD1-CB 4.38Å; L490-A508 HydrophobicContact CD2-CB 4.16Å; L490-A508 HydrophobicContact CG-CB 4.26Å
509	L	93.6	Very high	88.1	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	144.8	177.9	-58.2	178.8	0	0	0	110.2	M439 L453 T454 V456 I484 V487 I507 L512	M439-L509 HydrophobicContact CE-CD1 4.16Å; M439-L509 HydrophobicContact SD-CD1 3.95Å; L453-L509 CarbonylContact C-O 3.59Å; L453-L509 WeakPolarHBondContact CA-O 3.35Å; T454-L509 PolarHBondContact N-O 3.03Å; T454-L509 PolarHBondContact O-N 2.9Å; V456-L509 HydrophobicContact CG1-CD1 4.04Å; V456-L509 HydrophobicContact CG2-CD1 3.77Å; V456-L509 HydrophobicContact CG2-CG 3.92Å; I484-L509 HydrophobicContact CD1-CD1 3.86Å; I484-L509 HydrophobicContact CD1-CD2 4.2Å; I484-L509 HydrophobicContact CG1-CD1 4.24Å; I484-L509 HydrophobicContact CG1-CD2 4.48Å; I484-L509 HydrophobicContact CG2-CD2 3.97Å; V487-L509 HydrophobicContact CB-CD2 4.43Å; V487-L509 HydrophobicContact CG1-CD2 4.3Å; V487-L509 HydrophobicContact CG2-CD2 3.86Å; I507-L509 HydrophobicContact CD1-CD2 3.84Å; I507-L509 HydrophobicContact CD1-CG 4.49Å; L509-L512 HydrophobicContact CB-CD1 4.26Å; L509-L512 HydrophobicContact CD1-CD1 4.22Å
510	S	92.5	Very high	88.2	Confident	4 Å²	4	20.4 Å²	20.4	3%	0.028	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	149.9	172.7	54.7	0	0	0	0	111.6	L485 N486	L485-S510 PolarHBondContact N-O 3.46Å; N486-S510 WeakPolarHBondContact CB-OG 3.37Å; N486-S510 PolarHBondContact N-OG 3.19Å; N486-S510 PolarHBondContact O-N 3.33Å; N486-S510 VanDerWaalsContact O-N 3.09Å; N486-S510 PolarHBondContact O-OG 3.18Å; N486-S510 VanDerWaalsContact O-OG 3.11Å
511	G	86.5	Confident	88.2	Confident	26 Å²	26	19 Å²	19	27%	0.268	11%	0.109	S	C	.	.			trans	105.5	-0.3	177.1	0	0	0	0	0	115.5
512	L	88.3	Confident	88.2	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.107	C	C	.	.			trans	-90.5	122.4	-177.6	-52.7	-173.3	0	0	0	111.4	P452 T454 I469 E482 I484 L509 L521 R589	P452-L512 WeakPolarHBondContact CG-O 3.38Å; T454-L512 HydrophobicContact CG2-CD1 4.02Å; I469-L512 HydrophobicContact CD1-CD1 3.94Å; I469-L512 HydrophobicContact CD1-CD2 3.75Å; I469-L512 HydrophobicContact CG1-CD2 4.25Å; E482-L512 HydrophobicContact CB-CD2 3.62Å; E482-L512 HydrophobicContact CG-CD2 4.5Å; E482-L512 WeakPolarHBondContact OE2-CA 3.12Å; E482-L512 VanDerWaalsContact OE2-CB 3.28Å; E482-L512 WeakPolarHBondContact OE2-CB 3.34Å; E482-L512 WeakPolarHBondContact OE2-CD2 3.42Å; I484-L512 HydrophobicContact CG1-CD2 4.28Å; L509-L512 HydrophobicContact CB-CD1 4.26Å; L509-L512 HydrophobicContact CD1-CD1 4.22Å; L512-L521 HydrophobicContact CD1-CD1 3.85Å; L512-R589 PolarHBondContact O-NH2 3.23Å
513	Q	82.3	Confident	88.1	Confident	156 Å²	156	19.4 Å²	19.4	73%	0.729	11%	0.11	S	C	*	.	S	Bend	trans	-114.5	-32.3	-171.5	-66.3	-171.4	-5.2	0	0	113.6	E482 R589	E482-Q513 PolarHBondContact OE1-N 3.26Å; Q513-R589 PolarHBondContact O-NH1 2.9Å
514	S	82.6	Confident	87.8	Confident	34 Å²	34	19.3 Å²	19.3	24%	0.238	11%	0.108	C	C	.	.	S	Bend	trans	-96.1	-12.2	179.6	67.1	0	0	0	0	113.5	E482 Y516	E482-S514 VanDerWaalsContact CD-OG 3.28Å; E482-S514 PolarHBondContact OE1-N 3.24Å; E482-S514 PolarHBondContact OE1-OG 3.17Å; S514-Y516 VanDerWaalsContact O-CD2 3.27Å; S514-Y516 WeakPolarHBondContact O-CD2 3.24Å
515	T	86.5	Confident	87.1	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.11	C	C	.	.			trans	-71.6	135.4	-176.7	-61.5	0	0	0	0	112.1	V441 I444 T454 E482 D519 L521 R589	V441-T515 HydrophobicContact CB-CG2 4.33Å; V441-T515 HydrophobicContact CG1-CG2 4.2Å; V441-T515 HydrophobicContact CG2-CG2 3.59Å; I444-T515 WeakPolarHBondContact CD1-O 3.31Å; T454-T515 HydrophobicContact CG2-CG2 4.09Å; E482-T515 PolarHBondContact OE2-OG1 3.14Å; T515-D519 HydrophobicContact CG2-CB 4.21Å; T515-L521 HydrophobicContact CG2-CD1 4.35Å; T515-L521 HydrophobicContact CG2-CD2 4.09Å; T515-R589 WeakPolarHBondContact O-CD 3.11Å; T515-R589 PolarHBondContact O-NE 3.3Å
516	Y	87	Confident	85.7	Confident	78 Å²	78	25.6 Å²	25.6	31%	0.306	14%	0.141	S	C	.	.			trans	-111.3	160	173.7	-78.7	-117.4	0	0	0	111.1	R474 S514 G518 D519 R589	R474-Y516 VanDerWaalsContact NH1-CD2 3.26Å; R474-Y516 VanDerWaalsContact NH2-CE2 3.34Å; S514-Y516 VanDerWaalsContact O-CD2 3.27Å; S514-Y516 WeakPolarHBondContact O-CD2 3.24Å; Y516-G518 PolarHBondContact O-N 3.02Å; Y516-D519 PolarHBondContact N-OD2 3.45Å; Y516-D519 WeakPolarHBondContact O-CB 3.3Å; Y516-D519 PolarHBondContact O-N 2.9Å; Y516-D519 VanDerWaalsContact O-N 3.16Å; Y516-R589 HydrophobicContact CD1-CB 4.19Å; Y516-R589 HydrophobicContact CD1-CG 3.7Å; Y516-R589 HydrophobicContact CD2-CG 3.86Å; Y516-R589 HydrophobicContact CE1-CB 3.99Å; Y516-R589 HydrophobicContact CE1-CG 3.77Å; Y516-R589 HydrophobicContact CE2-CG 3.93Å; Y516-R589 HydrophobicContact CG-CG 3.75Å
517	T	87	Confident	83.7	Confident	8 Å²	8	28.5 Å²	28.5	5%	0.049	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	123.2	170.9	-63.3	0	0	0	0	110.2	R140 F442 F558 R589 E590 P592	R140-T517 HydrophobicContact CG-CG2 4.27Å; F442-T517 WeakPolarHBondContact O-CG2 3.21Å; T517-F558 HydrophobicContact CG2-CE2 3.76Å; T517-F558 HydrophobicContact CG2-CZ 4.25Å; T517-R589 PolarHBondContact OG1-O 3.46Å; T517-E590 PolarHBondContact OG1-O 3.12Å; T517-P592 HydrophobicContact CG2-CG 4.16Å
518	G	84.5	Confident	81.4	Confident	8 Å²	8	34.2 Å²	34.2	8%	0.082	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	100.7	-1.3	-177.2	0	0	0	0	0	114.6	V441 Y516 I557	V441-G518 VanDerWaalsContact O-CA 3.25Å; V441-G518 WeakPolarHBondContact O-CA 3.21Å; V441-G518 PolarHBondContact O-N 3.27Å; Y516-G518 PolarHBondContact O-N 3.02Å; G518-I557 WeakPolarHBondContact O-CD1 3.44Å; G518-I557 WeakPolarHBondContact O-CG1 3.39Å
519	D	87.4	Confident	78.9	Confident	14 Å²	14	43.3 Å²	43.3	8%	0.075	24%	0.235	C	C	.	.			trans	-76.4	147.9	175.7	-72.9	-22.2	0	0	0	111.8	V441 N471 S473 R474 T515 Y516	V441-D519 WeakPolarHBondContact CB-O 3.42Å; V441-D519 WeakPolarHBondContact CG2-O 3.41Å; V441-D519 PolarHBondContact N-O 3.01Å; N471-D519 VanDerWaalsContact ND2-CG 3.28Å; N471-D519 PolarHBondContact ND2-OD2 3.32Å; S473-D519 WeakPolarHBondContact CB-OD1 3.4Å; R474-D519 IonicContact NE-OD1 3.58Å; R474-D519 IonicContact NE-OD2 3.58Å; T515-D519 HydrophobicContact CG2-CB 4.21Å; Y516-D519 PolarHBondContact N-OD2 3.45Å; Y516-D519 WeakPolarHBondContact O-CB 3.3Å; Y516-D519 PolarHBondContact O-N 2.9Å; Y516-D519 VanDerWaalsContact O-N 3.16Å
520	I	88.2	Confident	76.4	Confident	2 Å²	2	46.3 Å²	46.3	1%	0.01	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	126.2	174.2	-63.8	159.7	0	0	0	107.5	I401 V404 L438 M439 L440 W472 S473 I557	I401-I520 HydrophobicContact CB-CD1 4.47Å; I401-I520 HydrophobicContact CG1-CD1 3.99Å; I401-I520 HydrophobicContact CG1-CG1 4.15Å; V404-I520 HydrophobicContact CB-CD1 3.93Å; V404-I520 HydrophobicContact CG1-CD1 4.42Å; V404-I520 HydrophobicContact CG2-CD1 3.7Å; L438-I520 HydrophobicContact CD1-CG2 3.81Å; M439-I520 WeakPolarHBondContact O-CA 3.43Å; L440-I520 HydrophobicContact CD1-CG1 4.37Å; W472-I520 HydrophobicContact CB-CG2 4.49Å; W472-I520 PolarHBondContact N-O 3Å; S473-I520 PolarHBondContact OG-N 3.25Å; I520-I557 HydrophobicContact CD1-CD1 3.75Å; I520-I557 HydrophobicContact CG1-CD1 3.65Å
521	L	89.3	Confident	73.7	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	135.4	-180	-54.6	173.3	0	0	0	109.3	M439 V441 V456 I469 N471 L512 T515	M439-L521 HydrophobicContact CB-CB 4.26Å; M439-L521 HydrophobicContact CE-CB 4.02Å; M439-L521 HydrophobicContact CE-CD1 4.5Å; M439-L521 PolarHBondContact N-O 3.22Å; M439-L521 PolarHBondContact O-N 3.31Å; V441-L521 HydrophobicContact CG2-CD1 3.42Å; V441-L521 VanDerWaalsContact CG2-CD1 3.42Å; V441-L521 HydrophobicContact CG2-CD2 4.44Å; V441-L521 HydrophobicContact CG2-CG 3.72Å; V456-L521 HydrophobicContact CG1-CD1 4.25Å; I469-L521 HydrophobicContact CD1-CB 4.16Å; I469-L521 HydrophobicContact CD1-CD1 3.71Å; I469-L521 HydrophobicContact CD1-CD2 4.33Å; I469-L521 HydrophobicContact CD1-CG 4.28Å; N471-L521 HydrophobicContact CB-CD2 4.15Å; L512-L521 HydrophobicContact CD1-CD1 3.85Å; T515-L521 HydrophobicContact CG2-CD1 4.35Å; T515-L521 HydrophobicContact CG2-CD2 4.09Å
522	G	87.2	Confident	71.2	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	-176.8	176.2	0	0	0	0	0	112.2	P437 I469 A470	P437-G522 WeakPolarHBondContact O-CA 3.25Å; I469-G522 CarbonylContact C-O 3.59Å; I469-G522 WeakPolarHBondContact CA-O 3.4Å; A470-G522 PolarHBondContact N-O 3.15Å; A470-G522 PolarHBondContact O-N 2.8Å
523	P	84.5	Confident	68.8	Low	22 Å²	22	67.1 Å²	67.1	14%	0.143	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	155.8	175	29	-39.1	0	0	0	112	F436 P437 W472 L525	F436-P523 HydrophobicContact CB-CG 3.91Å; F436-P523 HydrophobicContact CD2-CG 3.97Å; F436-P523 HydrophobicContact CG-CG 4.11Å; P437-P523 WeakPolarHBondContact O-CD 3.29Å; W472-P523 HydrophobicContact CH2-CG 4.3Å; W472-P523 HydrophobicContact CZ2-CG 3.72Å; W472-P523 PolarHBondContact NE1-O 3.49Å; P523-L525 PolarHBondContact O-N 3.3Å
524	V	81.5	Confident	66.7	Low	41 Å²	41	67.8 Å²	67.8	25%	0.248	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-66.7	125.1	174	-173.6	0	0	0	0	109.5	Q468 A470 P481	Q468-V524 HydrophobicContact CB-CG2 3.98Å; A470-V524 HydrophobicContact CB-CG2 4.33Å; P481-V524 HydrophobicContact CB-CG1 4.38Å; P481-V524 HydrophobicContact CB-CG2 3.66Å
525	L	73	Confident	64.4	Low	12 Å²	12	73.3 Å²	73.3	6%	0.063	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-90	121.2	179.6	-59.9	171.2	0	0	0	109.4	L408 L412 W472 I478 P523 S527	L408-L525 HydrophobicContact CD1-CD1 4.41Å; L408-L525 HydrophobicContact CD2-CD1 4.11Å; L412-L525 HydrophobicContact CD2-CD2 4.14Å; W472-L525 HydrophobicContact CZ2-CD2 4.2Å; I478-L525 HydrophobicContact CG2-CD1 4.32Å; P523-L525 PolarHBondContact O-N 3.3Å; L525-S527 PolarHBondContact O-N 3.38Å
526	N	60.6	Low	62.2	Low	132 Å²	132	78 Å²	78	71%	0.706	41%	0.412	S	S	*	.			trans	-78.9	108.9	176.6	-71.7	-23.5	0	0	0	110.2	T528	N526-T528 HydrophobicContact CB-CG2 4.49Å; N526-T528 PolarHBondContact O-N 3.36Å
527	S	50.7	Low	59.5	Low	60 Å²	60	84.3 Å²	84.3	42%	0.42	44%	0.441	S	S	.	.			trans	-74.3	72.3	171.9	63.1	0	0	0	0	111.5	L525 K529 S530	L525-S527 PolarHBondContact O-N 3.38Å; S527-K529 PolarHBondContact O-N 2.97Å; S527-S530 WeakPolarHBondContact CB-OG 3.27Å; S527-S530 PolarHBondContact O-OG 3.12Å; S527-S530 PolarHBondContact OG-OG 3.07Å
528	T	43	Very low	56.8	Low	120 Å²	120	86.9 Å²	86.9	74%	0.736	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-5	175.2	43.6	0	0	0	0	113.6	N526	N526-T528 HydrophobicContact CB-CG2 4.49Å; N526-T528 PolarHBondContact O-N 3.36Å
529	K	40.6	Very low	54.2	Low	192 Å²	192	93.3 Å²	93.3	84%	0.835	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	-16.5	179.9	-70.1	-174.1	177.9	178.1	0	115.9	S527	S527-K529 PolarHBondContact O-N 2.97Å
530	S	40.3	Very low	51.3	Low	63 Å²	63	96.3 Å²	96.3	44%	0.441	54%	0.541	S	S	.	.	G	3₁₀ helix	trans	-79.8	-25.4	-177.6	44.3	0	0	0	0	113.8	S527 Q532	S527-S530 WeakPolarHBondContact CB-OG 3.27Å; S527-S530 PolarHBondContact O-OG 3.12Å; S527-S530 PolarHBondContact OG-OG 3.07Å; S530-Q532 PolarHBondContact O-N 2.96Å
531	R	36.2	Very low	48.7	Very low	215 Å²	215	103.3 Å²	103.3	81%	0.811	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-76.5	-9.2	-175.3	-76.8	-175.5	174.2	170.4	-0	116.4
532	Q	33.7	Very low	45.6	Very low	178 Å²	178	109.8 Å²	109.8	83%	0.832	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-96.7	-9.4	179	-74.3	-172.9	-7	0	0	114.4	S530	S530-Q532 PolarHBondContact O-N 2.96Å
533	A	38	Very low	42.9	Very low	74 Å²	74	117 Å²	117	61%	0.612	65%	0.651	S	S	*	*	S	Bend	trans	-86	-18.3	179.8	0	0	0	0	0	114	N535 S536	A533-N535 PolarHBondContact O-N 2.91Å; A533-S536 PolarHBondContact O-OG 2.91Å
534	E	38.3	Very low	40.3	Very low	169 Å²	169	120.5 Å²	120.5	79%	0.79	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-1.5	-172.6	-68.6	-178.6	166.4	0	0	115
535	N	34.5	Very low	37.8	Very low	151 Å²	151	127.9 Å²	127.9	81%	0.807	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.6	5	-177.5	-87.2	-27.8	0	0	0	115.7	A533 K537	A533-N535 PolarHBondContact O-N 2.91Å; N535-K537 PolarHBondContact O-N 3.46Å
536	S	40	Very low	35.6	Very low	97 Å²	97	135.5 Å²	135.5	68%	0.678	74%	0.739	S	S	*	*			trans	-93.5	99.4	171.1	21.8	0	0	0	0	110.5	A533	A533-S536 PolarHBondContact O-OG 2.91Å
537	K	31.5	Very low	34	Very low	212 Å²	212	136.5 Å²	136.5	92%	0.922	74%	0.741	S	S	*	*			trans	-41.1	138	166.7	-65	171.8	174.8	175.6	0	112.5	N535	N535-K537 PolarHBondContact O-N 3.46Å
538	G	30.1	Very low	33	Very low	61 Å²	61	142.7 Å²	142.7	63%	0.629	76%	0.761	S	S	*	*			trans	130.9	115.4	146.5	0	0	0	0	0	115.4
539	T	30.4	Very low	32.2	Very low	143 Å²	143	143.7 Å²	143.7	88%	0.877	76%	0.762	S	S	*	*			trans	69.6	98.5	146.3	57.4	0	0	0	0	118.7
540	G	26.5	Very low	31.4	Very low	78 Å²	78	140.8 Å²	140.8	80%	0.804	76%	0.756	S	S	*	*			trans	63.7	90.9	132.5	0	0	0	0	0	117.8
541	L	31.8	Very low	30.8	Very low	148 Å²	148	141.2 Å²	141.2	78%	0.775	77%	0.77	S	S	*	*			trans	-132.8	94.2	156.6	-91.3	131.7	0	0	0	108
542	N	26.1	Very low	30.3	Very low	138 Å²	138	135.5 Å²	135.5	74%	0.738	76%	0.763	S	S	*	*			trans	-76.5	148.6	149	-65.5	-16.3	0	0	0	106.7
543	D	28.7	Very low	30.3	Very low	151 Å²	151	135 Å²	135	81%	0.807	76%	0.761	S	S	*	*	S	Bend	trans	80.5	45.4	153.6	-42.7	-29.8	0	0	0	119.5
544	T	30.7	Very low	30.2	Very low	95 Å²	95	135.4 Å²	135.4	58%	0.583	76%	0.759	S	S	*	*			trans	-137.4	9.1	162.9	48.9	0	0	0	0	116.5	E546	T544-E546 VanDerWaalsContact C-N 3.33Å
545	E	28.3	Very low	30.2	Very low	196 Å²	196	130.1 Å²	130.1	92%	0.916	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-7.4	169.7	-71.3	-169.7	160.4	0	0	113.4
546	E	28.5	Very low	30.8	Very low	172 Å²	172	126.3 Å²	126.3	80%	0.804	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	13	179.5	-68.1	-169.6	165.2	0	0	114.7	T544	T544-E546 VanDerWaalsContact C-N 3.33Å
547	M	26.4	Very low	31.5	Very low	153 Å²	153	122.7 Å²	122.7	75%	0.754	70%	0.698	S	S	*	*	S	Bend	trans	-99	5.6	-176	-115.4	-176.7	165.8	0	0	116.3
548	F	28.7	Very low	32.8	Very low	191 Å²	191	112.9 Å²	112.9	84%	0.838	66%	0.655	S	S	*	*	S	Bend	trans	-131.5	18.5	172.8	-79.1	-80.9	0	0	0	114.1
549	D	27.4	Very low	34.1	Very low	141 Å²	141	115.6 Å²	115.6	75%	0.754	65%	0.651	S	S	*	*			trans	-97.9	10.3	172.2	-149.6	23.5	0	0	0	112.9	G551	D549-G551 PolarHBondContact O-N 3.22Å
550	N	24.5	Very low	35.4	Very low	130 Å²	130	111.1 Å²	111.1	70%	0.695	62%	0.624	S	S	*	*	S	Bend	trans	-89.3	88.6	170	-70.9	-29.7	0	0	0	109.6	S552	N550-S552 PolarHBondContact O-N 3.32Å; N550-S552 PolarHBondContact O-OG 2.77Å; N550-S552 VanDerWaalsContact O-OG 3.11Å
551	G	26.3	Very low	37	Very low	73 Å²	73	109.3 Å²	109.3	75%	0.753	60%	0.599	S	S	*	*			trans	52.8	21.2	147	0	0	0	0	0	118.5	D549 E553	D549-G551 PolarHBondContact O-N 3.22Å; G551-E553 VanDerWaalsContact C-N 3.27Å; G551-E553 PolarHBondContact O-N 2.94Å
552	S	26.5	Very low	38.5	Very low	94 Å²	94	105.8 Å²	105.8	66%	0.657	58%	0.578	S	S	*	*			trans	-81.2	83.3	179	-53.8	0	0	0	0	107.8	N550 S554	N550-S552 PolarHBondContact O-N 3.32Å; N550-S552 PolarHBondContact O-OG 2.77Å; N550-S552 VanDerWaalsContact O-OG 3.11Å; S552-S554 PolarHBondContact O-N 3.16Å; S552-S554 VanDerWaalsContact O-N 3.14Å
553	E	33.8	Very low	40.5	Very low	168 Å²	168	99.8 Å²	99.8	79%	0.785	55%	0.547	S	S	*	.			trans	-39.3	119.9	174	-68.2	174.6	165.5	0	0	109.5	G551	G551-E553 VanDerWaalsContact C-N 3.27Å; G551-E553 PolarHBondContact O-N 2.94Å
554	S	36.3	Very low	42.3	Very low	83 Å²	83	93.8 Å²	93.8	58%	0.58	52%	0.515	S	S	*	.			trans	-44	131.1	162.8	48.2	0	0	0	0	107.1	S552 S556	S552-S554 PolarHBondContact O-N 3.16Å; S552-S554 VanDerWaalsContact O-N 3.14Å; S554-S556 VanDerWaalsContact C-N 3.26Å; S554-S556 PolarHBondContact O-N 2.9Å
555	P	38.2	Very low	44.3	Very low	57 Å²	57	89.7 Å²	89.7	37%	0.37	49%	0.49	S	S	.	.			trans	-61.1	94.9	-173.9	24.6	-32.9	0	0	0	108.2	V404 I557	V404-P555 HydrophobicContact CG2-CG 4.26Å; P555-I557 PolarHBondContact O-N 3.31Å; P555-I557 VanDerWaalsContact O-N 3.08Å
556	S	46.1	Very low	46.7	Very low	72 Å²	72	84.1 Å²	84.1	50%	0.503	46%	0.462	S	S	.	.			trans	-66.5	114.6	179.1	45	0	0	0	0	105.4	S554 F558	S554-S556 VanDerWaalsContact C-N 3.26Å; S554-S556 PolarHBondContact O-N 2.9Å; S556-F558 WeakPolarHBondContact CB-O 3.18Å; S556-F558 PolarHBondContact O-N 2.8Å; S556-F558 PolarHBondContact OG-O 3.11Å
557	I	54.9	Low	49.2	Very low	21 Å²	21	76.7 Å²	76.7	11%	0.108	43%	0.429	C	S	.	.	S	Bend	trans	-62.8	-29.3	178.6	-56.4	-166.1	0	0	0	109.9	S400 L440 G518 I520 P555	S400-I557 VanDerWaalsContact CB-CG1 3.49Å; S400-I557 WeakPolarHBondContact OG-CD1 3.32Å; S400-I557 WeakPolarHBondContact OG-CG2 3.4Å; L440-I557 HydrophobicContact CD1-CD1 3.29Å; L440-I557 HydrophobicContact CD1-CG2 4.38Å; G518-I557 WeakPolarHBondContact O-CD1 3.44Å; G518-I557 WeakPolarHBondContact O-CG1 3.39Å; I520-I557 HydrophobicContact CD1-CD1 3.75Å; I520-I557 HydrophobicContact CG1-CD1 3.65Å; P555-I557 PolarHBondContact O-N 3.31Å; P555-I557 VanDerWaalsContact O-N 3.08Å
558	F	59.3	Low	52	Low	6 Å²	6	69.4 Å²	69.4	3%	0.026	39%	0.393	C	S	.	.	S	Bend	trans	-96.9	136.7	176.9	-45.8	-60.3	0	0	0	109.6	F136 R140 T143 T517 S556 V560	F136-F558 HydrophobicContact CE2-CB 3.64Å; F136-F558 HydrophobicContact CE2-CD2 4.38Å; F136-F558 HydrophobicContact CE2-CG 4.14Å; F136-F558 HydrophobicContact CZ-CB 4.12Å; F136-F558 AromaticContact CZ-CD2 3.99Å; F136-F558 HydrophobicContact CZ-CD2 3.99Å; F136-F558 HydrophobicContact CZ-CG 4.18Å; R140-F558 HydrophobicContact CB-CE1 4.14Å; R140-F558 HydrophobicContact CB-CZ 4.37Å; R140-F558 HydrophobicContact CG-CD1 3.94Å; R140-F558 HydrophobicContact CG-CD2 4.24Å; R140-F558 HydrophobicContact CG-CE1 3.78Å; R140-F558 HydrophobicContact CG-CE2 4.03Å; R140-F558 HydrophobicContact CG-CG 4.19Å; R140-F558 HydrophobicContact CG-CZ 3.83Å; T143-F558 HydrophobicContact CG2-CD1 3.73Å; T143-F558 HydrophobicContact CG2-CE1 3.57Å; T517-F558 HydrophobicContact CG2-CE2 3.76Å; T517-F558 HydrophobicContact CG2-CZ 4.25Å; S556-F558 WeakPolarHBondContact CB-O 3.18Å; S556-F558 PolarHBondContact O-N 2.8Å; S556-F558 PolarHBondContact OG-O 3.11Å; F558-V560 HydrophobicContact CB-CG2 4.42Å; F558-V560 PolarHBondContact O-N 3.42Å
559	Q	56.2	Low	55	Low	117 Å²	117	60.3 Å²	60.3	55%	0.547	35%	0.354	S	S	.	.			trans	-70	87.7	159.9	-173.8	173.6	-1.1	0	0	107	S561	Q559-S561 PolarHBondContact O-N 3.43Å
560	V	58.6	Low	57.8	Low	50 Å²	50	58 Å²	58	30%	0.303	34%	0.338	S	S	.	.			trans	-64.6	109.9	175.8	-174.9	0	0	0	0	106.6	F136 F558 P592	F136-V560 HydrophobicContact CE2-CB 4.42Å; F136-V560 HydrophobicContact CE2-CG1 4.49Å; F136-V560 HydrophobicContact CE2-CG2 3.93Å; F136-V560 HydrophobicContact CZ-CG2 4.37Å; F558-V560 HydrophobicContact CB-CG2 4.42Å; F558-V560 PolarHBondContact O-N 3.42Å; V560-P592 HydrophobicContact CG2-CB 4.47Å
561	S	59.7	Low	61	Low	40 Å²	40	53.5 Å²	53.5	28%	0.28	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-65.1	137.1	173	-63.2	0	0	0	0	108.5	Q559	Q559-S561 PolarHBondContact O-N 3.43Å
562	E	63.4	Low	63.9	Low	74 Å²	74	51.8 Å²	51.8	35%	0.346	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-61.8	139.4	177	-68.6	-172.9	176.9	0	0	109.9	V564 S880 R882	E562-V564 PolarHBondContact O-N 2.97Å; E562-S880 VanDerWaalsContact OE2-CB 3.26Å; E562-S880 WeakPolarHBondContact OE2-CB 3.38Å; E562-R882 IonicContact OE1-CZ 3.28Å; E562-R882 IonicContact OE1-NE 3.69Å; E562-R882 IonicContact OE1-NH2 2.82Å; E562-R882 PolarHBondContact OE1-NH2 3.09Å; E562-R882 IonicContact OE2-NE 3.89Å
563	P	68.2	Low	66.8	Low	12 Å²	12	49.3 Å²	49.3	8%	0.078	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-64.4	136.8	-179.8	28.7	-36.2	0	0	0	110.6	Y566	P563-Y566 HydrophobicContact CG-CE1 4.41Å; P563-Y566 WeakPolarHBondContact O-CE2 3.2Å; P563-Y566 PolarHBondContact O-OH 3.42Å
564	V	67	Low	69.4	Low	24 Å²	24	52.4 Å²	52.4	15%	0.145	29%	0.286	C	S	.	.			trans	-99	-26.7	-172.5	-175.6	0	0	0	0	111	E562 G609 F879	E562-V564 PolarHBondContact O-N 2.97Å; V564-G609 PolarHBondContact N-O 2.88Å; V564-F879 HydrophobicContact CB-CD1 4.47Å; V564-F879 HydrophobicContact CG1-CD1 3.54Å; V564-F879 HydrophobicContact CG1-CE1 4.17Å
565	V	71.7	Confident	71.9	Confident	9 Å²	9	53.5 Å²	53.5	6%	0.055	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	138.2	-177.6	-173.2	0	0	0	0	109.9	S608 G609 G611 D612 L615 S866	V565-S608 CarbonylContact O-C 3.58Å; V565-S608 WeakPolarHBondContact O-CA 3.44Å; V565-G609 PolarHBondContact N-O 3.23Å; V565-G609 PolarHBondContact O-N 3.41Å; V565-G611 VanDerWaalsContact CG2-CA 3.49Å; V565-D612 WeakPolarHBondContact CG1-OD1 3.18Å; V565-L615 HydrophobicContact CB-CD1 4.12Å; V565-L615 HydrophobicContact CG1-CD1 3.54Å; V565-L615 HydrophobicContact CG1-CG 4.45Å; V565-S866 VanDerWaalsContact CG2-OG 3.23Å; V565-S866 WeakPolarHBondContact CG2-OG 3.18Å
566	Y	78.3	Confident	74.3	Confident	80 Å²	80	52.4 Å²	52.4	31%	0.314	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	138.5	-179.6	-63.1	-100.4	0	0	0	108.9	P563 I606 I607 S608 I881	P563-Y566 HydrophobicContact CG-CE1 4.41Å; P563-Y566 WeakPolarHBondContact O-CE2 3.2Å; P563-Y566 PolarHBondContact O-OH 3.42Å; Y566-I606 HydrophobicContact CD1-CG2 4.45Å; Y566-I607 WeakPolarHBondContact CA-O 3.28Å; Y566-S608 WeakPolarHBondContact CD1-OG 3.36Å; Y566-S608 VanDerWaalsContact CE1-OG 3.29Å; Y566-S608 WeakPolarHBondContact CE1-OG 3.36Å; Y566-I881 HydrophobicContact CE2-CD1 4.22Å
567	A	81.6	Confident	76.3	Confident	15 Å²	15	52.1 Å²	52.1	12%	0.124	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	156	177	0	0	0	0	0	111.7	I607 L615 M632	A567-I607 HydrophobicContact CB-CG1 4.33Å; A567-I607 PolarHBondContact N-O 3.16Å; A567-I607 WeakPolarHBondContact O-CG1 3.4Å; A567-I607 PolarHBondContact O-N 3.23Å; A567-L615 HydrophobicContact CB-CD1 3.93Å; A567-M632 HydrophobicContact CB-CE 3.19Å
568	A	86.3	Confident	78	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	137.5	176.9	0	0	0	0	0	110.4	Q604 W605 M632 G633 L635	A568-Q604 HydrophobicContact CB-CB 4.32Å; A568-W605 CarbonylContact C-O 3.53Å; A568-W605 WeakPolarHBondContact CA-O 3.47Å; A568-M632 WeakPolarHBondContact O-CA 3.45Å; A568-G633 PolarHBondContact N-O 2.63Å; A568-G633 PolarHBondContact O-N 2.7Å; A568-L635 HydrophobicContact CB-CD2 4.3Å
569	V	89.9	Confident	79.6	Confident	1 Å²	1	59 Å²	59	1%	0.006	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	128.7	177.8	156.1	0	0	0	0	109.3	L580 W605 I607 V630 M632	V569-L580 HydrophobicContact CG1-CD1 3.94Å; V569-L580 HydrophobicContact CG1-CD2 3.94Å; V569-W605 HydrophobicContact CB-CB 4.32Å; V569-W605 HydrophobicContact CG1-CB 4.44Å; V569-W605 PolarHBondContact N-O 3.4Å; V569-W605 WeakPolarHBondContact O-CB 3.4Å; V569-I607 HydrophobicContact CB-CG2 4.08Å; V569-I607 HydrophobicContact CG2-CB 4.39Å; V569-I607 HydrophobicContact CG2-CD1 3.53Å; V569-I607 HydrophobicContact CG2-CG1 3.78Å; V569-I607 HydrophobicContact CG2-CG2 3.74Å; V569-V630 HydrophobicContact CB-CG1 4.25Å; V569-V630 HydrophobicContact CG1-CG1 3.4Å; V569-V630 VanDerWaalsContact CG1-CG1 3.4Å; V569-V630 HydrophobicContact CG2-CG1 4.12Å; V569-M632 HydrophobicContact CG2-CE 4.07Å; V569-M632 HydrophobicContact CG2-SD 3.34Å; V569-M632 WeakPolarHBondContact CG2-SD 3.37Å
570	E	87.6	Confident	81.3	Confident	91 Å²	91	53.4 Å²	53.4	43%	0.425	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	137.5	175.1	-66.3	-178.7	-179.1	0	0	110.8	Q604 R631	E570-Q604 PolarHBondContact OE1-NE2 3.16Å; E570-R631 PolarHBondContact N-O 3.17Å; E570-R631 PolarHBondContact O-N 3.2Å
571	P	90.2	Very high	82.8	Confident	36 Å²	36	54.9 Å²	54.9	23%	0.234	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	146	174	29.2	-31.9	0	0	0	110.1	S573 E576 I577 L580	P571-S573 PolarHBondContact O-N 3.5Å; P571-E576 HydrophobicContact CB-CB 4.15Å; P571-I577 HydrophobicContact CG-CG1 3.82Å; P571-L580 HydrophobicContact CB-CD2 3.94Å; P571-L580 HydrophobicContact CG-CD2 4.13Å
572	G	87.7	Confident	84.2	Confident	38 Å²	38	58.5 Å²	58.5	39%	0.392	31%	0.309	S	S	.	.	S	Bend	trans	-62.6	-25.8	178.3	0	0	0	0	0	113.2	E576 N629	G572-E576 PolarHBondContact N-OE2 2.76Å; G572-N629 PolarHBondContact N-O 3.17Å
573	S	87.8	Confident	85.5	Confident	42 Å²	42	55 Å²	55	29%	0.294	29%	0.293	S	S	.	.	S	Bend	trans	-145.4	155.7	178.1	65.9	0	0	0	0	112.2	P571 S575 E576	P571-S573 PolarHBondContact O-N 3.5Å; S573-S575 PolarHBondContact O-N 2.8Å; S573-S575 PolarHBondContact OG-OG 3.32Å; S573-E576 PolarHBondContact N-OE2 3.3Å; S573-E576 PolarHBondContact O-N 3.26Å; S573-E576 VanDerWaalsContact O-N 3.09Å; S573-E576 VanDerWaalsContact OG-CD 3.27Å; S573-E576 WeakPolarHBondContact OG-CG 3.43Å; S573-E576 PolarHBondContact OG-OE2 3.13Å
574	R	87.5	Confident	86.6	Confident	232 Å²	232	54.4 Å²	54.4	88%	0.875	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-61.7	-24.4	175.8	-69.9	-176.1	178.5	178.8	-0.8	113.6	E576 I577	R574-E576 VanDerWaalsContact C-N 3.28Å; R574-E576 PolarHBondContact O-N 3.28Å; R574-I577 HydrophobicContact CB-CD1 4.27Å; R574-I577 WeakPolarHBondContact O-CD1 3.39Å; R574-I577 WeakPolarHBondContact O-CG1 3.25Å
575	S	89.3	Confident	87.6	Confident	106 Å²	106	57 Å²	57	74%	0.741	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-70.5	-22.5	176.1	37.7	0	0	0	0	113.7	S573	S573-S575 PolarHBondContact O-N 2.8Å; S573-S575 PolarHBondContact OG-OG 3.32Å
576	E	88.8	Confident	88.3	Confident	34 Å²	34	57.7 Å²	57.7	16%	0.159	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-89.6	-1.9	-176.6	-72.6	165	143.9	0	0	113	P571 G572 S573 R574 N578 A579 L580 V628 N629	P571-E576 HydrophobicContact CB-CB 4.15Å; G572-E576 PolarHBondContact N-OE2 2.76Å; S573-E576 PolarHBondContact N-OE2 3.3Å; S573-E576 PolarHBondContact O-N 3.26Å; S573-E576 VanDerWaalsContact O-N 3.09Å; S573-E576 VanDerWaalsContact OG-CD 3.27Å; S573-E576 WeakPolarHBondContact OG-CG 3.43Å; S573-E576 PolarHBondContact OG-OE2 3.13Å; R574-E576 VanDerWaalsContact C-N 3.28Å; R574-E576 PolarHBondContact O-N 3.28Å; E576-N578 PolarHBondContact O-N 2.82Å; E576-A579 PolarHBondContact O-N 3.45Å; E576-A579 VanDerWaalsContact O-N 3.16Å; E576-L580 WeakPolarHBondContact O-CB 3.29Å; E576-L580 PolarHBondContact O-N 2.89Å; E576-V628 HydrophobicContact CB-CG1 4.39Å; E576-N629 PolarHBondContact OE1-N 2.88Å; E576-N629 PolarHBondContact OE1-ND2 2.74Å
577	I	89.2	Confident	88.8	Confident	67 Å²	67	54.1 Å²	54.1	34%	0.344	29%	0.294	S	S	.	.	H	α-helix	trans	-55.2	-51.3	-176.2	-67.7	169.1	0	0	0	111.9	P571 R574 A579 L580 E581	P571-I577 HydrophobicContact CG-CG1 3.82Å; R574-I577 HydrophobicContact CB-CD1 4.27Å; R574-I577 WeakPolarHBondContact O-CD1 3.39Å; R574-I577 WeakPolarHBondContact O-CG1 3.25Å; I577-A579 VanDerWaalsContact C-N 3.3Å; I577-A579 PolarHBondContact O-N 2.98Å; I577-L580 WeakPolarHBondContact O-CB 3.29Å; I577-L580 PolarHBondContact O-N 3.11Å; I577-E581 PolarHBondContact O-N 3.18Å
578	N	90.8	Very high	89.1	Confident	124 Å²	124	56.2 Å²	56.2	66%	0.663	30%	0.301	S	S	*	.	H	α-helix	trans	-68.3	-32.2	-178.4	-62.9	-4.4	0	0	0	112.2	E576 H582	E576-N578 PolarHBondContact O-N 2.82Å; N578-H582 WeakPolarHBondContact O-CB 3.49Å; N578-H582 PolarHBondContact O-N 2.86Å
579	A	91.1	Very high	89	Confident	47 Å²	47	57.8 Å²	57.8	39%	0.388	31%	0.306	S	S	.	.	H	α-helix	trans	-70.8	-39.7	177.1	0	0	0	0	0	110.9	E576 I577 A583 V628	E576-A579 PolarHBondContact O-N 3.45Å; E576-A579 VanDerWaalsContact O-N 3.16Å; I577-A579 VanDerWaalsContact C-N 3.3Å; I577-A579 PolarHBondContact O-N 2.98Å; A579-A583 VanDerWaalsContact O-CB 3.29Å; A579-A583 WeakPolarHBondContact O-CB 3.46Å; A579-A583 PolarHBondContact O-N 3.25Å; A579-V628 HydrophobicContact CB-CG2 3.95Å
580	L	92.1	Very high	88.8	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-61.7	-49.3	172.6	177.4	63.7	0	0	0	110.9	V569 P571 E576 I577 H582 A583 L584 L622 V628 V630	V569-L580 HydrophobicContact CG1-CD1 3.94Å; V569-L580 HydrophobicContact CG1-CD2 3.94Å; P571-L580 HydrophobicContact CB-CD2 3.94Å; P571-L580 HydrophobicContact CG-CD2 4.13Å; E576-L580 WeakPolarHBondContact O-CB 3.29Å; E576-L580 PolarHBondContact O-N 2.89Å; I577-L580 WeakPolarHBondContact O-CB 3.29Å; I577-L580 PolarHBondContact O-N 3.11Å; L580-H582 VanDerWaalsContact C-N 3.33Å; L580-H582 PolarHBondContact O-N 2.79Å; L580-A583 PolarHBondContact O-N 3.48Å; L580-L584 HydrophobicContact CD1-CD1 3.88Å; L580-L584 HydrophobicContact CD1-CD2 4.4Å; L580-L584 HydrophobicContact CD1-CG 3.92Å; L580-L584 HydrophobicContact CD2-CD1 4.48Å; L580-L584 HydrophobicContact CG-CD1 3.81Å; L580-L584 HydrophobicContact CG-CG 4.25Å; L580-L584 WeakPolarHBondContact O-CB 3.37Å; L580-L584 VanDerWaalsContact O-CG 3.26Å; L580-L584 WeakPolarHBondContact O-CG 3.29Å; L580-L584 PolarHBondContact O-N 3.01Å; L580-L622 HydrophobicContact CD1-CD1 4.47Å; L580-V628 HydrophobicContact CB-CG1 3.99Å; L580-V628 HydrophobicContact CD1-CG1 4.24Å; L580-V630 HydrophobicContact CD1-CG2 3.72Å
581	E	91.5	Very high	88.6	Confident	81 Å²	81	54.9 Å²	54.9	38%	0.379	29%	0.294	S	S	.	.	H	α-helix	trans	-58.3	-44.9	178	-178	178.9	-175.1	0	0	111.8	I577 N585 W605	I577-E581 PolarHBondContact O-N 3.18Å; E581-N585 WeakPolarHBondContact O-CB 3.39Å; E581-N585 PolarHBondContact O-N 3.49Å; E581-N585 VanDerWaalsContact O-N 3.08Å; E581-N585 PolarHBondContact O-ND2 3.08Å; E581-N585 VanDerWaalsContact O-ND2 3.09Å; E581-W605 HydrophobicContact CB-CH2 4.43Å; E581-W605 HydrophobicContact CB-CZ2 4.1Å; E581-W605 HydrophobicContact CG-CH2 3.94Å; E581-W605 HydrophobicContact CG-CZ2 4.01Å
582	H	89.2	Confident	88.1	Confident	116 Å²	116	54.3 Å²	54.3	54%	0.537	29%	0.29	S	S	.	.	H	α-helix	trans	-61.9	-46.6	175.5	-178.3	58.4	0	0	0	112.1	N578 L580 N585 C586	N578-H582 WeakPolarHBondContact O-CB 3.49Å; N578-H582 PolarHBondContact O-N 2.86Å; L580-H582 VanDerWaalsContact C-N 3.33Å; L580-H582 PolarHBondContact O-N 2.79Å; H582-N585 PolarHBondContact O-N 3.21Å; H582-C586 VanDerWaalsContact CE1-SG 3.59Å; H582-C586 PolarHBondContact O-N 2.85Å; H582-C586 PolarHBondContact O-SG 3.3Å; H582-C586 VanDerWaalsContact O-SG 3.33Å
583	A	90	Very high	87.8	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.9	-44.6	-179.9	0	0	0	0	0	112	A579 L580 N585 C586 M587 L622 Y626 V628	A579-A583 VanDerWaalsContact O-CB 3.29Å; A579-A583 WeakPolarHBondContact O-CB 3.46Å; A579-A583 PolarHBondContact O-N 3.25Å; L580-A583 PolarHBondContact O-N 3.48Å; A583-N585 PolarHBondContact O-N 2.91Å; A583-C586 PolarHBondContact O-N 3.21Å; A583-M587 VanDerWaalsContact O-CG 3.29Å; A583-M587 WeakPolarHBondContact O-CG 3.46Å; A583-M587 PolarHBondContact O-N 2.94Å; A583-L622 HydrophobicContact CB-CD2 3.52Å; A583-Y626 HydrophobicContact CB-CD1 3.58Å; A583-Y626 HydrophobicContact CB-CD2 4.01Å; A583-Y626 HydrophobicContact CB-CE1 4.16Å; A583-Y626 HydrophobicContact CB-CG 3.5Å; A583-Y626 VanDerWaalsContact CB-CG 3.5Å; A583-V628 HydrophobicContact CB-CG2 4.41Å
584	L	91.8	Very high	87.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.2	-43.5	177.4	-71.6	175.1	0	0	0	111.9	L580 C586 M587 Q588 F594 V596 W605 I607 L622	L580-L584 HydrophobicContact CD1-CD1 3.88Å; L580-L584 HydrophobicContact CD1-CD2 4.4Å; L580-L584 HydrophobicContact CD1-CG 3.92Å; L580-L584 HydrophobicContact CD2-CD1 4.48Å; L580-L584 HydrophobicContact CG-CD1 3.81Å; L580-L584 HydrophobicContact CG-CG 4.25Å; L580-L584 WeakPolarHBondContact O-CB 3.37Å; L580-L584 VanDerWaalsContact O-CG 3.26Å; L580-L584 WeakPolarHBondContact O-CG 3.29Å; L580-L584 PolarHBondContact O-N 3.01Å; L584-C586 PolarHBondContact O-N 2.93Å; L584-M587 PolarHBondContact O-N 3.38Å; L584-Q588 WeakPolarHBondContact O-CB 3.25Å; L584-Q588 PolarHBondContact O-N 3.09Å; L584-F594 HydrophobicContact CD2-CE1 4.04Å; L584-F594 HydrophobicContact CD2-CZ 3.93Å; L584-V596 HydrophobicContact CB-CG1 4.08Å; L584-V596 HydrophobicContact CB-CG2 4.16Å; L584-V596 HydrophobicContact CD1-CG1 3.83Å; L584-V596 HydrophobicContact CD2-CG2 4.08Å; L584-V596 HydrophobicContact CG-CG1 4.36Å; L584-W605 HydrophobicContact CD1-CB 4.35Å; L584-W605 HydrophobicContact CD1-CD2 3.93Å; L584-W605 HydrophobicContact CD1-CE3 3.9Å; L584-W605 HydrophobicContact CD1-CG 4.16Å; L584-W605 HydrophobicContact CD1-CZ3 4.48Å; L584-I607 HydrophobicContact CD2-CG2 4.13Å; L584-L622 HydrophobicContact CD2-CD1 4.1Å
585	N	88	Confident	87.6	Confident	78 Å²	78	42.8 Å²	42.8	42%	0.417	23%	0.231	S	C	.	.	H	α-helix	trans	-62.9	-41	175.5	-76.6	-36.5	0	0	0	112.4	E581 H582 A583 R589	E581-N585 WeakPolarHBondContact O-CB 3.39Å; E581-N585 PolarHBondContact O-N 3.49Å; E581-N585 VanDerWaalsContact O-N 3.08Å; E581-N585 PolarHBondContact O-ND2 3.08Å; E581-N585 VanDerWaalsContact O-ND2 3.09Å; H582-N585 PolarHBondContact O-N 3.21Å; A583-N585 PolarHBondContact O-N 2.91Å; N585-R589 PolarHBondContact O-N 3.22Å; N585-R589 VanDerWaalsContact O-N 3.12Å
586	C	86.1	Confident	87.6	Confident	24 Å²	24	38.7 Å²	38.7	16%	0.162	20%	0.202	C	C	.	.	H	α-helix	trans	-64.6	-42.5	175.3	-70.3	0	0	0	0	111.7	H582 A583 L584 R589 E590 Y626	H582-C586 VanDerWaalsContact CE1-SG 3.59Å; H582-C586 PolarHBondContact O-N 2.85Å; H582-C586 PolarHBondContact O-SG 3.3Å; H582-C586 VanDerWaalsContact O-SG 3.33Å; A583-C586 PolarHBondContact O-N 3.21Å; L584-C586 PolarHBondContact O-N 2.93Å; C586-R589 VanDerWaalsContact O-CB 3.32Å; C586-R589 WeakPolarHBondContact O-CB 3.31Å; C586-R589 PolarHBondContact O-N 3.01Å; C586-E590 WeakPolarHBondContact O-CG 3.45Å; C586-E590 PolarHBondContact O-N 3.3Å; C586-E590 VanDerWaalsContact O-N 3.14Å; C586-Y626 HydrophobicContact CB-CE1 3.91Å; C586-Y626 WeakPolarHBondContact CB-OH 3.37Å
587	M	87.6	Confident	87.5	Confident	5 Å²	5	43.8 Å²	43.8	3%	0.025	22%	0.223	C	C	.	.	H	α-helix	trans	-66.6	-41.7	178.7	-70.1	-169.8	75.1	0	0	112.9	A583 L584 R589 E590 D591 F594 I618 R621 L622 Y626	A583-M587 VanDerWaalsContact O-CG 3.29Å; A583-M587 WeakPolarHBondContact O-CG 3.46Å; A583-M587 PolarHBondContact O-N 2.94Å; L584-M587 PolarHBondContact O-N 3.38Å; M587-R589 PolarHBondContact O-N 3.14Å; M587-E590 PolarHBondContact O-N 3.21Å; M587-E590 VanDerWaalsContact O-N 3.13Å; M587-D591 PolarHBondContact O-N 3.18Å; M587-F594 HydrophobicContact CB-CD1 4.06Å; M587-F594 HydrophobicContact CB-CE1 4.03Å; M587-I618 HydrophobicContact CE-CB 3.86Å; M587-I618 HydrophobicContact CE-CG1 3.82Å; M587-I618 HydrophobicContact CE-CG2 3.54Å; M587-I618 HydrophobicContact SD-CG2 4.07Å; M587-R621 HydrophobicContact CE-CB 4.05Å; M587-L622 HydrophobicContact CG-CD2 4.48Å; M587-L622 HydrophobicContact SD-CD1 4.41Å; M587-L622 HydrophobicContact SD-CD2 3.37Å; M587-L622 WeakPolarHBondContact SD-CD2 3.42Å; M587-L622 HydrophobicContact SD-CG 3.55Å; M587-L622 VanDerWaalsContact SD-CG 3.55Å; M587-Y626 HydrophobicContact CG-CE2 3.92Å; M587-Y626 HydrophobicContact SD-CE2 4.35Å
588	Q	88.4	Confident	87.4	Confident	58 Å²	58	45.6 Å²	45.6	27%	0.271	23%	0.229	S	C	.	.	H	α-helix	trans	-63.6	-28.7	173.8	-178.8	170.3	0.7	0	0	112.1	L584 D591 F594	L584-Q588 WeakPolarHBondContact O-CB 3.25Å; L584-Q588 PolarHBondContact O-N 3.09Å; Q588-D591 CarbonylContact O-C 3.46Å; Q588-F594 HydrophobicContact CB-CD1 4.42Å; Q588-F594 WeakPolarHBondContact CG-O 3.38Å
589	R	85.1	Confident	86.9	Confident	33 Å²	33	41 Å²	41	13%	0.125	20%	0.204	C	C	.	.	H	α-helix	trans	-69.3	-37.6	173.2	-161.8	-177.8	89.7	168.1	18.2	112.4	I444 L512 Q513 T515 Y516 T517 N585 C586 M587	I444-R589 HydrophobicContact CD1-CG 4.16Å; L512-R589 PolarHBondContact O-NH2 3.23Å; Q513-R589 PolarHBondContact O-NH1 2.9Å; T515-R589 WeakPolarHBondContact O-CD 3.11Å; T515-R589 PolarHBondContact O-NE 3.3Å; Y516-R589 HydrophobicContact CD1-CB 4.19Å; Y516-R589 HydrophobicContact CD1-CG 3.7Å; Y516-R589 HydrophobicContact CD2-CG 3.86Å; Y516-R589 HydrophobicContact CE1-CB 3.99Å; Y516-R589 HydrophobicContact CE1-CG 3.77Å; Y516-R589 HydrophobicContact CE2-CG 3.93Å; Y516-R589 HydrophobicContact CG-CG 3.75Å; T517-R589 PolarHBondContact OG1-O 3.46Å; N585-R589 PolarHBondContact O-N 3.22Å; N585-R589 VanDerWaalsContact O-N 3.12Å; C586-R589 VanDerWaalsContact O-CB 3.32Å; C586-R589 WeakPolarHBondContact O-CB 3.31Å; C586-R589 PolarHBondContact O-N 3.01Å; M587-R589 PolarHBondContact O-N 3.14Å
590	E	84.3	Confident	86.3	Confident	10 Å²	10	41.8 Å²	41.8	5%	0.047	22%	0.217	C	C	.	.	H	α-helix	trans	-72.8	-45.7	177.8	-67	-176.6	166.8	0	0	112.2	R140 I444 F446 T517 C586 M587 P592 R621	R140-E590 PolarHBondContact NH1-O 2.98Å; I444-E590 HydrophobicContact CB-CG 4.33Å; I444-E590 HydrophobicContact CG2-CG 4.21Å; I444-E590 WeakPolarHBondContact O-CG 3.43Å; F446-E590 WeakPolarHBondContact CB-OE1 3.39Å; F446-E590 PolarHBondContact N-OE1 2.87Å; T517-E590 PolarHBondContact OG1-O 3.12Å; C586-E590 WeakPolarHBondContact O-CG 3.45Å; C586-E590 PolarHBondContact O-N 3.3Å; C586-E590 VanDerWaalsContact O-N 3.14Å; M587-E590 PolarHBondContact O-N 3.21Å; M587-E590 VanDerWaalsContact O-N 3.13Å; E590-P592 WeakPolarHBondContact O-CD 3.44Å; E590-R621 IonicContact OE1-NH2 3.62Å; E590-R621 IonicContact OE2-CZ 3.23Å; E590-R621 IonicContact OE2-NH1 3.07Å; E590-R621 PolarHBondContact OE2-NH1 3.19Å; E590-R621 IonicContact OE2-NH2 2.73Å; E590-R621 PolarHBondContact OE2-NH2 3.22Å
591	D	83.5	Confident	85.2	Confident	21 Å²	21	47.1 Å²	47.1	11%	0.112	24%	0.242	C	C	.	.			trans	-122	97.3	-177.9	-167.9	-13.9	0	0	0	112	F136 R140 M587 Q588 S593 F594 H614	F136-D591 WeakPolarHBondContact CD1-OD1 3.37Å; F136-D591 WeakPolarHBondContact CE1-OD1 3.42Å; R140-D591 IonicContact NH2-OD1 2.66Å; R140-D591 IonicContact NH2-OD2 3.36Å; M587-D591 PolarHBondContact O-N 3.18Å; Q588-D591 CarbonylContact O-C 3.46Å; D591-S593 VanDerWaalsContact CG-OG 3.26Å; D591-S593 PolarHBondContact O-N 3.22Å; D591-S593 VanDerWaalsContact O-N 3.14Å; D591-S593 WeakPolarHBondContact OD1-CB 3.35Å; D591-S593 PolarHBondContact OD1-N 3.12Å; D591-S593 PolarHBondContact OD1-OG 2.76Å; D591-S593 PolarHBondContact OD2-OG 3.21Å; D591-F594 HydrophobicContact CB-CB 4.23Å; D591-F594 WeakPolarHBondContact O-CB 3.33Å; D591-F594 PolarHBondContact O-N 2.96Å; D591-H614 IonicContact OD2-CE1 3.61Å; D591-H614 PolarHBondContact OD2-CE1 3.19Å; D591-H614 IonicContact OD2-NE2 3.78Å; D591-H614 PolarHBondContact OD2-NE2 2.95Å
592	P	80.7	Confident	84.5	Confident	25 Å²	25	44.9 Å²	44.9	16%	0.162	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-21.6	173.2	-27.3	26	0	0	0	116.5	F136 T517 V560 E590 F594 H595	F136-P592 HydrophobicContact CE1-CB 3.94Å; F136-P592 HydrophobicContact CE1-CG 3.95Å; F136-P592 HydrophobicContact CZ-CB 3.67Å; F136-P592 HydrophobicContact CZ-CG 3.84Å; T517-P592 HydrophobicContact CG2-CG 4.16Å; V560-P592 HydrophobicContact CG2-CB 4.47Å; E590-P592 WeakPolarHBondContact O-CD 3.44Å; P592-F594 VanDerWaalsContact C-N 3.25Å; P592-H595 PolarHBondContact O-CE1 3.08Å
593	S	80.9	Confident	84	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.007	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-13.6	175.9	74.6	0	0	0	0	113.4	D591	D591-S593 VanDerWaalsContact CG-OG 3.26Å; D591-S593 PolarHBondContact O-N 3.22Å; D591-S593 VanDerWaalsContact O-N 3.14Å; D591-S593 WeakPolarHBondContact OD1-CB 3.35Å; D591-S593 PolarHBondContact OD1-N 3.12Å; D591-S593 PolarHBondContact OD1-OG 2.76Å; D591-S593 PolarHBondContact OD2-OG 3.21Å
594	F	86.8	Confident	83.7	Confident	1 Å²	1	42.1 Å²	42.1	0%	0.004	23%	0.234	C	C	.	.			trans	-88.4	109.9	173.2	179	-118.5	0	0	0	109.6	L584 M587 Q588 D591 P592 V596 I607 S608 L615 I618	L584-F594 HydrophobicContact CD2-CE1 4.04Å; L584-F594 HydrophobicContact CD2-CZ 3.93Å; M587-F594 HydrophobicContact CB-CD1 4.06Å; M587-F594 HydrophobicContact CB-CE1 4.03Å; Q588-F594 HydrophobicContact CB-CD1 4.42Å; Q588-F594 WeakPolarHBondContact CG-O 3.38Å; D591-F594 HydrophobicContact CB-CB 4.23Å; D591-F594 WeakPolarHBondContact O-CB 3.33Å; D591-F594 PolarHBondContact O-N 2.96Å; P592-F594 VanDerWaalsContact C-N 3.25Å; F594-V596 HydrophobicContact CD1-CG2 3.82Å; F594-V596 HydrophobicContact CE1-CG2 3.19Å; F594-V596 HydrophobicContact CE2-CG2 4.38Å; F594-V596 HydrophobicContact CZ-CG2 3.53Å; F594-I607 HydrophobicContact CE2-CB 3.7Å; F594-I607 HydrophobicContact CE2-CD1 4.15Å; F594-I607 HydrophobicContact CE2-CG1 4.45Å; F594-I607 HydrophobicContact CE2-CG2 4.12Å; F594-I607 HydrophobicContact CZ-CB 3.93Å; F594-I607 HydrophobicContact CZ-CG2 3.8Å; F594-S608 WeakPolarHBondContact CD2-O 3.3Å; F594-L615 HydrophobicContact CE2-CD2 4.39Å; F594-I618 HydrophobicContact CB-CD1 4.28Å; F594-I618 HydrophobicContact CD2-CD1 3.21Å; F594-I618 HydrophobicContact CD2-CG1 4.29Å; F594-I618 HydrophobicContact CD2-CG2 4.46Å; F594-I618 HydrophobicContact CE1-CG2 4.32Å; F594-I618 HydrophobicContact CE2-CD1 3.54Å; F594-I618 HydrophobicContact CE2-CG1 4.39Å; F594-I618 HydrophobicContact CE2-CG2 3.77Å; F594-I618 HydrophobicContact CG-CD1 3.82Å; F594-I618 HydrophobicContact CZ-CD1 4.4Å; F594-I618 HydrophobicContact CZ-CG2 3.7Å
595	H	85.2	Confident	83.5	Confident	67 Å²	67	43.8 Å²	43.8	31%	0.31	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	136	178.3	-66.5	-72.2	0	0	0	110.9	P592 I607 S608	P592-H595 PolarHBondContact O-CE1 3.08Å; H595-I607 CarbonylContact O-C 3.58Å; H595-I607 WeakPolarHBondContact O-CA 3.31Å; H595-S608 PolarHBondContact N-O 2.86Å; H595-S608 PolarHBondContact O-N 2.9Å
596	V	87.9	Confident	83.5	Confident	21 Å²	21	41.8 Å²	41.8	13%	0.127	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	129.6	176.1	-178.4	0	0	0	0	108.3	L584 F594 W605 I607	L584-V596 HydrophobicContact CB-CG1 4.08Å; L584-V596 HydrophobicContact CB-CG2 4.16Å; L584-V596 HydrophobicContact CD1-CG1 3.83Å; L584-V596 HydrophobicContact CD2-CG2 4.08Å; L584-V596 HydrophobicContact CG-CG1 4.36Å; F594-V596 HydrophobicContact CD1-CG2 3.82Å; F594-V596 HydrophobicContact CE1-CG2 3.19Å; F594-V596 HydrophobicContact CE2-CG2 4.38Å; F594-V596 HydrophobicContact CZ-CG2 3.53Å; V596-W605 HydrophobicContact CG1-CE3 3.41Å; V596-W605 VanDerWaalsContact CG1-CE3 3.41Å; V596-W605 HydrophobicContact CG1-CZ3 3.64Å; V596-I607 HydrophobicContact CG2-CG2 4.39Å
597	K	86.8	Confident	83.6	Confident	141 Å²	141	40.8 Å²	40.8	61%	0.613	22%	0.222	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-135.7	127.4	173.6	-175.2	-179.4	177	-172.6	0	109.2	D599 I606	K597-D599 PolarHBondContact O-N 2.97Å; K597-I606 PolarHBondContact N-O 3.48Å; K597-I606 PolarHBondContact O-N 3.26Å
598	F	87.3	Confident	83.4	Confident	104 Å²	104	41 Å²	41	46%	0.456	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	118.8	165	-175.6	-106.7	0	0	0	108.5	W605	F598-W605 HydrophobicContact CB-CD2 4.14Å; F598-W605 HydrophobicContact CB-CE3 3.86Å; F598-W605 HydrophobicContact CB-CH2 3.96Å; F598-W605 HydrophobicContact CB-CZ2 4.21Å; F598-W605 HydrophobicContact CB-CZ3 3.78Å; F598-W605 AromaticContact CD2-CD1 3.95Å; F598-W605 AromaticContact CD2-CD2 3.83Å; F598-W605 HydrophobicContact CD2-CD2 3.83Å; F598-W605 AromaticContact CD2-CE2 3.66Å; F598-W605 HydrophobicContact CD2-CE3 4.41Å; F598-W605 HydrophobicContact CD2-CG 4.04Å; F598-W605 HydrophobicContact CD2-CZ2 4.14Å; F598-W605 AromaticContact CD2-NE1 3.7Å; F598-W605 HydrophobicContact CG-CD2 4.46Å; F598-W605 HydrophobicContact CG-CZ2 4.42Å
599	D	80.3	Confident	82.8	Confident	28 Å²	28	38.2 Å²	38.2	15%	0.15	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	110.6	173	179.3	31.1	0	0	0	109.8	K597 E601 T602 G603 Q604 I606	K597-D599 PolarHBondContact O-N 2.97Å; D599-E601 PolarHBondContact O-N 2.84Å; D599-E601 PolarHBondContact OD1-N 3.38Å; D599-T602 WeakPolarHBondContact CB-OG1 3.29Å; D599-T602 VanDerWaalsContact OD2-CB 3.3Å; D599-T602 WeakPolarHBondContact OD2-CB 3.26Å; D599-T602 WeakPolarHBondContact OD2-CG2 3.48Å; D599-T602 PolarHBondContact OD2-N 2.7Å; D599-T602 VanDerWaalsContact OD2-N 3.11Å; D599-T602 PolarHBondContact OD2-OG1 3.01Å; D599-G603 VanDerWaalsContact O-CA 3.26Å; D599-G603 WeakPolarHBondContact O-CA 3.26Å; D599-G603 PolarHBondContact O-N 3.5Å; D599-Q604 PolarHBondContact N-O 2.83Å; D599-Q604 PolarHBondContact O-N 2.79Å; D599-I606 HydrophobicContact CB-CD1 3.66Å; D599-I606 HydrophobicContact CB-CG1 4.18Å
600	G	78.4	Confident	82.5	Confident	64 Å²	64	37.2 Å²	37.2	66%	0.66	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-24.1	178.9	0	0	0	0	0	113.5
601	E	69.7	Low	81.9	Confident	112 Å²	112	36.8 Å²	36.8	52%	0.523	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-47.7	179.3	-66	-171.8	-177.7	0	0	111.2	D599 K640	D599-E601 PolarHBondContact O-N 2.84Å; D599-E601 PolarHBondContact OD1-N 3.38Å; E601-K640 IonicContact OE1-NZ 2.61Å; E601-K640 IonicContact OE2-NZ 2.76Å
602	T	76.5	Confident	81.6	Confident	34 Å²	34	38.6 Å²	38.6	21%	0.209	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-18.7	177.9	58.6	0	0	0	0	113.9	D599 Q604 L636	D599-T602 WeakPolarHBondContact CB-OG1 3.29Å; D599-T602 VanDerWaalsContact OD2-CB 3.3Å; D599-T602 WeakPolarHBondContact OD2-CB 3.26Å; D599-T602 WeakPolarHBondContact OD2-CG2 3.48Å; D599-T602 PolarHBondContact OD2-N 2.7Å; D599-T602 VanDerWaalsContact OD2-N 3.11Å; D599-T602 PolarHBondContact OD2-OG1 3.01Å; T602-Q604 PolarHBondContact O-N 3.2Å; T602-L636 HydrophobicContact CG2-CB 3.87Å
603	G	78.8	Confident	81.7	Confident	47 Å²	47	38.7 Å²	38.7	49%	0.485	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.5	15.8	-173.8	0	0	0	0	0	113.8	D599	D599-G603 VanDerWaalsContact O-CA 3.26Å; D599-G603 WeakPolarHBondContact O-CA 3.26Å; D599-G603 PolarHBondContact O-N 3.5Å
604	Q	83.8	Confident	81.8	Confident	10 Å²	10	39 Å²	39	5%	0.047	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	148.7	-177.5	-63.9	-173.6	-44.1	0	0	111.5	A568 E570 D599 T602 I606 L636	A568-Q604 HydrophobicContact CB-CB 4.32Å; E570-Q604 PolarHBondContact OE1-NE2 3.16Å; D599-Q604 PolarHBondContact N-O 2.83Å; D599-Q604 PolarHBondContact O-N 2.79Å; T602-Q604 PolarHBondContact O-N 3.2Å; Q604-I606 PolarHBondContact O-N 3.13Å; Q604-L636 VanDerWaalsContact CD-CD1 3.48Å; Q604-L636 HydrophobicContact CG-CD1 4.26Å; Q604-L636 VanDerWaalsContact OE1-CG 3.3Å
605	W	87.7	Confident	81.8	Confident	36 Å²	36	39.3 Å²	39.3	14%	0.136	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	114	163.6	-73.4	93.6	0	0	0	108.4	A568 V569 E581 L584 V596 F598	A568-W605 CarbonylContact C-O 3.53Å; A568-W605 WeakPolarHBondContact CA-O 3.47Å; V569-W605 HydrophobicContact CB-CB 4.32Å; V569-W605 HydrophobicContact CG1-CB 4.44Å; V569-W605 PolarHBondContact N-O 3.4Å; V569-W605 WeakPolarHBondContact O-CB 3.4Å; E581-W605 HydrophobicContact CB-CH2 4.43Å; E581-W605 HydrophobicContact CB-CZ2 4.1Å; E581-W605 HydrophobicContact CG-CH2 3.94Å; E581-W605 HydrophobicContact CG-CZ2 4.01Å; L584-W605 HydrophobicContact CD1-CB 4.35Å; L584-W605 HydrophobicContact CD1-CD2 3.93Å; L584-W605 HydrophobicContact CD1-CE3 3.9Å; L584-W605 HydrophobicContact CD1-CG 4.16Å; L584-W605 HydrophobicContact CD1-CZ3 4.48Å; V596-W605 HydrophobicContact CG1-CE3 3.41Å; V596-W605 VanDerWaalsContact CG1-CE3 3.41Å; V596-W605 HydrophobicContact CG1-CZ3 3.64Å; F598-W605 HydrophobicContact CB-CD2 4.14Å; F598-W605 HydrophobicContact CB-CE3 3.86Å; F598-W605 HydrophobicContact CB-CH2 3.96Å; F598-W605 HydrophobicContact CB-CZ2 4.21Å; F598-W605 HydrophobicContact CB-CZ3 3.78Å; F598-W605 AromaticContact CD2-CD1 3.95Å; F598-W605 AromaticContact CD2-CD2 3.83Å; F598-W605 HydrophobicContact CD2-CD2 3.83Å; F598-W605 AromaticContact CD2-CE2 3.66Å; F598-W605 HydrophobicContact CD2-CE3 4.41Å; F598-W605 HydrophobicContact CD2-CG 4.04Å; F598-W605 HydrophobicContact CD2-CZ2 4.14Å; F598-W605 AromaticContact CD2-NE1 3.7Å; F598-W605 HydrophobicContact CG-CD2 4.46Å; F598-W605 HydrophobicContact CG-CZ2 4.42Å
606	I	87	Confident	81.8	Confident	36 Å²	36	40.2 Å²	40.2	19%	0.185	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	119.5	173.7	-58.6	177.4	0	0	0	107.1	Y566 K597 D599 Q604 L635	Y566-I606 HydrophobicContact CD1-CG2 4.45Å; K597-I606 PolarHBondContact N-O 3.48Å; K597-I606 PolarHBondContact O-N 3.26Å; D599-I606 HydrophobicContact CB-CD1 3.66Å; D599-I606 HydrophobicContact CB-CG1 4.18Å; Q604-I606 PolarHBondContact O-N 3.13Å; I606-L635 HydrophobicContact CG1-CD2 4.21Å; I606-L635 HydrophobicContact CG2-CD2 3.92Å
607	I	88.6	Confident	81.7	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	146.9	171.2	68.8	163.8	0	0	0	109.6	Y566 A567 V569 L584 F594 H595 V596 L615 M632	Y566-I607 WeakPolarHBondContact CA-O 3.28Å; A567-I607 HydrophobicContact CB-CG1 4.33Å; A567-I607 PolarHBondContact N-O 3.16Å; A567-I607 WeakPolarHBondContact O-CG1 3.4Å; A567-I607 PolarHBondContact O-N 3.23Å; V569-I607 HydrophobicContact CB-CG2 4.08Å; V569-I607 HydrophobicContact CG2-CB 4.39Å; V569-I607 HydrophobicContact CG2-CD1 3.53Å; V569-I607 HydrophobicContact CG2-CG1 3.78Å; V569-I607 HydrophobicContact CG2-CG2 3.74Å; L584-I607 HydrophobicContact CD2-CG2 4.13Å; F594-I607 HydrophobicContact CE2-CB 3.7Å; F594-I607 HydrophobicContact CE2-CD1 4.15Å; F594-I607 HydrophobicContact CE2-CG1 4.45Å; F594-I607 HydrophobicContact CE2-CG2 4.12Å; F594-I607 HydrophobicContact CZ-CB 3.93Å; F594-I607 HydrophobicContact CZ-CG2 3.8Å; H595-I607 CarbonylContact O-C 3.58Å; H595-I607 WeakPolarHBondContact O-CA 3.31Å; V596-I607 HydrophobicContact CG2-CG2 4.39Å; I607-L615 HydrophobicContact CD1-CD2 3.88Å; I607-L615 HydrophobicContact CG1-CD2 4.27Å; I607-M632 HydrophobicContact CD1-CE 3.66Å; I607-M632 HydrophobicContact CD1-SD 4.16Å; I607-M632 HydrophobicContact CG1-CE 4.11Å
608	S	82.9	Confident	81.8	Confident	9 Å²	9	33 Å²	33	6%	0.063	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	140.6	-179.6	-36.1	0	0	0	0	110.2	V565 Y566 F594 H595	V565-S608 CarbonylContact O-C 3.58Å; V565-S608 WeakPolarHBondContact O-CA 3.44Å; Y566-S608 WeakPolarHBondContact CD1-OG 3.36Å; Y566-S608 VanDerWaalsContact CE1-OG 3.29Å; Y566-S608 WeakPolarHBondContact CE1-OG 3.36Å; F594-S608 WeakPolarHBondContact CD2-O 3.3Å; H595-S608 PolarHBondContact N-O 2.86Å; H595-S608 PolarHBondContact O-N 2.9Å
609	G	77.7	Confident	81.8	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	174.8	-177.9	0	0	0	0	0	112.9	V564 V565 G611	V564-G609 PolarHBondContact N-O 2.88Å; V565-G609 PolarHBondContact N-O 3.23Å; V565-G609 PolarHBondContact O-N 3.41Å; G609-G611 VanDerWaalsContact C-N 3.27Å; G609-G611 PolarHBondContact O-N 2.55Å
610	M	76.9	Confident	82.1	Confident	13 Å²	13	29.7 Å²	29.7	6%	0.064	18%	0.182	C	C	.	.	S	Bend	trans	-65.8	-19.2	-176.4	-65.6	-57.2	-64.1	0	0	115.5	D133 H614 R870	D133-M610 VanDerWaalsContact O-CB 3.31Å; D133-M610 WeakPolarHBondContact O-CB 3.15Å; M610-H614 PolarHBondContact N-ND1 3.47Å; M610-R870 PolarHBondContact O-NH2 2.89Å
611	G	73.2	Confident	82.5	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.158	C	C	.	.			trans	-178.2	168.6	-175	0	0	0	0	0	113.4	D133 V565 G609 L613 H614 L615	D133-G611 WeakPolarHBondContact OD2-CA 3.43Å; V565-G611 VanDerWaalsContact CG2-CA 3.49Å; G609-G611 VanDerWaalsContact C-N 3.27Å; G609-G611 PolarHBondContact O-N 2.55Å; G611-L613 VanDerWaalsContact C-N 3.33Å; G611-L613 PolarHBondContact O-N 3.41Å; G611-H614 WeakPolarHBondContact O-CB 3.43Å; G611-H614 PolarHBondContact O-N 2.93Å; G611-L615 PolarHBondContact O-N 3.38Å; G611-L615 VanDerWaalsContact O-N 3.14Å
612	D	77.5	Confident	83.4	Confident	59 Å²	59	23.2 Å²	23.2	32%	0.316	13%	0.133	S	C	.	.	H	α-helix	trans	-63.1	-40.3	-179.7	-55.1	-38	0	0	0	111.6	V565 H614 L615 D616	V565-D612 WeakPolarHBondContact CG1-OD1 3.18Å; D612-H614 PolarHBondContact O-N 3.3Å; D612-L615 PolarHBondContact O-N 2.91Å; D612-D616 PolarHBondContact O-N 3.38Å
613	L	81.4	Confident	84	Confident	28 Å²	28	26.3 Å²	26.3	15%	0.147	14%	0.143	C	C	.	.	H	α-helix	trans	-61.9	-37.1	177.1	-168.1	76.4	0	0	0	111.3	I107 D133 F134 G611 V617	I107-L613 HydrophobicContact CD1-CD2 3.7Å; D133-L613 HydrophobicContact CB-CB 4.24Å; D133-L613 WeakPolarHBondContact OD2-CB 3.39Å; D133-L613 PolarHBondContact OD2-N 3.03Å; F134-L613 HydrophobicContact CE2-CD2 3.69Å; F134-L613 HydrophobicContact CE2-CG 4.27Å; F134-L613 HydrophobicContact CZ-CD2 4.21Å; F134-L613 HydrophobicContact CZ-CG 4.29Å; G611-L613 VanDerWaalsContact C-N 3.33Å; G611-L613 PolarHBondContact O-N 3.41Å; L613-V617 VanDerWaalsContact O-CG2 3.28Å; L613-V617 WeakPolarHBondContact O-CG2 3.3Å; L613-V617 PolarHBondContact O-N 2.96Å
614	H	83.9	Confident	84.2	Confident	6 Å²	6	28.1 Å²	28.1	3%	0.028	14%	0.136	C	C	.	.	H	α-helix	trans	-64.5	-48.2	177.2	-177.3	-162	0	0	0	110.7	D133 F134 D591 M610 G611 D612 D616 V617 I618	D133-H614 HydrophobicContact CB-CB 4.25Å; F134-H614 HydrophobicContact CE1-CB 4.07Å; F134-H614 AromaticContact CE1-CD2 3.8Å; D591-H614 IonicContact OD2-CE1 3.61Å; D591-H614 PolarHBondContact OD2-CE1 3.19Å; D591-H614 IonicContact OD2-NE2 3.78Å; D591-H614 PolarHBondContact OD2-NE2 2.95Å; M610-H614 PolarHBondContact N-ND1 3.47Å; G611-H614 WeakPolarHBondContact O-CB 3.43Å; G611-H614 PolarHBondContact O-N 2.93Å; D612-H614 PolarHBondContact O-N 3.3Å; H614-D616 VanDerWaalsContact C-N 3.34Å; H614-D616 PolarHBondContact O-N 3.32Å; H614-V617 PolarHBondContact O-N 3.28Å; H614-I618 WeakPolarHBondContact CD2-CD1 3.49Å; H614-I618 VanDerWaalsContact NE2-CD1 3.25Å; H614-I618 WeakPolarHBondContact NE2-CD1 3.31Å; H614-I618 WeakPolarHBondContact O-CD1 3.41Å; H614-I618 WeakPolarHBondContact O-CG1 3.26Å; H614-I618 PolarHBondContact O-N 3.05Å
615	L	85.8	Confident	84.2	Confident	9 Å²	9	29.9 Å²	29.9	5%	0.047	14%	0.144	C	C	.	.	H	α-helix	trans	-63.9	-37.9	177.5	-62.2	-170.9	0	0	0	112.6	V565 A567 F594 I607 G611 D612 I618 L619	V565-L615 HydrophobicContact CB-CD1 4.12Å; V565-L615 HydrophobicContact CG1-CD1 3.54Å; V565-L615 HydrophobicContact CG1-CG 4.45Å; A567-L615 HydrophobicContact CB-CD1 3.93Å; F594-L615 HydrophobicContact CE2-CD2 4.39Å; I607-L615 HydrophobicContact CD1-CD2 3.88Å; I607-L615 HydrophobicContact CG1-CD2 4.27Å; G611-L615 PolarHBondContact O-N 3.38Å; G611-L615 VanDerWaalsContact O-N 3.14Å; D612-L615 PolarHBondContact O-N 2.91Å; L615-I618 HydrophobicContact CD2-CD1 4.17Å; L615-I618 PolarHBondContact O-N 3.42Å; L615-L619 WeakPolarHBondContact O-CB 3.38Å; L615-L619 PolarHBondContact O-N 3.44Å
616	D	85.6	Confident	84.1	Confident	85 Å²	85	30 Å²	30	46%	0.455	15%	0.145	S	C	.	.	H	α-helix	trans	-60.5	-45.7	174.6	-84.5	-7.3	0	0	0	112.1	R105 D612 H614 I618 L619 S620	R105-D616 IonicContact NH2-OD2 3.53Å; R105-D616 PolarHBondContact NH2-OD2 2.54Å; D612-D616 PolarHBondContact O-N 3.38Å; H614-D616 VanDerWaalsContact C-N 3.34Å; H614-D616 PolarHBondContact O-N 3.32Å; D616-I618 VanDerWaalsContact C-N 3.35Å; D616-L619 PolarHBondContact O-N 2.91Å; D616-S620 PolarHBondContact O-N 3.14Å
617	V	86.6	Confident	84.1	Confident	5 Å²	5	36.4 Å²	36.4	3%	0.03	17%	0.171	C	C	.	.	H	α-helix	trans	-63.1	-45.4	176.9	169.6	0	0	0	0	109.8	I109 F134 L613 H614 L619 S620 R621	I109-V617 HydrophobicContact CD1-CG2 3.65Å; I109-V617 HydrophobicContact CG1-CG2 4.37Å; I109-V617 HydrophobicContact CG2-CB 4.48Å; I109-V617 HydrophobicContact CG2-CG1 3.84Å; I109-V617 HydrophobicContact CG2-CG2 4.13Å; F134-V617 HydrophobicContact CZ-CB 4.43Å; F134-V617 HydrophobicContact CZ-CG2 3.96Å; L613-V617 VanDerWaalsContact O-CG2 3.28Å; L613-V617 WeakPolarHBondContact O-CG2 3.3Å; L613-V617 PolarHBondContact O-N 2.96Å; H614-V617 PolarHBondContact O-N 3.28Å; V617-L619 VanDerWaalsContact C-N 3.31Å; V617-L619 PolarHBondContact O-N 3.23Å; V617-S620 PolarHBondContact O-N 3.33Å; V617-R621 HydrophobicContact CG1-CG 4.29Å; V617-R621 VanDerWaalsContact O-CG 3.29Å; V617-R621 WeakPolarHBondContact O-CG 3.35Å; V617-R621 PolarHBondContact O-N 3.45Å
618	I	88	Confident	84.1	Confident	5 Å²	5	36.4 Å²	36.4	3%	0.026	17%	0.171	C	C	.	.	H	α-helix	trans	-56.4	-47.2	177.4	-75.5	158	0	0	0	111.1	M587 F594 H614 L615 D616 S620 R621 L622	M587-I618 HydrophobicContact CE-CB 3.86Å; M587-I618 HydrophobicContact CE-CG1 3.82Å; M587-I618 HydrophobicContact CE-CG2 3.54Å; M587-I618 HydrophobicContact SD-CG2 4.07Å; F594-I618 HydrophobicContact CB-CD1 4.28Å; F594-I618 HydrophobicContact CD2-CD1 3.21Å; F594-I618 HydrophobicContact CD2-CG1 4.29Å; F594-I618 HydrophobicContact CD2-CG2 4.46Å; F594-I618 HydrophobicContact CE1-CG2 4.32Å; F594-I618 HydrophobicContact CE2-CD1 3.54Å; F594-I618 HydrophobicContact CE2-CG1 4.39Å; F594-I618 HydrophobicContact CE2-CG2 3.77Å; F594-I618 HydrophobicContact CG-CD1 3.82Å; F594-I618 HydrophobicContact CZ-CD1 4.4Å; F594-I618 HydrophobicContact CZ-CG2 3.7Å; H614-I618 WeakPolarHBondContact CD2-CD1 3.49Å; H614-I618 VanDerWaalsContact NE2-CD1 3.25Å; H614-I618 WeakPolarHBondContact NE2-CD1 3.31Å; H614-I618 WeakPolarHBondContact O-CD1 3.41Å; H614-I618 WeakPolarHBondContact O-CG1 3.26Å; H614-I618 PolarHBondContact O-N 3.05Å; L615-I618 HydrophobicContact CD2-CD1 4.17Å; L615-I618 PolarHBondContact O-N 3.42Å; D616-I618 VanDerWaalsContact C-N 3.35Å; I618-S620 PolarHBondContact O-N 3.17Å; I618-R621 WeakPolarHBondContact O-CB 3.37Å; I618-R621 PolarHBondContact O-N 3.11Å; I618-L622 HydrophobicContact CG2-CD1 4.34Å; I618-L622 WeakPolarHBondContact O-CG 3.13Å; I618-L622 PolarHBondContact O-N 3Å
619	L	87.8	Confident	84.4	Confident	27 Å²	27	40.7 Å²	40.7	14%	0.141	19%	0.194	C	C	.	.	H	α-helix	trans	-65	-39.1	179	178.4	142.8	0	0	0	112.6	L615 D616 V617 R621 L622 K623 V630 M632	L615-L619 WeakPolarHBondContact O-CB 3.38Å; L615-L619 PolarHBondContact O-N 3.44Å; D616-L619 PolarHBondContact O-N 2.91Å; V617-L619 VanDerWaalsContact C-N 3.31Å; V617-L619 PolarHBondContact O-N 3.23Å; L619-R621 VanDerWaalsContact C-N 3.33Å; L619-L622 PolarHBondContact O-N 2.89Å; L619-K623 HydrophobicContact CD2-CD 3.99Å; L619-K623 WeakPolarHBondContact O-CG 3.29Å; L619-K623 PolarHBondContact O-N 3.29Å; L619-K623 VanDerWaalsContact O-N 3.16Å; L619-V630 HydrophobicContact CD1-CG1 4.45Å; L619-M632 HydrophobicContact CD1-CG 3.22Å; L619-M632 HydrophobicContact CD1-SD 3.52Å; L619-M632 VanDerWaalsContact CD1-SD 3.52Å
620	S	86.5	Confident	84.9	Confident	36 Å²	36	41 Å²	41	25%	0.252	20%	0.195	S	C	.	.	H	α-helix	trans	-63.3	-41.8	174.4	-164.8	0	0	0	0	111.3	E101 D616 V617 I618 K623 R624	E101-S620 VanDerWaalsContact OE1-CB 3.26Å; E101-S620 WeakPolarHBondContact OE1-CB 3.44Å; E101-S620 PolarHBondContact OE1-OG 3.3Å; D616-S620 PolarHBondContact O-N 3.14Å; V617-S620 PolarHBondContact O-N 3.33Å; I618-S620 PolarHBondContact O-N 3.17Å; S620-K623 PolarHBondContact O-N 2.69Å; S620-R624 WeakPolarHBondContact O-CB 3.37Å; S620-R624 PolarHBondContact O-N 2.91Å
621	R	86.8	Confident	85.4	Confident	39 Å²	39	49 Å²	49	15%	0.147	23%	0.225	C	C	.	.	H	α-helix	trans	-62.6	-43.2	175.1	-68.3	-177	69.4	-155.3	-10.9	112.1	M587 E590 V617 I618 L619 K623 R624 E625	M587-R621 HydrophobicContact CE-CB 4.05Å; E590-R621 IonicContact OE1-NH2 3.62Å; E590-R621 IonicContact OE2-CZ 3.23Å; E590-R621 IonicContact OE2-NH1 3.07Å; E590-R621 PolarHBondContact OE2-NH1 3.19Å; E590-R621 IonicContact OE2-NH2 2.73Å; E590-R621 PolarHBondContact OE2-NH2 3.22Å; V617-R621 HydrophobicContact CG1-CG 4.29Å; V617-R621 VanDerWaalsContact O-CG 3.29Å; V617-R621 WeakPolarHBondContact O-CG 3.35Å; V617-R621 PolarHBondContact O-N 3.45Å; I618-R621 WeakPolarHBondContact O-CB 3.37Å; I618-R621 PolarHBondContact O-N 3.11Å; L619-R621 VanDerWaalsContact C-N 3.33Å; R621-K623 VanDerWaalsContact C-N 3.28Å; R621-K623 PolarHBondContact O-N 2.9Å; R621-R624 PolarHBondContact O-N 2.83Å; R621-E625 WeakPolarHBondContact CG-OE1 3.44Å; R621-E625 IonicContact CZ-OE1 3.94Å; R621-E625 IonicContact CZ-OE2 3.6Å; R621-E625 IonicContact NE-OE1 3.78Å; R621-E625 PolarHBondContact NE-OE1 3.24Å; R621-E625 IonicContact NE-OE2 3.88Å; R621-E625 PolarHBondContact NE-OE2 3.46Å; R621-E625 IonicContact NH2-OE1 2.87Å; R621-E625 IonicContact NH2-OE2 2.92Å; R621-E625 PolarHBondContact NH2-OE2 2.83Å; R621-E625 VanDerWaalsContact O-CB 3.32Å; R621-E625 WeakPolarHBondContact O-CB 3.37Å; R621-E625 PolarHBondContact O-N 2.63Å
622	L	88.4	Confident	85.9	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-56.1	-42.5	173.9	-74.3	173.3	0	0	0	112.2	L580 A583 L584 M587 I618 L619 Y626 K627 V628 V630	L580-L622 HydrophobicContact CD1-CD1 4.47Å; A583-L622 HydrophobicContact CB-CD2 3.52Å; L584-L622 HydrophobicContact CD2-CD1 4.1Å; M587-L622 HydrophobicContact CG-CD2 4.48Å; M587-L622 HydrophobicContact SD-CD1 4.41Å; M587-L622 HydrophobicContact SD-CD2 3.37Å; M587-L622 WeakPolarHBondContact SD-CD2 3.42Å; M587-L622 HydrophobicContact SD-CG 3.55Å; M587-L622 VanDerWaalsContact SD-CG 3.55Å; I618-L622 HydrophobicContact CG2-CD1 4.34Å; I618-L622 WeakPolarHBondContact O-CG 3.13Å; I618-L622 PolarHBondContact O-N 3Å; L619-L622 PolarHBondContact O-N 2.89Å; L622-Y626 HydrophobicContact CD2-CD2 4.34Å; L622-Y626 CarbonylContact O-C 3.55Å; L622-Y626 PolarHBondContact O-N 3.35Å; L622-K627 PolarHBondContact O-N 3.05Å; L622-V628 PolarHBondContact O-N 2.93Å; L622-V628 VanDerWaalsContact O-N 3.13Å; L622-V630 HydrophobicContact CB-CG2 4.34Å; L622-V630 HydrophobicContact CD1-CG2 4.25Å
623	K	89.1	Confident	85.7	Confident	99 Å²	99	50.9 Å²	50.9	43%	0.43	24%	0.238	S	C	.	.	H	α-helix	trans	-72.1	-40.4	178.5	-70.5	176.9	-179.1	178	0	112.8	L619 S620 R621 K627 V630	L619-K623 HydrophobicContact CD2-CD 3.99Å; L619-K623 WeakPolarHBondContact O-CG 3.29Å; L619-K623 PolarHBondContact O-N 3.29Å; L619-K623 VanDerWaalsContact O-N 3.16Å; S620-K623 PolarHBondContact O-N 2.69Å; R621-K623 VanDerWaalsContact C-N 3.28Å; R621-K623 PolarHBondContact O-N 2.9Å; K623-K627 VanDerWaalsContact O-CA 3.3Å; K623-K627 WeakPolarHBondContact O-CA 3.31Å; K623-K627 PolarHBondContact O-N 2.91Å; K623-V630 VanDerWaalsContact CE-O 3.26Å; K623-V630 WeakPolarHBondContact CE-O 3.21Å
624	R	84.1	Confident	85.2	Confident	86 Å²	86	54.8 Å²	54.8	33%	0.325	27%	0.265	S	S	.	.	H	α-helix	trans	-85	-51.3	-174	-178	176.3	63.4	-145.7	-0.3	113.3	E101 S620 R621	E101-R624 IonicContact OE1-CZ 3.85Å; E101-R624 IonicContact OE1-NH1 2.78Å; E101-R624 PolarHBondContact OE1-NH1 3.04Å; E101-R624 IonicContact OE1-NH2 2.87Å; E101-R624 IonicContact OE2-CZ 3.39Å; E101-R624 VanDerWaalsContact OE2-CZ 3.26Å; E101-R624 IonicContact OE2-NH1 3.12Å; E101-R624 PolarHBondContact OE2-NH1 2.83Å; E101-R624 IonicContact OE2-NH2 3.88Å; E101-R624 PolarHBondContact OE2-NH2 3.14Å; S620-R624 WeakPolarHBondContact O-CB 3.37Å; S620-R624 PolarHBondContact O-N 2.91Å; R621-R624 PolarHBondContact O-N 2.83Å
625	E	83.6	Confident	84.7	Confident	47 Å²	47	57 Å²	57	22%	0.22	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-49.4	-172.8	-64.5	171.1	-160	0	0	110.6	R621	R621-E625 WeakPolarHBondContact CG-OE1 3.44Å; R621-E625 IonicContact CZ-OE1 3.94Å; R621-E625 IonicContact CZ-OE2 3.6Å; R621-E625 IonicContact NE-OE1 3.78Å; R621-E625 PolarHBondContact NE-OE1 3.24Å; R621-E625 IonicContact NE-OE2 3.88Å; R621-E625 PolarHBondContact NE-OE2 3.46Å; R621-E625 IonicContact NH2-OE1 2.87Å; R621-E625 IonicContact NH2-OE2 2.92Å; R621-E625 PolarHBondContact NH2-OE2 2.83Å; R621-E625 VanDerWaalsContact O-CB 3.32Å; R621-E625 WeakPolarHBondContact O-CB 3.37Å; R621-E625 PolarHBondContact O-N 2.63Å
626	Y	85.2	Confident	84	Confident	38 Å²	38	61.3 Å²	61.3	15%	0.149	30%	0.3	C	S	.	.	S	Bend	trans	-93.2	-10.1	-176.2	-61.9	-88.2	0	0	0	113.7	A583 C586 M587 L622 V628	A583-Y626 HydrophobicContact CB-CD1 3.58Å; A583-Y626 HydrophobicContact CB-CD2 4.01Å; A583-Y626 HydrophobicContact CB-CE1 4.16Å; A583-Y626 HydrophobicContact CB-CG 3.5Å; A583-Y626 VanDerWaalsContact CB-CG 3.5Å; C586-Y626 HydrophobicContact CB-CE1 3.91Å; C586-Y626 WeakPolarHBondContact CB-OH 3.37Å; M587-Y626 HydrophobicContact CG-CE2 3.92Å; M587-Y626 HydrophobicContact SD-CE2 4.35Å; L622-Y626 HydrophobicContact CD2-CD2 4.34Å; L622-Y626 CarbonylContact O-C 3.55Å; L622-Y626 PolarHBondContact O-N 3.35Å; Y626-V628 PolarHBondContact O-N 3.23Å
627	K	86.8	Confident	83.7	Confident	170 Å²	170	59.2 Å²	59.2	74%	0.739	29%	0.288	S	S	*	.			trans	56.8	31.5	-178.7	-56.5	177.6	-176.9	172.9	0	113.3	L622 K623	L622-K627 PolarHBondContact O-N 3.05Å; K623-K627 VanDerWaalsContact O-CA 3.3Å; K623-K627 WeakPolarHBondContact O-CA 3.31Å; K623-K627 PolarHBondContact O-N 2.91Å
628	V	88.2	Confident	83.2	Confident	3 Å²	3	60.1 Å²	60.1	2%	0.018	30%	0.296	C	S	.	.			trans	-95.8	123.1	177.7	-176.1	0	0	0	0	108.7	E576 A579 L580 A583 L622 Y626 V630	E576-V628 HydrophobicContact CB-CG1 4.39Å; A579-V628 HydrophobicContact CB-CG2 3.95Å; L580-V628 HydrophobicContact CB-CG1 3.99Å; L580-V628 HydrophobicContact CD1-CG1 4.24Å; A583-V628 HydrophobicContact CB-CG2 4.41Å; L622-V628 PolarHBondContact O-N 2.93Å; L622-V628 VanDerWaalsContact O-N 3.13Å; Y626-V628 PolarHBondContact O-N 3.23Å; V628-V630 HydrophobicContact CB-CG2 4.26Å; V628-V630 HydrophobicContact CG1-CG2 3.73Å; V628-V630 PolarHBondContact O-N 3.31Å
629	N	88.9	Confident	83.1	Confident	99 Å²	99	61.9 Å²	61.9	53%	0.529	30%	0.302	S	S	.	.			trans	-76.8	116.3	173.6	-66.2	-61.8	0	0	0	109.7	G572 E576	G572-N629 PolarHBondContact N-O 3.17Å; E576-N629 PolarHBondContact OE1-N 2.88Å; E576-N629 PolarHBondContact OE1-ND2 2.74Å
630	V	89.2	Confident	83	Confident	6 Å²	6	62 Å²	62	4%	0.036	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	141.4	-177	-178.1	0	0	0	0	110.7	V569 L580 L619 L622 K623 V628	V569-V630 HydrophobicContact CB-CG1 4.25Å; V569-V630 HydrophobicContact CG1-CG1 3.4Å; V569-V630 VanDerWaalsContact CG1-CG1 3.4Å; V569-V630 HydrophobicContact CG2-CG1 4.12Å; L580-V630 HydrophobicContact CD1-CG2 3.72Å; L619-V630 HydrophobicContact CD1-CG1 4.45Å; L622-V630 HydrophobicContact CB-CG2 4.34Å; L622-V630 HydrophobicContact CD1-CG2 4.25Å; K623-V630 VanDerWaalsContact CE-O 3.26Å; K623-V630 WeakPolarHBondContact CE-O 3.21Å; V628-V630 HydrophobicContact CB-CG2 4.26Å; V628-V630 HydrophobicContact CG1-CG2 3.73Å; V628-V630 PolarHBondContact O-N 3.31Å
631	R	86.5	Confident	83.1	Confident	182 Å²	182	60.3 Å²	60.3	69%	0.687	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.8	138.3	171.9	-63.6	-177.9	-179.1	-177.9	1	109.6	E570	E570-R631 PolarHBondContact N-O 3.17Å; E570-R631 PolarHBondContact O-N 3.2Å
632	M	83.6	Confident	83.1	Confident	77 Å²	77	58.8 Å²	58.8	38%	0.379	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	137.2	169.6	-61.5	-58.5	-74.4	0	0	109.4	A567 A568 V569 I607 L619	A567-M632 HydrophobicContact CB-CE 3.19Å; A568-M632 WeakPolarHBondContact O-CA 3.45Å; V569-M632 HydrophobicContact CG2-CE 4.07Å; V569-M632 HydrophobicContact CG2-SD 3.34Å; V569-M632 WeakPolarHBondContact CG2-SD 3.37Å; I607-M632 HydrophobicContact CD1-CE 3.66Å; I607-M632 HydrophobicContact CD1-SD 4.16Å; I607-M632 HydrophobicContact CG1-CE 4.11Å; L619-M632 HydrophobicContact CD1-CG 3.22Å; L619-M632 HydrophobicContact CD1-SD 3.52Å; L619-M632 VanDerWaalsContact CD1-SD 3.52Å
633	G	73.3	Confident	83.1	Confident	21 Å²	21	59 Å²	59	22%	0.216	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	160.6	168.5	0	0	0	0	0	110.8	A568	A568-G633 PolarHBondContact N-O 2.63Å; A568-G633 PolarHBondContact O-N 2.7Å
634	P	71.7	Confident	83	Confident	110 Å²	110	56 Å²	56	71%	0.714	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-61.4	150.6	165.5	30	-34.4	0	0	0	109.2	L636	P634-L636 PolarHBondContact O-N 2.83Å
635	L	72.4	Confident	82.6	Confident	53 Å²	53	58.5 Å²	58.5	28%	0.277	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-60.7	126.9	172	-65.8	171	0	0	0	109.6	A568 I606 I637	A568-L635 HydrophobicContact CB-CD2 4.3Å; I606-L635 HydrophobicContact CG1-CD2 4.21Å; I606-L635 HydrophobicContact CG2-CD2 3.92Å; L635-I637 PolarHBondContact O-N 3.28Å
636	L	72.7	Confident	82.5	Confident	99 Å²	99	63.8 Å²	63.8	52%	0.518	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-71.9	127.1	166.7	-66.8	177.9	0	0	0	108.8	T602 Q604 P634 A638	T602-L636 HydrophobicContact CG2-CB 3.87Å; Q604-L636 VanDerWaalsContact CD-CD1 3.48Å; Q604-L636 HydrophobicContact CG-CD1 4.26Å; Q604-L636 VanDerWaalsContact OE1-CG 3.3Å; P634-L636 PolarHBondContact O-N 2.83Å; L636-A638 PolarHBondContact O-N 2.76Å
637	I	77.4	Confident	82.4	Confident	41 Å²	41	62.7 Å²	62.7	21%	0.21	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-79.9	120.2	176.9	-59	167.7	0	0	0	107.3	L635 Y639 P795 S860	L635-I637 PolarHBondContact O-N 3.28Å; I637-Y639 HydrophobicContact CB-CD2 4.16Å; I637-Y639 HydrophobicContact CB-CE2 3.68Å; I637-Y639 HydrophobicContact CD1-CE2 4.44Å; I637-Y639 WeakPolarHBondContact CD1-OH 3.41Å; I637-Y639 HydrophobicContact CG2-CD1 4.22Å; I637-Y639 HydrophobicContact CG2-CD2 4.15Å; I637-Y639 HydrophobicContact CG2-CE1 3.9Å; I637-Y639 HydrophobicContact CG2-CE2 3.84Å; I637-Y639 HydrophobicContact CG2-CG 4.32Å; I637-Y639 WeakPolarHBondContact O-CD2 3.28Å; I637-Y639 PolarHBondContact O-N 3.46Å; I637-P795 HydrophobicContact CG2-CG 3.64Å; I637-S860 VanDerWaalsContact CD1-CB 3.47Å
638	A	77.4	Confident	82.3	Confident	23 Å²	23	59 Å²	59	19%	0.19	31%	0.314	C	S	.	.			trans	-73.4	74.3	174.9	0	0	0	0	0	110.4	L636 Y886	L636-A638 PolarHBondContact O-N 2.76Å; A638-Y886 WeakPolarHBondContact O-CE1 3.37Å; A638-Y886 PolarHBondContact O-OH 3.28Å
639	Y	85.6	Confident	82.3	Confident	42 Å²	42	62.1 Å²	62.1	17%	0.165	34%	0.337	C	S	.	.			trans	-59.7	149.9	169.4	-66.9	-72.9	0	0	0	110.1	I637 L718 S720 V792 M793 E794 L897	I637-Y639 HydrophobicContact CB-CD2 4.16Å; I637-Y639 HydrophobicContact CB-CE2 3.68Å; I637-Y639 HydrophobicContact CD1-CE2 4.44Å; I637-Y639 WeakPolarHBondContact CD1-OH 3.41Å; I637-Y639 HydrophobicContact CG2-CD1 4.22Å; I637-Y639 HydrophobicContact CG2-CD2 4.15Å; I637-Y639 HydrophobicContact CG2-CE1 3.9Å; I637-Y639 HydrophobicContact CG2-CE2 3.84Å; I637-Y639 HydrophobicContact CG2-CG 4.32Å; I637-Y639 WeakPolarHBondContact O-CD2 3.28Å; I637-Y639 PolarHBondContact O-N 3.46Å; Y639-L718 HydrophobicContact CD2-CD1 4.49Å; Y639-L718 HydrophobicContact CG-CD1 4.34Å; Y639-S720 VanDerWaalsContact O-CB 3.31Å; Y639-S720 WeakPolarHBondContact O-CB 3.42Å; Y639-V792 HydrophobicContact CD1-CG1 3.86Å; Y639-V792 HydrophobicContact CG-CG1 4.21Å; Y639-M793 WeakPolarHBondContact CA-O 3.48Å; Y639-E794 HydrophobicContact CD1-CB 4.23Å; Y639-E794 HydrophobicContact CE1-CB 3.96Å; Y639-L897 HydrophobicContact CD1-CD1 4.04Å; Y639-L897 HydrophobicContact CE1-CD1 3.54Å; Y639-L897 HydrophobicContact CE1-CD2 4.32Å; Y639-L897 HydrophobicContact CE2-CD1 4.27Å; Y639-L897 HydrophobicContact CE2-CD2 3.76Å; Y639-L897 WeakPolarHBondContact OH-CD2 3.33Å
640	K	85.5	Confident	82.3	Confident	30 Å²	30	57.9 Å²	57.9	13%	0.13	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	165.2	175.1	-62.5	-174.2	173.5	179	0	109.6	E601 P721 I723 V792 M793 Y886	E601-K640 IonicContact OE1-NZ 2.61Å; E601-K640 IonicContact OE2-NZ 2.76Å; K640-P721 CarbonylContact C-O 3.37Å; K640-P721 WeakPolarHBondContact CA-O 3.3Å; K640-P721 WeakPolarHBondContact CB-O 3.46Å; K640-I723 HydrophobicContact CB-CD1 4.06Å; K640-I723 HydrophobicContact CB-CG1 4.1Å; K640-I723 HydrophobicContact CB-CG2 4.32Å; K640-I723 HydrophobicContact CD-CD1 4.31Å; K640-I723 HydrophobicContact CD-CG2 3.65Å; K640-I723 HydrophobicContact CG-CG2 4.45Å; K640-V792 CarbonylContact O-C 3.5Å; K640-M793 HydrophobicContact CB-CB 4.15Å; K640-M793 PolarHBondContact N-O 3.16Å; K640-M793 WeakPolarHBondContact O-CB 3.35Å; K640-M793 PolarHBondContact O-N 3.38Å; K640-Y886 HydrophobicContact CB-CD1 4.44Å; K640-Y886 HydrophobicContact CB-CE1 4.4Å; K640-Y886 HydrophobicContact CD-CD1 4.2Å; K640-Y886 HydrophobicContact CD-CD2 4.48Å; K640-Y886 HydrophobicContact CD-CE1 3.72Å; K640-Y886 HydrophobicContact CD-CE2 4.05Å; K640-Y886 VanDerWaalsContact CE-OH 3.26Å; K640-Y886 WeakPolarHBondContact CE-OH 3.35Å; K640-Y886 HydrophobicContact CG-CD1 4.3Å; K640-Y886 HydrophobicContact CG-CE1 3.81Å; K640-Y886 PolarHBondContact NZ-OH 2.86Å
641	E	88.7	Confident	82.2	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	135.7	177.1	-83.9	167.6	-117.1	0	0	110.5	G715 P716 I717 L718 R719 S720 P721 I722 I723 W790 H791 V792	E641-G715 VanDerWaalsContact OE2-CA 3.28Å; E641-G715 WeakPolarHBondContact OE2-CA 3.48Å; E641-P716 WeakPolarHBondContact OE2-CD 3.48Å; E641-I717 HydrophobicContact CG-CB 4.43Å; E641-I717 WeakPolarHBondContact OE2-CB 3.47Å; E641-I717 PolarHBondContact OE2-N 2.81Å; E641-L718 WeakPolarHBondContact OE1-CA 3.49Å; E641-L718 PolarHBondContact OE1-N 3.23Å; E641-R719 PolarHBondContact OE1-N 3.17Å; E641-S720 VanDerWaalsContact CD-OG 3.26Å; E641-S720 WeakPolarHBondContact CG-OG 3.47Å; E641-S720 PolarHBondContact N-OG 3.01Å; E641-S720 PolarHBondContact OE1-N 3.18Å; E641-S720 VanDerWaalsContact OE1-N 3.11Å; E641-S720 PolarHBondContact OE1-OG 3.5Å; E641-P721 PolarHBondContact N-O 3.43Å; E641-I722 CarbonylContact O-C 3.5Å; E641-I722 VanDerWaalsContact O-CA 3.27Å; E641-I722 WeakPolarHBondContact O-CA 3.45Å; E641-I723 PolarHBondContact O-N 2.97Å; E641-W790 HydrophobicContact CB-CE3 4.16Å; E641-H791 WeakPolarHBondContact CA-O 3.26Å; E641-V792 HydrophobicContact CG-CG2 4.49Å
642	C	87.7	Confident	82.3	Confident	7 Å²	7	52.2 Å²	52.2	5%	0.047	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	140.8	179.9	-172.6	0	0	0	0	110.9	M678 I723 W790 H791 M793	C642-M678 HydrophobicContact CB-CE 3.71Å; C642-M678 WeakPolarHBondContact SG-CE 3.26Å; C642-I723 HydrophobicContact CB-CG1 4.14Å; C642-W790 VanDerWaalsContact C-CE3 3.43Å; C642-H791 PolarHBondContact N-O 2.77Å; C642-H791 PolarHBondContact O-N 3.29Å; C642-M793 HydrophobicContact CB-CG 3.83Å; C642-M793 HydrophobicContact CB-SD 3.98Å
643	P	88.6	Confident	82.5	Confident	7 Å²	7	50 Å²	50	5%	0.045	29%	0.291	C	S	.	.			trans	-65.5	159.6	166.2	31.8	-38.7	0	0	0	111.1	A647 P675 V725 I787 W790	P643-A647 HydrophobicContact CB-CB 3.92Å; P643-P675 HydrophobicContact CG-CB 4.1Å; P643-P675 HydrophobicContact CG-CG 4.27Å; P643-V725 HydrophobicContact CG-CG1 3.56Å; P643-I787 HydrophobicContact CB-CG2 3.97Å; P643-W790 HydrophobicContact CB-CH2 4.39Å; P643-W790 HydrophobicContact CB-CZ3 4.42Å; P643-W790 VanDerWaalsContact CD-CZ3 3.47Å; P643-W790 HydrophobicContact CG-CZ3 4.47Å
644	P	85.2	Confident	83.3	Confident	34 Å²	34	50 Å²	50	22%	0.221	29%	0.288	C	S	.	.			trans	-61.9	151.7	171.7	20.6	-24.2	0	0	0	111.2	D646 A647 N789	P644-D646 PolarHBondContact O-N 3.1Å; P644-D646 VanDerWaalsContact O-N 3.17Å; P644-A647 HydrophobicContact CG-CB 3.96Å; P644-A647 WeakPolarHBondContact O-CB 3.44Å; P644-A647 PolarHBondContact O-N 2.83Å; P644-N789 WeakPolarHBondContact CD-O 3.34Å
645	Q	76.8	Confident	84.1	Confident	140 Å²	140	47.8 Å²	47.8	65%	0.654	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-33.7	-176.8	-70.7	-176.1	-3.4	0	0	113.1
646	D	81.3	Confident	84.9	Confident	158 Å²	158	46.5 Å²	46.5	85%	0.845	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	17.1	179.8	-57.9	-38.8	0	0	0	113.4	P644	P644-D646 PolarHBondContact O-N 3.1Å; P644-D646 VanDerWaalsContact O-N 3.17Å
647	A	82.8	Confident	85.7	Confident	14 Å²	14	44.3 Å²	44.3	12%	0.116	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-62.8	134.2	-179.9	0	0	0	0	0	111.5	P643 P644 P675 I787	P643-A647 HydrophobicContact CB-CB 3.92Å; P644-A647 HydrophobicContact CG-CB 3.96Å; P644-A647 WeakPolarHBondContact O-CB 3.44Å; P644-A647 PolarHBondContact O-N 2.83Å; A647-P675 HydrophobicContact CB-CB 4.22Å; A647-P675 HydrophobicContact CB-CG 3.66Å; A647-P675 WeakPolarHBondContact O-CG 3.32Å; A647-I787 HydrophobicContact CB-CG2 4.03Å
648	P	85.4	Confident	86.1	Confident	93 Å²	93	43 Å²	43	60%	0.604	25%	0.247	S	C	*	.	P	Polyproline II helix	trans	-68	149.2	172.3	29.4	-34	0	0	0	110.3	S650	P648-S650 PolarHBondContact O-N 3.16Å
649	S	87	Confident	86.4	Confident	69 Å²	69	49.2 Å²	49.2	48%	0.483	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-61.5	136.4	171.7	-48.8	0	0	0	0	110.5	L673	S649-L673 CarbonylContact C-O 3.52Å; S649-L673 VanDerWaalsContact CA-O 3.22Å; S649-L673 WeakPolarHBondContact CA-O 3.24Å; S649-L673 WeakPolarHBondContact CB-O 3.41Å
650	S	88.7	Confident	86.2	Confident	9 Å²	9	47.3 Å²	47.3	6%	0.063	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	133.6	-177.9	69.6	0	0	0	0	111.7	P648 I672 L673 A783 I787	P648-S650 PolarHBondContact O-N 3.16Å; S650-I672 CarbonylContact O-C 3.56Å; S650-I672 WeakPolarHBondContact O-CA 3.38Å; S650-L673 PolarHBondContact N-O 2.95Å; S650-L673 PolarHBondContact O-N 2.73Å; S650-A783 WeakPolarHBondContact CB-O 3.45Å; S650-A783 PolarHBondContact OG-O 3.12Å; S650-I787 WeakPolarHBondContact OG-CD1 3.32Å
651	S	88.8	Confident	85.7	Confident	67 Å²	67	50.5 Å²	50.5	47%	0.469	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	134.8	176.2	63.3	0	0	0	0	111.4	V671 K786	S651-V671 CarbonylContact C-O 3.56Å; S651-V671 WeakPolarHBondContact CA-O 3.42Å; S651-K786 WeakPolarHBondContact O-CD 3.43Å; S651-K786 PolarHBondContact O-NZ 3.07Å
652	G	87.9	Confident	85.1	Confident	3 Å²	3	53.7 Å²	53.7	3%	0.031	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	135.7	176.8	0	0	0	0	0	109.9	G670 V671 S779	G652-G670 WeakPolarHBondContact O-CA 3.03Å; G652-V671 PolarHBondContact N-O 2.69Å; G652-V671 PolarHBondContact O-N 2.78Å; G652-S779 WeakPolarHBondContact CA-O 3.26Å
653	W	88.4	Confident	84.8	Confident	30 Å²	30	56.7 Å²	56.7	11%	0.114	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	137.3	176.9	-176.8	-98.2	0	0	0	109	A668 S731 N742 I747 N782	W653-A668 HydrophobicContact CH2-CB 3.76Å; W653-A668 HydrophobicContact CZ2-CB 3.46Å; W653-A668 VanDerWaalsContact CZ2-CB 3.46Å; W653-S731 WeakPolarHBondContact CZ3-OG 3.48Å; W653-N742 PolarHBondContact NE1-O 2.96Å; W653-I747 HydrophobicContact CE3-CD1 4Å; W653-I747 HydrophobicContact CH2-CD1 3.07Å; W653-I747 HydrophobicContact CH2-CG1 3.89Å; W653-I747 HydrophobicContact CZ2-CD1 3.7Å; W653-I747 HydrophobicContact CZ2-CG1 4.27Å; W653-I747 HydrophobicContact CZ3-CD1 3.23Å; W653-I747 HydrophobicContact CZ3-CG1 4.46Å; W653-N782 PolarHBondContact O-ND2 2.8Å
654	S	88.3	Confident	84.7	Confident	21 Å²	21	61.2 Å²	61.2	15%	0.147	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	150.3	174.7	-165.5	0	0	0	0	110	A668 I669 C775 S778 S779	S654-A668 VanDerWaalsContact O-CA 3.26Å; S654-A668 WeakPolarHBondContact O-CA 3.23Å; S654-A668 WeakPolarHBondContact O-CB 3.29Å; S654-I669 PolarHBondContact N-O 2.69Å; S654-I669 PolarHBondContact O-N 3.49Å; S654-C775 PolarHBondContact O-SG 3.45Å; S654-S778 WeakPolarHBondContact OG-CB 3.3Å; S654-S779 WeakPolarHBondContact CB-OG 3.33Å; S654-S779 PolarHBondContact N-OG 3.44Å; S654-S779 VanDerWaalsContact N-OG 3.08Å
655	R	88.7	Confident	84.6	Confident	63 Å²	63	60.8 Å²	60.8	24%	0.238	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	127.8	175.3	-174.2	-179.3	106.1	111.2	6	108.5	A666 V667 A668 V737 I740 N742	R655-A666 HydrophobicContact CG-CB 4.41Å; R655-V667 WeakPolarHBondContact CA-O 3.35Å; R655-A668 HydrophobicContact CB-CB 4.36Å; R655-A668 HydrophobicContact CG-CB 4.39Å; R655-V737 PolarHBondContact NH1-O 3.25Å; R655-I740 VanDerWaalsContact CD-O 3.22Å; R655-I740 WeakPolarHBondContact CD-O 3.42Å; R655-I740 HydrophobicContact CG-CG2 4.17Å; R655-I740 PolarHBondContact NH1-O 3.1Å; R655-N742 VanDerWaalsContact CD-OD1 3.28Å; R655-N742 WeakPolarHBondContact CD-OD1 3.41Å; R655-N742 PolarHBondContact NE-OD1 2.82Å
656	V	89.4	Confident	85	Confident	27 Å²	27	54.1 Å²	54.1	16%	0.164	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	134.8	175.3	-176.4	0	0	0	0	108.7	V667 L771 T774 C775	V656-V667 PolarHBondContact N-O 3.18Å; V656-V667 PolarHBondContact O-N 3.04Å; V656-L771 HydrophobicContact CG1-CD2 3.75Å; V656-T774 HydrophobicContact CG2-CG2 4.37Å; V656-C775 HydrophobicContact CB-CB 4.24Å; V656-C775 HydrophobicContact CG2-CB 3.73Å
657	V	89.3	Confident	85.3	Confident	53 Å²	53	46.6 Å²	46.6	32%	0.321	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	140.5	176.8	-178.4	0	0	0	0	108.9	E664 A666 V737	V657-E664 HydrophobicContact CG1-CG 3.79Å; V657-E664 VanDerWaalsContact CG1-OE1 3.32Å; V657-E664 WeakPolarHBondContact CG1-OE1 3.41Å; V657-A666 HydrophobicContact CG2-CB 4.17Å; V657-V737 HydrophobicContact CG1-CG1 4.28Å; V657-V737 HydrophobicContact CG1-CG2 3.63Å; V657-V737 HydrophobicContact CG2-CG1 3.99Å
658	G	86.2	Confident	85.5	Confident	13 Å²	13	46 Å²	46	13%	0.134	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.8	178.5	172.5	0	0	0	0	0	112.9	K665	G658-K665 PolarHBondContact N-O 2.93Å; G658-K665 PolarHBondContact O-N 3.47Å
659	Y	84.7	Confident	85.6	Confident	153 Å²	153	41.5 Å²	41.5	60%	0.6	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92.1	125.8	-179.7	-69.2	-92.6	0	0	0	110.5	S663 E664	Y659-S663 WeakPolarHBondContact CA-O 3.34Å; Y659-E664 HydrophobicContact CD1-CB 4.35Å; Y659-E664 HydrophobicContact CE1-CB 4.08Å; Y659-E664 HydrophobicContact CE1-CG 4.47Å
660	I	80.2	Confident	85.6	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.01	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	113.5	173.3	-59.2	173.8	0	0	0	107.3	G662 S663 K665 V667 L768 L771	I660-G662 PolarHBondContact O-N 2.85Å; I660-S663 PolarHBondContact N-O 3.01Å; I660-S663 PolarHBondContact O-N 3.48Å; I660-S663 VanDerWaalsContact O-N 3.14Å; I660-K665 HydrophobicContact CB-CD 4.15Å; I660-K665 HydrophobicContact CD1-CB 3.97Å; I660-K665 HydrophobicContact CD1-CD 4.01Å; I660-K665 HydrophobicContact CD1-CG 4.49Å; I660-K665 HydrophobicContact CG1-CB 4.39Å; I660-V667 HydrophobicContact CD1-CG2 4.46Å; I660-L768 HydrophobicContact CD1-CB 4.02Å; I660-L768 HydrophobicContact CD1-CD1 3.56Å; I660-L768 HydrophobicContact CD1-CG 4.34Å; I660-L768 HydrophobicContact CG1-CB 4.42Å; I660-L768 HydrophobicContact CG2-CB 4.37Å; I660-L771 HydrophobicContact CD1-CD1 4Å; I660-L771 HydrophobicContact CG1-CD1 3.75Å
661	N	75	Confident	85.6	Confident	97 Å²	97	37.9 Å²	37.9	52%	0.519	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	42.6	-178.3	-58.4	-4.5	0	0	0	112.7	S663 S765	N661-S663 VanDerWaalsContact C-N 3.35Å; N661-S663 PolarHBondContact O-N 3.09Å; N661-S765 PolarHBondContact OD1-OG 3.39Å; N661-S765 VanDerWaalsContact OD1-OG 3.06Å
662	G	76.8	Confident	85.7	Confident	68 Å²	68	37.3 Å²	37.3	70%	0.701	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.7	-4.4	177.4	0	0	0	0	0	116.2	I660	I660-G662 PolarHBondContact O-N 2.85Å
663	S	81.3	Confident	85.8	Confident	69 Å²	69	37.1 Å²	37.1	48%	0.483	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	135.4	173.5	-59.6	0	0	0	0	111.2	Y659 I660 N661 K665	Y659-S663 WeakPolarHBondContact CA-O 3.34Å; I660-S663 PolarHBondContact N-O 3.01Å; I660-S663 PolarHBondContact O-N 3.48Å; I660-S663 VanDerWaalsContact O-N 3.14Å; N661-S663 VanDerWaalsContact C-N 3.35Å; N661-S663 PolarHBondContact O-N 3.09Å; S663-K665 PolarHBondContact O-N 2.81Å
664	E	85.7	Confident	85.7	Confident	102 Å²	102	39.6 Å²	39.6	48%	0.477	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	123.3	172.8	-158.9	-175.3	-177.6	0	0	110.1	V657 Y659 V737	V657-E664 HydrophobicContact CG1-CG 3.79Å; V657-E664 VanDerWaalsContact CG1-OE1 3.32Å; V657-E664 WeakPolarHBondContact CG1-OE1 3.41Å; Y659-E664 HydrophobicContact CD1-CB 4.35Å; Y659-E664 HydrophobicContact CE1-CB 4.08Å; Y659-E664 HydrophobicContact CE1-CG 4.47Å; E664-V737 HydrophobicContact CB-CG2 4.29Å; E664-V737 HydrophobicContact CG-CG2 3.69Å
665	K	83.6	Confident	85.6	Confident	26 Å²	26	39.6 Å²	39.6	11%	0.113	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	148.2	-179.3	-68.5	-166	-176.1	-178.2	0	110	G658 I660 S663 G735	G658-K665 PolarHBondContact N-O 2.93Å; G658-K665 PolarHBondContact O-N 3.47Å; I660-K665 HydrophobicContact CB-CD 4.15Å; I660-K665 HydrophobicContact CD1-CB 3.97Å; I660-K665 HydrophobicContact CD1-CD 4.01Å; I660-K665 HydrophobicContact CD1-CG 4.49Å; I660-K665 HydrophobicContact CG1-CB 4.39Å; S663-K665 PolarHBondContact O-N 2.81Å; K665-G735 CarbonylContact C-O 3.54Å; K665-G735 WeakPolarHBondContact CA-O 3.32Å; K665-G735 VanDerWaalsContact CB-O 3.31Å; K665-G735 WeakPolarHBondContact CB-O 3.43Å
666	A	85.1	Confident	85.1	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	143.1	169	0	0	0	0	0	110	R655 V657 C734 G735 V737 I740	R655-A666 HydrophobicContact CG-CB 4.41Å; V657-A666 HydrophobicContact CG2-CB 4.17Å; A666-C734 WeakPolarHBondContact O-CA 3.31Å; A666-G735 PolarHBondContact N-O 2.89Å; A666-G735 PolarHBondContact O-N 3.47Å; A666-V737 HydrophobicContact CB-CG2 4.4Å; A666-I740 HydrophobicContact CB-CB 4.1Å; A666-I740 HydrophobicContact CB-CD1 3.94Å; A666-I740 HydrophobicContact CB-CG1 4.47Å; A666-I740 VanDerWaalsContact O-CD1 3.23Å; A666-I740 WeakPolarHBondContact O-CD1 3.27Å
667	V	87.2	Confident	83.9	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	130.2	173.3	176.3	0	0	0	0	107.1	R655 V656 I660 I669 V733 C734 L768 L771 L772 C775	R655-V667 WeakPolarHBondContact CA-O 3.35Å; V656-V667 PolarHBondContact N-O 3.18Å; V656-V667 PolarHBondContact O-N 3.04Å; I660-V667 HydrophobicContact CD1-CG2 4.46Å; V667-I669 HydrophobicContact CG1-CG1 4.37Å; V667-V733 WeakPolarHBondContact CA-O 3.35Å; V667-C734 HydrophobicContact CG2-CB 4.43Å; V667-L768 HydrophobicContact CG2-CD1 4.11Å; V667-L771 HydrophobicContact CG2-CB 4.19Å; V667-L772 HydrophobicContact CG1-CD2 3.5Å; V667-L772 VanDerWaalsContact CG1-CD2 3.5Å; V667-L772 HydrophobicContact CG1-CG 4.14Å; V667-C775 HydrophobicContact CG1-CB 4.34Å
668	A	87.2	Confident	82.5	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	140.9	174.7	0	0	0	0	0	111.1	W653 S654 R655 V733 I740	W653-A668 HydrophobicContact CH2-CB 3.76Å; W653-A668 HydrophobicContact CZ2-CB 3.46Å; W653-A668 VanDerWaalsContact CZ2-CB 3.46Å; S654-A668 VanDerWaalsContact O-CA 3.26Å; S654-A668 WeakPolarHBondContact O-CA 3.23Å; S654-A668 WeakPolarHBondContact O-CB 3.29Å; R655-A668 HydrophobicContact CB-CB 4.36Å; R655-A668 HydrophobicContact CG-CB 4.39Å; A668-V733 PolarHBondContact N-O 2.9Å; A668-V733 PolarHBondContact O-N 2.98Å; A668-I740 HydrophobicContact CB-CG2 3.6Å
669	I	87.7	Confident	81.2	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	125.1	-174.8	-56.4	-179.8	0	0	0	109	S654 V667 V671 I729 S731 I732 L772 C775 C776 S779	S654-I669 PolarHBondContact N-O 2.69Å; S654-I669 PolarHBondContact O-N 3.49Å; V667-I669 HydrophobicContact CG1-CG1 4.37Å; I669-V671 HydrophobicContact CG2-CG1 4.06Å; I669-I729 HydrophobicContact CG2-CG2 4.45Å; I669-S731 WeakPolarHBondContact CA-O 3.48Å; I669-I732 HydrophobicContact CG1-CG2 4.3Å; I669-I732 HydrophobicContact CG2-CG1 4.43Å; I669-L772 HydrophobicContact CD1-CD2 3.86Å; I669-L772 HydrophobicContact CG1-CD2 4.47Å; I669-C775 HydrophobicContact CD1-CB 3.97Å; I669-C775 HydrophobicContact CG1-CB 4.25Å; I669-C776 HydrophobicContact CD1-CB 4.4Å; I669-C776 WeakPolarHBondContact CD1-SG 2.92Å; I669-S779 PolarHBondContact O-OG 2.97Å
670	G	87.2	Confident	79.7	Confident	2 Å²	2	46.7 Å²	46.7	2%	0.021	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	131.7	169.6	0	0	0	0	0	111.4	G652 N730 S731	G652-G670 WeakPolarHBondContact O-CA 3.03Å; G670-N730 WeakPolarHBondContact CA-OD1 3.39Å; G670-N730 PolarHBondContact O-N 2.82Å; G670-N730 PolarHBondContact O-OD1 3.32Å; G670-S731 PolarHBondContact N-O 3.19Å
671	V	89.5	Confident	78.6	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	146.8	176.6	-58.1	0	0	0	0	110.1	S651 G652 I669 I727 H728 I729 V780 A783	S651-V671 CarbonylContact C-O 3.56Å; S651-V671 WeakPolarHBondContact CA-O 3.42Å; G652-V671 PolarHBondContact N-O 2.69Å; G652-V671 PolarHBondContact O-N 2.78Å; I669-V671 HydrophobicContact CG2-CG1 4.06Å; V671-I727 HydrophobicContact CB-CG2 4.24Å; V671-I727 HydrophobicContact CG1-CG2 4.37Å; V671-H728 CarbonylContact C-O 3.59Å; V671-H728 VanDerWaalsContact CA-O 3.32Å; V671-H728 WeakPolarHBondContact CA-O 3.44Å; V671-I729 HydrophobicContact CG1-CG1 4.43Å; V671-V780 HydrophobicContact CG2-CG2 4.39Å; V671-A783 HydrophobicContact CG2-CB 4.19Å
672	I	90.4	Very high	78.2	Confident	54 Å²	54	50.7 Å²	50.7	28%	0.277	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	118.7	170.5	-59.2	171.9	0	0	0	106.6	S650 H728 N730	S650-I672 CarbonylContact O-C 3.56Å; S650-I672 WeakPolarHBondContact O-CA 3.38Å; I672-H728 HydrophobicContact CB-CB 4.15Å; I672-H728 PolarHBondContact N-O 3.48Å; I672-H728 PolarHBondContact O-N 3.29Å; I672-N730 HydrophobicContact CD1-CB 4.28Å
673	L	89.7	Confident	77.9	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	115.3	172	-101.4	150.1	0	0	0	108	S649 S650 L711 V725 I727 V780 A783 V784	S649-L673 CarbonylContact C-O 3.52Å; S649-L673 VanDerWaalsContact CA-O 3.22Å; S649-L673 WeakPolarHBondContact CA-O 3.24Å; S649-L673 WeakPolarHBondContact CB-O 3.41Å; S650-L673 PolarHBondContact N-O 2.95Å; S650-L673 PolarHBondContact O-N 2.73Å; L673-L711 HydrophobicContact CD2-CD2 4.34Å; L673-V725 HydrophobicContact CD2-CB 3.6Å; L673-V725 HydrophobicContact CD2-CG1 4.04Å; L673-V725 HydrophobicContact CD2-CG2 3.61Å; L673-I727 HydrophobicContact CD2-CG1 4.07Å; L673-I727 HydrophobicContact CG-CG1 4.29Å; L673-V780 HydrophobicContact CD1-CG1 4.24Å; L673-A783 HydrophobicContact CB-CB 4.26Å; L673-A783 HydrophobicContact CD1-CB 3.42Å; L673-A783 VanDerWaalsContact CD1-CB 3.42Å; L673-A783 HydrophobicContact CG-CB 4.3Å; L673-V784 HydrophobicContact CD1-CG2 3.63Å
674	Q	87.5	Confident	77.7	Confident	81 Å²	81	54.1 Å²	54.1	38%	0.379	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	113.4	179.6	-175.6	170.8	-9.9	0	0	109.7	V725 D726 H728	Q674-V725 WeakPolarHBondContact O-CA 3.43Å; Q674-D726 PolarHBondContact N-O 3.29Å; Q674-D726 PolarHBondContact O-N 2.92Å; Q674-H728 PolarHBondContact OE1-NE2 2.92Å
675	P	84.8	Confident	77.6	Confident	21 Å²	21	54.2 Å²	54.2	14%	0.136	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	137.6	170.6	-24.6	36.9	0	0	0	110.8	P643 A647 G724	P643-P675 HydrophobicContact CG-CB 4.1Å; P643-P675 HydrophobicContact CG-CG 4.27Å; A647-P675 HydrophobicContact CB-CB 4.22Å; A647-P675 HydrophobicContact CB-CG 3.66Å; A647-P675 WeakPolarHBondContact O-CG 3.32Å; P675-G724 WeakPolarHBondContact CA-O 3.27Å
676	K	78.4	Confident	77.7	Confident	81 Å²	81	54.1 Å²	54.1	35%	0.352	27%	0.273	S	S	.	.			trans	-118	149.4	174.4	-88.4	-167.1	170.6	173.2	0	110.9	G724 D726	K676-G724 PolarHBondContact N-O 3.11Å; K676-D726 WeakPolarHBondContact CD-OD2 3.49Å; K676-D726 WeakPolarHBondContact CE-OD2 3.29Å; K676-D726 IonicContact NZ-OD2 2.86Å; K676-D726 PolarHBondContact NZ-OD2 2.88Å
677	T	64.7	Low	77.7	Confident	120 Å²	120	56.8 Å²	56.8	74%	0.736	29%	0.287	S	S	*	.			trans	-62.9	135.3	174.6	39.5	0	0	0	0	110.7	H679	T677-H679 PolarHBondContact O-N 3.48Å
678	M	60.2	Low	77.5	Confident	66 Å²	66	57.8 Å²	57.8	33%	0.325	29%	0.291	S	S	.	.			trans	-53.2	103.9	-172.6	-85.6	-85.9	152.2	0	0	112.7	C642 I723 M793	C642-M678 HydrophobicContact CB-CE 3.71Å; C642-M678 WeakPolarHBondContact SG-CE 3.26Å; M678-I723 HydrophobicContact CE-CD1 4.35Å; M678-M793 HydrophobicContact CE-CE 3.77Å; M678-M793 HydrophobicContact CE-SD 4.29Å; M678-M793 HydrophobicContact SD-CE 3.93Å
679	H	58	Low	76.8	Confident	144 Å²	144	61.6 Å²	61.6	67%	0.667	31%	0.311	S	S	*	.			trans	-104.6	125.8	149.9	-139.7	-74.9	0	0	0	107.1	T677 L681 H682	T677-H679 PolarHBondContact O-N 3.48Å; H679-L681 PolarHBondContact O-N 2.8Å; H679-H682 HydrophobicContact CB-CB 4.33Å; H679-H682 WeakPolarHBondContact O-CB 3.4Å; H679-H682 PolarHBondContact O-N 3.45Å
680	P	54.1	Low	75.7	Confident	48 Å²	48	72.1 Å²	72.1	31%	0.312	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-4.2	-162.6	20.5	-33.6	0	0	0	116.9	N885	P680-N885 HydrophobicContact CB-CB 3.29Å; P680-N885 HydrophobicContact CG-CB 3.97Å
681	L	57.1	Low	74.5	Confident	132 Å²	132	73.5 Å²	73.5	69%	0.691	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.9	17.7	179.7	-73.3	160.4	0	0	0	112	H679 K683	H679-L681 PolarHBondContact O-N 2.8Å; L681-K683 PolarHBondContact O-N 2.92Å
682	H	65.2	Low	72.8	Confident	51 Å²	51	78 Å²	78	24%	0.236	40%	0.395	C	S	.	.			trans	-64.5	108.7	-179.4	-174.4	68.1	0	0	0	110.1	H679 D726	H679-H682 HydrophobicContact CB-CB 4.33Å; H679-H682 WeakPolarHBondContact O-CB 3.4Å; H679-H682 PolarHBondContact O-N 3.45Å; H682-D726 IonicContact CD2-OD1 3.63Å; H682-D726 IonicContact CE1-OD1 3.87Å; H682-D726 IonicContact NE2-OD1 3.06Å; H682-D726 PolarHBondContact NE2-OD1 3.47Å; H682-D726 IonicContact NE2-OD2 3.89Å
683	K	70.8	Confident	71.2	Confident	177 Å²	177	79.5 Å²	79.5	77%	0.77	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-70.5	129.3	170.7	-69.9	-175.3	179.1	-179.9	0	108.4	L681 Q685	L681-K683 PolarHBondContact O-N 2.92Å; K683-Q685 PolarHBondContact O-N 2.85Å
684	P	77.6	Confident	69.7	Low	32 Å²	32	87.8 Å²	87.8	21%	0.208	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-57.8	131.4	-179.9	23.4	-32.7	0	0	0	110.2	L708 L711 V725	P684-L708 HydrophobicContact CB-CD2 4.39Å; P684-L708 HydrophobicContact CG-CD2 3.85Å; P684-L711 HydrophobicContact CB-CD1 3.54Å; P684-L711 HydrophobicContact CG-CD1 3.83Å; P684-V725 WeakPolarHBondContact CB-O 3.46Å
685	Q	83.3	Confident	68.3	Low	104 Å²	104	91.5 Å²	91.5	49%	0.486	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-101.4	141.6	178.3	-64.1	-171.7	-7.3	0	0	110.9	K683 I687 D726 I727	K683-Q685 PolarHBondContact O-N 2.85Å; Q685-I687 HydrophobicContact CB-CG1 4.47Å; Q685-D726 PolarHBondContact N-OD1 3.39Å; Q685-I727 PolarHBondContact O-N 3.36Å
686	V	85.1	Confident	67.6	Low	23 Å²	23	90.8 Å²	90.8	14%	0.139	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	106.5	173.6	-176.1	0	0	0	0	108.4	F688 T704 C707 L708 I727 I729	V686-F688 HydrophobicContact CG1-CE2 3.95Å; V686-F688 HydrophobicContact CG1-CZ 4.25Å; V686-T704 HydrophobicContact CB-CG2 4.13Å; V686-T704 HydrophobicContact CG2-CG2 4.05Å; V686-C707 HydrophobicContact CG1-CB 4.38Å; V686-C707 HydrophobicContact CG2-CB 3.72Å; V686-L708 HydrophobicContact CG2-CD2 4.33Å; V686-L708 HydrophobicContact CG2-CG 4.36Å; V686-I727 CarbonylContact C-O 3.49Å; V686-I727 WeakPolarHBondContact CA-O 3.4Å; V686-I729 HydrophobicContact CG1-CD1 3.48Å; V686-I729 VanDerWaalsContact CG1-CD1 3.48Å; V686-I729 HydrophobicContact CG1-CG1 4.25Å
687	I	85.3	Confident	67.5	Low	56 Å²	56	91.3 Å²	91.3	29%	0.287	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	130.1	-176.6	-59.6	169.6	0	0	0	108.4	Q685 I727 H728 I729	Q685-I687 HydrophobicContact CB-CG1 4.47Å; I687-I727 PolarHBondContact N-O 2.86Å; I687-H728 CarbonylContact O-C 3.5Å; I687-H728 WeakPolarHBondContact O-CA 3.38Å; I687-I729 PolarHBondContact O-N 3.3Å
688	F	82.8	Confident	68.2	Low	22 Å²	22	94.7 Å²	94.7	10%	0.096	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	110.3	177.4	-67.9	-99.8	0	0	0	108.8	V686 R690 L691 R700 I703 T704 I729	V686-F688 HydrophobicContact CG1-CE2 3.95Å; V686-F688 HydrophobicContact CG1-CZ 4.25Å; F688-R690 VanDerWaalsContact C-N 3.34Å; F688-R690 PolarHBondContact O-N 3.37Å; F688-L691 HydrophobicContact CB-CB 4.4Å; F688-L691 HydrophobicContact CD1-CD1 4.18Å; F688-R700 HydrophobicContact CD1-CG 4.43Å; F688-R700 HydrophobicContact CE1-CG 4.09Å; F688-R700 HydrophobicContact CE2-CB 4.26Å; F688-R700 HydrophobicContact CE2-CG 4.31Å; F688-R700 HydrophobicContact CZ-CB 4.01Å; F688-R700 HydrophobicContact CZ-CG 4.03Å; F688-I703 HydrophobicContact CE1-CB 4.37Å; F688-I703 HydrophobicContact CE1-CD1 4.47Å; F688-I703 HydrophobicContact CE1-CG2 4.01Å; F688-I703 HydrophobicContact CZ-CB 4.19Å; F688-I703 HydrophobicContact CZ-CG2 3.96Å; F688-T704 WeakPolarHBondContact CE2-OG1 3.34Å; F688-I729 HydrophobicContact CD1-CB 4.18Å; F688-I729 HydrophobicContact CD1-CD1 3.73Å; F688-I729 HydrophobicContact CD1-CG2 4.39Å; F688-I729 HydrophobicContact CE1-CD1 3.33Å; F688-I729 HydrophobicContact CE2-CD1 4.19Å; F688-I729 HydrophobicContact CG-CD1 4.32Å; F688-I729 HydrophobicContact CZ-CD1 3.59Å
689	D	74	Confident	69.3	Low	79 Å²	79	91.8 Å²	91.8	42%	0.422	45%	0.447	S	S	.	.	S	Bend	trans	-70.9	-28.7	-172.2	-63.7	-25.7	0	0	0	112.8	H728 I729	D689-H728 IonicContact OD1-CE1 2.93Å; D689-H728 IonicContact OD1-CG 2.71Å; D689-H728 IonicContact OD1-ND1 3.83Å; D689-H728 PolarHBondContact OD1-ND1 3.01Å; D689-I729 PolarHBondContact N-O 3.48Å; D689-I729 VanDerWaalsContact N-O 3.16Å
690	R	64.6	Low	70.5	Confident	222 Å²	222	89.1 Å²	89.1	84%	0.838	43%	0.431	S	S	*	.	S	Bend	trans	-137	25	-169.1	-66.2	-172.9	178.3	178.3	0.5	116.4	F688	F688-R690 VanDerWaalsContact C-N 3.34Å; F688-R690 PolarHBondContact O-N 3.37Å
691	L	61.2	Low	72	Confident	30 Å²	30	92.3 Å²	92.3	16%	0.157	44%	0.441	C	S	.	.			trans	-130.1	85.6	-178.5	-83.1	138.6	0	0	0	112.2	F688 I696 R700 I732 L755	F688-L691 HydrophobicContact CB-CB 4.4Å; F688-L691 HydrophobicContact CD1-CD1 4.18Å; L691-I696 HydrophobicContact CD2-CD1 3.57Å; L691-I696 HydrophobicContact CD2-CG2 4.45Å; L691-R700 PolarHBondContact O-NH1 2.76Å; L691-I732 HydrophobicContact CD1-CD1 3.6Å; L691-I732 HydrophobicContact CD1-CG1 4.27Å; L691-L755 HydrophobicContact CD2-CD1 4.09Å
692	A	53.4	Low	73.3	Confident	94 Å²	94	86.4 Å²	86.4	78%	0.777	41%	0.412	S	S	*	.			trans	-89.7	-3.9	-179.1	0	0	0	0	0	114.7
693	D	58.5	Low	74.4	Confident	86 Å²	86	84.1 Å²	84.1	46%	0.46	40%	0.401	S	S	.	.			trans	-81.4	126.7	-165.6	-111.5	15.6	0	0	0	114.9	K695 I696	D693-K695 PolarHBondContact O-N 2.89Å; D693-I696 HydrophobicContact CB-CD1 4.21Å; D693-I696 HydrophobicContact CB-CG1 4.44Å; D693-I696 PolarHBondContact O-N 3.34Å
694	H	57.4	Low	75.3	Confident	174 Å²	174	77.5 Å²	77.5	81%	0.806	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-60.2	-16	176.6	-72.4	-74	0	0	0	114.2	I696 V697	H694-I696 VanDerWaalsContact C-N 3.27Å; H694-I696 PolarHBondContact O-N 3.43Å; H694-V697 WeakPolarHBondContact O-CG2 3.45Å
695	K	58.4	Low	75.8	Confident	159 Å²	159	80.2 Å²	80.2	69%	0.691	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-74.5	-15.1	178.9	-67.6	179.3	-176.7	169.5	0	113.5	D693	D693-K695 PolarHBondContact O-N 2.89Å
696	I	70.8	Confident	76.1	Confident	6 Å²	6	75.3 Å²	75.3	3%	0.031	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-106.9	10.8	-167.7	-52.5	176.8	0	0	0	111.8	L691 D693 H694 R698 I699 R700 L755	L691-I696 HydrophobicContact CD2-CD1 3.57Å; L691-I696 HydrophobicContact CD2-CG2 4.45Å; D693-I696 HydrophobicContact CB-CD1 4.21Å; D693-I696 HydrophobicContact CB-CG1 4.44Å; D693-I696 PolarHBondContact O-N 3.34Å; H694-I696 VanDerWaalsContact C-N 3.27Å; H694-I696 PolarHBondContact O-N 3.43Å; I696-R698 VanDerWaalsContact C-N 3.27Å; I696-R698 PolarHBondContact O-N 3.15Å; I696-R698 VanDerWaalsContact O-N 3.11Å; I696-I699 HydrophobicContact CG2-CB 3.65Å; I696-I699 HydrophobicContact CG2-CD1 4.17Å; I696-I699 HydrophobicContact CG2-CG2 3.88Å; I696-I699 PolarHBondContact O-N 3.39Å; I696-R700 HydrophobicContact CG2-CG 4.34Å; I696-R700 PolarHBondContact O-N 3.06Å; I696-L755 HydrophobicContact CD1-CB 4.18Å
697	V	76	Confident	76.4	Confident	92 Å²	92	74.2 Å²	74.2	56%	0.558	36%	0.356	S	S	*	.	H	α-helix	trans	-50.6	-43.6	-176.1	175.2	0	0	0	0	112.9	H694 I699 R700 H701	H694-V697 WeakPolarHBondContact O-CG2 3.45Å; V697-I699 PolarHBondContact O-N 2.87Å; V697-R700 PolarHBondContact O-N 3.41Å; V697-H701 WeakPolarHBondContact O-CB 3.26Å; V697-H701 PolarHBondContact O-N 3.03Å
698	R	79	Confident	76.5	Confident	191 Å²	191	74.2 Å²	74.2	72%	0.721	36%	0.356	S	S	*	.	H	α-helix	trans	-63.2	-41.4	178.3	-71.9	-173	178.6	179.3	0.4	113.3	I696 A702	I696-R698 VanDerWaalsContact C-N 3.27Å; I696-R698 PolarHBondContact O-N 3.15Å; I696-R698 VanDerWaalsContact O-N 3.11Å; R698-A702 WeakPolarHBondContact O-CB 3.35Å; R698-A702 PolarHBondContact O-N 3.45Å
699	I	82.5	Confident	76.7	Confident	5 Å²	5	75.4 Å²	75.4	3%	0.026	37%	0.367	C	S	.	.	H	α-helix	trans	-73.4	-40.2	179.6	-73.2	154.3	0	0	0	110.2	I696 V697 H701 A702 I703 L755 L763 L769 L772	I696-I699 HydrophobicContact CG2-CB 3.65Å; I696-I699 HydrophobicContact CG2-CD1 4.17Å; I696-I699 HydrophobicContact CG2-CG2 3.88Å; I696-I699 PolarHBondContact O-N 3.39Å; V697-I699 PolarHBondContact O-N 2.87Å; I699-H701 VanDerWaalsContact C-N 3.34Å; I699-H701 PolarHBondContact O-N 2.85Å; I699-A702 PolarHBondContact O-N 2.87Å; I699-I703 HydrophobicContact CG2-CD1 3.61Å; I699-I703 HydrophobicContact CG2-CG1 4.25Å; I699-I703 WeakPolarHBondContact O-CB 3.41Å; I699-I703 VanDerWaalsContact O-CG1 3.27Å; I699-I703 WeakPolarHBondContact O-CG1 3.36Å; I699-I703 PolarHBondContact O-N 2.99Å; I699-L755 HydrophobicContact CD1-CD2 3.95Å; I699-L763 HydrophobicContact CD1-CB 4.11Å; I699-L763 HydrophobicContact CD1-CD2 3.39Å; I699-L763 HydrophobicContact CD1-CG 4.37Å; I699-L769 HydrophobicContact CG1-CD2 3.8Å; I699-L772 HydrophobicContact CG1-CD1 4.43Å; I699-L772 HydrophobicContact CG2-CD1 3.98Å
700	R	83.6	Confident	77.4	Confident	88 Å²	88	71.8 Å²	71.8	33%	0.332	35%	0.349	S	S	.	.	H	α-helix	trans	-57.1	-49.7	172.7	-73.7	-174	69.5	160.1	-6.1	110.4	F688 L691 I696 V697 A702 I703 T704	F688-R700 HydrophobicContact CD1-CG 4.43Å; F688-R700 HydrophobicContact CE1-CG 4.09Å; F688-R700 HydrophobicContact CE2-CB 4.26Å; F688-R700 HydrophobicContact CE2-CG 4.31Å; F688-R700 HydrophobicContact CZ-CB 4.01Å; F688-R700 HydrophobicContact CZ-CG 4.03Å; L691-R700 PolarHBondContact O-NH1 2.76Å; I696-R700 HydrophobicContact CG2-CG 4.34Å; I696-R700 PolarHBondContact O-N 3.06Å; V697-R700 PolarHBondContact O-N 3.41Å; R700-A702 PolarHBondContact O-N 3.13Å; R700-I703 PolarHBondContact O-N 2.91Å; R700-T704 WeakPolarHBondContact O-CB 3.42Å; R700-T704 PolarHBondContact O-N 3.01Å; R700-T704 PolarHBondContact O-OG1 3.26Å
701	H	84.7	Confident	78.6	Confident	116 Å²	116	61.4 Å²	61.4	54%	0.537	31%	0.31	S	S	.	.	H	α-helix	trans	-59.3	-47.2	176.8	-176.6	68.1	0	0	0	112.2	V697 I699 I703 T704 E705	V697-H701 WeakPolarHBondContact O-CB 3.26Å; V697-H701 PolarHBondContact O-N 3.03Å; I699-H701 VanDerWaalsContact C-N 3.34Å; I699-H701 PolarHBondContact O-N 2.85Å; H701-I703 VanDerWaalsContact C-N 3.34Å; H701-I703 PolarHBondContact O-N 2.73Å; H701-T704 PolarHBondContact O-N 3.05Å; H701-E705 IonicContact NE2-OE1 3.77Å; H701-E705 PolarHBondContact O-N 2.92Å
702	A	86	Confident	79.6	Confident	8 Å²	8	65.6 Å²	65.6	7%	0.066	33%	0.328	C	S	.	.	H	α-helix	trans	-62.5	-37.6	178.7	0	0	0	0	0	113.6	R698 I699 R700 A706 L769 K773	R698-A702 WeakPolarHBondContact O-CB 3.35Å; R698-A702 PolarHBondContact O-N 3.45Å; I699-A702 PolarHBondContact O-N 2.87Å; R700-A702 PolarHBondContact O-N 3.13Å; A702-A706 WeakPolarHBondContact O-CB 3.16Å; A702-A706 PolarHBondContact O-N 3.4Å; A702-L769 HydrophobicContact CB-CD2 3.81Å; A702-K773 WeakPolarHBondContact O-CE 3.43Å
703	I	88.5	Confident	81	Confident	2 Å²	2	65.4 Å²	65.4	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-72.5	-43.3	176	-70.5	172.8	0	0	0	110.6	F688 I699 R700 H701 E705 A706 C707 I729 I732	F688-I703 HydrophobicContact CE1-CB 4.37Å; F688-I703 HydrophobicContact CE1-CD1 4.47Å; F688-I703 HydrophobicContact CE1-CG2 4.01Å; F688-I703 HydrophobicContact CZ-CB 4.19Å; F688-I703 HydrophobicContact CZ-CG2 3.96Å; I699-I703 HydrophobicContact CG2-CD1 3.61Å; I699-I703 HydrophobicContact CG2-CG1 4.25Å; I699-I703 WeakPolarHBondContact O-CB 3.41Å; I699-I703 VanDerWaalsContact O-CG1 3.27Å; I699-I703 WeakPolarHBondContact O-CG1 3.36Å; I699-I703 PolarHBondContact O-N 2.99Å; R700-I703 PolarHBondContact O-N 2.91Å; H701-I703 VanDerWaalsContact C-N 3.34Å; H701-I703 PolarHBondContact O-N 2.73Å; I703-E705 PolarHBondContact O-N 2.82Å; I703-A706 PolarHBondContact O-N 3.22Å; I703-A706 VanDerWaalsContact O-N 3.16Å; I703-C707 WeakPolarHBondContact O-CB 3.38Å; I703-C707 PolarHBondContact O-N 2.9Å; I703-C707 PolarHBondContact O-SG 3.45Å; I703-C707 VanDerWaalsContact O-SG 3.36Å; I703-I729 HydrophobicContact CG2-CD1 3.37Å; I703-I732 HydrophobicContact CD1-CD1 3.53Å
704	T	89.3	Confident	82.2	Confident	39 Å²	39	62 Å²	62	24%	0.239	30%	0.3	C	S	.	.	H	α-helix	trans	-58.5	-48.7	175.6	-64.1	0	0	0	0	110.6	V686 F688 R700 H701 A706 C707 L708	V686-T704 HydrophobicContact CB-CG2 4.13Å; V686-T704 HydrophobicContact CG2-CG2 4.05Å; F688-T704 WeakPolarHBondContact CE2-OG1 3.34Å; R700-T704 WeakPolarHBondContact O-CB 3.42Å; R700-T704 PolarHBondContact O-N 3.01Å; R700-T704 PolarHBondContact O-OG1 3.26Å; H701-T704 PolarHBondContact O-N 3.05Å; T704-A706 VanDerWaalsContact C-N 3.33Å; T704-A706 PolarHBondContact O-N 2.91Å; T704-C707 PolarHBondContact O-N 3.22Å; T704-L708 HydrophobicContact CG2-CD1 3.95Å; T704-L708 HydrophobicContact CG2-CG 4.42Å; T704-L708 WeakPolarHBondContact O-CB 3.41Å; T704-L708 VanDerWaalsContact O-CG 3.27Å; T704-L708 WeakPolarHBondContact O-CG 3.44Å; T704-L708 PolarHBondContact O-N 2.92Å
705	E	88.1	Confident	83.4	Confident	88 Å²	88	54 Å²	54	41%	0.411	26%	0.264	S	S	.	.	H	α-helix	trans	-58	-42.6	173.1	-76.7	-162.3	147.1	0	0	112.6	H701 I703 L708 S709 K773	H701-E705 IonicContact NE2-OE1 3.77Å; H701-E705 PolarHBondContact O-N 2.92Å; I703-E705 PolarHBondContact O-N 2.82Å; E705-L708 PolarHBondContact O-N 3.49Å; E705-S709 VanDerWaalsContact O-CB 3.31Å; E705-S709 WeakPolarHBondContact O-CB 3.35Å; E705-S709 PolarHBondContact O-N 3.46Å; E705-S709 PolarHBondContact O-OG 3.49Å; E705-K773 IonicContact OE2-NZ 3.77Å; E705-K773 PolarHBondContact OE2-NZ 3.19Å
706	A	89.9	Confident	84.7	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.008	25%	0.252	C	S	.	.	H	α-helix	trans	-66.1	-38.4	179.1	0	0	0	0	0	112.8	A702 I703 T704 S709 A710 K773 C776	A702-A706 WeakPolarHBondContact O-CB 3.16Å; A702-A706 PolarHBondContact O-N 3.4Å; I703-A706 PolarHBondContact O-N 3.22Å; I703-A706 VanDerWaalsContact O-N 3.16Å; T704-A706 VanDerWaalsContact C-N 3.33Å; T704-A706 PolarHBondContact O-N 2.91Å; A706-S709 WeakPolarHBondContact CA-OG 3.5Å; A706-S709 PolarHBondContact O-OG 3.45Å; A706-A710 VanDerWaalsContact O-CB 3.27Å; A706-A710 WeakPolarHBondContact O-CB 3.41Å; A706-A710 PolarHBondContact O-N 2.93Å; A706-K773 HydrophobicContact CB-CB 4.03Å; A706-K773 HydrophobicContact CB-CG 3.94Å; A706-C776 HydrophobicContact CB-CB 3.96Å
707	C	89.7	Confident	85.4	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-66.7	-45.6	175.3	-74.7	0	0	0	0	111.3	V686 I703 T704 A710 L711 I727	V686-C707 HydrophobicContact CG1-CB 4.38Å; V686-C707 HydrophobicContact CG2-CB 3.72Å; I703-C707 WeakPolarHBondContact O-CB 3.38Å; I703-C707 PolarHBondContact O-N 2.9Å; I703-C707 PolarHBondContact O-SG 3.45Å; I703-C707 VanDerWaalsContact O-SG 3.36Å; T704-C707 PolarHBondContact O-N 3.22Å; C707-A710 WeakPolarHBondContact O-CB 3.28Å; C707-A710 PolarHBondContact O-N 2.62Å; C707-L711 PolarHBondContact O-N 3.3Å; C707-L711 VanDerWaalsContact O-N 3.08Å; C707-I727 HydrophobicContact CB-CD1 3.79Å
708	L	88.4	Confident	85.7	Confident	57 Å²	57	47.9 Å²	47.9	30%	0.298	24%	0.239	S	C	.	.	H	α-helix	trans	-64.2	-48.5	178.4	-66.9	175.2	0	0	0	111.4	P684 V686 T704 E705 A710 L711 E712	P684-L708 HydrophobicContact CB-CD2 4.39Å; P684-L708 HydrophobicContact CG-CD2 3.85Å; V686-L708 HydrophobicContact CG2-CD2 4.33Å; V686-L708 HydrophobicContact CG2-CG 4.36Å; T704-L708 HydrophobicContact CG2-CD1 3.95Å; T704-L708 HydrophobicContact CG2-CG 4.42Å; T704-L708 WeakPolarHBondContact O-CB 3.41Å; T704-L708 VanDerWaalsContact O-CG 3.27Å; T704-L708 WeakPolarHBondContact O-CG 3.44Å; T704-L708 PolarHBondContact O-N 2.92Å; E705-L708 PolarHBondContact O-N 3.49Å; L708-A710 PolarHBondContact O-N 2.81Å; L708-L711 WeakPolarHBondContact O-CB 3.27Å; L708-L711 PolarHBondContact O-N 3.11Å; L708-E712 WeakPolarHBondContact O-CG 3.11Å; L708-E712 PolarHBondContact O-N 3.39Å; L708-E712 VanDerWaalsContact O-N 3.07Å
709	S	86.8	Confident	86	Confident	47 Å²	47	45.9 Å²	45.9	33%	0.329	23%	0.232	S	C	.	.	H	α-helix	trans	-61.8	-30	174.7	60.2	0	0	0	0	113.4	E705 A706	E705-S709 VanDerWaalsContact O-CB 3.31Å; E705-S709 WeakPolarHBondContact O-CB 3.35Å; E705-S709 PolarHBondContact O-N 3.46Å; E705-S709 PolarHBondContact O-OG 3.49Å; A706-S709 WeakPolarHBondContact CA-OG 3.5Å; A706-S709 PolarHBondContact O-OG 3.45Å
710	A	89.4	Confident	86	Confident	3 Å²	3	46.1 Å²	46.1	3%	0.025	23%	0.234	C	C	.	.	H	α-helix	trans	-66.8	-42.9	172.1	0	0	0	0	0	111.4	A706 C707 L708 E712 V713 S714 I777 V780	A706-A710 VanDerWaalsContact O-CB 3.27Å; A706-A710 WeakPolarHBondContact O-CB 3.41Å; A706-A710 PolarHBondContact O-N 2.93Å; C707-A710 WeakPolarHBondContact O-CB 3.28Å; C707-A710 PolarHBondContact O-N 2.62Å; L708-A710 PolarHBondContact O-N 2.81Å; A710-E712 VanDerWaalsContact C-N 3.3Å; A710-E712 PolarHBondContact O-N 2.99Å; A710-V713 PolarHBondContact O-N 3.04Å; A710-S714 WeakPolarHBondContact O-CB 3.46Å; A710-S714 PolarHBondContact O-N 3.24Å; A710-S714 PolarHBondContact O-OG 3.18Å; A710-I777 HydrophobicContact CB-CB 4.42Å; A710-I777 HydrophobicContact CB-CG1 4.17Å; A710-I777 HydrophobicContact CB-CG2 4.41Å; A710-V780 HydrophobicContact CB-CB 3.97Å; A710-V780 HydrophobicContact CB-CG1 3.86Å; A710-V780 HydrophobicContact CB-CG2 4.41Å
711	L	88.7	Confident	86	Confident	4 Å²	4	43.5 Å²	43.5	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-65.3	-32.5	177.5	-69.4	177.3	0	0	0	112.7	L673 P684 C707 L708 V713 I722 V725 I727 V780	L673-L711 HydrophobicContact CD2-CD2 4.34Å; P684-L711 HydrophobicContact CB-CD1 3.54Å; P684-L711 HydrophobicContact CG-CD1 3.83Å; C707-L711 PolarHBondContact O-N 3.3Å; C707-L711 VanDerWaalsContact O-N 3.08Å; L708-L711 WeakPolarHBondContact O-CB 3.27Å; L708-L711 PolarHBondContact O-N 3.11Å; L711-V713 VanDerWaalsContact C-N 3.29Å; L711-V713 PolarHBondContact O-N 2.76Å; L711-I722 HydrophobicContact CB-CB 4.42Å; L711-I722 HydrophobicContact CD2-CB 4.04Å; L711-I722 HydrophobicContact CD2-CD1 4.25Å; L711-I722 HydrophobicContact CD2-CG2 4.07Å; L711-I722 PolarHBondContact O-N 2.88Å; L711-V725 HydrophobicContact CD1-CG2 4.23Å; L711-V725 HydrophobicContact CD2-CG2 3.96Å; L711-I727 HydrophobicContact CD1-CD1 3.59Å; L711-I727 HydrophobicContact CD1-CG1 4.25Å; L711-I727 HydrophobicContact CD2-CD1 4.08Å; L711-I727 HydrophobicContact CG-CD1 3.77Å; L711-V780 HydrophobicContact CD2-CG1 4.17Å
712	E	83.2	Confident	86.2	Confident	118 Å²	118	38.1 Å²	38.1	55%	0.551	20%	0.204	S	C	*	.	H	α-helix	trans	-64.3	-30.6	178.6	-73.5	170.7	-179.9	0	0	113.4	L708 A710	L708-E712 WeakPolarHBondContact O-CG 3.11Å; L708-E712 PolarHBondContact O-N 3.39Å; L708-E712 VanDerWaalsContact O-N 3.07Å; A710-E712 VanDerWaalsContact C-N 3.3Å; A710-E712 PolarHBondContact O-N 2.99Å
713	V	82.7	Confident	86.2	Confident	90 Å²	90	39 Å²	39	55%	0.545	21%	0.206	S	C	.	.	H	α-helix	trans	-114	-12.8	-171.1	-171.8	0	0	0	0	113.4	A710 L711	A710-V713 PolarHBondContact O-N 3.04Å; L711-V713 VanDerWaalsContact C-N 3.29Å; L711-V713 PolarHBondContact O-N 2.76Å
714	S	82.2	Confident	85.8	Confident	15 Å²	15	39.2 Å²	39.2	11%	0.105	21%	0.21	C	C	.	.			trans	-97.4	14.4	-166.2	-55.3	0	0	0	0	115.5	A710 K781	A710-S714 WeakPolarHBondContact O-CB 3.46Å; A710-S714 PolarHBondContact O-N 3.24Å; A710-S714 PolarHBondContact O-OG 3.18Å; S714-K781 VanDerWaalsContact OG-CE 3.23Å; S714-K781 WeakPolarHBondContact OG-CE 3.42Å; S714-K781 WeakPolarHBondContact OG-CG 3.39Å
715	G	84	Confident	85.8	Confident	4 Å²	4	37.4 Å²	37.4	4%	0.041	20%	0.199	C	C	.	.			trans	-52	125.2	173	0	0	0	0	0	112.3	E641 I717 R719 S720	E641-G715 VanDerWaalsContact OE2-CA 3.28Å; E641-G715 WeakPolarHBondContact OE2-CA 3.48Å; G715-I717 VanDerWaalsContact C-N 3.34Å; G715-I717 PolarHBondContact O-N 3.29Å; G715-R719 WeakPolarHBondContact O-CA 3.42Å; G715-R719 PolarHBondContact O-N 3.18Å; G715-S720 WeakPolarHBondContact CA-O 3.33Å; G715-S720 PolarHBondContact N-O 3.22Å
716	P	86	Confident	85.8	Confident	67 Å²	67	33.2 Å²	33.2	44%	0.435	18%	0.179	S	C	.	.	S	Bend	trans	-68.8	-21.9	-178.2	24.1	-33.2	0	0	0	115.7	E641 V784 W790	E641-P716 WeakPolarHBondContact OE2-CD 3.48Å; P716-V784 HydrophobicContact CG-CG1 4.35Å; P716-W790 HydrophobicContact CG-CB 3.96Å; P716-W790 VanDerWaalsContact CG-CD1 3.45Å; P716-W790 HydrophobicContact CG-CD2 3.52Å; P716-W790 HydrophobicContact CG-CE3 4.19Å; P716-W790 HydrophobicContact CG-CG 3.36Å
717	I	85.2	Confident	85.8	Confident	45 Å²	45	33.2 Å²	33.2	23%	0.231	18%	0.179	C	C	.	.	S	Bend	trans	-96.6	-67.1	-173.6	-54.8	176.7	0	0	0	111.5	E641 G715 W790 V792 I898	E641-I717 HydrophobicContact CG-CB 4.43Å; E641-I717 WeakPolarHBondContact OE2-CB 3.47Å; E641-I717 PolarHBondContact OE2-N 2.81Å; G715-I717 VanDerWaalsContact C-N 3.34Å; G715-I717 PolarHBondContact O-N 3.29Å; I717-W790 HydrophobicContact CD1-CB 3.68Å; I717-W790 VanDerWaalsContact CD1-O 3.26Å; I717-W790 WeakPolarHBondContact CD1-O 3.2Å; I717-W790 HydrophobicContact CG1-CB 4.11Å; I717-V792 HydrophobicContact CB-CG2 4.26Å; I717-V792 HydrophobicContact CD1-CG2 3.96Å; I717-V792 HydrophobicContact CG2-CG2 3.88Å; I717-I898 HydrophobicContact CG2-CD1 3.79Å; I717-I898 HydrophobicContact CG2-CG1 3.69Å
718	L	82.8	Confident	85.8	Confident	18 Å²	18	34.7 Å²	34.7	9%	0.094	19%	0.186	C	C	.	.	S	Bend	trans	-104.1	-2.6	-175.9	-63.2	178.7	0	0	0	112.2	Y639 E641 V792 L897 I898 Y901	Y639-L718 HydrophobicContact CD2-CD1 4.49Å; Y639-L718 HydrophobicContact CG-CD1 4.34Å; E641-L718 WeakPolarHBondContact OE1-CA 3.49Å; E641-L718 PolarHBondContact OE1-N 3.23Å; L718-V792 HydrophobicContact CD1-CG1 3.74Å; L718-V792 HydrophobicContact CD1-CG2 3.98Å; L718-V792 HydrophobicContact CG-CG2 4.22Å; L718-L897 HydrophobicContact CD1-CB 4.48Å; L718-I898 HydrophobicContact CD2-CG1 4.49Å; L718-Y901 HydrophobicContact CD2-CD2 4.29Å; L718-Y901 HydrophobicContact CD2-CG 4.01Å; L718-Y901 VanDerWaalsContact O-CE2 3.26Å; L718-Y901 WeakPolarHBondContact O-CE2 3.37Å; L718-Y901 PolarHBondContact O-OH 3.41Å
719	R	83.5	Confident	85.7	Confident	148 Å²	148	32 Å²	32	56%	0.558	17%	0.172	S	C	*	.	S	Bend	trans	58.7	37.4	-165.5	-57.1	-171.4	174.7	175.6	-3.1	112.2	E641 G715 R905	E641-R719 PolarHBondContact OE1-N 3.17Å; G715-R719 WeakPolarHBondContact O-CA 3.42Å; G715-R719 PolarHBondContact O-N 3.18Å; R719-R905 VanDerWaalsContact CD-NH2 3.33Å; R719-R905 VanDerWaalsContact NH1-NH2 3.17Å
720	S	82.7	Confident	85.4	Confident	10 Å²	10	32.3 Å²	32.3	7%	0.07	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-90.7	165.4	177.7	66.7	0	0	0	0	111.9	Y639 E641 G715 I722	Y639-S720 VanDerWaalsContact O-CB 3.31Å; Y639-S720 WeakPolarHBondContact O-CB 3.42Å; E641-S720 VanDerWaalsContact CD-OG 3.26Å; E641-S720 WeakPolarHBondContact CG-OG 3.47Å; E641-S720 PolarHBondContact N-OG 3.01Å; E641-S720 PolarHBondContact OE1-N 3.18Å; E641-S720 VanDerWaalsContact OE1-N 3.11Å; E641-S720 PolarHBondContact OE1-OG 3.5Å; G715-S720 WeakPolarHBondContact CA-O 3.33Å; G715-S720 PolarHBondContact N-O 3.22Å; S720-I722 PolarHBondContact O-N 3.48Å
721	P	84.7	Confident	84.9	Confident	33 Å²	33	33.4 Å²	33.4	21%	0.214	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-59.8	133.7	177.9	-25.5	35.3	0	0	0	112.6	K640 E641	K640-P721 CarbonylContact C-O 3.37Å; K640-P721 WeakPolarHBondContact CA-O 3.3Å; K640-P721 WeakPolarHBondContact CB-O 3.46Å; E641-P721 PolarHBondContact N-O 3.43Å
722	I	88.4	Confident	84.5	Confident	4 Å²	4	33.9 Å²	33.9	2%	0.021	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-84.5	131.3	178.5	-65.7	169.3	0	0	0	110.6	E641 L711 S720 V725 V784 W790	E641-I722 CarbonylContact O-C 3.5Å; E641-I722 VanDerWaalsContact O-CA 3.27Å; E641-I722 WeakPolarHBondContact O-CA 3.45Å; L711-I722 HydrophobicContact CB-CB 4.42Å; L711-I722 HydrophobicContact CD2-CB 4.04Å; L711-I722 HydrophobicContact CD2-CD1 4.25Å; L711-I722 HydrophobicContact CD2-CG2 4.07Å; L711-I722 PolarHBondContact O-N 2.88Å; S720-I722 PolarHBondContact O-N 3.48Å; I722-V725 HydrophobicContact CG2-CG1 4.31Å; I722-V725 HydrophobicContact CG2-CG2 3.58Å; I722-V784 HydrophobicContact CD1-CB 4.43Å; I722-V784 HydrophobicContact CD1-CG1 3.77Å; I722-V784 HydrophobicContact CD1-CG2 3.71Å; I722-W790 HydrophobicContact CB-CZ3 4.4Å; I722-W790 HydrophobicContact CD1-CH2 4.03Å; I722-W790 HydrophobicContact CD1-CZ3 4.18Å; I722-W790 HydrophobicContact CG1-CH2 4.32Å; I722-W790 HydrophobicContact CG1-CZ3 3.99Å; I722-W790 HydrophobicContact CG2-CH2 3.85Å; I722-W790 HydrophobicContact CG2-CZ3 3.65Å
723	I	85.2	Confident	84.4	Confident	25 Å²	25	29.4 Å²	29.4	13%	0.128	16%	0.16	C	C	.	.			trans	-121.7	170.4	173	60.4	169.2	0	0	0	112	K640 E641 C642 M678 V725 M793	K640-I723 HydrophobicContact CB-CD1 4.06Å; K640-I723 HydrophobicContact CB-CG1 4.1Å; K640-I723 HydrophobicContact CB-CG2 4.32Å; K640-I723 HydrophobicContact CD-CD1 4.31Å; K640-I723 HydrophobicContact CD-CG2 3.65Å; K640-I723 HydrophobicContact CG-CG2 4.45Å; E641-I723 PolarHBondContact O-N 2.97Å; C642-I723 HydrophobicContact CB-CG1 4.14Å; M678-I723 HydrophobicContact CE-CD1 4.35Å; I723-V725 VanDerWaalsContact C-N 3.32Å; I723-V725 PolarHBondContact O-N 2.96Å; I723-M793 HydrophobicContact CD1-CB 4.45Å; I723-M793 HydrophobicContact CD1-CE 4.48Å; I723-M793 HydrophobicContact CD1-CG 4.14Å
724	G	81.8	Confident	84.2	Confident	8 Å²	8	25.5 Å²	25.5	8%	0.082	14%	0.137	C	C	.	.	S	Bend	trans	73.7	22	175.9	0	0	0	0	0	114.2	P675 K676	P675-G724 WeakPolarHBondContact CA-O 3.27Å; K676-G724 PolarHBondContact N-O 3.11Å
725	V	87.5	Confident	84	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	144	179.3	-62.2	0	0	0	0	111.5	P643 L673 Q674 P684 L711 I722 I723	P643-V725 HydrophobicContact CG-CG1 3.56Å; L673-V725 HydrophobicContact CD2-CB 3.6Å; L673-V725 HydrophobicContact CD2-CG1 4.04Å; L673-V725 HydrophobicContact CD2-CG2 3.61Å; Q674-V725 WeakPolarHBondContact O-CA 3.43Å; P684-V725 WeakPolarHBondContact CB-O 3.46Å; L711-V725 HydrophobicContact CD1-CG2 4.23Å; L711-V725 HydrophobicContact CD2-CG2 3.96Å; I722-V725 HydrophobicContact CG2-CG1 4.31Å; I722-V725 HydrophobicContact CG2-CG2 3.58Å; I723-V725 VanDerWaalsContact C-N 3.32Å; I723-V725 PolarHBondContact O-N 2.96Å
726	D	88.6	Confident	83.6	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	150.3	164.3	-76.6	-10.2	0	0	0	110.1	Q674 K676 H682 Q685	Q674-D726 PolarHBondContact N-O 3.29Å; Q674-D726 PolarHBondContact O-N 2.92Å; K676-D726 WeakPolarHBondContact CD-OD2 3.49Å; K676-D726 WeakPolarHBondContact CE-OD2 3.29Å; K676-D726 IonicContact NZ-OD2 2.86Å; K676-D726 PolarHBondContact NZ-OD2 2.88Å; H682-D726 IonicContact CD2-OD1 3.63Å; H682-D726 IonicContact CE1-OD1 3.87Å; H682-D726 IonicContact NE2-OD1 3.06Å; H682-D726 PolarHBondContact NE2-OD1 3.47Å; H682-D726 IonicContact NE2-OD2 3.89Å; Q685-D726 PolarHBondContact N-OD1 3.39Å
727	I	89.4	Confident	83.3	Confident	1 Å²	1	32 Å²	32	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	116.8	179.2	-61.4	172.4	0	0	0	108.6	V671 L673 Q685 V686 I687 C707 L711 I729 V780	V671-I727 HydrophobicContact CB-CG2 4.24Å; V671-I727 HydrophobicContact CG1-CG2 4.37Å; L673-I727 HydrophobicContact CD2-CG1 4.07Å; L673-I727 HydrophobicContact CG-CG1 4.29Å; Q685-I727 PolarHBondContact O-N 3.36Å; V686-I727 CarbonylContact C-O 3.49Å; V686-I727 WeakPolarHBondContact CA-O 3.4Å; I687-I727 PolarHBondContact N-O 2.86Å; C707-I727 HydrophobicContact CB-CD1 3.79Å; L711-I727 HydrophobicContact CD1-CD1 3.59Å; L711-I727 HydrophobicContact CD1-CG1 4.25Å; L711-I727 HydrophobicContact CD2-CD1 4.08Å; L711-I727 HydrophobicContact CG-CD1 3.77Å; I727-I729 HydrophobicContact CG2-CG1 4.39Å; I727-V780 HydrophobicContact CD1-CG1 4.37Å; I727-V780 HydrophobicContact CD1-CG2 4.11Å
728	H	90	Very high	82.6	Confident	31 Å²	31	38.2 Å²	38.2	14%	0.144	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	123.6	169.9	-75.7	-99.2	0	0	0	110.2	V671 I672 Q674 I687 D689	V671-H728 CarbonylContact C-O 3.59Å; V671-H728 VanDerWaalsContact CA-O 3.32Å; V671-H728 WeakPolarHBondContact CA-O 3.44Å; I672-H728 HydrophobicContact CB-CB 4.15Å; I672-H728 PolarHBondContact N-O 3.48Å; I672-H728 PolarHBondContact O-N 3.29Å; Q674-H728 PolarHBondContact OE1-NE2 2.92Å; I687-H728 CarbonylContact O-C 3.5Å; I687-H728 WeakPolarHBondContact O-CA 3.38Å; D689-H728 IonicContact OD1-CE1 2.93Å; D689-H728 IonicContact OD1-CG 2.71Å; D689-H728 IonicContact OD1-ND1 3.83Å; D689-H728 PolarHBondContact OD1-ND1 3.01Å
729	I	86	Confident	82.1	Confident	2 Å²	2	42 Å²	42	1%	0.01	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	107	174.8	-60.8	163.6	0	0	0	107.8	I669 V671 V686 I687 F688 D689 I703 I727 I732	I669-I729 HydrophobicContact CG2-CG2 4.45Å; V671-I729 HydrophobicContact CG1-CG1 4.43Å; V686-I729 HydrophobicContact CG1-CD1 3.48Å; V686-I729 VanDerWaalsContact CG1-CD1 3.48Å; V686-I729 HydrophobicContact CG1-CG1 4.25Å; I687-I729 PolarHBondContact O-N 3.3Å; F688-I729 HydrophobicContact CD1-CB 4.18Å; F688-I729 HydrophobicContact CD1-CD1 3.73Å; F688-I729 HydrophobicContact CD1-CG2 4.39Å; F688-I729 HydrophobicContact CE1-CD1 3.33Å; F688-I729 HydrophobicContact CE2-CD1 4.19Å; F688-I729 HydrophobicContact CG-CD1 4.32Å; F688-I729 HydrophobicContact CZ-CD1 3.59Å; D689-I729 PolarHBondContact N-O 3.48Å; D689-I729 VanDerWaalsContact N-O 3.16Å; I703-I729 HydrophobicContact CG2-CD1 3.37Å; I727-I729 HydrophobicContact CG2-CG1 4.39Å; I729-I732 HydrophobicContact CG2-CD1 3.98Å; I729-I732 HydrophobicContact CG2-CG1 3.76Å
730	N	81.3	Confident	81.5	Confident	53 Å²	53	35.5 Å²	35.5	28%	0.283	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-30	-174	66.1	13.4	0	0	0	112.8	G670 I672	G670-N730 WeakPolarHBondContact CA-OD1 3.39Å; G670-N730 PolarHBondContact O-N 2.82Å; G670-N730 PolarHBondContact O-OD1 3.32Å; I672-N730 HydrophobicContact CD1-CB 4.28Å
731	S	78.3	Confident	80.9	Confident	26 Å²	26	37.1 Å²	37.1	18%	0.182	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	136.7	-172.6	56.5	0	0	0	0	111.7	W653 I669 G670	W653-S731 WeakPolarHBondContact CZ3-OG 3.48Å; I669-S731 WeakPolarHBondContact CA-O 3.48Å; G670-S731 PolarHBondContact N-O 3.19Å
732	I	80.6	Confident	80	Confident	14 Å²	14	40.9 Å²	40.9	7%	0.072	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	121.4	171.4	-55.3	173.1	0	0	0	106.8	I669 L691 I703 I729 L755 L772	I669-I732 HydrophobicContact CG1-CG2 4.3Å; I669-I732 HydrophobicContact CG2-CG1 4.43Å; L691-I732 HydrophobicContact CD1-CD1 3.6Å; L691-I732 HydrophobicContact CD1-CG1 4.27Å; I703-I732 HydrophobicContact CD1-CD1 3.53Å; I729-I732 HydrophobicContact CG2-CD1 3.98Å; I729-I732 HydrophobicContact CG2-CG1 3.76Å; I732-L755 HydrophobicContact CB-CD1 4.04Å; I732-L755 HydrophobicContact CD1-CD1 4.08Å; I732-L755 HydrophobicContact CG2-CD1 3.72Å; I732-L755 HydrophobicContact CG2-CG 4.36Å; I732-L772 HydrophobicContact CG2-CD2 3.93Å
733	V	80.7	Confident	78.9	Confident	24 Å²	24	46.4 Å²	46.4	15%	0.145	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	132.1	-178.2	-171.1	0	0	0	0	109.1	V667 A668 I740 L753	V667-V733 WeakPolarHBondContact CA-O 3.35Å; A668-V733 PolarHBondContact N-O 2.9Å; A668-V733 PolarHBondContact O-N 2.98Å; V733-I740 HydrophobicContact CB-CD1 4.48Å; V733-I740 HydrophobicContact CG1-CD1 3.84Å; V733-I740 HydrophobicContact CG1-CG1 4.11Å; V733-L753 HydrophobicContact CG1-CB 4.07Å
734	C	79.3	Confident	77.8	Confident	8 Å²	8	48.7 Å²	48.7	5%	0.054	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	129.2	172.8	-178.2	0	0	0	0	109.5	A666 V667 L758	A666-C734 WeakPolarHBondContact O-CA 3.31Å; V667-C734 HydrophobicContact CG2-CB 4.43Å; C734-L758 HydrophobicContact CB-CD1 4.14Å
735	G	77.7	Confident	76.5	Confident	8 Å²	8	51.3 Å²	51.3	8%	0.082	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.2	-171.2	-172.5	0	0	0	0	0	113.3	K665 A666	K665-G735 CarbonylContact C-O 3.54Å; K665-G735 WeakPolarHBondContact CA-O 3.32Å; K665-G735 VanDerWaalsContact CB-O 3.31Å; K665-G735 WeakPolarHBondContact CB-O 3.43Å; A666-G735 PolarHBondContact N-O 2.89Å; A666-G735 PolarHBondContact O-N 3.47Å
736	R	76.8	Confident	74.4	Confident	179 Å²	179	55 Å²	55	68%	0.675	31%	0.306	S	S	*	.			trans	-66.9	147.5	171.5	-69.1	-176.6	179.3	171.8	-0	109.8	E738 H739	R736-E738 PolarHBondContact O-N 2.76Å; R736-E738 VanDerWaalsContact O-N 3.16Å; R736-H739 PolarHBondContact O-N 3Å; R736-H739 VanDerWaalsContact O-N 3.08Å
737	V	77.9	Confident	72.6	Confident	36 Å²	36	57.4 Å²	57.4	22%	0.218	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-56.7	-34.7	-174.5	-175.2	0	0	0	0	112.7	R655 V657 E664 A666 H739	R655-V737 PolarHBondContact NH1-O 3.25Å; V657-V737 HydrophobicContact CG1-CG1 4.28Å; V657-V737 HydrophobicContact CG1-CG2 3.63Å; V657-V737 HydrophobicContact CG2-CG1 3.99Å; E664-V737 HydrophobicContact CB-CG2 4.29Å; E664-V737 HydrophobicContact CG-CG2 3.69Å; A666-V737 HydrophobicContact CB-CG2 4.4Å; V737-H739 VanDerWaalsContact C-N 3.29Å; V737-H739 PolarHBondContact O-N 3.3Å
738	E	71.5	Confident	70.4	Confident	175 Å²	175	64.8 Å²	64.8	82%	0.818	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-68.8	-24.6	-178.1	-64.1	166.6	-165.9	0	0	113.6	R736	R736-E738 PolarHBondContact O-N 2.76Å; R736-E738 VanDerWaalsContact O-N 3.16Å
739	H	71.1	Confident	68.1	Low	97 Å²	97	70.9 Å²	70.9	45%	0.449	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-93.5	-9.4	-171.4	-69.1	-154.3	0	0	0	113.4	R736 V737 L750	R736-H739 PolarHBondContact O-N 3Å; R736-H739 VanDerWaalsContact O-N 3.08Å; V737-H739 VanDerWaalsContact C-N 3.29Å; V737-H739 PolarHBondContact O-N 3.3Å; H739-L750 HydrophobicContact CB-CD2 4.41Å
740	I	71.2	Confident	66	Low	12 Å²	12	74.4 Å²	74.4	6%	0.062	41%	0.41	C	S	.	.	S	Bend	trans	-116.8	105.7	-173.7	-59.1	176.4	0	0	0	108	R655 A666 A668 V733	R655-I740 VanDerWaalsContact CD-O 3.22Å; R655-I740 WeakPolarHBondContact CD-O 3.42Å; R655-I740 HydrophobicContact CG-CG2 4.17Å; R655-I740 PolarHBondContact NH1-O 3.1Å; A666-I740 HydrophobicContact CB-CB 4.1Å; A666-I740 HydrophobicContact CB-CD1 3.94Å; A666-I740 HydrophobicContact CB-CG1 4.47Å; A666-I740 VanDerWaalsContact O-CD1 3.23Å; A666-I740 WeakPolarHBondContact O-CD1 3.27Å; A668-I740 HydrophobicContact CB-CG2 3.6Å; V733-I740 HydrophobicContact CB-CD1 4.48Å; V733-I740 HydrophobicContact CG1-CD1 3.84Å; V733-I740 HydrophobicContact CG1-CG1 4.11Å
741	S	69.7	Low	64	Low	44 Å²	44	75 Å²	75	31%	0.308	43%	0.429	S	S	.	.			trans	-67	156.3	175.9	53.9	0	0	0	0	111.9	D743	S741-D743 PolarHBondContact OG-O 3.43Å
742	N	67.6	Low	62.3	Low	111 Å²	111	78.7 Å²	78.7	59%	0.594	45%	0.446	S	S	*	.	S	Bend	trans	-69.8	-24.7	170.8	-74.9	-14.3	0	0	0	112.1	W653 R655	W653-N742 PolarHBondContact NE1-O 2.96Å; R655-N742 VanDerWaalsContact CD-OD1 3.28Å; R655-N742 WeakPolarHBondContact CD-OD1 3.41Å; R655-N742 PolarHBondContact NE-OD1 2.82Å
743	D	65.1	Low	60.7	Low	121 Å²	121	80.5 Å²	80.5	65%	0.647	46%	0.456	S	S	*	.	S	Bend	trans	-96.2	141.3	-176.3	-63.1	-29.3	0	0	0	112	S741 G745	S741-D743 PolarHBondContact OG-O 3.43Å; D743-G745 PolarHBondContact O-N 3.2Å
744	S	62.1	Low	59.7	Low	72 Å²	72	82.1 Å²	82.1	50%	0.503	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-66.9	-13	-179.7	61.4	0	0	0	0	113.9	C746 I747	S744-C746 PolarHBondContact O-N 3.03Å; S744-I747 WeakPolarHBondContact O-CD1 3.37Å
745	G	53.6	Low	58.7	Low	63 Å²	63	81.9 Å²	81.9	65%	0.649	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-74.5	-14.6	-170.3	0	0	0	0	0	115.9	D743	D743-G745 PolarHBondContact O-N 3.2Å
746	C	44.1	Very low	57.6	Low	78 Å²	78	86.1 Å²	86.1	53%	0.527	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-103.1	10.3	-171.3	-66.9	0	0	0	0	115.2	S744	S744-C746 PolarHBondContact O-N 3.03Å
747	I	50.2	Low	56.7	Low	50 Å²	50	84 Å²	84	26%	0.256	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-81.4	-18.3	-170.7	-55.9	158.4	0	0	0	112.4	W653 S744 D749 L750	W653-I747 HydrophobicContact CE3-CD1 4Å; W653-I747 HydrophobicContact CH2-CD1 3.07Å; W653-I747 HydrophobicContact CH2-CG1 3.89Å; W653-I747 HydrophobicContact CZ2-CD1 3.7Å; W653-I747 HydrophobicContact CZ2-CG1 4.27Å; W653-I747 HydrophobicContact CZ3-CD1 3.23Å; W653-I747 HydrophobicContact CZ3-CG1 4.46Å; S744-I747 WeakPolarHBondContact O-CD1 3.37Å; I747-D749 PolarHBondContact O-N 3.41Å; I747-D749 VanDerWaalsContact O-N 3.17Å; I747-L750 PolarHBondContact O-N 2.76Å
748	N	42.7	Very low	56	Low	157 Å²	157	83.4 Å²	83.4	84%	0.84	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-69.7	-15.5	-172.5	-68.4	-12.7	0	0	0	114.4
749	D	42.2	Very low	55.5	Low	159 Å²	159	77.7 Å²	77.7	85%	0.85	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-111.5	1.1	-178.6	-71.2	-30.8	0	0	0	114.6	I747 G751	I747-D749 PolarHBondContact O-N 3.41Å; I747-D749 VanDerWaalsContact O-N 3.17Å; D749-G751 PolarHBondContact O-N 3.19Å
750	L	41.7	Very low	55.1	Low	76 Å²	76	78.7 Å²	78.7	40%	0.398	46%	0.464	S	S	.	.			trans	-92.7	83.8	172.8	-86.6	107.7	0	0	0	110.7	H739 I747 D752 L753	H739-L750 HydrophobicContact CB-CD2 4.41Å; I747-L750 PolarHBondContact O-N 2.76Å; L750-D752 PolarHBondContact O-N 3.37Å; L750-D752 VanDerWaalsContact O-N 3.12Å; L750-L753 HydrophobicContact CD2-CD1 3.94Å
751	G	40	Very low	54.7	Low	65 Å²	65	82.7 Å²	82.7	67%	0.67	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	115.1	165.6	0	0	0	0	0	111.6	D749	D749-G751 PolarHBondContact O-N 3.19Å
752	D	42.7	Very low	54.6	Low	104 Å²	104	83 Å²	83	56%	0.556	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	64.9	163.2	-56	-23.2	0	0	0	116.8	L750 T754 K757	L750-D752 PolarHBondContact O-N 3.37Å; L750-D752 VanDerWaalsContact O-N 3.12Å; D752-T754 VanDerWaalsContact C-N 3.32Å; D752-K757 WeakPolarHBondContact O-CD 3.27Å; D752-K757 WeakPolarHBondContact O-CE 3.36Å; D752-K757 PolarHBondContact O-NZ 3.08Å
753	L	47.3	Very low	54.7	Low	52 Å²	52	78.6 Å²	78.6	27%	0.272	46%	0.462	S	S	.	.			trans	-104.9	49.3	149.9	-83.8	160.6	0	0	0	109.7	V733 L750	V733-L753 HydrophobicContact CG1-CB 4.07Å; L750-L753 HydrophobicContact CD2-CD1 3.94Å
754	T	58.4	Low	55	Low	58 Å²	58	75.5 Å²	75.5	36%	0.356	45%	0.45	S	S	.	.	S	Bend	trans	-72.1	152.8	169.3	49.1	0	0	0	0	110	D752 D756 K757	D752-T754 VanDerWaalsContact C-N 3.32Å; T754-D756 WeakPolarHBondContact CB-OD2 3.43Å; T754-D756 PolarHBondContact O-N 2.94Å; T754-D756 PolarHBondContact OG1-OD2 2.74Å; T754-D756 VanDerWaalsContact OG1-OD2 3.05Å; T754-K757 PolarHBondContact O-N 3.32Å; T754-K757 VanDerWaalsContact O-N 3.11Å
755	L	58	Low	55.8	Low	3 Å²	3	72.4 Å²	72.4	2%	0.016	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-46.4	-24.1	173.5	-82.7	144.2	0	0	0	113.2	L691 I696 I699 I732 K757 L758 L763	L691-L755 HydrophobicContact CD2-CD1 4.09Å; I696-L755 HydrophobicContact CD1-CB 4.18Å; I699-L755 HydrophobicContact CD1-CD2 3.95Å; I732-L755 HydrophobicContact CB-CD1 4.04Å; I732-L755 HydrophobicContact CD1-CD1 4.08Å; I732-L755 HydrophobicContact CG2-CD1 3.72Å; I732-L755 HydrophobicContact CG2-CG 4.36Å; L755-K757 PolarHBondContact O-N 3Å; L755-L758 HydrophobicContact CD2-CD1 4.14Å; L755-L758 WeakPolarHBondContact O-CB 3.5Å; L755-L758 PolarHBondContact O-N 3.01Å; L755-L763 HydrophobicContact CB-CD2 4.4Å; L755-L763 HydrophobicContact CD2-CD2 3.78Å
756	D	55.5	Low	57.2	Low	97 Å²	97	74.4 Å²	74.4	52%	0.519	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-61.1	-22	-179.1	-46.5	-32.2	0	0	0	114.1	T754	T754-D756 WeakPolarHBondContact CB-OD2 3.43Å; T754-D756 PolarHBondContact O-N 2.94Å; T754-D756 PolarHBondContact OG1-OD2 2.74Å; T754-D756 VanDerWaalsContact OG1-OD2 3.05Å
757	K	58.8	Low	59.2	Low	135 Å²	135	73.3 Å²	73.3	59%	0.587	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-86.5	-5.9	175.6	-68.4	-171.4	-178.2	168.8	0	114.1	D752 T754 L755	D752-K757 WeakPolarHBondContact O-CD 3.27Å; D752-K757 WeakPolarHBondContact O-CE 3.36Å; D752-K757 PolarHBondContact O-NZ 3.08Å; T754-K757 PolarHBondContact O-N 3.32Å; T754-K757 VanDerWaalsContact O-N 3.11Å; L755-K757 PolarHBondContact O-N 3Å
758	L	62.9	Low	60.9	Low	23 Å²	23	71 Å²	71	12%	0.12	41%	0.411	C	S	.	.	S	Bend	trans	-85.5	134.8	177.3	-67.1	166	0	0	0	110.3	C734 L755 Q762 L763 L768	C734-L758 HydrophobicContact CB-CD1 4.14Å; L755-L758 HydrophobicContact CD2-CD1 4.14Å; L755-L758 WeakPolarHBondContact O-CB 3.5Å; L755-L758 PolarHBondContact O-N 3.01Å; L758-Q762 HydrophobicContact CB-CB 4.22Å; L758-Q762 HydrophobicContact CD2-CB 4.26Å; L758-Q762 VanDerWaalsContact CD2-OE1 3.27Å; L758-L763 HydrophobicContact CB-CD2 4.18Å; L758-L763 HydrophobicContact CB-CG 4.02Å; L758-L763 HydrophobicContact CD1-CD2 4.47Å; L758-L763 WeakPolarHBondContact O-CD1 3.26Å; L758-L768 HydrophobicContact CD1-CD2 4.22Å
759	S	60	Low	63	Low	55 Å²	55	65.6 Å²	65.6	39%	0.385	38%	0.382	S	S	.	.			trans	-63.1	154.1	175.1	65.8	0	0	0	0	111.6	T761 Q762 L763	S759-T761 PolarHBondContact O-N 2.81Å; S759-T761 PolarHBondContact OG-OG1 2.83Å; S759-Q762 WeakPolarHBondContact O-CA 3.48Å; S759-Q762 WeakPolarHBondContact O-CB 3.5Å; S759-Q762 PolarHBondContact O-N 3.41Å; S759-L763 PolarHBondContact O-N 2.89Å
760	N	63.9	Low	65.1	Low	118 Å²	118	60.5 Å²	60.5	63%	0.631	36%	0.362	S	S	*	.	H	α-helix	trans	-53.7	-29.6	177.2	-73.5	-13.7	0	0	0	113.5	S764	N760-S764 PolarHBondContact O-N 2.89Å; N760-S764 PolarHBondContact O-OG 3.37Å
761	T	63	Low	67.3	Low	96 Å²	96	58 Å²	58	59%	0.589	35%	0.349	S	S	*	.	H	α-helix	trans	-71.6	-32	175.1	63.2	0	0	0	0	112.9	S759 S764	S759-T761 PolarHBondContact O-N 2.81Å; S759-T761 PolarHBondContact OG-OG1 2.83Å; T761-S764 PolarHBondContact O-OG 3.19Å
762	Q	67.3	Low	69.7	Low	49 Å²	49	55 Å²	55	23%	0.229	32%	0.318	C	S	.	.	H	α-helix	trans	-77.5	-38.9	174.7	-72.9	176.8	-27.8	0	0	111.3	L758 S759 S764 S765 L768	L758-Q762 HydrophobicContact CB-CB 4.22Å; L758-Q762 HydrophobicContact CD2-CB 4.26Å; L758-Q762 VanDerWaalsContact CD2-OE1 3.27Å; S759-Q762 WeakPolarHBondContact O-CA 3.48Å; S759-Q762 WeakPolarHBondContact O-CB 3.5Å; S759-Q762 PolarHBondContact O-N 3.41Å; Q762-S764 PolarHBondContact O-N 3.06Å; Q762-S765 WeakPolarHBondContact O-CB 3.36Å; Q762-S765 PolarHBondContact O-N 3.21Å; Q762-L768 VanDerWaalsContact O-CD2 3.27Å; Q762-L768 WeakPolarHBondContact O-CD2 3.36Å
763	L	69.5	Low	71.9	Confident	19 Å²	19	53.6 Å²	53.6	10%	0.099	31%	0.307	C	S	.	.	H	α-helix	trans	-63.2	-26	176.5	-71.6	162.9	0	0	0	113	I699 L755 L758 S759	I699-L763 HydrophobicContact CD1-CB 4.11Å; I699-L763 HydrophobicContact CD1-CD2 3.39Å; I699-L763 HydrophobicContact CD1-CG 4.37Å; L755-L763 HydrophobicContact CB-CD2 4.4Å; L755-L763 HydrophobicContact CD2-CD2 3.78Å; L758-L763 HydrophobicContact CB-CD2 4.18Å; L758-L763 HydrophobicContact CB-CG 4.02Å; L758-L763 HydrophobicContact CD1-CD2 4.47Å; L758-L763 WeakPolarHBondContact O-CD1 3.26Å; S759-L763 PolarHBondContact O-N 2.89Å
764	S	70.4	Confident	74	Confident	57 Å²	57	54.6 Å²	54.6	40%	0.399	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	1.2	178.1	50.3	0	0	0	0	114.4	N760 T761 Q762 P766	N760-S764 PolarHBondContact O-N 2.89Å; N760-S764 PolarHBondContact O-OG 3.37Å; T761-S764 PolarHBondContact O-OG 3.19Å; Q762-S764 PolarHBondContact O-N 3.06Å; S764-P766 WeakPolarHBondContact O-CD 3.33Å
765	S	79.4	Confident	75.5	Confident	7 Å²	7	51.8 Å²	51.8	5%	0.049	30%	0.298	C	S	.	.			trans	-68.3	124.6	-178.1	-177.3	0	0	0	0	111.5	N661 Q762 S767 L768 L769	N661-S765 PolarHBondContact OD1-OG 3.39Å; N661-S765 VanDerWaalsContact OD1-OG 3.06Å; Q762-S765 WeakPolarHBondContact O-CB 3.36Å; Q762-S765 PolarHBondContact O-N 3.21Å; S765-S767 PolarHBondContact O-N 3.44Å; S765-L768 PolarHBondContact O-N 3.13Å; S765-L768 VanDerWaalsContact O-N 3.13Å; S765-L769 PolarHBondContact O-N 2.95Å
766	P	83.8	Confident	77	Confident	104 Å²	104	51.7 Å²	51.7	68%	0.675	30%	0.298	S	S	*	.	H	α-helix	trans	-56.9	-32.4	175.5	-25.5	34.3	0	0	0	113.3	S764 L769 A770	S764-P766 WeakPolarHBondContact O-CD 3.33Å; P766-L769 PolarHBondContact O-N 3.41Å; P766-A770 WeakPolarHBondContact O-CB 3.48Å; P766-A770 PolarHBondContact O-N 3.27Å
767	S	85.7	Confident	78.7	Confident	56 Å²	56	49.5 Å²	49.5	39%	0.392	29%	0.285	S	S	.	.	H	α-helix	trans	-66.2	-41	177.7	-52.6	0	0	0	0	112.3	S765 A770 L771	S765-S767 PolarHBondContact O-N 3.44Å; S767-A770 PolarHBondContact O-N 2.98Å; S767-L771 VanDerWaalsContact O-CG 3.3Å; S767-L771 WeakPolarHBondContact O-CG 3.37Å; S767-L771 PolarHBondContact O-N 2.84Å
768	L	85.4	Confident	80.2	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-64.6	-44.6	175.4	173.2	63.9	0	0	0	110.6	I660 V667 L758 Q762 S765 A770 L771 L772	I660-L768 HydrophobicContact CD1-CB 4.02Å; I660-L768 HydrophobicContact CD1-CD1 3.56Å; I660-L768 HydrophobicContact CD1-CG 4.34Å; I660-L768 HydrophobicContact CG1-CB 4.42Å; I660-L768 HydrophobicContact CG2-CB 4.37Å; V667-L768 HydrophobicContact CG2-CD1 4.11Å; L758-L768 HydrophobicContact CD1-CD2 4.22Å; Q762-L768 VanDerWaalsContact O-CD2 3.27Å; Q762-L768 WeakPolarHBondContact O-CD2 3.36Å; S765-L768 PolarHBondContact O-N 3.13Å; S765-L768 VanDerWaalsContact O-N 3.13Å; L768-A770 VanDerWaalsContact C-N 3.35Å; L768-A770 PolarHBondContact O-N 3.47Å; L768-L771 PolarHBondContact O-N 2.89Å; L768-L772 HydrophobicContact CD1-CD1 3.97Å; L768-L772 HydrophobicContact CD1-CG 4.05Å; L768-L772 HydrophobicContact CD2-CD1 4.48Å; L768-L772 HydrophobicContact CG-CD1 3.84Å; L768-L772 HydrophobicContact CG-CG 4.38Å; L768-L772 WeakPolarHBondContact O-CB 3.35Å; L768-L772 WeakPolarHBondContact O-CG 3.24Å; L768-L772 PolarHBondContact O-N 3.43Å
769	L	86.3	Confident	81.6	Confident	43 Å²	43	44.2 Å²	44.2	23%	0.225	27%	0.267	C	S	.	.	H	α-helix	trans	-59.8	-45.2	176.9	-67.9	174.6	0	0	0	111.3	I699 A702 S765 P766 L771 L772 K773	I699-L769 HydrophobicContact CG1-CD2 3.8Å; A702-L769 HydrophobicContact CB-CD2 3.81Å; S765-L769 PolarHBondContact O-N 2.95Å; P766-L769 PolarHBondContact O-N 3.41Å; L769-L771 PolarHBondContact O-N 3.22Å; L769-L772 PolarHBondContact O-N 3.47Å; L769-K773 WeakPolarHBondContact O-CB 3.1Å; L769-K773 VanDerWaalsContact O-CG 3.29Å; L769-K773 WeakPolarHBondContact O-CG 3.25Å; L769-K773 PolarHBondContact O-N 3.35Å
770	A	86.9	Confident	83.1	Confident	53 Å²	53	41.6 Å²	41.6	44%	0.438	25%	0.249	S	C	.	.	H	α-helix	trans	-61.4	-42.3	177.1	0	0	0	0	0	112.8	P766 S767 L768 K773 T774	P766-A770 WeakPolarHBondContact O-CB 3.48Å; P766-A770 PolarHBondContact O-N 3.27Å; S767-A770 PolarHBondContact O-N 2.98Å; L768-A770 VanDerWaalsContact C-N 3.35Å; L768-A770 PolarHBondContact O-N 3.47Å; A770-K773 PolarHBondContact O-N 2.84Å; A770-T774 PolarHBondContact O-N 3.31Å; A770-T774 PolarHBondContact O-OG1 3.4Å
771	L	89.2	Confident	84.3	Confident	23 Å²	23	41 Å²	41	12%	0.12	24%	0.241	C	C	.	.	H	α-helix	trans	-65.9	-43.3	176.7	-69.9	169.1	0	0	0	111.9	V656 I660 V667 S767 L768 L769 T774 C775	V656-L771 HydrophobicContact CG1-CD2 3.75Å; I660-L771 HydrophobicContact CD1-CD1 4Å; I660-L771 HydrophobicContact CG1-CD1 3.75Å; V667-L771 HydrophobicContact CG2-CB 4.19Å; S767-L771 VanDerWaalsContact O-CG 3.3Å; S767-L771 WeakPolarHBondContact O-CG 3.37Å; S767-L771 PolarHBondContact O-N 2.84Å; L768-L771 PolarHBondContact O-N 2.89Å; L769-L771 PolarHBondContact O-N 3.22Å; L771-T774 PolarHBondContact O-N 3.02Å; L771-C775 VanDerWaalsContact O-CB 3.26Å; L771-C775 WeakPolarHBondContact O-CB 3.44Å; L771-C775 PolarHBondContact O-N 2.83Å
772	L	88.6	Confident	85.6	Confident	3 Å²	3	39.2 Å²	39.2	2%	0.016	23%	0.227	C	C	.	.	H	α-helix	trans	-59.4	-47.9	174.3	-74.4	166.4	0	0	0	110.9	V667 I669 I699 I732 L768 L769 T774 C775 C776	V667-L772 HydrophobicContact CG1-CD2 3.5Å; V667-L772 VanDerWaalsContact CG1-CD2 3.5Å; V667-L772 HydrophobicContact CG1-CG 4.14Å; I669-L772 HydrophobicContact CD1-CD2 3.86Å; I669-L772 HydrophobicContact CG1-CD2 4.47Å; I699-L772 HydrophobicContact CG1-CD1 4.43Å; I699-L772 HydrophobicContact CG2-CD1 3.98Å; I732-L772 HydrophobicContact CG2-CD2 3.93Å; L768-L772 HydrophobicContact CD1-CD1 3.97Å; L768-L772 HydrophobicContact CD1-CG 4.05Å; L768-L772 HydrophobicContact CD2-CD1 4.48Å; L768-L772 HydrophobicContact CG-CD1 3.84Å; L768-L772 HydrophobicContact CG-CG 4.38Å; L768-L772 WeakPolarHBondContact O-CB 3.35Å; L768-L772 WeakPolarHBondContact O-CG 3.24Å; L768-L772 PolarHBondContact O-N 3.43Å; L769-L772 PolarHBondContact O-N 3.47Å; L772-T774 PolarHBondContact O-N 3.07Å; L772-C775 PolarHBondContact O-N 3.16Å; L772-C776 WeakPolarHBondContact O-CB 3.34Å; L772-C776 PolarHBondContact O-N 3.5Å; L772-C776 PolarHBondContact O-SG 2.94Å
773	K	89.7	Confident	86.7	Confident	73 Å²	73	36.9 Å²	36.9	32%	0.317	22%	0.217	S	C	.	.	H	α-helix	trans	-58.3	-48.9	178	-70.3	-165.5	171.2	-163.3	0	111.5	A702 E705 A706 L769 A770 C775 C776 I777	A702-K773 WeakPolarHBondContact O-CE 3.43Å; E705-K773 IonicContact OE2-NZ 3.77Å; E705-K773 PolarHBondContact OE2-NZ 3.19Å; A706-K773 HydrophobicContact CB-CB 4.03Å; A706-K773 HydrophobicContact CB-CG 3.94Å; L769-K773 WeakPolarHBondContact O-CB 3.1Å; L769-K773 VanDerWaalsContact O-CG 3.29Å; L769-K773 WeakPolarHBondContact O-CG 3.25Å; L769-K773 PolarHBondContact O-N 3.35Å; A770-K773 PolarHBondContact O-N 2.84Å; K773-C775 PolarHBondContact O-N 2.81Å; K773-C776 PolarHBondContact O-N 3.04Å; K773-I777 VanDerWaalsContact O-CG1 3.3Å; K773-I777 WeakPolarHBondContact O-CG1 3.4Å; K773-I777 PolarHBondContact O-N 2.86Å
774	T	90.4	Very high	87.7	Confident	73 Å²	73	36.1 Å²	36.1	45%	0.448	21%	0.213	S	C	.	.	H	α-helix	trans	-62.9	-40.4	178.5	-57.2	0	0	0	0	112.5	V656 A770 L771 L772 S778	V656-T774 HydrophobicContact CG2-CG2 4.37Å; A770-T774 PolarHBondContact O-N 3.31Å; A770-T774 PolarHBondContact O-OG1 3.4Å; L771-T774 PolarHBondContact O-N 3.02Å; L772-T774 PolarHBondContact O-N 3.07Å; T774-S778 WeakPolarHBondContact O-CB 3.48Å; T774-S778 PolarHBondContact O-N 3.29Å; T774-S778 VanDerWaalsContact O-N 3.16Å; T774-S778 PolarHBondContact O-OG 2.82Å
775	C	90.8	Very high	88.6	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-65.8	-45.6	176.9	-167.3	0	0	0	0	111.4	S654 V656 V667 I669 L771 L772 K773 I777 S778 S779	S654-C775 PolarHBondContact O-SG 3.45Å; V656-C775 HydrophobicContact CB-CB 4.24Å; V656-C775 HydrophobicContact CG2-CB 3.73Å; V667-C775 HydrophobicContact CG1-CB 4.34Å; I669-C775 HydrophobicContact CD1-CB 3.97Å; I669-C775 HydrophobicContact CG1-CB 4.25Å; L771-C775 VanDerWaalsContact O-CB 3.26Å; L771-C775 WeakPolarHBondContact O-CB 3.44Å; L771-C775 PolarHBondContact O-N 2.83Å; L772-C775 PolarHBondContact O-N 3.16Å; K773-C775 PolarHBondContact O-N 2.81Å; C775-I777 PolarHBondContact O-N 2.81Å; C775-S778 PolarHBondContact O-N 3.04Å; C775-S779 PolarHBondContact O-N 2.88Å; C775-S779 PolarHBondContact O-OG 3.25Å; C775-S779 VanDerWaalsContact O-OG 3.13Å
776	C	90.2	Very high	89	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.007	24%	0.244	C	C	.	.	H	α-helix	trans	-55.5	-51.6	175.2	-76.9	0	0	0	0	111.7	I669 A706 L772 K773 S778 S779 V780	I669-C776 HydrophobicContact CD1-CB 4.4Å; I669-C776 WeakPolarHBondContact CD1-SG 2.92Å; A706-C776 HydrophobicContact CB-CB 3.96Å; L772-C776 WeakPolarHBondContact O-CB 3.34Å; L772-C776 PolarHBondContact O-N 3.5Å; L772-C776 PolarHBondContact O-SG 2.94Å; K773-C776 PolarHBondContact O-N 3.04Å; C776-S778 PolarHBondContact O-N 3.27Å; C776-S779 PolarHBondContact O-N 3.07Å; C776-V780 WeakPolarHBondContact O-CG2 3.3Å; C776-V780 PolarHBondContact O-N 3.03Å
777	I	90.3	Very high	89.1	Confident	51 Å²	51	38.1 Å²	38.1	26%	0.262	21%	0.214	S	C	.	.	H	α-helix	trans	-58	-41.9	-179.2	-67.5	163.9	0	0	0	110.6	A710 K773 C775 K781	A710-I777 HydrophobicContact CB-CB 4.42Å; A710-I777 HydrophobicContact CB-CG1 4.17Å; A710-I777 HydrophobicContact CB-CG2 4.41Å; K773-I777 VanDerWaalsContact O-CG1 3.3Å; K773-I777 WeakPolarHBondContact O-CG1 3.4Å; K773-I777 PolarHBondContact O-N 2.86Å; C775-I777 PolarHBondContact O-N 2.81Å; I777-K781 HydrophobicContact CG2-CD 4.08Å; I777-K781 WeakPolarHBondContact O-CB 3.21Å; I777-K781 VanDerWaalsContact O-CG 3.28Å; I777-K781 WeakPolarHBondContact O-CG 3.23Å; I777-K781 PolarHBondContact O-N 3.36Å
778	S	90.8	Very high	89.1	Confident	47 Å²	47	39 Å²	39	33%	0.329	22%	0.219	S	C	.	.	H	α-helix	trans	-69.7	-40.6	179.6	-57.6	0	0	0	0	112.3	S654 T774 C775 C776 K781 N782	S654-S778 WeakPolarHBondContact OG-CB 3.3Å; T774-S778 WeakPolarHBondContact O-CB 3.48Å; T774-S778 PolarHBondContact O-N 3.29Å; T774-S778 VanDerWaalsContact O-N 3.16Å; T774-S778 PolarHBondContact O-OG 2.82Å; C775-S778 PolarHBondContact O-N 3.04Å; C776-S778 PolarHBondContact O-N 3.27Å; S778-K781 PolarHBondContact O-N 3.11Å; S778-N782 WeakPolarHBondContact O-CB 3.37Å; S778-N782 PolarHBondContact O-N 2.98Å
779	S	91.3	Very high	89.1	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.1	-43.7	175.7	-64.1	0	0	0	0	111.9	G652 S654 I669 C775 C776 N782 A783	G652-S779 WeakPolarHBondContact CA-O 3.26Å; S654-S779 WeakPolarHBondContact CB-OG 3.33Å; S654-S779 PolarHBondContact N-OG 3.44Å; S654-S779 VanDerWaalsContact N-OG 3.08Å; I669-S779 PolarHBondContact O-OG 2.97Å; C775-S779 PolarHBondContact O-N 2.88Å; C775-S779 PolarHBondContact O-OG 3.25Å; C775-S779 VanDerWaalsContact O-OG 3.13Å; C776-S779 PolarHBondContact O-N 3.07Å; S779-N782 WeakPolarHBondContact O-CB 3.27Å; S779-N782 PolarHBondContact O-N 2.81Å; S779-A783 PolarHBondContact O-N 3.45Å
780	V	91.3	Very high	89.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-63.6	-47.4	176.6	173.8	0	0	0	0	110.4	V671 L673 A710 L711 I727 C776 N782 A783 V784	V671-V780 HydrophobicContact CG2-CG2 4.39Å; L673-V780 HydrophobicContact CD1-CG1 4.24Å; A710-V780 HydrophobicContact CB-CB 3.97Å; A710-V780 HydrophobicContact CB-CG1 3.86Å; A710-V780 HydrophobicContact CB-CG2 4.41Å; L711-V780 HydrophobicContact CD2-CG1 4.17Å; I727-V780 HydrophobicContact CD1-CG1 4.37Å; I727-V780 HydrophobicContact CD1-CG2 4.11Å; C776-V780 WeakPolarHBondContact O-CG2 3.3Å; C776-V780 PolarHBondContact O-N 3.03Å; V780-N782 VanDerWaalsContact C-N 3.29Å; V780-N782 PolarHBondContact O-N 3.09Å; V780-A783 PolarHBondContact O-N 3.2Å; V780-A783 VanDerWaalsContact O-N 3.15Å; V780-V784 HydrophobicContact CG1-CG2 4.26Å; V780-V784 WeakPolarHBondContact O-CG2 3.44Å; V780-V784 PolarHBondContact O-N 3.19Å
781	K	90	Very high	89.3	Confident	104 Å²	104	44.9 Å²	44.9	45%	0.452	24%	0.239	S	C	.	.	H	α-helix	trans	-57.5	-40.7	175.8	-77.6	176.7	179.4	180	0	112.9	S714 I777 S778 V784 S785	S714-K781 VanDerWaalsContact OG-CE 3.23Å; S714-K781 WeakPolarHBondContact OG-CE 3.42Å; S714-K781 WeakPolarHBondContact OG-CG 3.39Å; I777-K781 HydrophobicContact CG2-CD 4.08Å; I777-K781 WeakPolarHBondContact O-CB 3.21Å; I777-K781 VanDerWaalsContact O-CG 3.28Å; I777-K781 WeakPolarHBondContact O-CG 3.23Å; I777-K781 PolarHBondContact O-N 3.36Å; S778-K781 PolarHBondContact O-N 3.11Å; K781-V784 PolarHBondContact O-N 2.88Å; K781-S785 WeakPolarHBondContact O-CB 3.41Å; K781-S785 PolarHBondContact O-N 3.07Å
782	N	90.3	Very high	89.3	Confident	59 Å²	59	43.8 Å²	43.8	32%	0.316	23%	0.234	S	C	.	.	H	α-helix	trans	-61.6	-48.4	175.8	-173.6	-24.9	0	0	0	111	W653 S778 S779 V780 V784 S785 K786	W653-N782 PolarHBondContact O-ND2 2.8Å; S778-N782 WeakPolarHBondContact O-CB 3.37Å; S778-N782 PolarHBondContact O-N 2.98Å; S779-N782 WeakPolarHBondContact O-CB 3.27Å; S779-N782 PolarHBondContact O-N 2.81Å; V780-N782 VanDerWaalsContact C-N 3.29Å; V780-N782 PolarHBondContact O-N 3.09Å; N782-V784 PolarHBondContact O-N 3.04Å; N782-S785 PolarHBondContact O-N 3.16Å; N782-S785 PolarHBondContact O-OG 3.4Å; N782-K786 WeakPolarHBondContact OD1-CE 3.04Å; N782-K786 PolarHBondContact OD1-NZ 2.81Å
783	A	90.6	Very high	89.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.1	-42.9	176.6	0	0	0	0	0	113.2	S650 V671 L673 S779 V780 S785 K786	S650-A783 WeakPolarHBondContact CB-O 3.45Å; S650-A783 PolarHBondContact OG-O 3.12Å; V671-A783 HydrophobicContact CG2-CB 4.19Å; L673-A783 HydrophobicContact CB-CB 4.26Å; L673-A783 HydrophobicContact CD1-CB 3.42Å; L673-A783 VanDerWaalsContact CD1-CB 3.42Å; L673-A783 HydrophobicContact CG-CB 4.3Å; S779-A783 PolarHBondContact O-N 3.45Å; V780-A783 PolarHBondContact O-N 3.2Å; V780-A783 VanDerWaalsContact O-N 3.15Å; A783-S785 VanDerWaalsContact C-N 3.33Å; A783-S785 PolarHBondContact O-N 3.33Å; A783-K786 PolarHBondContact O-N 3.17Å
784	V	90.6	Very high	89.1	Confident	4 Å²	4	40.9 Å²	40.9	2%	0.024	22%	0.221	C	C	.	.	H	α-helix	trans	-59.5	-44	177.1	171.3	0	0	0	0	111.1	L673 P716 I722 V780 K781 N782 K786 I787 W790	L673-V784 HydrophobicContact CD1-CG2 3.63Å; P716-V784 HydrophobicContact CG-CG1 4.35Å; I722-V784 HydrophobicContact CD1-CB 4.43Å; I722-V784 HydrophobicContact CD1-CG1 3.77Å; I722-V784 HydrophobicContact CD1-CG2 3.71Å; V780-V784 HydrophobicContact CG1-CG2 4.26Å; V780-V784 WeakPolarHBondContact O-CG2 3.44Å; V780-V784 PolarHBondContact O-N 3.19Å; K781-V784 PolarHBondContact O-N 2.88Å; N782-V784 PolarHBondContact O-N 3.04Å; V784-K786 PolarHBondContact O-N 3.05Å; V784-K786 VanDerWaalsContact O-N 3.12Å; V784-I787 PolarHBondContact O-N 3.42Å; V784-W790 HydrophobicContact CB-CZ2 4.44Å; V784-W790 HydrophobicContact CG1-CH2 4.14Å; V784-W790 HydrophobicContact CG1-CZ2 3.71Å
785	S	88.2	Confident	88.9	Confident	88 Å²	88	37.7 Å²	37.7	62%	0.615	20%	0.201	S	C	*	.	H	α-helix	trans	-63.3	-18.5	-177.9	73.2	0	0	0	0	115	K781 N782 A783	K781-S785 WeakPolarHBondContact O-CB 3.41Å; K781-S785 PolarHBondContact O-N 3.07Å; N782-S785 PolarHBondContact O-N 3.16Å; N782-S785 PolarHBondContact O-OG 3.4Å; A783-S785 VanDerWaalsContact C-N 3.33Å; A783-S785 PolarHBondContact O-N 3.33Å
786	K	88.3	Confident	88.7	Confident	113 Å²	113	38.5 Å²	38.5	49%	0.491	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-15.2	-179.3	-70.6	176	-179.1	172.2	0	113.9	S651 N782 A783 V784 P788	S651-K786 WeakPolarHBondContact O-CD 3.43Å; S651-K786 PolarHBondContact O-NZ 3.07Å; N782-K786 WeakPolarHBondContact OD1-CE 3.04Å; N782-K786 PolarHBondContact OD1-NZ 2.81Å; A783-K786 PolarHBondContact O-N 3.17Å; V784-K786 PolarHBondContact O-N 3.05Å; V784-K786 VanDerWaalsContact O-N 3.12Å; K786-P788 WeakPolarHBondContact O-CD 3.13Å
787	I	87.1	Confident	88.5	Confident	8 Å²	8	39.5 Å²	39.5	4%	0.041	21%	0.21	C	C	.	.			trans	-86	120.8	178.7	-59.6	176.3	0	0	0	108.3	P643 A647 S650 V784 W790	P643-I787 HydrophobicContact CB-CG2 3.97Å; A647-I787 HydrophobicContact CB-CG2 4.03Å; S650-I787 WeakPolarHBondContact OG-CD1 3.32Å; V784-I787 PolarHBondContact O-N 3.42Å; I787-W790 HydrophobicContact CB-CZ2 3.96Å; I787-W790 HydrophobicContact CD1-CZ2 4.04Å; I787-W790 HydrophobicContact CG1-CZ2 4.5Å; I787-W790 HydrophobicContact CG2-CZ2 4.27Å; I787-W790 PolarHBondContact O-NE1 3.02Å
788	P	84.7	Confident	88.4	Confident	76 Å²	76	41 Å²	41	49%	0.494	22%	0.216	S	C	.	.			trans	-80.7	164.4	174.9	33.2	-34.2	0	0	0	112.2	K786	K786-P788 WeakPolarHBondContact O-CD 3.13Å
789	N	84.8	Confident	88.3	Confident	127 Å²	127	38.8 Å²	38.8	68%	0.679	20%	0.201	S	C	*	.			trans	59.4	51.3	166.8	-56.4	-21.5	0	0	0	116	P644 H791	P644-N789 WeakPolarHBondContact CD-O 3.34Å; N789-H791 PolarHBondContact O-CE1 3.32Å; N789-H791 PolarHBondContact O-ND1 2.72Å
790	W	88.8	Confident	88.1	Confident	18 Å²	18	40.4 Å²	40.4	7%	0.068	21%	0.208	C	C	.	.			trans	-64.5	146.8	172	-70.2	77.4	0	0	0	112	E641 C642 P643 P716 I717 I722 V784 I787	E641-W790 HydrophobicContact CB-CE3 4.16Å; C642-W790 VanDerWaalsContact C-CE3 3.43Å; P643-W790 HydrophobicContact CB-CH2 4.39Å; P643-W790 HydrophobicContact CB-CZ3 4.42Å; P643-W790 VanDerWaalsContact CD-CZ3 3.47Å; P643-W790 HydrophobicContact CG-CZ3 4.47Å; P716-W790 HydrophobicContact CG-CB 3.96Å; P716-W790 VanDerWaalsContact CG-CD1 3.45Å; P716-W790 HydrophobicContact CG-CD2 3.52Å; P716-W790 HydrophobicContact CG-CE3 4.19Å; P716-W790 HydrophobicContact CG-CG 3.36Å; I717-W790 HydrophobicContact CD1-CB 3.68Å; I717-W790 VanDerWaalsContact CD1-O 3.26Å; I717-W790 WeakPolarHBondContact CD1-O 3.2Å; I717-W790 HydrophobicContact CG1-CB 4.11Å; I722-W790 HydrophobicContact CB-CZ3 4.4Å; I722-W790 HydrophobicContact CD1-CH2 4.03Å; I722-W790 HydrophobicContact CD1-CZ3 4.18Å; I722-W790 HydrophobicContact CG1-CH2 4.32Å; I722-W790 HydrophobicContact CG1-CZ3 3.99Å; I722-W790 HydrophobicContact CG2-CH2 3.85Å; I722-W790 HydrophobicContact CG2-CZ3 3.65Å; V784-W790 HydrophobicContact CB-CZ2 4.44Å; V784-W790 HydrophobicContact CG1-CH2 4.14Å; V784-W790 HydrophobicContact CG1-CZ2 3.71Å; I787-W790 HydrophobicContact CB-CZ2 3.96Å; I787-W790 HydrophobicContact CD1-CZ2 4.04Å; I787-W790 HydrophobicContact CG1-CZ2 4.5Å; I787-W790 HydrophobicContact CG2-CZ2 4.27Å; I787-W790 PolarHBondContact O-NE1 3.02Å
791	H	88.7	Confident	87.9	Confident	75 Å²	75	40.4 Å²	40.4	35%	0.347	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	137.1	175.6	-62.8	84	0	0	0	109.8	E641 C642 N789	E641-H791 WeakPolarHBondContact CA-O 3.26Å; C642-H791 PolarHBondContact N-O 2.77Å; C642-H791 PolarHBondContact O-N 3.29Å; N789-H791 PolarHBondContact O-CE1 3.32Å; N789-H791 PolarHBondContact O-ND1 2.72Å
792	V	89.6	Confident	87.5	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	135.6	168	-179.5	0	0	0	0	108.2	Y639 K640 E641 I717 L718 V889 Q894 L897	Y639-V792 HydrophobicContact CD1-CG1 3.86Å; Y639-V792 HydrophobicContact CG-CG1 4.21Å; K640-V792 CarbonylContact O-C 3.5Å; E641-V792 HydrophobicContact CG-CG2 4.49Å; I717-V792 HydrophobicContact CB-CG2 4.26Å; I717-V792 HydrophobicContact CD1-CG2 3.96Å; I717-V792 HydrophobicContact CG2-CG2 3.88Å; L718-V792 HydrophobicContact CD1-CG1 3.74Å; L718-V792 HydrophobicContact CD1-CG2 3.98Å; L718-V792 HydrophobicContact CG-CG2 4.22Å; V792-V889 HydrophobicContact CB-CG2 4.34Å; V792-V889 HydrophobicContact CG1-CG2 4.06Å; V792-V889 WeakPolarHBondContact O-CB 3.31Å; V792-V889 WeakPolarHBondContact O-CG2 3.49Å; V792-V889 PolarHBondContact O-N 3.05Å; V792-Q894 HydrophobicContact CB-CG 4.31Å; V792-Q894 HydrophobicContact CG2-CG 3.89Å; V792-Q894 VanDerWaalsContact N-OE1 3.14Å; V792-L897 HydrophobicContact CG1-CD1 4.21Å
793	M	86.7	Confident	87.1	Confident	5 Å²	5	35.8 Å²	35.8	3%	0.025	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	129.5	-178.8	-57.2	-70.1	-63.6	0	0	108.9	Y639 K640 C642 M678 I723 Y886 H887 P888	Y639-M793 WeakPolarHBondContact CA-O 3.48Å; K640-M793 HydrophobicContact CB-CB 4.15Å; K640-M793 PolarHBondContact N-O 3.16Å; K640-M793 WeakPolarHBondContact O-CB 3.35Å; K640-M793 PolarHBondContact O-N 3.38Å; C642-M793 HydrophobicContact CB-CG 3.83Å; C642-M793 HydrophobicContact CB-SD 3.98Å; M678-M793 HydrophobicContact CE-CE 3.77Å; M678-M793 HydrophobicContact CE-SD 4.29Å; M678-M793 HydrophobicContact SD-CE 3.93Å; I723-M793 HydrophobicContact CD1-CB 4.45Å; I723-M793 HydrophobicContact CD1-CE 4.48Å; I723-M793 HydrophobicContact CD1-CG 4.14Å; M793-Y886 HydrophobicContact CB-CD1 4.18Å; M793-Y886 WeakPolarHBondContact CE-O 3.28Å; M793-H887 CarbonylContact C-O 3.59Å; M793-H887 VanDerWaalsContact CA-O 3.26Å; M793-H887 WeakPolarHBondContact CA-O 3.42Å; M793-P888 HydrophobicContact SD-CB 4.01Å
794	E	87.2	Confident	86.2	Confident	10 Å²	10	36.9 Å²	36.9	5%	0.047	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	144.7	173.5	61.1	-175.1	160.3	0	0	111.3	Y639 M796 R824 P858 Y886 H887 V889	Y639-E794 HydrophobicContact CD1-CB 4.23Å; Y639-E794 HydrophobicContact CE1-CB 3.96Å; E794-M796 HydrophobicContact CG-SD 4.21Å; E794-R824 IonicContact OE1-CZ 2.7Å; E794-R824 IonicContact OE1-NH1 3.42Å; E794-R824 PolarHBondContact OE1-NH1 2.86Å; E794-R824 IonicContact OE1-NH2 3.46Å; E794-R824 IonicContact OE2-CZ 3.38Å; E794-R824 IonicContact OE2-NH1 3.73Å; E794-R824 IonicContact OE2-NH2 3.22Å; E794-R824 PolarHBondContact OE2-NH2 3.44Å; E794-R824 VanDerWaalsContact OE2-NH2 3.14Å; E794-P858 HydrophobicContact CG-CB 4.45Å; E794-P858 WeakPolarHBondContact OE2-CB 3.41Å; E794-Y886 WeakPolarHBondContact O-CA 3.22Å; E794-H887 PolarHBondContact N-O 3.29Å; E794-H887 PolarHBondContact O-N 3.41Å; E794-V889 HydrophobicContact CB-CG2 3.6Å; E794-V889 HydrophobicContact CG-CG2 3.69Å
795	P	86	Confident	85.2	Confident	5 Å²	5	38.1 Å²	38.1	3%	0.032	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	128.4	173.1	28	-31.3	0	0	0	110.4	I637 L859 L883 Y886	I637-P795 HydrophobicContact CG2-CG 3.64Å; P795-L859 HydrophobicContact CG-CB 4Å; P795-L859 HydrophobicContact CG-CD2 4.19Å; P795-L859 PolarHBondContact O-N 3.4Å; P795-L883 HydrophobicContact CB-CD1 3.77Å; P795-Y886 HydrophobicContact CB-CD1 4.3Å; P795-Y886 HydrophobicContact CB-CE1 3.79Å; P795-Y886 HydrophobicContact CG-CE1 4.3Å
796	M	87.2	Confident	84	Confident	18 Å²	18	38 Å²	38	9%	0.089	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	136.5	173.8	-58	-60.9	-73.2	0	0	110.2	E794 I856 P858 S884 N885 H887	E794-M796 HydrophobicContact CG-SD 4.21Å; M796-I856 HydrophobicContact CB-CG2 3.71Å; M796-I856 HydrophobicContact CE-CG2 3.73Å; M796-I856 HydrophobicContact CG-CG2 4.38Å; M796-P858 HydrophobicContact CE-CG 3.73Å; M796-P858 HydrophobicContact SD-CB 3.89Å; M796-P858 HydrophobicContact SD-CG 3.59Å; M796-P858 VanDerWaalsContact SD-CG 3.59Å; M796-S884 PolarHBondContact O-N 3.15Å; M796-N885 WeakPolarHBondContact CB-OD1 3.45Å; M796-N885 PolarHBondContact N-O 3.3Å; M796-N885 PolarHBondContact O-N 2.84Å; M796-H887 HydrophobicContact CG-CB 3.72Å; M796-H887 WeakPolarHBondContact CG-ND1 3.47Å; M796-H887 HydrophobicContact SD-CB 4.14Å
797	M	85.8	Confident	82.4	Confident	22 Å²	22	42.9 Å²	42.9	11%	0.108	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	128.2	-178.2	-52.9	-53.5	-72.4	0	0	110	I856 T857 L859 L862 I881 R882 L883	M797-I856 CarbonylContact O-C 3.58Å; M797-I856 VanDerWaalsContact O-CA 3.28Å; M797-I856 WeakPolarHBondContact O-CA 3.44Å; M797-T857 PolarHBondContact N-O 2.82Å; M797-T857 PolarHBondContact O-N 2.97Å; M797-L859 HydrophobicContact CE-CD1 4.37Å; M797-L859 HydrophobicContact CG-CB 3.82Å; M797-L859 HydrophobicContact CG-CD1 3.81Å; M797-L859 HydrophobicContact CG-CG 4.37Å; M797-L859 HydrophobicContact SD-CB 4.14Å; M797-L859 HydrophobicContact SD-CD1 4.07Å; M797-L859 HydrophobicContact SD-CD2 4.47Å; M797-L859 HydrophobicContact SD-CG 4.45Å; M797-L862 HydrophobicContact CB-CD1 3.69Å; M797-L862 HydrophobicContact CG-CD1 3.75Å; M797-I881 HydrophobicContact CB-CG2 3.52Å; M797-I881 HydrophobicContact CE-CG2 3.41Å; M797-I881 VanDerWaalsContact CE-CG2 3.41Å; M797-I881 HydrophobicContact CG-CG2 3.89Å; M797-I881 HydrophobicContact SD-CG2 4.5Å; M797-R882 CarbonylContact C-O 3.56Å; M797-R882 VanDerWaalsContact CA-O 3.24Å; M797-R882 WeakPolarHBondContact CA-O 3.46Å; M797-L883 HydrophobicContact CE-CB 4.32Å; M797-L883 HydrophobicContact SD-CB 4.37Å; M797-L883 HydrophobicContact SD-CD1 3.86Å
798	E	87.8	Confident	81	Confident	83 Å²	83	45.8 Å²	45.8	39%	0.388	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	122.1	163.2	-176.2	174.3	-160.3	0	0	108.4	I881 R882	E798-I881 CarbonylContact O-C 3.57Å; E798-I881 WeakPolarHBondContact O-CA 3.45Å; E798-R882 PolarHBondContact N-O 3.38Å; E798-R882 PolarHBondContact O-N 3.21Å
799	I	88.9	Confident	79.7	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	132.5	175.9	-66.4	173.5	0	0	0	108.1	L801 L820 C854 A855 T857 L862 Y865 F879 S880	I799-L801 HydrophobicContact CG2-CD1 4.18Å; I799-L801 HydrophobicContact CG2-CG 3.83Å; I799-L820 HydrophobicContact CD1-CD2 4.31Å; I799-C854 CarbonylContact O-C 3.49Å; I799-C854 WeakPolarHBondContact O-CA 3.21Å; I799-A855 PolarHBondContact N-O 2.87Å; I799-A855 PolarHBondContact O-N 2.93Å; I799-T857 HydrophobicContact CD1-CG2 3.18Å; I799-T857 HydrophobicContact CG1-CG2 4.04Å; I799-L862 HydrophobicContact CD1-CD1 4.02Å; I799-L862 HydrophobicContact CD1-CD2 3.42Å; I799-L862 VanDerWaalsContact CD1-CD2 3.42Å; I799-L862 HydrophobicContact CD1-CG 4.25Å; I799-L862 HydrophobicContact CG1-CD1 4.3Å; I799-L862 HydrophobicContact CG1-CD2 4.39Å; I799-Y865 HydrophobicContact CD1-CE1 4.32Å; I799-F879 HydrophobicContact CB-CE2 4.31Å; I799-F879 HydrophobicContact CD1-CE2 4.15Å; I799-F879 HydrophobicContact CG1-CE2 4.02Å; I799-F879 HydrophobicContact CG2-CD2 3.7Å; I799-F879 HydrophobicContact CG2-CE2 3.46Å; I799-F879 VanDerWaalsContact CG2-CE2 3.46Å; I799-S880 WeakPolarHBondContact CA-O 3.31Å
800	E	87	Confident	78.7	Confident	34 Å²	34	47 Å²	47	16%	0.159	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	121.5	163.8	164.9	-177.9	-179.8	0	0	109.5	Q802 R852 I853 F879 S880	E800-Q802 HydrophobicContact CG-CG 4.46Å; E800-Q802 PolarHBondContact OE1-NE2 2.78Å; E800-R852 HydrophobicContact CG-CG 4.22Å; E800-R852 IonicContact OE1-CZ 3.59Å; E800-R852 VanDerWaalsContact OE1-CZ 3.23Å; E800-R852 IonicContact OE1-NE 3.59Å; E800-R852 PolarHBondContact OE1-NE 2.86Å; E800-R852 IonicContact OE1-NH2 3.45Å; E800-R852 PolarHBondContact OE1-NH2 3.29Å; E800-R852 VanDerWaalsContact OE1-NH2 3.07Å; E800-R852 IonicContact OE2-CZ 2.89Å; E800-R852 IonicContact OE2-NE 2.88Å; E800-R852 IonicContact OE2-NH2 3.26Å; E800-R852 PolarHBondContact OE2-NH2 2.9Å; E800-I853 WeakPolarHBondContact CA-O 3.05Å; E800-F879 WeakPolarHBondContact O-CA 3.32Å; E800-S880 WeakPolarHBondContact CB-OG 3.22Å; E800-S880 PolarHBondContact N-O 3.23Å; E800-S880 PolarHBondContact O-N 3.41Å; E800-S880 PolarHBondContact O-OG 3.31Å
801	L	86.7	Confident	77.8	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	130.1	175.5	-74.3	163.4	0	0	0	109.9	I799 F816 L820 R852 I853 I869 E878 F879	I799-L801 HydrophobicContact CG2-CD1 4.18Å; I799-L801 HydrophobicContact CG2-CG 3.83Å; L801-F816 HydrophobicContact CD1-CD1 4.27Å; L801-L820 HydrophobicContact CD1-CD1 3.97Å; L801-L820 HydrophobicContact CD1-CD2 4.43Å; L801-L820 HydrophobicContact CD1-CG 4.47Å; L801-R852 CarbonylContact O-C 3.57Å; L801-R852 VanDerWaalsContact O-CA 3.31Å; L801-R852 WeakPolarHBondContact O-CA 3.27Å; L801-I853 HydrophobicContact CB-CB 4.22Å; L801-I853 PolarHBondContact N-O 3.06Å; L801-I853 PolarHBondContact O-N 2.97Å; L801-I869 HydrophobicContact CD2-CD1 3.76Å; L801-I869 HydrophobicContact CD2-CG1 4Å; L801-I869 HydrophobicContact CD2-CG2 4.1Å; L801-E878 CarbonylContact C-O 3.58Å; L801-E878 WeakPolarHBondContact CA-O 3.46Å; L801-F879 HydrophobicContact CD2-CB 3.81Å; L801-F879 HydrophobicContact CD2-CD2 3.52Å; L801-F879 HydrophobicContact CD2-CE2 4.48Å; L801-F879 HydrophobicContact CD2-CG 4.07Å; L801-F879 HydrophobicContact CG-CD2 4.06Å
802	Q	82.8	Confident	77.1	Confident	61 Å²	61	47.2 Å²	47.2	29%	0.285	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	121.5	173.4	-57.8	-174.5	5	0	0	110.3	E800 H851 R852 A877 E878	E800-Q802 HydrophobicContact CG-CG 4.46Å; E800-Q802 PolarHBondContact OE1-NE2 2.78Å; Q802-H851 WeakPolarHBondContact CA-O 3.43Å; Q802-R852 HydrophobicContact CG-CG 4.39Å; Q802-A877 CarbonylContact O-C 3.48Å; Q802-A877 VanDerWaalsContact O-CA 3.29Å; Q802-A877 WeakPolarHBondContact O-CA 3.22Å; Q802-E878 HydrophobicContact CB-CB 4.27Å; Q802-E878 PolarHBondContact N-O 2.99Å; Q802-E878 PolarHBondContact O-N 3.17Å
803	L	81.1	Confident	76.9	Confident	4 Å²	4	48.9 Å²	48.9	2%	0.021	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	129.7	-177.3	-63.6	165.9	0	0	0	109.7	A805 F816 Y850 H851 I853 A877	L803-A805 PolarHBondContact O-N 3.04Å; L803-F816 HydrophobicContact CD1-CB 4.34Å; L803-F816 HydrophobicContact CD1-CD2 3.64Å; L803-F816 HydrophobicContact CD1-CE2 4.19Å; L803-F816 HydrophobicContact CD1-CG 4.04Å; L803-F816 HydrophobicContact CD2-CD2 3.8Å; L803-F816 HydrophobicContact CD2-CE2 3.44Å; L803-F816 VanDerWaalsContact CD2-CE2 3.44Å; L803-F816 HydrophobicContact CD2-CZ 3.89Å; L803-F816 HydrophobicContact CG-CD2 4.39Å; L803-F816 HydrophobicContact CG-CE2 4.47Å; L803-Y850 CarbonylContact O-C 3.53Å; L803-Y850 WeakPolarHBondContact O-CA 3.26Å; L803-H851 HydrophobicContact CB-CB 4.29Å; L803-H851 PolarHBondContact N-O 2.61Å; L803-H851 PolarHBondContact O-N 3.44Å; L803-I853 HydrophobicContact CD1-CD1 3.84Å; L803-A877 HydrophobicContact CD2-CB 3.46Å; L803-A877 VanDerWaalsContact CD2-CB 3.46Å
804	P	72.3	Confident	76.8	Confident	23 Å²	23	51.9 Å²	51.9	15%	0.149	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	123.5	174.7	22.9	-28.5	0	0	0	111	L806 Y850 R876	P804-L806 PolarHBondContact O-N 3.14Å; P804-L806 VanDerWaalsContact O-N 3.1Å; P804-Y850 HydrophobicContact CB-CD1 4.18Å; P804-Y850 HydrophobicContact CB-CE1 3.92Å; P804-R876 WeakPolarHBondContact CD-O 3.48Å; P804-R876 HydrophobicContact CG-CB 3.81Å; P804-R876 HydrophobicContact CG-CG 4.49Å
805	A	69.7	Low	76.8	Confident	31 Å²	31	54.5 Å²	54.5	26%	0.256	30%	0.301	S	S	.	.			trans	-82.8	82.5	178.5	0	0	0	0	0	110	L803 K849 H851	L803-A805 PolarHBondContact O-N 3.04Å; A805-K849 HydrophobicContact CB-CB 3.77Å; A805-K849 WeakPolarHBondContact CB-O 3.36Å; A805-K849 PolarHBondContact N-O 2.86Å; A805-H851 VanDerWaalsContact CB-NE2 3.28Å; A805-H851 WeakPolarHBondContact CB-NE2 3.39Å
806	L	62.1	Low	76.9	Confident	85 Å²	85	54.3 Å²	54.3	45%	0.445	30%	0.299	S	S	.	.			trans	-87.9	138.2	174.1	-69.3	167.2	0	0	0	110.2	P804 G808 Y809	P804-L806 PolarHBondContact O-N 3.14Å; P804-L806 VanDerWaalsContact O-N 3.1Å; L806-G808 PolarHBondContact O-N 3.24Å; L806-G808 VanDerWaalsContact O-N 3.1Å; L806-Y809 HydrophobicContact CB-CD2 3.53Å; L806-Y809 HydrophobicContact CB-CE2 4.12Å; L806-Y809 HydrophobicContact CB-CG 4.39Å; L806-Y809 HydrophobicContact CD1-CD2 4.39Å; L806-Y809 HydrophobicContact CD1-CE2 4.37Å; L806-Y809 PolarHBondContact O-N 2.88Å; L806-Y809 VanDerWaalsContact O-N 3.16Å
807	K	56.1	Low	77.1	Confident	216 Å²	216	55.4 Å²	55.4	94%	0.939	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	117.9	177.2	-73.2	-176.8	177	178.5	0	110.2
808	G	56.9	Low	77.3	Confident	68 Å²	68	57.8 Å²	57.8	70%	0.701	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.3	0.2	178.4	0	0	0	0	0	116	L806	L806-G808 PolarHBondContact O-N 3.24Å; L806-G808 VanDerWaalsContact O-N 3.1Å
809	Y	57.6	Low	77.5	Confident	110 Å²	110	55.4 Å²	55.4	43%	0.431	31%	0.313	S	S	.	.			trans	-108.6	22.2	-177.2	-71.4	-85.2	0	0	0	114.8	L806 S811 E812	L806-Y809 HydrophobicContact CB-CD2 3.53Å; L806-Y809 HydrophobicContact CB-CE2 4.12Å; L806-Y809 HydrophobicContact CB-CG 4.39Å; L806-Y809 HydrophobicContact CD1-CD2 4.39Å; L806-Y809 HydrophobicContact CD1-CE2 4.37Å; L806-Y809 PolarHBondContact O-N 2.88Å; L806-Y809 VanDerWaalsContact O-N 3.16Å; Y809-S811 PolarHBondContact O-N 3.03Å; Y809-E812 HydrophobicContact CD1-CG 4.12Å; Y809-E812 WeakPolarHBondContact CD1-OE1 3.02Å; Y809-E812 WeakPolarHBondContact O-CB 3.44Å; Y809-E812 PolarHBondContact O-N 2.93Å
810	D	63.1	Low	77.6	Confident	120 Å²	120	55.4 Å²	55.4	64%	0.642	31%	0.314	S	S	*	.	H	α-helix	trans	-58.2	-19.3	175.2	-61.1	-26.3	0	0	0	112.9	E812 S814	D810-E812 VanDerWaalsContact C-N 3.3Å; D810-E812 PolarHBondContact O-N 3.44Å; D810-S814 PolarHBondContact O-N 3.44Å; D810-S814 PolarHBondContact O-OG 3.02Å
811	S	70.3	Confident	77.8	Confident	71 Å²	71	57.9 Å²	57.9	50%	0.497	33%	0.331	S	S	.	.	H	α-helix	trans	-63.1	-31.2	171.7	56.6	0	0	0	0	113.3	Y809 S814 T815	Y809-S811 PolarHBondContact O-N 3.03Å; S811-S814 PolarHBondContact O-OG 2.9Å; S811-T815 PolarHBondContact O-N 3.35Å; S811-T815 PolarHBondContact O-OG1 3.38Å
812	E	75.2	Confident	78	Confident	26 Å²	26	63.7 Å²	63.7	12%	0.121	36%	0.362	C	S	.	.	H	α-helix	trans	-69.4	-46.4	-179.2	-63.2	-175.1	167.9	0	0	110.4	Y809 D810 S814 T815 F816 R876	Y809-E812 HydrophobicContact CD1-CG 4.12Å; Y809-E812 WeakPolarHBondContact CD1-OE1 3.02Å; Y809-E812 WeakPolarHBondContact O-CB 3.44Å; Y809-E812 PolarHBondContact O-N 2.93Å; D810-E812 VanDerWaalsContact C-N 3.3Å; D810-E812 PolarHBondContact O-N 3.44Å; E812-S814 PolarHBondContact O-N 3.3Å; E812-T815 WeakPolarHBondContact O-CB 3.5Å; E812-T815 PolarHBondContact O-N 3.02Å; E812-T815 VanDerWaalsContact O-N 3.13Å; E812-F816 VanDerWaalsContact O-CD2 3.26Å; E812-F816 WeakPolarHBondContact O-CD2 3.26Å; E812-F816 PolarHBondContact O-N 3.48Å; E812-R876 IonicContact OE1-CZ 2.6Å; E812-R876 IonicContact OE1-NH1 3.88Å; E812-R876 IonicContact OE1-NH2 3.85Å; E812-R876 PolarHBondContact OE1-NH2 2.84Å; E812-R876 IonicContact OE2-CZ 3.11Å; E812-R876 IonicContact OE2-NH1 3.49Å; E812-R876 PolarHBondContact OE2-NH1 3.32Å; E812-R876 IonicContact OE2-NH2 2.78Å; E812-R876 PolarHBondContact OE2-NH2 2.99Å
813	L	84.1	Confident	78.3	Confident	35 Å²	35	63 Å²	63	18%	0.183	36%	0.357	C	S	.	.	H	α-helix	trans	-57.6	-47.6	178.7	-179.1	145.6	0	0	0	111.9	T815 F816 L817 V830 H851	L813-T815 VanDerWaalsContact C-N 3.28Å; L813-T815 PolarHBondContact O-N 3.04Å; L813-F816 PolarHBondContact O-N 3.39Å; L813-L817 HydrophobicContact CD2-CD1 3.58Å; L813-L817 HydrophobicContact CD2-CG 4.24Å; L813-L817 HydrophobicContact CG-CD1 4.47Å; L813-L817 WeakPolarHBondContact O-CG 3.35Å; L813-L817 PolarHBondContact O-N 3.48Å; L813-V830 HydrophobicContact CD1-CG1 4.21Å; L813-H851 HydrophobicContact CD1-CB 3.75Å; L813-H851 VanDerWaalsContact CD1-CG 3.49Å
814	S	85	Confident	78.8	Confident	67 Å²	67	66.6 Å²	66.6	47%	0.469	37%	0.37	S	S	.	.	H	α-helix	trans	-63.2	-34.6	178.1	55.9	0	0	0	0	112.9	D810 S811 E812 C818	D810-S814 PolarHBondContact O-N 3.44Å; D810-S814 PolarHBondContact O-OG 3.02Å; S811-S814 PolarHBondContact O-OG 2.9Å; E812-S814 PolarHBondContact O-N 3.3Å; S814-C818 WeakPolarHBondContact O-CB 3.46Å; S814-C818 PolarHBondContact O-N 3.45Å; S814-C818 VanDerWaalsContact O-N 3.08Å
815	T	88	Confident	79.7	Confident	66 Å²	66	66.1 Å²	66.1	41%	0.405	37%	0.368	S	S	.	.	H	α-helix	trans	-65.6	-42.4	174.9	-54.1	0	0	0	0	111.3	S811 E812 L813 C818 D819 L872	S811-T815 PolarHBondContact O-N 3.35Å; S811-T815 PolarHBondContact O-OG1 3.38Å; E812-T815 WeakPolarHBondContact O-CB 3.5Å; E812-T815 PolarHBondContact O-N 3.02Å; E812-T815 VanDerWaalsContact O-N 3.13Å; L813-T815 VanDerWaalsContact C-N 3.28Å; L813-T815 PolarHBondContact O-N 3.04Å; T815-C818 PolarHBondContact O-N 3.44Å; T815-D819 PolarHBondContact O-N 3.06Å; T815-L872 HydrophobicContact CG2-CD1 4.46Å; T815-L872 HydrophobicContact CG2-CD2 3.77Å
816	F	88.2	Confident	80.8	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-64.4	-44	176.3	-87.3	-76.2	0	0	0	112.9	L801 L803 E812 L813 C818 D819 L820 I853 I869 L872 A877	L801-F816 HydrophobicContact CD1-CD1 4.27Å; L803-F816 HydrophobicContact CD1-CB 4.34Å; L803-F816 HydrophobicContact CD1-CD2 3.64Å; L803-F816 HydrophobicContact CD1-CE2 4.19Å; L803-F816 HydrophobicContact CD1-CG 4.04Å; L803-F816 HydrophobicContact CD2-CD2 3.8Å; L803-F816 HydrophobicContact CD2-CE2 3.44Å; L803-F816 VanDerWaalsContact CD2-CE2 3.44Å; L803-F816 HydrophobicContact CD2-CZ 3.89Å; L803-F816 HydrophobicContact CG-CD2 4.39Å; L803-F816 HydrophobicContact CG-CE2 4.47Å; E812-F816 VanDerWaalsContact O-CD2 3.26Å; E812-F816 WeakPolarHBondContact O-CD2 3.26Å; E812-F816 PolarHBondContact O-N 3.48Å; L813-F816 PolarHBondContact O-N 3.39Å; F816-C818 VanDerWaalsContact C-N 3.3Å; F816-C818 PolarHBondContact O-N 3.11Å; F816-D819 PolarHBondContact O-N 3.29Å; F816-L820 WeakPolarHBondContact O-CB 3.31Å; F816-L820 WeakPolarHBondContact O-CG 3.22Å; F816-L820 PolarHBondContact O-N 2.85Å; F816-I853 HydrophobicContact CB-CD1 4.22Å; F816-I869 HydrophobicContact CE1-CB 4.23Å; F816-I869 HydrophobicContact CE1-CG1 4.12Å; F816-I869 HydrophobicContact CE1-CG2 4.03Å; F816-I869 HydrophobicContact CZ-CG2 4.21Å; F816-L872 HydrophobicContact CD1-CD1 4.31Å; F816-L872 HydrophobicContact CE1-CB 4Å; F816-L872 HydrophobicContact CE1-CD1 4.16Å; F816-L872 HydrophobicContact CE2-CB 3.84Å; F816-L872 HydrophobicContact CZ-CB 3.51Å; F816-L872 HydrophobicContact CZ-CD1 4.48Å; F816-A877 HydrophobicContact CZ-CB 4.4Å
817	L	89.7	Confident	82.2	Confident	41 Å²	41	70.1 Å²	70.1	22%	0.215	38%	0.381	C	S	.	.	H	α-helix	trans	-63.1	-38.8	177.3	-66	178.8	0	0	0	111.8	L813 T821 I827 V830 I853	L813-L817 HydrophobicContact CD2-CD1 3.58Å; L813-L817 HydrophobicContact CD2-CG 4.24Å; L813-L817 HydrophobicContact CG-CD1 4.47Å; L813-L817 WeakPolarHBondContact O-CG 3.35Å; L813-L817 PolarHBondContact O-N 3.48Å; L817-T821 WeakPolarHBondContact O-CB 3.36Å; L817-T821 PolarHBondContact O-N 3.45Å; L817-T821 PolarHBondContact O-OG1 2.99Å; L817-I827 HydrophobicContact CD2-CD1 3.83Å; L817-I827 HydrophobicContact CD2-CG1 4.43Å; L817-V830 HydrophobicContact CD2-CG2 4.02Å; L817-I853 HydrophobicContact CD2-CD1 4.09Å; L817-I853 HydrophobicContact CD2-CG2 4.14Å
818	C	90.2	Very high	83.8	Confident	72 Å²	72	64.1 Å²	64.1	49%	0.486	36%	0.358	S	S	.	.	H	α-helix	trans	-63.8	-45.8	175.3	-171.8	0	0	0	0	111.8	S814 T815 F816 T821 N822	S814-C818 WeakPolarHBondContact O-CB 3.46Å; S814-C818 PolarHBondContact O-N 3.45Å; S814-C818 VanDerWaalsContact O-N 3.08Å; T815-C818 PolarHBondContact O-N 3.44Å; F816-C818 VanDerWaalsContact C-N 3.3Å; F816-C818 PolarHBondContact O-N 3.11Å; C818-T821 PolarHBondContact O-N 3.28Å; C818-N822 PolarHBondContact O-N 3.46Å; C818-N822 PolarHBondContact O-ND2 3.31Å
819	D	91.9	Very high	85.4	Confident	33 Å²	33	62.4 Å²	62.4	18%	0.176	34%	0.336	C	S	.	.	H	α-helix	trans	-64.1	-44	178.7	-170	86.5	0	0	0	112.3	T815 F816 T821 N822 R823 Y865 L872	T815-D819 PolarHBondContact O-N 3.06Å; F816-D819 PolarHBondContact O-N 3.29Å; D819-T821 VanDerWaalsContact C-N 3.33Å; D819-T821 PolarHBondContact O-N 2.93Å; D819-N822 WeakPolarHBondContact O-CB 3.5Å; D819-N822 PolarHBondContact O-N 2.91Å; D819-N822 VanDerWaalsContact O-N 3.17Å; D819-R823 WeakPolarHBondContact O-CG 3.2Å; D819-R823 PolarHBondContact O-N 3.02Å; D819-R823 VanDerWaalsContact O-N 3.16Å; D819-R823 IonicContact OD2-CZ 3.14Å; D819-R823 IonicContact OD2-NE 3.75Å; D819-R823 PolarHBondContact OD2-NE 3.08Å; D819-R823 IonicContact OD2-NH2 2.74Å; D819-Y865 WeakPolarHBondContact OD2-CE2 3.47Å; D819-L872 HydrophobicContact CB-CD1 4.11Å
820	L	91.4	Very high	86.9	Confident	1 Å²	1	60 Å²	60	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-59.7	-42.6	174.6	-77.8	175.3	0	0	0	112.1	I799 L801 F816 N822 R823 A825 I853 A855 Y865	I799-L820 HydrophobicContact CD1-CD2 4.31Å; L801-L820 HydrophobicContact CD1-CD1 3.97Å; L801-L820 HydrophobicContact CD1-CD2 4.43Å; L801-L820 HydrophobicContact CD1-CG 4.47Å; F816-L820 WeakPolarHBondContact O-CB 3.31Å; F816-L820 WeakPolarHBondContact O-CG 3.22Å; F816-L820 PolarHBondContact O-N 2.85Å; L820-N822 VanDerWaalsContact C-N 3.29Å; L820-N822 PolarHBondContact O-N 3.47Å; L820-R823 CarbonylContact O-C 3.5Å; L820-R823 PolarHBondContact O-N 2.73Å; L820-A825 HydrophobicContact CB-CB 3.93Å; L820-A825 HydrophobicContact CD2-CB 4.1Å; L820-A825 WeakPolarHBondContact O-CB 3.33Å; L820-A825 PolarHBondContact O-N 2.69Å; L820-I853 HydrophobicContact CD1-CG2 3.83Å; L820-A855 HydrophobicContact CD1-CB 4.27Å; L820-Y865 HydrophobicContact CD2-CE1 4.1Å; L820-Y865 VanDerWaalsContact CD2-OH 3.27Å; L820-Y865 WeakPolarHBondContact CD2-OH 3.33Å
821	T	91.1	Very high	88	Confident	86 Å²	86	57.9 Å²	57.9	53%	0.528	32%	0.321	S	S	.	.	H	α-helix	trans	-62	-39.3	177.1	-54.5	0	0	0	0	111.3	L817 C818 D819 R823 R824	L817-T821 WeakPolarHBondContact O-CB 3.36Å; L817-T821 PolarHBondContact O-N 3.45Å; L817-T821 PolarHBondContact O-OG1 2.99Å; C818-T821 PolarHBondContact O-N 3.28Å; D819-T821 VanDerWaalsContact C-N 3.33Å; D819-T821 PolarHBondContact O-N 2.93Å; T821-R823 PolarHBondContact O-N 3.04Å; T821-R824 PolarHBondContact O-N 3.06Å
822	N	91.6	Very high	88.3	Confident	121 Å²	121	60.2 Å²	60.2	65%	0.647	33%	0.328	S	S	*	.	H	α-helix	trans	-65	-26.8	175.8	-69.3	-30	0	0	0	112.9	C818 D819 L820 R824	C818-N822 PolarHBondContact O-N 3.46Å; C818-N822 PolarHBondContact O-ND2 3.31Å; D819-N822 WeakPolarHBondContact O-CB 3.5Å; D819-N822 PolarHBondContact O-N 2.91Å; D819-N822 VanDerWaalsContact O-N 3.17Å; L820-N822 VanDerWaalsContact C-N 3.29Å; L820-N822 PolarHBondContact O-N 3.47Å; N822-R824 VanDerWaalsContact C-N 3.3Å; N822-R824 PolarHBondContact O-N 2.72Å
823	R	89.9	Confident	87.8	Confident	46 Å²	46	60.9 Å²	60.9	17%	0.174	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	23	178.4	-67	179.5	-173.2	-86.5	-4.3	113.5	D819 L820 T821 A825 T857 E861 Y865	D819-R823 WeakPolarHBondContact O-CG 3.2Å; D819-R823 PolarHBondContact O-N 3.02Å; D819-R823 VanDerWaalsContact O-N 3.16Å; D819-R823 IonicContact OD2-CZ 3.14Å; D819-R823 IonicContact OD2-NE 3.75Å; D819-R823 PolarHBondContact OD2-NE 3.08Å; D819-R823 IonicContact OD2-NH2 2.74Å; L820-R823 CarbonylContact O-C 3.5Å; L820-R823 PolarHBondContact O-N 2.73Å; T821-R823 PolarHBondContact O-N 3.04Å; R823-A825 PolarHBondContact O-N 3.46Å; R823-A825 VanDerWaalsContact O-N 3.12Å; R823-T857 PolarHBondContact O-OG1 3.25Å; R823-E861 HydrophobicContact CB-CB 4.06Å; R823-E861 PolarHBondContact NH1-O 3.14Å; R823-E861 WeakPolarHBondContact O-CG 3.4Å; R823-Y865 VanDerWaalsContact NE-CD2 3.32Å
824	R	90.8	Very high	86.6	Confident	80 Å²	80	64.7 Å²	64.7	30%	0.302	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.9	28.5	-178	-50	-173.3	-72.1	136	-6.9	113.3	E794 T821 N822 P858 S860 E861 Q893	E794-R824 IonicContact OE1-CZ 2.7Å; E794-R824 IonicContact OE1-NH1 3.42Å; E794-R824 PolarHBondContact OE1-NH1 2.86Å; E794-R824 IonicContact OE1-NH2 3.46Å; E794-R824 IonicContact OE2-CZ 3.38Å; E794-R824 IonicContact OE2-NH1 3.73Å; E794-R824 IonicContact OE2-NH2 3.22Å; E794-R824 PolarHBondContact OE2-NH2 3.44Å; E794-R824 VanDerWaalsContact OE2-NH2 3.14Å; T821-R824 PolarHBondContact O-N 3.06Å; N822-R824 VanDerWaalsContact C-N 3.3Å; N822-R824 PolarHBondContact O-N 2.72Å; R824-P858 HydrophobicContact CB-CG 4.48Å; R824-P858 VanDerWaalsContact CZ-CG 3.41Å; R824-S860 PolarHBondContact NH2-OG 3.49Å; R824-E861 IonicContact CZ-OE1 3.94Å; R824-E861 IonicContact NE-OE1 2.81Å; R824-E861 PolarHBondContact NE-OE1 2.86Å; R824-E861 IonicContact NH2-OE1 3.22Å; R824-E861 PolarHBondContact NH2-OE1 3.27Å; R824-Q893 VanDerWaalsContact NH1-NE2 3.14Å
825	A	90.8	Very high	84.9	Confident	14 Å²	14	65.1 Å²	65.1	12%	0.116	35%	0.354	C	S	.	.			trans	-79.7	134.8	177.4	0	0	0	0	0	110.9	L820 R823 A855 I856	L820-A825 HydrophobicContact CB-CB 3.93Å; L820-A825 HydrophobicContact CD2-CB 4.1Å; L820-A825 WeakPolarHBondContact O-CB 3.33Å; L820-A825 PolarHBondContact O-N 2.69Å; R823-A825 PolarHBondContact O-N 3.46Å; R823-A825 VanDerWaalsContact O-N 3.12Å; A825-A855 HydrophobicContact CB-CB 4.29Å; A825-I856 CarbonylContact C-O 3.55Å; A825-I856 VanDerWaalsContact CA-O 3.25Å; A825-I856 WeakPolarHBondContact CA-O 3.23Å
826	E	92.3	Very high	82.7	Confident	131 Å²	131	65.9 Å²	65.9	61%	0.612	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91	114.7	167.3	-175.1	177.7	179	0	0	108.7	I828 A855 I856	E826-I828 PolarHBondContact O-N 2.89Å; E826-A855 CarbonylContact O-C 3.56Å; E826-A855 WeakPolarHBondContact O-CA 3.39Å; E826-A855 WeakPolarHBondContact O-CB 3.09Å; E826-I856 PolarHBondContact N-O 3.43Å; E826-I856 PolarHBondContact O-N 2.61Å
827	I	92.4	Very high	80.2	Confident	68 Å²	68	69.8 Å²	69.8	35%	0.349	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	118.4	-179.7	-60.9	157	0	0	0	108.7	L817 V830	L817-I827 HydrophobicContact CD2-CD1 3.83Å; L817-I827 HydrophobicContact CD2-CG1 4.43Å; I827-V830 HydrophobicContact CG2-CG2 3.84Å
828	I	90.5	Very high	77.5	Confident	91 Å²	91	74.5 Å²	74.5	47%	0.467	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-53.6	179	-59.1	161.7	0	0	0	110.4	E826 C854 I856	E826-I828 PolarHBondContact O-N 2.89Å; I828-C854 HydrophobicContact CB-CB 4.4Å; I828-C854 WeakPolarHBondContact CB-O 3.26Å; I828-C854 PolarHBondContact N-O 3.29Å; I828-I856 HydrophobicContact CD1-CD1 3.63Å; I828-I856 HydrophobicContact CD1-CG1 3.57Å; I828-I856 HydrophobicContact CG1-CD1 4.21Å; I828-I856 HydrophobicContact CG1-CG1 4.28Å
829	S	90.5	Very high	74.8	Confident	32 Å²	32	75.2 Å²	75.2	22%	0.224	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	152.7	-178.7	72.4	0	0	0	0	112.1	D831 C854	S829-D831 PolarHBondContact OG-OD2 2.83Å; S829-C854 PolarHBondContact N-O 3.25Å; S829-C854 PolarHBondContact O-N 3.16Å
830	V	88.3	Confident	72	Confident	59 Å²	59	82.7 Å²	82.7	36%	0.358	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	99.7	170.1	-178.3	0	0	0	0	106.6	L813 L817 I827 R852 I853	L813-V830 HydrophobicContact CD1-CG1 4.21Å; L817-V830 HydrophobicContact CD2-CG2 4.02Å; I827-V830 HydrophobicContact CG2-CG2 3.84Å; V830-R852 CarbonylContact C-O 3.57Å; V830-R852 WeakPolarHBondContact CA-O 3.5Å; V830-I853 HydrophobicContact CG1-CG1 4.31Å; V830-I853 HydrophobicContact CG2-CG1 4.45Å; V830-I853 HydrophobicContact CG2-CG2 4.41Å
831	D	85.3	Confident	69.5	Low	75 Å²	75	90.1 Å²	90.1	40%	0.401	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	137.3	-174.1	-61.4	-45.4	0	0	0	110.5	S829 A833 H851 R852	S829-D831 PolarHBondContact OG-OD2 2.83Å; D831-A833 PolarHBondContact O-N 3.43Å; D831-H851 CarbonylContact O-C 3.58Å; D831-H851 WeakPolarHBondContact O-CA 3.43Å; D831-R852 HydrophobicContact CB-CB 4.41Å; D831-R852 PolarHBondContact N-O 2.85Å; D831-R852 PolarHBondContact O-N 2.84Å
832	N	78.3	Confident	67	Low	121 Å²	121	90.6 Å²	90.6	65%	0.647	50%	0.498	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91	93.1	168.4	-65.7	-19.7	0	0	0	107.5	Y850 H851	N832-Y850 CarbonylContact C-O 3.57Å; N832-H851 PolarHBondContact OD1-CE1 3.47Å; N832-H851 VanDerWaalsContact OD1-CE1 3.25Å; N832-H851 PolarHBondContact OD1-ND1 3.36Å
833	A	63.8	Low	64.4	Low	40 Å²	40	90.4 Å²	90.4	33%	0.331	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	120	178.4	0	0	0	0	0	109.8	D831 Y850	D831-A833 PolarHBondContact O-N 3.43Å; A833-Y850 PolarHBondContact N-O 3.4Å; A833-Y850 PolarHBondContact O-N 3.4Å
834	E	58	Low	62.2	Low	115 Å²	115	95.6 Å²	95.6	54%	0.537	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	135.1	157.1	-58.9	-167.2	162.9	0	0	106.7	S836 V847 K849	E834-S836 VanDerWaalsContact C-N 3.35Å; E834-S836 PolarHBondContact O-N 2.81Å; E834-V847 HydrophobicContact CB-CG1 4.11Å; E834-K849 HydrophobicContact CG-CG 4.32Å; E834-K849 WeakPolarHBondContact OE1-CE 3.23Å; E834-K849 IonicContact OE1-NZ 3.58Å; E834-K849 PolarHBondContact OE1-NZ 3.35Å
835	T	50.4	Low	59.9	Low	75 Å²	75	95.2 Å²	95.2	46%	0.46	52%	0.52	S	S	.	.			trans	-61.5	101.5	176	-46.9	0	0	0	0	107.3	A837 G848	T835-A837 PolarHBondContact O-N 3.29Å; T835-G848 PolarHBondContact OG1-O 2.95Å; T835-G848 VanDerWaalsContact OG1-O 3.11Å
836	S	41.1	Very low	57.6	Low	83 Å²	83	97 Å²	97	58%	0.58	54%	0.54	S	S	*	.			trans	-64.1	127.3	178.5	53.8	0	0	0	0	108.6	E834 N838	E834-S836 VanDerWaalsContact C-N 3.35Å; E834-S836 PolarHBondContact O-N 2.81Å; S836-N838 PolarHBondContact O-N 2.77Å
837	A	36	Very low	55.4	Low	81 Å²	81	94.9 Å²	94.9	67%	0.669	54%	0.535	S	S	*	.			trans	-71.7	49.9	-179.7	0	0	0	0	0	112.1	T835 C839	T835-A837 PolarHBondContact O-N 3.29Å; A837-C839 PolarHBondContact O-N 2.82Å
838	N	32.9	Very low	53.6	Low	141 Å²	141	92.8 Å²	92.8	75%	0.754	53%	0.531	S	S	*	.			trans	-83.3	12.2	-179.5	-72.2	-5.5	0	0	0	113.1	S836	S836-N838 PolarHBondContact O-N 2.77Å
839	C	32.9	Very low	52.5	Low	87 Å²	87	94.1 Å²	94.1	59%	0.588	53%	0.533	S	S	*	.	S	Bend	trans	-114	106.9	159.6	-62.3	0	0	0	0	106.9	A837 D841 D842	A837-C839 PolarHBondContact O-N 2.82Å; C839-D841 PolarHBondContact O-N 2.89Å; C839-D842 HydrophobicContact CB-CB 4.39Å; C839-D842 PolarHBondContact O-N 2.87Å
840	E	34.6	Very low	51.8	Low	189 Å²	189	94.1 Å²	94.1	88%	0.883	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-7.5	-177.1	-68.2	-176.2	148.7	0	0	114
841	D	37.3	Very low	51.5	Low	157 Å²	157	92.8 Å²	92.8	84%	0.84	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-7.3	-178.1	-76.2	-35.1	0	0	0	115.7	C839 N843	C839-D841 PolarHBondContact O-N 2.89Å; D841-N843 PolarHBondContact O-N 2.91Å
842	D	39	Very low	51.6	Low	96 Å²	96	93.7 Å²	93.7	51%	0.513	52%	0.516	S	S	.	.			trans	-100.6	38.9	-166.6	-116	-4.7	0	0	0	115	C839 R844	C839-D842 HydrophobicContact CB-CB 4.39Å; C839-D842 PolarHBondContact O-N 2.87Å; D842-R844 PolarHBondContact O-N 3.37Å
843	N	36.9	Very low	52.1	Low	118 Å²	118	87.9 Å²	87.9	63%	0.631	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	13.6	-178.6	-99.4	-34.9	0	0	0	115.3	K204 D841	K204-N843 WeakPolarHBondContact CE-O 3.28Å; K204-N843 PolarHBondContact NZ-O 2.93Å; D841-N843 PolarHBondContact O-N 2.91Å
844	R	43.7	Very low	53.4	Low	154 Å²	154	86.5 Å²	86.5	58%	0.581	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	-13.4	-169.3	-68.2	-178.1	-177.5	174.5	-0.5	115.4	D842	D842-R844 PolarHBondContact O-N 3.37Å
845	I	42	Very low	55.1	Low	73 Å²	73	81 Å²	81	37%	0.374	45%	0.447	S	S	.	.	B	Isolated β-bridge	trans	-109.7	125.3	179	-54.9	175.3	0	0	0	107.8	V847	I845-V847 PolarHBondContact O-N 2.76Å
846	G	43.6	Very low	57.1	Low	52 Å²	52	78.6 Å²	78.6	54%	0.536	43%	0.431	S	S	.	.			trans	-55.2	130.5	170.2	0	0	0	0	0	109.4	G848	G846-G848 PolarHBondContact O-N 3.4Å
847	V	46.4	Very low	59.5	Low	86 Å²	86	74.7 Å²	74.7	52%	0.521	40%	0.403	S	S	.	.			trans	-53.1	100.6	-178.2	-178.3	0	0	0	0	109.1	E834 I845 K849	E834-V847 HydrophobicContact CB-CG1 4.11Å; I845-V847 PolarHBondContact O-N 2.76Å; V847-K849 PolarHBondContact O-N 2.84Å
848	G	55	Low	62.1	Low	24 Å²	24	70.9 Å²	70.9	25%	0.247	37%	0.372	C	S	.	.			trans	-67.6	122.3	172	0	0	0	0	0	107.6	T835 G846 Y850	T835-G848 PolarHBondContact OG1-O 2.95Å; T835-G848 VanDerWaalsContact OG1-O 3.11Å; G846-G848 PolarHBondContact O-N 3.4Å; G848-Y850 WeakPolarHBondContact O-CD2 3.19Å; G848-Y850 VanDerWaalsContact O-CE2 3.27Å; G848-Y850 WeakPolarHBondContact O-CE2 3.49Å
849	K	67	Low	64.5	Low	119 Å²	119	66.2 Å²	66.2	52%	0.517	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	135.4	166.8	-60.9	-166.6	-173.9	-134.8	0	107.4	A805 E834 V847	A805-K849 HydrophobicContact CB-CB 3.77Å; A805-K849 WeakPolarHBondContact CB-O 3.36Å; A805-K849 PolarHBondContact N-O 2.86Å; E834-K849 HydrophobicContact CG-CG 4.32Å; E834-K849 WeakPolarHBondContact OE1-CE 3.23Å; E834-K849 IonicContact OE1-NZ 3.58Å; E834-K849 PolarHBondContact OE1-NZ 3.35Å; V847-K849 PolarHBondContact O-N 2.84Å
850	Y	74.2	Confident	67	Low	32 Å²	32	63.5 Å²	63.5	13%	0.125	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	145.7	175.4	-65	-92	0	0	0	109.9	R167 L803 P804 N832 A833 G848	R167-Y850 PolarHBondContact NH1-OH 2.92Å; R167-Y850 PolarHBondContact NH2-OH 2.84Å; R167-Y850 VanDerWaalsContact NH2-OH 3.16Å; L803-Y850 CarbonylContact O-C 3.53Å; L803-Y850 WeakPolarHBondContact O-CA 3.26Å; P804-Y850 HydrophobicContact CB-CD1 4.18Å; P804-Y850 HydrophobicContact CB-CE1 3.92Å; N832-Y850 CarbonylContact C-O 3.57Å; A833-Y850 PolarHBondContact N-O 3.4Å; A833-Y850 PolarHBondContact O-N 3.4Å; G848-Y850 WeakPolarHBondContact O-CD2 3.19Å; G848-Y850 VanDerWaalsContact O-CE2 3.27Å; G848-Y850 WeakPolarHBondContact O-CE2 3.49Å
851	H	83.2	Confident	69.4	Low	30 Å²	30	57.1 Å²	57.1	14%	0.139	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	121.1	162.5	-59.9	-67.1	0	0	0	108.1	Q802 L803 A805 L813 D831 N832	Q802-H851 WeakPolarHBondContact CA-O 3.43Å; L803-H851 HydrophobicContact CB-CB 4.29Å; L803-H851 PolarHBondContact N-O 2.61Å; L803-H851 PolarHBondContact O-N 3.44Å; A805-H851 VanDerWaalsContact CB-NE2 3.28Å; A805-H851 WeakPolarHBondContact CB-NE2 3.39Å; L813-H851 HydrophobicContact CD1-CB 3.75Å; L813-H851 VanDerWaalsContact CD1-CG 3.49Å; D831-H851 CarbonylContact O-C 3.58Å; D831-H851 WeakPolarHBondContact O-CA 3.43Å; N832-H851 PolarHBondContact OD1-CE1 3.47Å; N832-H851 VanDerWaalsContact OD1-CE1 3.25Å; N832-H851 PolarHBondContact OD1-ND1 3.36Å
852	R	86.7	Confident	71.6	Confident	94 Å²	94	50.3 Å²	50.3	36%	0.355	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	119	174.2	-173.5	-176.1	-170.7	-159	0	108.3	E800 L801 Q802 V830 D831	E800-R852 HydrophobicContact CG-CG 4.22Å; E800-R852 IonicContact OE1-CZ 3.59Å; E800-R852 VanDerWaalsContact OE1-CZ 3.23Å; E800-R852 IonicContact OE1-NE 3.59Å; E800-R852 PolarHBondContact OE1-NE 2.86Å; E800-R852 IonicContact OE1-NH2 3.45Å; E800-R852 PolarHBondContact OE1-NH2 3.29Å; E800-R852 VanDerWaalsContact OE1-NH2 3.07Å; E800-R852 IonicContact OE2-CZ 2.89Å; E800-R852 IonicContact OE2-NE 2.88Å; E800-R852 IonicContact OE2-NH2 3.26Å; E800-R852 PolarHBondContact OE2-NH2 2.9Å; L801-R852 CarbonylContact O-C 3.57Å; L801-R852 VanDerWaalsContact O-CA 3.31Å; L801-R852 WeakPolarHBondContact O-CA 3.27Å; Q802-R852 HydrophobicContact CG-CG 4.39Å; V830-R852 CarbonylContact C-O 3.57Å; V830-R852 WeakPolarHBondContact CA-O 3.5Å; D831-R852 HydrophobicContact CB-CB 4.41Å; D831-R852 PolarHBondContact N-O 2.85Å; D831-R852 PolarHBondContact O-N 2.84Å
853	I	89.9	Confident	73.4	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	119.4	177.1	-56	169.6	0	0	0	107.5	E800 L801 L803 F816 L817 L820 V830	E800-I853 WeakPolarHBondContact CA-O 3.05Å; L801-I853 HydrophobicContact CB-CB 4.22Å; L801-I853 PolarHBondContact N-O 3.06Å; L801-I853 PolarHBondContact O-N 2.97Å; L803-I853 HydrophobicContact CD1-CD1 3.84Å; F816-I853 HydrophobicContact CB-CD1 4.22Å; L817-I853 HydrophobicContact CD2-CD1 4.09Å; L817-I853 HydrophobicContact CD2-CG2 4.14Å; L820-I853 HydrophobicContact CD1-CG2 3.83Å; V830-I853 HydrophobicContact CG1-CG1 4.31Å; V830-I853 HydrophobicContact CG2-CG1 4.45Å; V830-I853 HydrophobicContact CG2-CG2 4.41Å
854	C	91.2	Very high	75.2	Confident	11 Å²	11	49.9 Å²	49.9	7%	0.074	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	124	172.7	-63.1	0	0	0	0	108.8	I799 I828 S829	I799-C854 CarbonylContact O-C 3.49Å; I799-C854 WeakPolarHBondContact O-CA 3.21Å; I828-C854 HydrophobicContact CB-CB 4.4Å; I828-C854 WeakPolarHBondContact CB-O 3.26Å; I828-C854 PolarHBondContact N-O 3.29Å; S829-C854 PolarHBondContact N-O 3.25Å; S829-C854 PolarHBondContact O-N 3.16Å
855	A	93.1	Very high	77.1	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	152.3	-179.1	0	0	0	0	0	111.5	I799 L820 A825 E826	I799-A855 PolarHBondContact N-O 2.87Å; I799-A855 PolarHBondContact O-N 2.93Å; L820-A855 HydrophobicContact CD1-CB 4.27Å; A825-A855 HydrophobicContact CB-CB 4.29Å; E826-A855 CarbonylContact O-C 3.56Å; E826-A855 WeakPolarHBondContact O-CA 3.39Å; E826-A855 WeakPolarHBondContact O-CB 3.09Å
856	I	92.7	Very high	78.6	Confident	24 Å²	24	39.3 Å²	39.3	12%	0.123	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	128.4	172.4	-69.6	165.9	0	0	0	108.8	M796 M797 A825 E826 I828	M796-I856 HydrophobicContact CB-CG2 3.71Å; M796-I856 HydrophobicContact CE-CG2 3.73Å; M796-I856 HydrophobicContact CG-CG2 4.38Å; M797-I856 CarbonylContact O-C 3.58Å; M797-I856 VanDerWaalsContact O-CA 3.28Å; M797-I856 WeakPolarHBondContact O-CA 3.44Å; A825-I856 CarbonylContact C-O 3.55Å; A825-I856 VanDerWaalsContact CA-O 3.25Å; A825-I856 WeakPolarHBondContact CA-O 3.23Å; E826-I856 PolarHBondContact N-O 3.43Å; E826-I856 PolarHBondContact O-N 2.61Å; I828-I856 HydrophobicContact CD1-CD1 3.63Å; I828-I856 HydrophobicContact CD1-CG1 3.57Å; I828-I856 HydrophobicContact CG1-CD1 4.21Å; I828-I856 HydrophobicContact CG1-CG1 4.28Å
857	T	91.6	Very high	80.2	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	151.1	177.5	-173.1	0	0	0	0	111.6	M797 I799 R823 L862	M797-T857 PolarHBondContact N-O 2.82Å; M797-T857 PolarHBondContact O-N 2.97Å; I799-T857 HydrophobicContact CD1-CG2 3.18Å; I799-T857 HydrophobicContact CG1-CG2 4.04Å; R823-T857 PolarHBondContact O-OG1 3.25Å; T857-L862 HydrophobicContact CG2-CD1 3.48Å; T857-L862 VanDerWaalsContact CG2-CD1 3.48Å; T857-L862 HydrophobicContact CG2-CD2 3.7Å; T857-L862 HydrophobicContact CG2-CG 3.54Å
858	P	89.6	Confident	82	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.006	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	139.1	175.5	-19.8	32	0	0	0	112.3	E794 M796 R824 S860 E861	E794-P858 HydrophobicContact CG-CB 4.45Å; E794-P858 WeakPolarHBondContact OE2-CB 3.41Å; M796-P858 HydrophobicContact CE-CG 3.73Å; M796-P858 HydrophobicContact SD-CB 3.89Å; M796-P858 HydrophobicContact SD-CG 3.59Å; M796-P858 VanDerWaalsContact SD-CG 3.59Å; R824-P858 HydrophobicContact CB-CG 4.48Å; R824-P858 VanDerWaalsContact CZ-CG 3.41Å; P858-S860 PolarHBondContact O-N 2.83Å; P858-S860 VanDerWaalsContact O-N 3.09Å; P858-E861 HydrophobicContact CB-CG 4.35Å; P858-E861 HydrophobicContact CG-CG 4.44Å; P858-E861 PolarHBondContact O-N 3.42Å
859	L	84.9	Confident	83.4	Confident	44 Å²	44	33.7 Å²	33.7	23%	0.23	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-57.6	-28.5	177.4	-176.1	60.7	0	0	0	112.4	P795 M797 E861 L862	P795-L859 HydrophobicContact CG-CB 4Å; P795-L859 HydrophobicContact CG-CD2 4.19Å; P795-L859 PolarHBondContact O-N 3.4Å; M797-L859 HydrophobicContact CE-CD1 4.37Å; M797-L859 HydrophobicContact CG-CB 3.82Å; M797-L859 HydrophobicContact CG-CD1 3.81Å; M797-L859 HydrophobicContact CG-CG 4.37Å; M797-L859 HydrophobicContact SD-CB 4.14Å; M797-L859 HydrophobicContact SD-CD1 4.07Å; M797-L859 HydrophobicContact SD-CD2 4.47Å; M797-L859 HydrophobicContact SD-CG 4.45Å; L859-E861 PolarHBondContact O-N 3.39Å; L859-L862 PolarHBondContact O-N 3.27Å
860	S	83.9	Confident	83.8	Confident	29 Å²	29	30.6 Å²	30.6	20%	0.203	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-61.7	-26.4	177.8	67.7	0	0	0	0	114.1	I637 R824 P858	I637-S860 VanDerWaalsContact CD1-CB 3.47Å; R824-S860 PolarHBondContact NH2-OG 3.49Å; P858-S860 PolarHBondContact O-N 2.83Å; P858-S860 VanDerWaalsContact O-N 3.09Å
861	E	86.5	Confident	84.2	Confident	55 Å²	55	37.4 Å²	37.4	26%	0.257	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-92.2	-7	-177.9	-57.1	-63.6	161.1	0	0	112.5	R823 R824 P858 L859	R823-E861 HydrophobicContact CB-CB 4.06Å; R823-E861 PolarHBondContact NH1-O 3.14Å; R823-E861 WeakPolarHBondContact O-CG 3.4Å; R824-E861 IonicContact CZ-OE1 3.94Å; R824-E861 IonicContact NE-OE1 2.81Å; R824-E861 PolarHBondContact NE-OE1 2.86Å; R824-E861 IonicContact NH2-OE1 3.22Å; R824-E861 PolarHBondContact NH2-OE1 3.27Å; P858-E861 HydrophobicContact CB-CG 4.35Å; P858-E861 HydrophobicContact CG-CG 4.44Å; P858-E861 PolarHBondContact O-N 3.42Å; L859-E861 PolarHBondContact O-N 3.39Å
862	L	82.1	Confident	84.3	Confident	15 Å²	15	38.4 Å²	38.4	8%	0.079	19%	0.189	C	C	.	.			trans	-94.7	4.3	-174.9	-72.8	171.7	0	0	0	114.6	M797 I799 T857 L859 D864 Y865 F879 I881	M797-L862 HydrophobicContact CB-CD1 3.69Å; M797-L862 HydrophobicContact CG-CD1 3.75Å; I799-L862 HydrophobicContact CD1-CD1 4.02Å; I799-L862 HydrophobicContact CD1-CD2 3.42Å; I799-L862 VanDerWaalsContact CD1-CD2 3.42Å; I799-L862 HydrophobicContact CD1-CG 4.25Å; I799-L862 HydrophobicContact CG1-CD1 4.3Å; I799-L862 HydrophobicContact CG1-CD2 4.39Å; T857-L862 HydrophobicContact CG2-CD1 3.48Å; T857-L862 VanDerWaalsContact CG2-CD1 3.48Å; T857-L862 HydrophobicContact CG2-CD2 3.7Å; T857-L862 HydrophobicContact CG2-CG 3.54Å; L859-L862 PolarHBondContact O-N 3.27Å; L862-D864 PolarHBondContact O-N 3.01Å; L862-Y865 HydrophobicContact CD2-CD1 3.4Å; L862-Y865 HydrophobicContact CD2-CE1 4.16Å; L862-Y865 HydrophobicContact CD2-CG 3.82Å; L862-Y865 WeakPolarHBondContact O-CB 3.35Å; L862-Y865 PolarHBondContact O-N 2.89Å; L862-Y865 VanDerWaalsContact O-N 3.17Å; L862-F879 HydrophobicContact CD2-CZ 4.43Å; L862-I881 HydrophobicContact CD1-CD1 4.38Å; L862-I881 HydrophobicContact CD1-CG2 4.18Å
863	T	77.7	Confident	83.9	Confident	92 Å²	92	34 Å²	34	56%	0.564	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	124.5	172.7	55.6	0	0	0	0	109.9	Y865	T863-Y865 PolarHBondContact O-N 3.22Å
864	D	75.2	Confident	83	Confident	112 Å²	112	37.2 Å²	37.2	60%	0.599	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.3	24.2	-179.5	-49.9	-27.5	0	0	0	115	L862 S866 A867 T868	L862-D864 PolarHBondContact O-N 3.01Å; D864-S866 VanDerWaalsContact C-N 3.33Å; D864-S866 PolarHBondContact O-N 3.13Å; D864-A867 PolarHBondContact O-N 3.18Å; D864-T868 PolarHBondContact O-N 2.9Å
865	Y	81.8	Confident	81.8	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.008	20%	0.202	C	C	.	.	H	α-helix	trans	-68.4	-33.1	-176.7	-171	-132.5	0	0	0	112.9	I799 D819 L820 R823 L862 T863 A867 T868 I869 F879	I799-Y865 HydrophobicContact CD1-CE1 4.32Å; D819-Y865 WeakPolarHBondContact OD2-CE2 3.47Å; L820-Y865 HydrophobicContact CD2-CE1 4.1Å; L820-Y865 VanDerWaalsContact CD2-OH 3.27Å; L820-Y865 WeakPolarHBondContact CD2-OH 3.33Å; R823-Y865 VanDerWaalsContact NE-CD2 3.32Å; L862-Y865 HydrophobicContact CD2-CD1 3.4Å; L862-Y865 HydrophobicContact CD2-CE1 4.16Å; L862-Y865 HydrophobicContact CD2-CG 3.82Å; L862-Y865 WeakPolarHBondContact O-CB 3.35Å; L862-Y865 PolarHBondContact O-N 2.89Å; L862-Y865 VanDerWaalsContact O-N 3.17Å; T863-Y865 PolarHBondContact O-N 3.22Å; Y865-A867 VanDerWaalsContact C-N 3.31Å; Y865-A867 PolarHBondContact O-N 2.89Å; Y865-T868 HydrophobicContact CD2-CG2 4.42Å; Y865-T868 HydrophobicContact CE2-CG2 4.33Å; Y865-T868 CarbonylContact O-C 3.56Å; Y865-T868 WeakPolarHBondContact O-CA 2.98Å; Y865-T868 WeakPolarHBondContact O-CB 3.38Å; Y865-T868 PolarHBondContact O-N 3.19Å; Y865-I869 HydrophobicContact CD1-CD1 3.44Å; Y865-I869 VanDerWaalsContact CD1-CD1 3.44Å; Y865-I869 HydrophobicContact CD1-CG1 4Å; Y865-I869 HydrophobicContact CD2-CG1 4.32Å; Y865-I869 HydrophobicContact CE1-CD1 3.46Å; Y865-I869 VanDerWaalsContact CE1-CD1 3.46Å; Y865-I869 HydrophobicContact CE1-CG1 3.73Å; Y865-I869 HydrophobicContact CE2-CD1 4.48Å; Y865-I869 HydrophobicContact CE2-CG1 3.99Å; Y865-I869 HydrophobicContact CG-CD1 4.02Å; Y865-I869 HydrophobicContact CG-CG1 4.3Å; Y865-I869 WeakPolarHBondContact O-CG1 3.28Å; Y865-I869 PolarHBondContact O-N 3.01Å; Y865-F879 AromaticContact CD1-CE2 3.66Å; Y865-F879 HydrophobicContact CD1-CE2 3.66Å; Y865-F879 AromaticContact CD1-CZ 3.63Å; Y865-F879 HydrophobicContact CD1-CZ 3.63Å; Y865-F879 AromaticContact CE1-CE2 3.85Å; Y865-F879 HydrophobicContact CE1-CE2 3.85Å; Y865-F879 HydrophobicContact CE1-CZ 4.3Å
866	S	75.2	Confident	80.6	Confident	4 Å²	4	39.9 Å²	39.9	3%	0.028	21%	0.211	C	C	.	.	H	α-helix	trans	-48.5	-47.8	172.1	58.7	0	0	0	0	113.2	V565 D864 T868 I869 R870	V565-S866 VanDerWaalsContact CG2-OG 3.23Å; V565-S866 WeakPolarHBondContact CG2-OG 3.18Å; D864-S866 VanDerWaalsContact C-N 3.33Å; D864-S866 PolarHBondContact O-N 3.13Å; S866-T868 VanDerWaalsContact C-N 3.32Å; S866-T868 PolarHBondContact O-N 3.08Å; S866-I869 PolarHBondContact O-N 3.49Å; S866-R870 WeakPolarHBondContact O-CD 3.16Å; S866-R870 VanDerWaalsContact O-CG 3.31Å; S866-R870 WeakPolarHBondContact O-CG 3.42Å; S866-R870 PolarHBondContact O-N 2.72Å
867	A	76.1	Confident	79.7	Confident	25 Å²	25	39.6 Å²	39.6	21%	0.207	21%	0.212	C	C	.	.	H	α-helix	trans	-66.9	-36.5	179.7	0	0	0	0	0	111.1	D864 Y865 R871	D864-A867 PolarHBondContact O-N 3.18Å; Y865-A867 VanDerWaalsContact C-N 3.31Å; Y865-A867 PolarHBondContact O-N 2.89Å; A867-R871 WeakPolarHBondContact O-CB 3.38Å; A867-R871 PolarHBondContact O-N 2.86Å
868	T	85.1	Confident	78.8	Confident	15 Å²	15	44.1 Å²	44.1	9%	0.092	23%	0.233	C	C	.	.	H	α-helix	trans	-66.2	-46.8	175.1	-56.5	0	0	0	0	110.8	D864 Y865 S866 R870 R871 L872	D864-T868 PolarHBondContact O-N 2.9Å; Y865-T868 HydrophobicContact CD2-CG2 4.42Å; Y865-T868 HydrophobicContact CE2-CG2 4.33Å; Y865-T868 CarbonylContact O-C 3.56Å; Y865-T868 WeakPolarHBondContact O-CA 2.98Å; Y865-T868 WeakPolarHBondContact O-CB 3.38Å; Y865-T868 PolarHBondContact O-N 3.19Å; S866-T868 VanDerWaalsContact C-N 3.32Å; S866-T868 PolarHBondContact O-N 3.08Å; T868-R870 VanDerWaalsContact C-N 3.33Å; T868-R870 PolarHBondContact O-N 2.89Å; T868-R871 WeakPolarHBondContact O-CB 3.32Å; T868-R871 PolarHBondContact O-N 3.38Å; T868-R871 VanDerWaalsContact O-N 3.15Å; T868-L872 HydrophobicContact CG2-CD1 3.96Å; T868-L872 HydrophobicContact CG2-CG 4.25Å; T868-L872 WeakPolarHBondContact O-CG 3.44Å; T868-L872 PolarHBondContact O-N 2.95Å
869	I	83	Confident	78.3	Confident	4 Å²	4	44.9 Å²	44.9	2%	0.021	24%	0.236	C	C	.	.	H	α-helix	trans	-58.5	-45.6	177.4	-68.3	157.2	0	0	0	111.1	L801 F816 Y865 S866 R871 L872 S873 A877 F879	L801-I869 HydrophobicContact CD2-CD1 3.76Å; L801-I869 HydrophobicContact CD2-CG1 4Å; L801-I869 HydrophobicContact CD2-CG2 4.1Å; F816-I869 HydrophobicContact CE1-CB 4.23Å; F816-I869 HydrophobicContact CE1-CG1 4.12Å; F816-I869 HydrophobicContact CE1-CG2 4.03Å; F816-I869 HydrophobicContact CZ-CG2 4.21Å; Y865-I869 HydrophobicContact CD1-CD1 3.44Å; Y865-I869 VanDerWaalsContact CD1-CD1 3.44Å; Y865-I869 HydrophobicContact CD1-CG1 4Å; Y865-I869 HydrophobicContact CD2-CG1 4.32Å; Y865-I869 HydrophobicContact CE1-CD1 3.46Å; Y865-I869 VanDerWaalsContact CE1-CD1 3.46Å; Y865-I869 HydrophobicContact CE1-CG1 3.73Å; Y865-I869 HydrophobicContact CE2-CD1 4.48Å; Y865-I869 HydrophobicContact CE2-CG1 3.99Å; Y865-I869 HydrophobicContact CG-CD1 4.02Å; Y865-I869 HydrophobicContact CG-CG1 4.3Å; Y865-I869 WeakPolarHBondContact O-CG1 3.28Å; Y865-I869 PolarHBondContact O-N 3.01Å; S866-I869 PolarHBondContact O-N 3.49Å; I869-R871 VanDerWaalsContact C-N 3.32Å; I869-R871 PolarHBondContact O-N 2.87Å; I869-L872 PolarHBondContact O-N 2.9Å; I869-S873 WeakPolarHBondContact O-CB 3.48Å; I869-S873 PolarHBondContact O-N 2.92Å; I869-S873 PolarHBondContact O-OG 3.2Å; I869-A877 HydrophobicContact CG2-CB 3.53Å; I869-F879 HydrophobicContact CD1-CB 3.84Å; I869-F879 HydrophobicContact CD1-CD1 3.81Å; I869-F879 HydrophobicContact CD1-CD2 3.42Å; I869-F879 VanDerWaalsContact CD1-CD2 3.42Å; I869-F879 HydrophobicContact CD1-CE1 4.02Å; I869-F879 HydrophobicContact CD1-CE2 3.69Å; I869-F879 HydrophobicContact CD1-CG 3.42Å; I869-F879 VanDerWaalsContact CD1-CG 3.42Å; I869-F879 HydrophobicContact CD1-CZ 3.95Å
870	R	76.9	Confident	77.7	Confident	53 Å²	53	43.8 Å²	43.8	20%	0.2	23%	0.232	C	C	.	.	H	α-helix	trans	-63.7	-38.9	178.2	-72.2	165.4	170.1	-155.4	-15.8	111.9	D133 M610 S866 T868 S874 G875	D133-R870 IonicContact OD1-CZ 2.68Å; D133-R870 IonicContact OD1-NH1 3.68Å; D133-R870 PolarHBondContact OD1-NH1 3.15Å; D133-R870 IonicContact OD1-NH2 3.87Å; D133-R870 PolarHBondContact OD1-NH2 2.74Å; D133-R870 IonicContact OD2-NH1 3.75Å; D133-R870 PolarHBondContact OD2-NH1 3.32Å; D133-R870 VanDerWaalsContact OD2-NH1 3.14Å; D133-R870 IonicContact OD2-NH2 3.23Å; M610-R870 PolarHBondContact O-NH2 2.89Å; S866-R870 WeakPolarHBondContact O-CD 3.16Å; S866-R870 VanDerWaalsContact O-CG 3.31Å; S866-R870 WeakPolarHBondContact O-CG 3.42Å; S866-R870 PolarHBondContact O-N 2.72Å; T868-R870 VanDerWaalsContact C-N 3.33Å; T868-R870 PolarHBondContact O-N 2.89Å; R870-S874 CarbonylContact O-C 3.58Å; R870-S874 VanDerWaalsContact O-CA 3.3Å; R870-S874 WeakPolarHBondContact O-CA 3.4Å; R870-S874 PolarHBondContact O-N 3.04Å; R870-G875 PolarHBondContact O-N 2.93Å
871	R	82.9	Confident	77.4	Confident	176 Å²	176	43.2 Å²	43.2	66%	0.664	23%	0.227	S	C	*	.	H	α-helix	trans	-64.4	-46.7	175.3	-166.2	-171.5	-53.1	130.5	6.1	111.6	A867 T868 I869	A867-R871 WeakPolarHBondContact O-CB 3.38Å; A867-R871 PolarHBondContact O-N 2.86Å; T868-R871 WeakPolarHBondContact O-CB 3.32Å; T868-R871 PolarHBondContact O-N 3.38Å; T868-R871 VanDerWaalsContact O-N 3.15Å; I869-R871 VanDerWaalsContact C-N 3.32Å; I869-R871 PolarHBondContact O-N 2.87Å
872	L	85.1	Confident	77	Confident	50 Å²	50	47.2 Å²	47.2	26%	0.262	24%	0.239	S	C	.	.	H	α-helix	trans	-70.5	-38.6	-177.5	-67.7	-178.9	0	0	0	112.9	T815 F816 D819 T868 I869	T815-L872 HydrophobicContact CG2-CD1 4.46Å; T815-L872 HydrophobicContact CG2-CD2 3.77Å; F816-L872 HydrophobicContact CD1-CD1 4.31Å; F816-L872 HydrophobicContact CE1-CB 4Å; F816-L872 HydrophobicContact CE1-CD1 4.16Å; F816-L872 HydrophobicContact CE2-CB 3.84Å; F816-L872 HydrophobicContact CZ-CB 3.51Å; F816-L872 HydrophobicContact CZ-CD1 4.48Å; D819-L872 HydrophobicContact CB-CD1 4.11Å; T868-L872 HydrophobicContact CG2-CD1 3.96Å; T868-L872 HydrophobicContact CG2-CG 4.25Å; T868-L872 WeakPolarHBondContact O-CG 3.44Å; T868-L872 PolarHBondContact O-N 2.95Å; I869-L872 PolarHBondContact O-N 2.9Å
873	S	76.7	Confident	76.7	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.007	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	0.3	179.9	63.5	0	0	0	0	114.4	I869 G875 R876 A877	I869-S873 WeakPolarHBondContact O-CB 3.48Å; I869-S873 PolarHBondContact O-N 2.92Å; I869-S873 PolarHBondContact O-OG 3.2Å; S873-G875 PolarHBondContact O-N 2.96Å; S873-G875 PolarHBondContact OG-N 2.85Å; S873-R876 WeakPolarHBondContact O-CB 3.39Å; S873-R876 PolarHBondContact O-N 2.78Å; S873-R876 VanDerWaalsContact O-N 3.17Å; S873-R876 PolarHBondContact O-NE 3.12Å; S873-R876 PolarHBondContact OG-N 3.18Å; S873-A877 VanDerWaalsContact CB-CB 3.47Å; S873-A877 WeakPolarHBondContact OG-CB 3.49Å; S873-A877 PolarHBondContact OG-N 3.28Å
874	S	71.1	Confident	76.9	Confident	69 Å²	69	48 Å²	48	48%	0.483	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	33.7	-166.4	-52.8	0	0	0	0	113.1	R870	R870-S874 CarbonylContact O-C 3.58Å; R870-S874 VanDerWaalsContact O-CA 3.3Å; R870-S874 WeakPolarHBondContact O-CA 3.4Å; R870-S874 PolarHBondContact O-N 3.04Å
875	G	67	Low	77.2	Confident	21 Å²	21	44.1 Å²	44.1	22%	0.216	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	78	15.1	179.8	0	0	0	0	0	115.5	R870 S873	R870-G875 PolarHBondContact O-N 2.93Å; S873-G875 PolarHBondContact O-N 2.96Å; S873-G875 PolarHBondContact OG-N 2.85Å
876	R	68.5	Low	77.3	Confident	46 Å²	46	45.2 Å²	45.2	17%	0.174	23%	0.226	C	C	.	.			trans	-93.5	-16.1	-178.9	-72.8	-175.9	-85.8	126.3	-3.6	114.8	P160 P804 E812 S873	P160-R876 HydrophobicContact CB-CG 4.41Å; P804-R876 WeakPolarHBondContact CD-O 3.48Å; P804-R876 HydrophobicContact CG-CB 3.81Å; P804-R876 HydrophobicContact CG-CG 4.49Å; E812-R876 IonicContact OE1-CZ 2.6Å; E812-R876 IonicContact OE1-NH1 3.88Å; E812-R876 IonicContact OE1-NH2 3.85Å; E812-R876 PolarHBondContact OE1-NH2 2.84Å; E812-R876 IonicContact OE2-CZ 3.11Å; E812-R876 IonicContact OE2-NH1 3.49Å; E812-R876 PolarHBondContact OE2-NH1 3.32Å; E812-R876 IonicContact OE2-NH2 2.78Å; E812-R876 PolarHBondContact OE2-NH2 2.99Å; S873-R876 WeakPolarHBondContact O-CB 3.39Å; S873-R876 PolarHBondContact O-N 2.78Å; S873-R876 VanDerWaalsContact O-N 3.17Å; S873-R876 PolarHBondContact O-NE 3.12Å; S873-R876 PolarHBondContact OG-N 3.18Å
877	A	73.3	Confident	77.9	Confident	18 Å²	18	48.4 Å²	48.4	15%	0.149	24%	0.24	C	C	.	.			trans	-81	139.9	-178.8	0	0	0	0	0	111.7	Q802 L803 F816 I869 S873	Q802-A877 CarbonylContact O-C 3.48Å; Q802-A877 VanDerWaalsContact O-CA 3.29Å; Q802-A877 WeakPolarHBondContact O-CA 3.22Å; L803-A877 HydrophobicContact CD2-CB 3.46Å; L803-A877 VanDerWaalsContact CD2-CB 3.46Å; F816-A877 HydrophobicContact CZ-CB 4.4Å; I869-A877 HydrophobicContact CG2-CB 3.53Å; S873-A877 VanDerWaalsContact CB-CB 3.47Å; S873-A877 WeakPolarHBondContact OG-CB 3.49Å; S873-A877 PolarHBondContact OG-N 3.28Å
878	E	72	Confident	78.5	Confident	94 Å²	94	50.8 Å²	50.8	44%	0.439	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	144.9	164.2	-61.2	178.3	-169.2	0	0	109	L801 Q802	L801-E878 CarbonylContact C-O 3.58Å; L801-E878 WeakPolarHBondContact CA-O 3.46Å; Q802-E878 HydrophobicContact CB-CB 4.27Å; Q802-E878 PolarHBondContact N-O 2.99Å; Q802-E878 PolarHBondContact O-N 3.17Å
879	F	78.8	Confident	78.7	Confident	17 Å²	17	50.6 Å²	50.6	8%	0.075	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	131.6	-173.2	167.8	-111	0	0	0	110.1	V564 I799 E800 L801 L862 Y865 I869 I881	V564-F879 HydrophobicContact CB-CD1 4.47Å; V564-F879 HydrophobicContact CG1-CD1 3.54Å; V564-F879 HydrophobicContact CG1-CE1 4.17Å; I799-F879 HydrophobicContact CB-CE2 4.31Å; I799-F879 HydrophobicContact CD1-CE2 4.15Å; I799-F879 HydrophobicContact CG1-CE2 4.02Å; I799-F879 HydrophobicContact CG2-CD2 3.7Å; I799-F879 HydrophobicContact CG2-CE2 3.46Å; I799-F879 VanDerWaalsContact CG2-CE2 3.46Å; E800-F879 WeakPolarHBondContact O-CA 3.32Å; L801-F879 HydrophobicContact CD2-CB 3.81Å; L801-F879 HydrophobicContact CD2-CD2 3.52Å; L801-F879 HydrophobicContact CD2-CE2 4.48Å; L801-F879 HydrophobicContact CD2-CG 4.07Å; L801-F879 HydrophobicContact CG-CD2 4.06Å; L862-F879 HydrophobicContact CD2-CZ 4.43Å; Y865-F879 AromaticContact CD1-CE2 3.66Å; Y865-F879 HydrophobicContact CD1-CE2 3.66Å; Y865-F879 AromaticContact CD1-CZ 3.63Å; Y865-F879 HydrophobicContact CD1-CZ 3.63Å; Y865-F879 AromaticContact CE1-CE2 3.85Å; Y865-F879 HydrophobicContact CE1-CE2 3.85Å; Y865-F879 HydrophobicContact CE1-CZ 4.3Å; I869-F879 HydrophobicContact CD1-CB 3.84Å; I869-F879 HydrophobicContact CD1-CD1 3.81Å; I869-F879 HydrophobicContact CD1-CD2 3.42Å; I869-F879 VanDerWaalsContact CD1-CD2 3.42Å; I869-F879 HydrophobicContact CD1-CE1 4.02Å; I869-F879 HydrophobicContact CD1-CE2 3.69Å; I869-F879 HydrophobicContact CD1-CG 3.42Å; I869-F879 VanDerWaalsContact CD1-CG 3.42Å; I869-F879 HydrophobicContact CD1-CZ 3.95Å; F879-I881 HydrophobicContact CD1-CD1 4.48Å; F879-I881 HydrophobicContact CD1-CG1 4.08Å; F879-I881 HydrophobicContact CE1-CD1 3.34Å; F879-I881 HydrophobicContact CE1-CG1 3.27Å; F879-I881 HydrophobicContact CE2-CD1 4.34Å; F879-I881 HydrophobicContact CE2-CG1 3.76Å; F879-I881 HydrophobicContact CZ-CD1 3.25Å; F879-I881 HydrophobicContact CZ-CG1 3.08Å
880	S	72.9	Confident	78.9	Confident	21 Å²	21	53 Å²	53	15%	0.147	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	147.6	173.5	54.7	0	0	0	0	110	E562 I799 E800	E562-S880 VanDerWaalsContact OE2-CB 3.26Å; E562-S880 WeakPolarHBondContact OE2-CB 3.38Å; I799-S880 WeakPolarHBondContact CA-O 3.31Å; E800-S880 WeakPolarHBondContact CB-OG 3.22Å; E800-S880 PolarHBondContact N-O 3.23Å; E800-S880 PolarHBondContact O-N 3.41Å; E800-S880 PolarHBondContact O-OG 3.31Å
881	I	78.3	Confident	79.3	Confident	18 Å²	18	55.7 Å²	55.7	9%	0.092	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	130.8	179.4	-46.7	179.3	0	0	0	108.7	Y566 M797 E798 L862 F879	Y566-I881 HydrophobicContact CE2-CD1 4.22Å; M797-I881 HydrophobicContact CB-CG2 3.52Å; M797-I881 HydrophobicContact CE-CG2 3.41Å; M797-I881 VanDerWaalsContact CE-CG2 3.41Å; M797-I881 HydrophobicContact CG-CG2 3.89Å; M797-I881 HydrophobicContact SD-CG2 4.5Å; E798-I881 CarbonylContact O-C 3.57Å; E798-I881 WeakPolarHBondContact O-CA 3.45Å; L862-I881 HydrophobicContact CD1-CD1 4.38Å; L862-I881 HydrophobicContact CD1-CG2 4.18Å; F879-I881 HydrophobicContact CD1-CD1 4.48Å; F879-I881 HydrophobicContact CD1-CG1 4.08Å; F879-I881 HydrophobicContact CE1-CD1 3.34Å; F879-I881 HydrophobicContact CE1-CG1 3.27Å; F879-I881 HydrophobicContact CE2-CD1 4.34Å; F879-I881 HydrophobicContact CE2-CG1 3.76Å; F879-I881 HydrophobicContact CZ-CD1 3.25Å; F879-I881 HydrophobicContact CZ-CG1 3.08Å
882	R	77	Confident	79.6	Confident	139 Å²	139	53 Å²	53	53%	0.525	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	146.1	173.4	-63.5	-178.7	-179.3	173.2	-1.1	111	E562 M797 E798 S884	E562-R882 IonicContact OE1-CZ 3.28Å; E562-R882 IonicContact OE1-NE 3.69Å; E562-R882 IonicContact OE1-NH2 2.82Å; E562-R882 PolarHBondContact OE1-NH2 3.09Å; E562-R882 IonicContact OE2-NE 3.89Å; M797-R882 CarbonylContact C-O 3.56Å; M797-R882 VanDerWaalsContact CA-O 3.24Å; M797-R882 WeakPolarHBondContact CA-O 3.46Å; E798-R882 PolarHBondContact N-O 3.38Å; E798-R882 PolarHBondContact O-N 3.21Å; R882-S884 PolarHBondContact O-N 3.21Å
883	L	76.2	Confident	79.6	Confident	88 Å²	88	52.4 Å²	52.4	46%	0.461	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	118.8	174.3	-179.1	71.1	0	0	0	108.7	P795 M797	P795-L883 HydrophobicContact CB-CD1 3.77Å; M797-L883 HydrophobicContact CE-CB 4.32Å; M797-L883 HydrophobicContact SD-CB 4.37Å; M797-L883 HydrophobicContact SD-CD1 3.86Å
884	S	81.6	Confident	80.2	Confident	34 Å²	34	54.1 Å²	54.1	24%	0.238	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	-61.6	178.7	-174.4	0	0	0	0	110.8	M796 R882	M796-S884 PolarHBondContact O-N 3.15Å; R882-S884 PolarHBondContact O-N 3.21Å
885	N	81.8	Confident	81	Confident	32 Å²	32	53.1 Å²	53.1	17%	0.171	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.3	-178	-172.2	49.1	28.2	0	0	0	111.3	P680 M796 H887	P680-N885 HydrophobicContact CB-CB 3.29Å; P680-N885 HydrophobicContact CG-CB 3.97Å; M796-N885 WeakPolarHBondContact CB-OD1 3.45Å; M796-N885 PolarHBondContact N-O 3.3Å; M796-N885 PolarHBondContact O-N 2.84Å; N885-H887 VanDerWaalsContact CG-CE1 3.42Å; N885-H887 PolarHBondContact ND2-CE1 3.32Å; N885-H887 PolarHBondContact OD1-CE1 3.22Å; N885-H887 PolarHBondContact OD1-ND1 2.97Å
886	Y	84.8	Confident	81.9	Confident	24 Å²	24	57.1 Å²	57.1	9%	0.094	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	134.1	171.9	-80.4	-94.2	0	0	0	110.1	A638 K640 M793 E794 P795	A638-Y886 WeakPolarHBondContact O-CE1 3.37Å; A638-Y886 PolarHBondContact O-OH 3.28Å; K640-Y886 HydrophobicContact CB-CD1 4.44Å; K640-Y886 HydrophobicContact CB-CE1 4.4Å; K640-Y886 HydrophobicContact CD-CD1 4.2Å; K640-Y886 HydrophobicContact CD-CD2 4.48Å; K640-Y886 HydrophobicContact CD-CE1 3.72Å; K640-Y886 HydrophobicContact CD-CE2 4.05Å; K640-Y886 VanDerWaalsContact CE-OH 3.26Å; K640-Y886 WeakPolarHBondContact CE-OH 3.35Å; K640-Y886 HydrophobicContact CG-CD1 4.3Å; K640-Y886 HydrophobicContact CG-CE1 3.81Å; K640-Y886 PolarHBondContact NZ-OH 2.86Å; M793-Y886 HydrophobicContact CB-CD1 4.18Å; M793-Y886 WeakPolarHBondContact CE-O 3.28Å; E794-Y886 WeakPolarHBondContact O-CA 3.22Å; P795-Y886 HydrophobicContact CB-CD1 4.3Å; P795-Y886 HydrophobicContact CB-CE1 3.79Å; P795-Y886 HydrophobicContact CG-CE1 4.3Å
887	H	86.5	Confident	82.7	Confident	72 Å²	72	56 Å²	56	33%	0.333	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	149	177.1	-81.9	77.2	0	0	0	111.6	M793 E794 M796 N885 V889	M793-H887 CarbonylContact C-O 3.59Å; M793-H887 VanDerWaalsContact CA-O 3.26Å; M793-H887 WeakPolarHBondContact CA-O 3.42Å; E794-H887 PolarHBondContact N-O 3.29Å; E794-H887 PolarHBondContact O-N 3.41Å; M796-H887 HydrophobicContact CG-CB 3.72Å; M796-H887 WeakPolarHBondContact CG-ND1 3.47Å; M796-H887 HydrophobicContact SD-CB 4.14Å; N885-H887 VanDerWaalsContact CG-CE1 3.42Å; N885-H887 PolarHBondContact ND2-CE1 3.32Å; N885-H887 PolarHBondContact OD1-CE1 3.22Å; N885-H887 PolarHBondContact OD1-ND1 2.97Å; H887-V889 PolarHBondContact O-N 3.13Å
888	P	88.3	Confident	83.3	Confident	75 Å²	75	57.1 Å²	57.1	49%	0.487	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	131.4	174.3	28	-33.5	0	0	0	110.1	M793	M793-P888 HydrophobicContact SD-CB 4.01Å
889	V	89.2	Confident	83.9	Confident	10 Å²	10	56.8 Å²	56.8	6%	0.061	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-67.6	145.9	177.3	178.9	0	0	0	0	109.7	V792 E794 H887 Q893 Q894 L897	V792-V889 HydrophobicContact CB-CG2 4.34Å; V792-V889 HydrophobicContact CG1-CG2 4.06Å; V792-V889 WeakPolarHBondContact O-CB 3.31Å; V792-V889 WeakPolarHBondContact O-CG2 3.49Å; V792-V889 PolarHBondContact O-N 3.05Å; E794-V889 HydrophobicContact CB-CG2 3.6Å; E794-V889 HydrophobicContact CG-CG2 3.69Å; H887-V889 PolarHBondContact O-N 3.13Å; V889-Q893 HydrophobicContact CG1-CB 3.28Å; V889-Q893 HydrophobicContact CG1-CG 4.47Å; V889-Q894 HydrophobicContact CG1-CB 4.35Å; V889-L897 HydrophobicContact CG1-CD1 4.27Å; V889-L897 HydrophobicContact CG2-CD1 4.47Å
890	S	87.9	Confident	83.9	Confident	54 Å²	54	61.7 Å²	61.7	38%	0.378	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-60.5	150	173.4	67.7	0	0	0	0	111.6	E892 Q893 Q894	S890-E892 PolarHBondContact O-N 3.02Å; S890-Q893 PolarHBondContact O-N 2.97Å; S890-Q893 VanDerWaalsContact O-N 3.09Å; S890-Q893 WeakPolarHBondContact OG-CB 3.49Å; S890-Q893 WeakPolarHBondContact OG-CG 3.44Å; S890-Q893 PolarHBondContact OG-N 3.41Å; S890-Q893 PolarHBondContact OG-OE1 2.75Å; S890-Q894 PolarHBondContact O-N 2.77Å
891	S	86.4	Confident	84.1	Confident	110 Å²	110	64.2 Å²	64.2	77%	0.769	33%	0.334	S	S	*	.	H	α-helix	trans	-57.7	-35.1	-178.2	53	0	0	0	0	113.3	A895	S891-A895 PolarHBondContact O-N 2.83Å; S891-A895 VanDerWaalsContact O-N 3.12Å
892	E	87.9	Confident	84	Confident	121 Å²	121	71.3 Å²	71.3	57%	0.565	36%	0.36	S	S	*	.	H	α-helix	trans	-66.6	-44.8	176.1	-167.3	-167.7	147.9	0	0	112	S890 A895 K896	S890-E892 PolarHBondContact O-N 3.02Å; E892-A895 WeakPolarHBondContact O-CB 3.26Å; E892-A895 PolarHBondContact O-N 3.36Å; E892-K896 WeakPolarHBondContact O-CG 3.3Å; E892-K896 PolarHBondContact O-N 3Å; E892-K896 VanDerWaalsContact O-N 3.11Å; E892-K896 VanDerWaalsContact OE1-CE 3.3Å; E892-K896 WeakPolarHBondContact OE1-CE 3.45Å; E892-K896 IonicContact OE1-NZ 3.89Å; E892-K896 PolarHBondContact OE1-NZ 3.01Å
893	Q	85.9	Confident	83.5	Confident	37 Å²	37	74.1 Å²	74.1	17%	0.173	37%	0.371	C	S	.	.	H	α-helix	trans	-70.8	-37.1	178	-75.7	162.7	-18.7	0	0	112.1	R824 V889 S890 A895 K896 L897	R824-Q893 VanDerWaalsContact NH1-NE2 3.14Å; V889-Q893 HydrophobicContact CG1-CB 3.28Å; V889-Q893 HydrophobicContact CG1-CG 4.47Å; S890-Q893 PolarHBondContact O-N 2.97Å; S890-Q893 VanDerWaalsContact O-N 3.09Å; S890-Q893 WeakPolarHBondContact OG-CB 3.49Å; S890-Q893 WeakPolarHBondContact OG-CG 3.44Å; S890-Q893 PolarHBondContact OG-N 3.41Å; S890-Q893 PolarHBondContact OG-OE1 2.75Å; Q893-A895 VanDerWaalsContact C-N 3.26Å; Q893-A895 PolarHBondContact O-N 3.16Å; Q893-K896 WeakPolarHBondContact O-CB 3.5Å; Q893-K896 PolarHBondContact O-N 3.29Å; Q893-K896 VanDerWaalsContact O-N 3.12Å; Q893-L897 WeakPolarHBondContact O-CG 3.16Å; Q893-L897 PolarHBondContact O-N 3.11Å
894	Q	88.3	Confident	82.8	Confident	36 Å²	36	76.1 Å²	76.1	17%	0.168	38%	0.382	C	S	.	.	H	α-helix	trans	-59.2	-41.1	173.5	-178.2	169.9	-48.5	0	0	110.7	V792 V889 S890 L897 I898	V792-Q894 HydrophobicContact CB-CG 4.31Å; V792-Q894 HydrophobicContact CG2-CG 3.89Å; V792-Q894 VanDerWaalsContact N-OE1 3.14Å; V889-Q894 HydrophobicContact CG1-CB 4.35Å; S890-Q894 PolarHBondContact O-N 2.77Å; Q894-L897 PolarHBondContact O-N 3.12Å; Q894-I898 HydrophobicContact CG-CD1 3.98Å; Q894-I898 WeakPolarHBondContact O-CD1 3.33Å; Q894-I898 WeakPolarHBondContact O-CG1 3.45Å; Q894-I898 PolarHBondContact O-N 3.5Å
895	A	87.9	Confident	81.6	Confident	49 Å²	49	79.6 Å²	79.6	41%	0.405	39%	0.39	S	S	.	.	H	α-helix	trans	-61.6	-45.4	173.3	0	0	0	0	0	112.1	S891 E892 Q893 L897 I898 D899	S891-A895 PolarHBondContact O-N 2.83Å; S891-A895 VanDerWaalsContact O-N 3.12Å; E892-A895 WeakPolarHBondContact O-CB 3.26Å; E892-A895 PolarHBondContact O-N 3.36Å; Q893-A895 VanDerWaalsContact C-N 3.26Å; Q893-A895 PolarHBondContact O-N 3.16Å; A895-L897 PolarHBondContact O-N 3.08Å; A895-I898 PolarHBondContact O-N 3Å; A895-D899 PolarHBondContact O-N 2.98Å
896	K	87	Confident	80.1	Confident	105 Å²	105	81.2 Å²	81.2	46%	0.457	40%	0.404	S	S	.	.	H	α-helix	trans	-59	-43.2	175.8	-69.5	173.5	-173.5	168.1	0	112.3	E892 Q893 D899 Q900	E892-K896 WeakPolarHBondContact O-CG 3.3Å; E892-K896 PolarHBondContact O-N 3Å; E892-K896 VanDerWaalsContact O-N 3.11Å; E892-K896 VanDerWaalsContact OE1-CE 3.3Å; E892-K896 WeakPolarHBondContact OE1-CE 3.45Å; E892-K896 IonicContact OE1-NZ 3.89Å; E892-K896 PolarHBondContact OE1-NZ 3.01Å; Q893-K896 WeakPolarHBondContact O-CB 3.5Å; Q893-K896 PolarHBondContact O-N 3.29Å; Q893-K896 VanDerWaalsContact O-N 3.12Å; K896-D899 PolarHBondContact O-N 3.36Å; K896-Q900 WeakPolarHBondContact O-CG 3.42Å; K896-Q900 PolarHBondContact O-N 2.73Å
897	L	85.3	Confident	78.1	Confident	21 Å²	21	82.2 Å²	82.2	11%	0.11	42%	0.421	C	S	.	.	H	α-helix	trans	-65.6	-41.1	178.4	-70.4	173.1	0	0	0	112.2	Y639 L718 V792 V889 Q893 Q894 A895 D899 Q900 Y901	Y639-L897 HydrophobicContact CD1-CD1 4.04Å; Y639-L897 HydrophobicContact CE1-CD1 3.54Å; Y639-L897 HydrophobicContact CE1-CD2 4.32Å; Y639-L897 HydrophobicContact CE2-CD1 4.27Å; Y639-L897 HydrophobicContact CE2-CD2 3.76Å; Y639-L897 WeakPolarHBondContact OH-CD2 3.33Å; L718-L897 HydrophobicContact CD1-CB 4.48Å; V792-L897 HydrophobicContact CG1-CD1 4.21Å; V889-L897 HydrophobicContact CG1-CD1 4.27Å; V889-L897 HydrophobicContact CG2-CD1 4.47Å; Q893-L897 WeakPolarHBondContact O-CG 3.16Å; Q893-L897 PolarHBondContact O-N 3.11Å; Q894-L897 PolarHBondContact O-N 3.12Å; A895-L897 PolarHBondContact O-N 3.08Å; L897-D899 VanDerWaalsContact C-N 3.32Å; L897-D899 PolarHBondContact O-N 3.4Å; L897-Q900 PolarHBondContact O-N 3.07Å; L897-Y901 WeakPolarHBondContact O-CB 3.18Å; L897-Y901 PolarHBondContact O-N 3.47Å
898	I	85.2	Confident	75.8	Confident	42 Å²	42	82.9 Å²	82.9	22%	0.215	43%	0.433	C	S	.	.	H	α-helix	trans	-62.5	-42.5	176	-69.6	164.9	0	0	0	110.5	I717 L718 Q894 A895 Y901 R902	I717-I898 HydrophobicContact CG2-CD1 3.79Å; I717-I898 HydrophobicContact CG2-CG1 3.69Å; L718-I898 HydrophobicContact CD2-CG1 4.49Å; Q894-I898 HydrophobicContact CG-CD1 3.98Å; Q894-I898 WeakPolarHBondContact O-CD1 3.33Å; Q894-I898 WeakPolarHBondContact O-CG1 3.45Å; Q894-I898 PolarHBondContact O-N 3.5Å; A895-I898 PolarHBondContact O-N 3Å; I898-Y901 PolarHBondContact O-N 3.12Å; I898-R902 VanDerWaalsContact O-CG 3.31Å; I898-R902 WeakPolarHBondContact O-CG 3.44Å; I898-R902 PolarHBondContact O-N 2.71Å
899	D	84.2	Confident	73.4	Confident	87 Å²	87	84.9 Å²	84.9	47%	0.465	45%	0.445	S	S	.	.	H	α-helix	trans	-65.1	-45.8	177.9	-73.8	-20.1	0	0	0	111.5	A895 K896 L897 Y901 R902 W903	A895-D899 PolarHBondContact O-N 2.98Å; K896-D899 PolarHBondContact O-N 3.36Å; L897-D899 VanDerWaalsContact C-N 3.32Å; L897-D899 PolarHBondContact O-N 3.4Å; D899-Y901 VanDerWaalsContact C-N 3.33Å; D899-Y901 PolarHBondContact O-N 3.37Å; D899-R902 PolarHBondContact O-N 3.49Å; D899-W903 VanDerWaalsContact O-CD1 3.28Å; D899-W903 PolarHBondContact O-N 2.78Å
900	Q	80.1	Confident	70.5	Confident	120 Å²	120	91.5 Å²	91.5	56%	0.561	48%	0.479	S	S	*	.	H	α-helix	trans	-58	-44.1	174.5	-73.7	176.8	-5.7	0	0	112.1	K896 L897 R902 W903 N904	K896-Q900 WeakPolarHBondContact O-CG 3.42Å; K896-Q900 PolarHBondContact O-N 2.73Å; L897-Q900 PolarHBondContact O-N 3.07Å; Q900-R902 PolarHBondContact O-N 3.43Å; Q900-W903 PolarHBondContact O-N 3.35Å; Q900-N904 PolarHBondContact O-N 2.77Å; Q900-N904 VanDerWaalsContact O-N 3.13Å
901	Y	76.5	Confident	67.8	Low	74 Å²	74	100.4 Å²	100.4	29%	0.29	51%	0.514	S	S	.	.	H	α-helix	trans	-63.8	-39.7	178.1	-173.7	-95.6	0	0	0	112.5	L718 L897 I898 D899 R905	L718-Y901 HydrophobicContact CD2-CD2 4.29Å; L718-Y901 HydrophobicContact CD2-CG 4.01Å; L718-Y901 VanDerWaalsContact O-CE2 3.26Å; L718-Y901 WeakPolarHBondContact O-CE2 3.37Å; L718-Y901 PolarHBondContact O-OH 3.41Å; L897-Y901 WeakPolarHBondContact O-CB 3.18Å; L897-Y901 PolarHBondContact O-N 3.47Å; I898-Y901 PolarHBondContact O-N 3.12Å; D899-Y901 VanDerWaalsContact C-N 3.33Å; D899-Y901 PolarHBondContact O-N 3.37Å; Y901-R905 PolarHBondContact O-N 3.29Å; Y901-R905 PolarHBondContact OH-NH2 3.09Å
902	R	77	Confident	66.8	Low	167 Å²	167	100 Å²	100	63%	0.63	50%	0.501	S	S	*	.	H	α-helix	trans	-64.2	-43.6	176.6	-76.7	174.1	175.6	-178.4	-0.6	111.8	I898 D899 Q900 R905 S906	I898-R902 VanDerWaalsContact O-CG 3.31Å; I898-R902 WeakPolarHBondContact O-CG 3.44Å; I898-R902 PolarHBondContact O-N 2.71Å; D899-R902 PolarHBondContact O-N 3.49Å; Q900-R902 PolarHBondContact O-N 3.43Å; R902-R905 PolarHBondContact O-N 3.12Å; R902-S906 PolarHBondContact O-N 2.72Å; R902-S906 PolarHBondContact O-OG 3.22Å; R902-S906 VanDerWaalsContact O-OG 3.09Å
903	W	65.7	Low	65.7	Low	199 Å²	199	98.8 Å²	98.8	75%	0.754	50%	0.498	S	S	*	.	H	α-helix	trans	-61.1	-42.7	177.5	-90.7	84.2	0	0	0	112.8	D899 Q900 R905 S906 G907	D899-W903 VanDerWaalsContact O-CD1 3.28Å; D899-W903 PolarHBondContact O-N 2.78Å; Q900-W903 PolarHBondContact O-N 3.35Å; W903-R905 VanDerWaalsContact C-N 3.25Å; W903-R905 PolarHBondContact O-N 3.5Å; W903-S906 PolarHBondContact O-N 2.84Å; W903-S906 PolarHBondContact O-OG 3.43Å; W903-G907 PolarHBondContact O-N 3.17Å
904	N	61.2	Low	64.6	Low	129 Å²	129	102.3 Å²	102.3	69%	0.69	52%	0.516	S	S	*	.	H	α-helix	trans	-63.7	-29.9	179	-75.2	-12.9	0	0	0	112.8	Q900	Q900-N904 PolarHBondContact O-N 2.77Å; Q900-N904 VanDerWaalsContact O-N 3.13Å
905	R	57.4	Low	63.2	Low	108 Å²	108	106.2 Å²	106.2	41%	0.408	54%	0.536	S	S	.	.	H	α-helix	trans	-73.3	-44.7	174.7	-82.7	-162.4	-177.4	175.8	12.4	113.4	R719 Y901 R902 W903 G907 S908	R719-R905 VanDerWaalsContact CD-NH2 3.33Å; R719-R905 VanDerWaalsContact NH1-NH2 3.17Å; Y901-R905 PolarHBondContact O-N 3.29Å; Y901-R905 PolarHBondContact OH-NH2 3.09Å; R902-R905 PolarHBondContact O-N 3.12Å; W903-R905 VanDerWaalsContact C-N 3.25Å; W903-R905 PolarHBondContact O-N 3.5Å; R905-G907 VanDerWaalsContact C-N 3.26Å; R905-G907 PolarHBondContact O-N 3.4Å; R905-S908 PolarHBondContact O-N 3.47Å; R905-S908 PolarHBondContact O-OG 3.34Å
906	S	49.6	Very low	61.7	Low	66 Å²	66	109.8 Å²	109.8	46%	0.462	55%	0.545	S	S	.	.	H	α-helix	trans	-67.6	-26.9	-178.2	31.5	0	0	0	0	112.8	R902 W903 T909	R902-S906 PolarHBondContact O-N 2.72Å; R902-S906 PolarHBondContact O-OG 3.22Å; R902-S906 VanDerWaalsContact O-OG 3.09Å; W903-S906 PolarHBondContact O-N 2.84Å; W903-S906 PolarHBondContact O-OG 3.43Å; S906-T909 PolarHBondContact O-OG1 2.96Å
907	G	41.8	Very low	60	Low	44 Å²	44	110.1 Å²	110.1	45%	0.454	55%	0.551	S	S	.	*	H	α-helix	trans	-70.7	-26.3	173.1	0	0	0	0	0	114.7	W903 R905 T909 L910	W903-G907 PolarHBondContact O-N 3.17Å; R905-G907 VanDerWaalsContact C-N 3.26Å; R905-G907 PolarHBondContact O-N 3.4Å; G907-T909 VanDerWaalsContact C-N 3.27Å; G907-T909 PolarHBondContact O-N 3.05Å; G907-L910 PolarHBondContact O-N 3.19Å
908	S	39.8	Very low	58.2	Low	86 Å²	86	116.4 Å²	116.4	60%	0.601	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-6.8	-176.3	69.8	0	0	0	0	115.2	R905	R905-S908 PolarHBondContact O-N 3.47Å; R905-S908 PolarHBondContact O-OG 3.34Å
909	T	36.4	Very low	56.1	Low	118 Å²	118	122.2 Å²	122.2	72%	0.724	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	4.1	176	41	0	0	0	0	113.9	S906 G907	S906-T909 PolarHBondContact O-OG1 2.96Å; G907-T909 VanDerWaalsContact C-N 3.27Å; G907-T909 PolarHBondContact O-N 3.05Å
910	L	30	Very low	53.7	Low	148 Å²	148	125.1 Å²	125.1	78%	0.775	62%	0.622	S	S	*	*			trans	-115.6	7.5	-176.2	-94.3	151.7	0	0	0	114.7	G907	G907-L910 PolarHBondContact O-N 3.19Å
911	H	29.5	Very low	51.4	Low	242 Å²	242	125.5 Å²	125.5	100%	1.12	63%	0.628	S	S	*	*			trans	-123.8	0	164	-86.3	-53.1	0	0	0	109.2

Retrieved 911 of 911 residues in 228.1 ms (Link to these results)

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