A0A077ZFG5_TRITR Loading...

Lissencephaly 1

AlphaFold DB , UniProt , Accession A0A077ZFG5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 961 aa.

						>A0A077ZFG5_TRITR|A0A077ZFG5
MAAESARSVIKRFWSDQLMLGHVLKLSTVGYEQFPCAQVRVRRNEFNAFLNMYFAKPTDFWALTKQLTIGIGDIVLIRKLDTAATPTVLHAVEKVIMQHGFLIDPITKKRVILKLLYIVVLSASRRLLLYRRIGFLRIMFRYLSFHWPFRMFSECPSQVDAADFIKQRAGAVGNLLAVIDNEKLPKGEVCQGPRTFIQRLPRHMRRRAMSHNVKRLPRRHRHRAEGLIEKSTHRSKPFCRRQRRRPSNLLRLYIRRQRKARWLETHIWHAKRFKMIEAWGYKLADKCFQRCWRASFRDSKRHCTIEDISYFICIELAGRQKQLINGLNELCSSEVGLTFAAVSVLRGHREGRVVLYEQGRYPYGCIGPCSFIWEPCDCPEDNIIRKIWIWVHPSIKTKILSSLRSLFHLGEYKSADAIMDTKKVNCLSDFRLLGSTRNCVLAPDGNISLVLLEDAMLRFRLSGPKSSFILRQVLDVREMAILLDKTATADGLPSETLFARWIRDFPASVSPLKAHVDFWLRSASLQPPDCIGQRRILSLLCSDPRIDIAYKKRLPADIELKPVSMSINELPFSPIWQEMYRLDLLRQKLPEKVINEARHRNVIRGTSVELGQVVNLIPLLLVCQSSSEAASCGWDVIAPAGWGMAFWTAIQYATARAVGLQFAGTFQRECGVAPFPDDWADSEAGNIAAKARDDEARAKYLSRPLKMRPSFSKLKIKYPFEFAWSELIDSWKNFDRRNSSPTDDEPYFVLRNKLALKRLSSMVTTEDWMANSLVRVSIESVGRGVPRRHALICLPNDEDLDRIVETKSSGCVERSGSLNGTLESDLSSEDGDTPAEIGVEKQIDFETLFPNPENVLARKKAEKKKLQKKKKQEKKVASSSSDVTSESVVHFGLRPVIGFVLDGGYSLLKGKGIASGLCSCLALNRLFSETKVRAPSGHMVLFRNTTSMYYRAAVLKVQQDD
					

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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	35.5	Very low	41.8	Very low	235 Å²	235	138.6 Å²	138.6	100%	1.158	79%	0.79	S	S	*	*				0	-21.2	0	-70.5	-159.1	-165.2	0	0	112.8
2	A	34.3	Very low	43.3	Very low	97 Å²	97	142.6 Å²	142.6	80%	0.802	78%	0.783	S	S	*	*				5.9	124.6	94.1	0	0	0	0	0	116.6
3	A	37.9	Very low	44.7	Very low	99 Å²	99	135.9 Å²	135.9	82%	0.818	74%	0.741	S	S	*	*	S	Bend	trans	96.9	-10.9	164.1	0	0	0	0	0	121
4	E	39	Very low	45.7	Very low	182 Å²	182	141.2 Å²	141.2	85%	0.85	75%	0.745	S	S	*	*	S	Bend	trans	-99.2	-14.4	-179.2	-77.3	-174.8	148.2	0	0	116	A6	E4-A6 PolarHBondContact O-N 3.34Å
5	S	41	Very low	47.4	Very low	128 Å²	128	136.5 Å²	136.5	90%	0.895	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	2.3	-172.7	56	0	0	0	0	116.1
6	A	38.3	Very low	49.3	Very low	89 Å²	89	131.8 Å²	131.8	74%	0.736	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116	14.8	-175.9	0	0	0	0	0	115.1	E4 S8	E4-A6 PolarHBondContact O-N 3.34Å; A6-S8 PolarHBondContact O-N 2.86Å; A6-S8 VanDerWaalsContact O-N 3.08Å
7	R	36.7	Very low	51.4	Low	226 Å²	226	132.5 Å²	132.5	85%	0.853	70%	0.702	S	S	*	*			trans	-83	74.1	163.7	-74.7	-176.3	179.8	166.8	2.8	108.7	V9	R7-V9 PolarHBondContact O-N 3.34Å
8	S	41.7	Very low	53.5	Low	93 Å²	93	129.4 Å²	129.4	65%	0.65	69%	0.685	S	S	*	*			trans	-53.5	108.9	160.8	61.2	0	0	0	0	106.5	A6 I10	A6-S8 PolarHBondContact O-N 2.86Å; A6-S8 VanDerWaalsContact O-N 3.08Å; S8-I10 PolarHBondContact O-N 2.64Å
9	V	48.7	Very low	55.4	Low	130 Å²	130	123.4 Å²	123.4	79%	0.788	65%	0.653	S	S	*	*			trans	-66.2	84.7	175.7	179	0	0	0	0	106.2	R7 K11	R7-V9 PolarHBondContact O-N 3.34Å; V9-K11 VanDerWaalsContact C-N 3.3Å; V9-K11 PolarHBondContact O-N 3.08Å
10	I	50.9	Low	57.1	Low	89 Å²	89	121.9 Å²	121.9	46%	0.456	64%	0.644	S	S	.	*			trans	-63.6	100.3	172.8	-62	171.5	0	0	0	104.6	S8 R12 F46	S8-I10 PolarHBondContact O-N 2.64Å; I10-R12 PolarHBondContact O-N 3.21Å; I10-R12 VanDerWaalsContact O-N 3.08Å; I10-F46 HydrophobicContact CD1-CE1 4.28Å; I10-F46 HydrophobicContact CG2-CD1 3.89Å; I10-F46 HydrophobicContact CG2-CE1 4.1Å; I10-F46 HydrophobicContact CG2-CG 4.16Å
11	K	55.6	Low	58.8	Low	157 Å²	157	116.1 Å²	116.1	68%	0.683	62%	0.615	S	S	*	*			trans	-51.2	120.3	178.6	-79.1	-177.1	175.2	176.3	0	108	V9 F13	V9-K11 VanDerWaalsContact C-N 3.3Å; V9-K11 PolarHBondContact O-N 3.08Å; K11-F13 PolarHBondContact O-N 3.2Å; K11-F13 VanDerWaalsContact O-N 3.12Å
12	R	60.4	Low	61.5	Low	186 Å²	186	109.5 Å²	109.5	70%	0.702	58%	0.581	S	S	*	*	S	Bend	trans	-54.5	-30.5	179.5	-95.8	-177.2	173.2	159.7	-1.6	112.5	I10 F46	I10-R12 PolarHBondContact O-N 3.21Å; I10-R12 VanDerWaalsContact O-N 3.08Å; R12-F46 PolarHBondContact O-N 3.21Å; R12-F46 VanDerWaalsContact O-N 3.12Å
13	F	60.7	Low	64.3	Low	56 Å²	56	105 Å²	105	25%	0.246	54%	0.543	C	S	.	.	B	Isolated β-bridge	trans	-129.9	141.6	178.3	-58.6	-77.6	0	0	0	110.5	K11 R43 E45	K11-F13 PolarHBondContact O-N 3.2Å; K11-F13 VanDerWaalsContact O-N 3.12Å; F13-R43 HydrophobicContact CD1-CB 3.85Å; F13-R43 HydrophobicContact CE1-CB 4.26Å; F13-E45 HydrophobicContact CD1-CB 4.36Å; F13-E45 HydrophobicContact CE1-CB 3.7Å; F13-E45 HydrophobicContact CE1-CG 3.89Å; F13-E45 HydrophobicContact CZ-CB 4.32Å; F13-E45 HydrophobicContact CZ-CG 4.01Å
14	W	59	Low	66.8	Low	210 Å²	210	103.4 Å²	103.4	80%	0.795	52%	0.521	S	S	*	.	S	Bend	trans	-81.6	119.4	169.8	-109.4	41.1	0	0	0	109.5
15	S	70.6	Confident	69.3	Low	71 Å²	71	100.3 Å²	100.3	50%	0.497	50%	0.504	S	S	.	.			trans	47	131	168.4	-171.7	0	0	0	0	118.5	Q17 R43	S15-Q17 PolarHBondContact OG-N 3.46Å; S15-R43 PolarHBondContact O-NH2 2.98Å
16	D	78.1	Confident	71.6	Confident	60 Å²	60	97.8 Å²	97.8	32%	0.321	48%	0.48	S	S	.	.	S	Bend	trans	-106.5	-2.4	175.3	-66.5	51.9	0	0	0	112.1	R43 K79	D16-R43 IonicContact OD1-CZ 2.78Å; D16-R43 IonicContact OD1-NH1 3.79Å; D16-R43 IonicContact OD1-NH2 3.19Å; D16-R43 PolarHBondContact OD1-NH2 3.39Å; D16-R43 IonicContact OD2-CZ 2.81Å; D16-R43 IonicContact OD2-NH1 3.76Å; D16-R43 PolarHBondContact OD2-NH1 3.1Å; D16-R43 IonicContact OD2-NH2 2.6Å; D16-R43 PolarHBondContact OD2-NH2 2.97Å; D16-K79 HydrophobicContact CB-CD 4.22Å; D16-K79 WeakPolarHBondContact O-CB 3.3Å
17	Q	85.1	Confident	74.1	Confident	145 Å²	145	95.2 Å²	95.2	68%	0.678	46%	0.457	S	S	*	.	S	Bend	trans	-72	-41	-170.1	-77.4	-161.5	-26.8	0	0	113.4	S15 R78 K79	S15-Q17 PolarHBondContact OG-N 3.46Å; Q17-R78 WeakPolarHBondContact O-CA 3.36Å; Q17-K79 PolarHBondContact O-N 2.93Å
18	L	88.8	Confident	76.5	Confident	76 Å²	76	88.5 Å²	88.5	40%	0.398	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	122.1	-177.1	-132.9	93.6	0	0	0	109.6	L76 R78 E93	L18-L76 HydrophobicContact CD2-CD1 4.26Å; L18-L76 HydrophobicContact CD2-CD2 3.67Å; L18-L76 HydrophobicContact CD2-CG 4.14Å; L18-L76 HydrophobicContact CG-CD2 4.27Å; L18-L76 HydrophobicContact CG-CG 4.44Å; L18-R78 HydrophobicContact CD1-CB 4.16Å; L18-R78 HydrophobicContact CD1-CG 4.04Å; L18-R78 VanDerWaalsContact CD1-NH2 3.34Å; L18-E93 WeakPolarHBondContact CD1-OE2 3.49Å
19	M	89.6	Confident	78.1	Confident	16 Å²	16	86 Å²	86	8%	0.079	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	152.5	-176.8	-63.8	-149.4	-67.7	0	0	112.5	V41 R43 F60 L76 I77	M19-V41 HydrophobicContact CB-CG1 3.84Å; M19-V41 HydrophobicContact CB-CG2 4.06Å; M19-V41 HydrophobicContact CE-CB 4.45Å; M19-V41 HydrophobicContact CE-CG1 4.13Å; M19-V41 HydrophobicContact CE-CG2 4.41Å; M19-V41 HydrophobicContact CG-CG1 4.35Å; M19-V41 HydrophobicContact SD-CG1 3.77Å; M19-R43 HydrophobicContact SD-CG 4.02Å; M19-R43 PolarHBondContact SD-NE 3.23Å; M19-F60 HydrophobicContact CE-CD2 3.72Å; M19-F60 HydrophobicContact CE-CE1 4.16Å; M19-F60 HydrophobicContact CE-CE2 3.19Å; M19-F60 HydrophobicContact CE-CG 4.4Å; M19-F60 HydrophobicContact CE-CZ 3.45Å; M19-F60 VanDerWaalsContact CE-CZ 3.45Å; M19-L76 CarbonylContact O-C 3.52Å; M19-L76 WeakPolarHBondContact O-CA 3.35Å; M19-I77 HydrophobicContact CB-CD1 4.4Å; M19-I77 HydrophobicContact CB-CG1 3.97Å; M19-I77 PolarHBondContact N-O 2.8Å; M19-I77 WeakPolarHBondContact O-CG1 3.36Å; M19-I77 PolarHBondContact O-N 2.72Å
20	L	90.9	Very high	79.1	Confident	92 Å²	92	82.1 Å²	82.1	48%	0.482	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	126.8	-175.8	-166.2	148.3	0	0	0	108.8	I74 L76 I96	L20-I74 HydrophobicContact CD2-CG2 3.5Å; L20-I74 HydrophobicContact CG-CG2 4.09Å; L20-L76 HydrophobicContact CB-CD1 4.35Å; L20-L76 HydrophobicContact CD1-CD1 4.16Å; L20-I96 HydrophobicContact CD1-CD1 3.15Å; L20-I96 HydrophobicContact CG-CD1 3.63Å
21	G	91.4	Very high	80.1	Confident	2 Å²	2	89.5 Å²	89.5	2%	0.021	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	174.3	-173.6	0	0	0	0	0	114	R40 I74 V75	G21-R40 CarbonylContact C-O 3.56Å; G21-R40 WeakPolarHBondContact CA-O 3.38Å; G21-I74 WeakPolarHBondContact O-CA 3.41Å; G21-V75 PolarHBondContact N-O 3.49Å; G21-V75 PolarHBondContact O-N 2.88Å
22	H	92.8	Very high	80.9	Confident	96 Å²	96	89.1 Å²	89.1	44%	0.444	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	137.3	-179.8	-61.2	-83.5	0	0	0	110.9	L24 V39 R40 D73	H22-L24 PolarHBondContact O-N 3.33Å; H22-V39 CarbonylContact O-C 3.55Å; H22-V39 WeakPolarHBondContact O-CA 2.97Å; H22-R40 PolarHBondContact N-O 3.19Å; H22-R40 PolarHBondContact O-N 3.4Å; H22-D73 WeakPolarHBondContact CA-O 3.32Å
23	V	92.4	Very high	81.9	Confident	3 Å²	3	86.9 Å²	86.9	2%	0.018	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	119.5	174.1	-176.6	0	0	0	0	109.8	L26 A37 V39 I69 G72 D73 V75	V23-L26 HydrophobicContact CG1-CD2 4.15Å; V23-L26 HydrophobicContact CG1-CG 4.31Å; V23-A37 HydrophobicContact CG1-CB 4.21Å; V23-V39 HydrophobicContact CG2-CG2 4.48Å; V23-I69 HydrophobicContact CB-CG2 4.42Å; V23-I69 HydrophobicContact CG1-CG2 4.3Å; V23-I69 HydrophobicContact CG2-CG2 3.58Å; V23-G72 PolarHBondContact O-N 3.5Å; V23-D73 HydrophobicContact CG2-CB 4.33Å; V23-D73 PolarHBondContact N-O 3.5Å; V23-V75 HydrophobicContact CG2-CB 4.46Å; V23-V75 HydrophobicContact CG2-CG1 4.14Å; V23-V75 HydrophobicContact CG2-CG2 3.47Å; V23-V75 VanDerWaalsContact CG2-CG2 3.47Å
24	L	90.8	Very high	82.8	Confident	65 Å²	65	87.9 Å²	87.9	34%	0.34	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-45.3	176	-72.7	172.2	0	0	0	112.1	H22 Q38 R40	H22-L24 PolarHBondContact O-N 3.33Å; L24-Q38 PolarHBondContact N-O 3.28Å; L24-R40 HydrophobicContact CD1-CB 3.74Å; L24-R40 HydrophobicContact CG-CB 3.99Å
25	K	91.3	Very high	84.2	Confident	117 Å²	117	81 Å²	81	51%	0.509	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	144.1	-171.8	-171.6	177.9	179	-175.5	0	109.7	A37 Q38	K25-A37 CarbonylContact O-C 3.42Å; K25-A37 WeakPolarHBondContact O-CA 3.01Å; K25-Q38 HydrophobicContact CB-CB 4.17Å; K25-Q38 PolarHBondContact O-N 3.17Å
26	L	90.1	Very high	85.2	Confident	75 Å²	75	77.8 Å²	77.8	39%	0.393	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	134.1	169.1	-64.4	163.7	0	0	0	107.8	V23 A37 I69	V23-L26 HydrophobicContact CG1-CD2 4.15Å; V23-L26 HydrophobicContact CG1-CG 4.31Å; L26-A37 HydrophobicContact CD2-CB 3.83Å; L26-I69 WeakPolarHBondContact CD1-O 3.42Å; L26-I69 HydrophobicContact CD2-CG2 4.4Å
27	S	89.5	Confident	85.8	Confident	34 Å²	34	74.9 Å²	74.9	24%	0.238	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	172.1	174.2	60.9	0	0	0	0	110.9	C36 W61	S27-C36 PolarHBondContact N-O 3.04Å; S27-C36 CarbonylContact O-C 3.58Å; S27-C36 PolarHBondContact O-N 3.39Å; S27-C36 PolarHBondContact O-SG 3.13Å; S27-W61 VanDerWaalsContact OG-CH2 3.27Å; S27-W61 WeakPolarHBondContact OG-CH2 3.45Å; S27-W61 WeakPolarHBondContact OG-CZ3 3.15Å
28	T	87.2	Confident	86.3	Confident	85 Å²	85	70.1 Å²	70.1	52%	0.521	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	141.2	170.3	46.6	0	0	0	0	109.3	Q33 F34	T28-Q33 HydrophobicContact CG2-CB 4.47Å; T28-Q33 WeakPolarHBondContact CG2-O 3.31Å; T28-F34 VanDerWaalsContact CA-O 3.28Å; T28-F34 WeakPolarHBondContact CA-O 3.44Å
29	V	75.2	Confident	86.5	Confident	41 Å²	41	66.5 Å²	66.5	25%	0.248	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	136.6	-177	178.6	0	0	0	0	110.1	F34 C36	V29-F34 PolarHBondContact N-O 2.89Å; V29-F34 VanDerWaalsContact N-O 3.08Å; V29-F34 PolarHBondContact O-N 3.48Å; V29-C36 VanDerWaalsContact CB-SG 3.56Å; V29-C36 WeakPolarHBondContact CG2-SG 3.17Å
30	G	71.2	Confident	86.8	Confident	49 Å²	49	70.7 Å²	70.7	51%	0.505	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.3	171.1	179	0	0	0	0	0	114.1	E32 Q33	G30-E32 VanDerWaalsContact C-N 3.28Å; G30-E32 PolarHBondContact O-N 3.04Å; G30-Q33 PolarHBondContact O-N 3.5Å
31	Y	71.4	Confident	86.8	Confident	243 Å²	243	66.5 Å²	66.5	95%	0.953	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-35.2	177.8	-122.9	-89.4	0	0	0	111.9	Q33	Y31-Q33 PolarHBondContact O-N 3.29Å
32	E	72.7	Confident	86.6	Confident	149 Å²	149	76 Å²	76	70%	0.696	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	4.3	178.5	-62.3	-177.2	-169.7	0	0	113.6	G30 F34	G30-E32 VanDerWaalsContact C-N 3.28Å; G30-E32 PolarHBondContact O-N 3.04Å; E32-F34 VanDerWaalsContact C-N 3.34Å; E32-F34 HydrophobicContact CB-CD2 4.08Å; E32-F34 HydrophobicContact CB-CE2 3.66Å; E32-F34 HydrophobicContact CB-CZ 3.95Å; E32-F34 HydrophobicContact CG-CE2 4.34Å; E32-F34 PolarHBondContact O-N 3.28Å; E32-F34 VanDerWaalsContact OE2-CE2 3.3Å; E32-F34 WeakPolarHBondContact OE2-CE2 3.34Å; E32-F34 WeakPolarHBondContact OE2-CZ 3.06Å
33	Q	80.3	Confident	86.3	Confident	139 Å²	139	72.3 Å²	72.3	65%	0.65	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	44.6	177.7	-59.9	-167.8	-1.9	0	0	114.8	T28 G30 Y31	T28-Q33 HydrophobicContact CG2-CB 4.47Å; T28-Q33 WeakPolarHBondContact CG2-O 3.31Å; G30-Q33 PolarHBondContact O-N 3.5Å; Y31-Q33 PolarHBondContact O-N 3.29Å
34	F	81.3	Confident	85.7	Confident	78 Å²	78	76.3 Å²	76.3	34%	0.342	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	126	178.6	-69.5	-68	0	0	0	111.8	T28 V29 E32 C36 L63	T28-F34 VanDerWaalsContact CA-O 3.28Å; T28-F34 WeakPolarHBondContact CA-O 3.44Å; V29-F34 PolarHBondContact N-O 2.89Å; V29-F34 VanDerWaalsContact N-O 3.08Å; V29-F34 PolarHBondContact O-N 3.48Å; E32-F34 VanDerWaalsContact C-N 3.34Å; E32-F34 HydrophobicContact CB-CD2 4.08Å; E32-F34 HydrophobicContact CB-CE2 3.66Å; E32-F34 HydrophobicContact CB-CZ 3.95Å; E32-F34 HydrophobicContact CG-CE2 4.34Å; E32-F34 PolarHBondContact O-N 3.28Å; E32-F34 VanDerWaalsContact OE2-CE2 3.3Å; E32-F34 WeakPolarHBondContact OE2-CE2 3.34Å; E32-F34 WeakPolarHBondContact OE2-CZ 3.06Å; F34-C36 PolarHBondContact O-N 2.74Å; F34-C36 PolarHBondContact O-SG 2.63Å; F34-L63 HydrophobicContact CB-CD2 4.07Å; F34-L63 HydrophobicContact CD1-CD2 4.27Å; F34-L63 HydrophobicContact CG-CD2 4.41Å
35	P	88.3	Confident	85.3	Confident	66 Å²	66	75.7 Å²	75.7	43%	0.429	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	126.2	175.9	28.5	-33.7	0	0	0	109.7	T64	P35-T64 PolarHBondContact O-N 2.89Å; P35-T64 PolarHBondContact O-OG1 3.09Å
36	C	90.8	Very high	84.7	Confident	2 Å²	2	72 Å²	72	1%	0.014	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	149.6	-180	34	0	0	0	0	112.3	S27 V29 F34 A62	S27-C36 PolarHBondContact N-O 3.04Å; S27-C36 CarbonylContact O-C 3.58Å; S27-C36 PolarHBondContact O-N 3.39Å; S27-C36 PolarHBondContact O-SG 3.13Å; V29-C36 VanDerWaalsContact CB-SG 3.56Å; V29-C36 WeakPolarHBondContact CG2-SG 3.17Å; F34-C36 PolarHBondContact O-N 2.74Å; F34-C36 PolarHBondContact O-SG 2.63Å; C36-A62 CarbonylContact C-O 3.5Å; C36-A62 VanDerWaalsContact CA-O 3.22Å; C36-A62 WeakPolarHBondContact CA-O 3.38Å; C36-A62 VanDerWaalsContact CB-O 3.3Å; C36-A62 WeakPolarHBondContact CB-O 3.44Å
37	A	91.6	Very high	84.1	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	133.8	179.1	0	0	0	0	0	109.8	V23 K25 L26 V39 A62 T64	V23-A37 HydrophobicContact CG1-CB 4.21Å; K25-A37 CarbonylContact O-C 3.42Å; K25-A37 WeakPolarHBondContact O-CA 3.01Å; L26-A37 HydrophobicContact CD2-CB 3.83Å; A37-V39 HydrophobicContact CB-CG2 4.09Å; A37-V39 PolarHBondContact O-N 3.15Å; A37-A62 PolarHBondContact N-O 3.19Å; A37-A62 PolarHBondContact O-N 2.9Å; A37-T64 HydrophobicContact CB-CG2 3.72Å
38	Q	94.1	Very high	83.3	Confident	44 Å²	44	72.8 Å²	72.8	21%	0.206	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	112.9	165.1	-166.1	179.6	13.4	0	0	108.4	L24 K25 D59 W61	L24-Q38 PolarHBondContact N-O 3.28Å; K25-Q38 HydrophobicContact CB-CB 4.17Å; K25-Q38 PolarHBondContact O-N 3.17Å; Q38-D59 HydrophobicContact CG-CB 4.41Å; Q38-W61 HydrophobicContact CB-CD2 4.33Å; Q38-W61 HydrophobicContact CB-CE3 4.03Å; Q38-W61 HydrophobicContact CB-CH2 3.88Å; Q38-W61 HydrophobicContact CB-CZ2 4.19Å; Q38-W61 HydrophobicContact CB-CZ3 3.77Å; Q38-W61 HydrophobicContact CG-CD2 4.44Å; Q38-W61 HydrophobicContact CG-CH2 4.37Å; Q38-W61 HydrophobicContact CG-CZ2 4.17Å
39	V	94.1	Very high	82.6	Confident	0 Å²	0	78.2 Å²	78.2	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	123.2	-174.9	-177.6	0	0	0	0	110.1	H22 V23 A37 V41 D59 F60 A62 V75 I77	H22-V39 CarbonylContact O-C 3.55Å; H22-V39 WeakPolarHBondContact O-CA 2.97Å; V23-V39 HydrophobicContact CG2-CG2 4.48Å; A37-V39 HydrophobicContact CB-CG2 4.09Å; A37-V39 PolarHBondContact O-N 3.15Å; V39-V41 HydrophobicContact CG1-CG2 4.29Å; V39-D59 WeakPolarHBondContact O-CA 3.49Å; V39-F60 PolarHBondContact N-O 3.12Å; V39-F60 PolarHBondContact O-N 3.31Å; V39-A62 HydrophobicContact CG2-CB 4.28Å; V39-V75 HydrophobicContact CG1-CG2 3.81Å; V39-V75 HydrophobicContact CG2-CG2 3.82Å; V39-I77 HydrophobicContact CB-CD1 4.3Å; V39-I77 HydrophobicContact CB-CG2 4.33Å; V39-I77 HydrophobicContact CG1-CD1 4.19Å; V39-I77 HydrophobicContact CG1-CG2 4.24Å; V39-I77 HydrophobicContact CG2-CG2 4.02Å
40	R	94.4	Very high	82.6	Confident	104 Å²	104	81.3 Å²	81.3	39%	0.392	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	114.3	174.5	179.6	163.3	-73.2	164.9	5.9	110.8	G21 H22 L24 P57 D59	G21-R40 CarbonylContact C-O 3.56Å; G21-R40 WeakPolarHBondContact CA-O 3.38Å; H22-R40 PolarHBondContact N-O 3.19Å; H22-R40 PolarHBondContact O-N 3.4Å; L24-R40 HydrophobicContact CD1-CB 3.74Å; L24-R40 HydrophobicContact CG-CB 3.99Å; R40-P57 HydrophobicContact CG-CB 3.97Å; R40-D59 VanDerWaalsContact CB-OD1 3.31Å; R40-D59 WeakPolarHBondContact CB-OD1 3.49Å; R40-D59 VanDerWaalsContact CG-OD1 3.29Å; R40-D59 WeakPolarHBondContact CG-OD1 3.49Å; R40-D59 IonicContact CZ-OD1 2.62Å; R40-D59 IonicContact CZ-OD2 2.66Å; R40-D59 IonicContact NE-OD1 3.15Å; R40-D59 PolarHBondContact NE-OD1 3.19Å; R40-D59 IonicContact NE-OD2 2.67Å; R40-D59 IonicContact NH2-OD1 3.82Å; R40-D59 PolarHBondContact NH2-OD1 3.38Å; R40-D59 IonicContact NH2-OD2 2.85Å; R40-D59 PolarHBondContact NH2-OD2 2.68Å
41	V	92.5	Very high	82.9	Confident	4 Å²	4	84.9 Å²	84.9	2%	0.024	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	142	177.2	176.7	0	0	0	0	109.7	M19 V39 R43 P57 T58 F60 I77	M19-V41 HydrophobicContact CB-CG1 3.84Å; M19-V41 HydrophobicContact CB-CG2 4.06Å; M19-V41 HydrophobicContact CE-CB 4.45Å; M19-V41 HydrophobicContact CE-CG1 4.13Å; M19-V41 HydrophobicContact CE-CG2 4.41Å; M19-V41 HydrophobicContact CG-CG1 4.35Å; M19-V41 HydrophobicContact SD-CG1 3.77Å; V39-V41 HydrophobicContact CG1-CG2 4.29Å; V41-R43 HydrophobicContact CG1-CG 4.01Å; V41-P57 CarbonylContact O-C 3.49Å; V41-P57 WeakPolarHBondContact O-CA 3.44Å; V41-T58 PolarHBondContact N-O 3.38Å; V41-T58 PolarHBondContact O-N 2.88Å; V41-T58 PolarHBondContact O-OG1 3.06Å; V41-F60 HydrophobicContact CB-CD2 4.21Å; V41-F60 HydrophobicContact CB-CE2 4.33Å; V41-F60 HydrophobicContact CG2-CD2 4.03Å; V41-I77 HydrophobicContact CG2-CD1 3.61Å; V41-I77 HydrophobicContact CG2-CG1 4.27Å
42	R	87.5	Confident	83	Confident	201 Å²	201	78.3 Å²	78.3	76%	0.758	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	112	167.9	-72.5	-166.5	175.1	174.4	1.2	110.2
43	R	85.4	Confident	83.2	Confident	19 Å²	19	75.5 Å²	75.5	7%	0.072	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	142.8	175.9	-57.3	-170.9	88.3	172	6.6	110.4	F13 S15 D16 M19 V41 E45 A55 K56 T58	F13-R43 HydrophobicContact CD1-CB 3.85Å; F13-R43 HydrophobicContact CE1-CB 4.26Å; S15-R43 PolarHBondContact O-NH2 2.98Å; D16-R43 IonicContact OD1-CZ 2.78Å; D16-R43 IonicContact OD1-NH1 3.79Å; D16-R43 IonicContact OD1-NH2 3.19Å; D16-R43 PolarHBondContact OD1-NH2 3.39Å; D16-R43 IonicContact OD2-CZ 2.81Å; D16-R43 IonicContact OD2-NH1 3.76Å; D16-R43 PolarHBondContact OD2-NH1 3.1Å; D16-R43 IonicContact OD2-NH2 2.6Å; D16-R43 PolarHBondContact OD2-NH2 2.97Å; M19-R43 HydrophobicContact SD-CG 4.02Å; M19-R43 PolarHBondContact SD-NE 3.23Å; V41-R43 HydrophobicContact CG1-CG 4.01Å; R43-E45 PolarHBondContact O-N 3.36Å; R43-A55 CarbonylContact O-C 3.57Å; R43-A55 WeakPolarHBondContact O-CA 3.24Å; R43-K56 PolarHBondContact N-O 3.29Å; R43-K56 PolarHBondContact O-N 3.14Å; R43-T58 WeakPolarHBondContact CD-OG1 3.44Å; R43-T58 VanDerWaalsContact CG-OG1 3.25Å; R43-T58 WeakPolarHBondContact CG-OG1 3.13Å
44	N	80.8	Confident	83.2	Confident	87 Å²	87	72.9 Å²	72.9	47%	0.465	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	109.9	172.8	-78	-16.2	0	0	0	108.9	Y53 F54	N44-Y53 HydrophobicContact CB-CD1 3.96Å; N44-Y53 HydrophobicContact CB-CG 4.34Å; N44-F54 CarbonylContact C-O 3.48Å; N44-F54 WeakPolarHBondContact CA-O 3.45Å
45	E	81.7	Confident	83.2	Confident	53 Å²	53	72.2 Å²	72.2	25%	0.248	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	125.6	174.3	-172.1	172.9	-160.2	0	0	109.6	F13 R43 N47 Y53 F54 K56	F13-E45 HydrophobicContact CD1-CB 4.36Å; F13-E45 HydrophobicContact CE1-CB 3.7Å; F13-E45 HydrophobicContact CE1-CG 3.89Å; F13-E45 HydrophobicContact CZ-CB 4.32Å; F13-E45 HydrophobicContact CZ-CG 4.01Å; R43-E45 PolarHBondContact O-N 3.36Å; E45-N47 PolarHBondContact O-N 3.18Å; E45-Y53 CarbonylContact O-C 3.59Å; E45-Y53 WeakPolarHBondContact O-CA 3.39Å; E45-F54 PolarHBondContact N-O 3.26Å; E45-F54 PolarHBondContact O-N 3.38Å; E45-K56 HydrophobicContact CB-CB 4.46Å; E45-K56 IonicContact OE1-NZ 3.39Å; E45-K56 WeakPolarHBondContact OE2-CD 3.4Å; E45-K56 WeakPolarHBondContact OE2-CE 3.18Å; E45-K56 IonicContact OE2-NZ 3.42Å; E45-K56 PolarHBondContact OE2-NZ 2.9Å
46	F	78.5	Confident	83	Confident	38 Å²	38	73.5 Å²	73.5	17%	0.167	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	123.5	175.2	-172.1	-112	0	0	0	111.1	I10 R12 A48 N51 Y53	I10-F46 HydrophobicContact CD1-CE1 4.28Å; I10-F46 HydrophobicContact CG2-CD1 3.89Å; I10-F46 HydrophobicContact CG2-CE1 4.1Å; I10-F46 HydrophobicContact CG2-CG 4.16Å; R12-F46 PolarHBondContact O-N 3.21Å; R12-F46 VanDerWaalsContact O-N 3.12Å; F46-A48 HydrophobicContact CD1-CB 4.45Å; F46-A48 HydrophobicContact CE1-CB 4.22Å; F46-N51 HydrophobicContact CZ-CB 4.26Å; F46-N51 WeakPolarHBondContact CZ-OD1 3.48Å; F46-Y53 HydrophobicContact CB-CD1 3.84Å; F46-Y53 HydrophobicContact CB-CE1 3.49Å; F46-Y53 VanDerWaalsContact CB-CE1 3.49Å; F46-Y53 HydrophobicContact CD2-CD1 4.29Å; F46-Y53 AromaticContact CD2-CD2 3.84Å; F46-Y53 HydrophobicContact CD2-CD2 3.84Å; F46-Y53 HydrophobicContact CD2-CE1 4.08Å; F46-Y53 AromaticContact CD2-CE2 3.58Å; F46-Y53 HydrophobicContact CD2-CE2 3.58Å; F46-Y53 HydrophobicContact CD2-CG 4.18Å; F46-Y53 AromaticContact CD2-CZ 3.69Å; F46-Y53 HydrophobicContact CE2-CE2 4.23Å; F46-Y53 HydrophobicContact CG-CE1 4.21Å; F46-Y53 HydrophobicContact CG-CE2 4.43Å
47	N	76.6	Confident	83	Confident	58 Å²	58	76.8 Å²	76.8	31%	0.31	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	105.4	170	-171.8	-30.6	0	0	0	110.1	E45 F49 L50 N51 M52 F54	E45-N47 PolarHBondContact O-N 3.18Å; N47-F49 PolarHBondContact O-N 3.09Å; N47-F49 PolarHBondContact OD1-N 3.04Å; N47-F49 VanDerWaalsContact OD1-N 3.08Å; N47-L50 HydrophobicContact CB-CB 4.44Å; N47-L50 PolarHBondContact O-N 3.43Å; N47-N51 PolarHBondContact O-N 2.84Å; N47-M52 PolarHBondContact N-O 2.96Å; N47-F54 HydrophobicContact CB-CD2 3.68Å; N47-F54 HydrophobicContact CB-CE2 3.62Å
48	A	74.4	Confident	82.9	Confident	68 Å²	68	78.4 Å²	78.4	56%	0.562	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-25.3	-177.4	0	0	0	0	0	114.3	F46 L50 N51	F46-A48 HydrophobicContact CD1-CB 4.45Å; F46-A48 HydrophobicContact CE1-CB 4.22Å; A48-L50 VanDerWaalsContact C-N 3.34Å; A48-N51 PolarHBondContact O-OD1 3.12Å
49	F	72.6	Confident	82.9	Confident	199 Å²	199	79.2 Å²	79.2	87%	0.873	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-22.8	178.2	-67.2	-78.8	0	0	0	113.2	N47	N47-F49 PolarHBondContact O-N 3.09Å; N47-F49 PolarHBondContact OD1-N 3.04Å; N47-F49 VanDerWaalsContact OD1-N 3.08Å
50	L	73.7	Confident	82.8	Confident	106 Å²	106	80.8 Å²	80.8	56%	0.555	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.1	-6.1	-177.7	-63.6	175.5	0	0	0	112.4	N47 A48 M52 F54	N47-L50 HydrophobicContact CB-CB 4.44Å; N47-L50 PolarHBondContact O-N 3.43Å; A48-L50 VanDerWaalsContact C-N 3.34Å; L50-M52 HydrophobicContact CB-CB 4.34Å; L50-M52 PolarHBondContact O-N 3.36Å; L50-F54 HydrophobicContact CB-CE2 4.22Å; L50-F54 HydrophobicContact CB-CZ 4.46Å; L50-F54 HydrophobicContact CD1-CE2 3.74Å; L50-F54 HydrophobicContact CD1-CZ 3.52Å
51	N	77.6	Confident	82.7	Confident	124 Å²	124	79.1 Å²	79.1	66%	0.663	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.4	43.6	-171	-76.9	-14.8	0	0	0	112.4	F46 N47 A48	F46-N51 HydrophobicContact CZ-CB 4.26Å; F46-N51 WeakPolarHBondContact CZ-OD1 3.48Å; N47-N51 PolarHBondContact O-N 2.84Å; A48-N51 PolarHBondContact O-OD1 3.12Å
52	M	73.6	Confident	82.7	Confident	105 Å²	105	79 Å²	79	52%	0.517	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	142.8	-175.5	-113.3	176.8	46.1	0	0	110.2	N47 L50 F54	N47-M52 PolarHBondContact N-O 2.96Å; L50-M52 HydrophobicContact CB-CB 4.34Å; L50-M52 PolarHBondContact O-N 3.36Å; M52-F54 HydrophobicContact CB-CE2 3.97Å; M52-F54 HydrophobicContact CB-CZ 4.26Å; M52-F54 HydrophobicContact CE-CE1 3.84Å; M52-F54 HydrophobicContact CE-CE2 4.3Å; M52-F54 HydrophobicContact CE-CZ 3.56Å; M52-F54 WeakPolarHBondContact O-CD2 3.35Å; M52-F54 WeakPolarHBondContact O-CE2 3.32Å
53	Y	76.9	Confident	82.9	Confident	90 Å²	90	70.7 Å²	70.7	35%	0.353	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	137.9	172.9	-75.2	-86.7	0	0	0	111.2	N44 E45 F46	N44-Y53 HydrophobicContact CB-CD1 3.96Å; N44-Y53 HydrophobicContact CB-CG 4.34Å; E45-Y53 CarbonylContact O-C 3.59Å; E45-Y53 WeakPolarHBondContact O-CA 3.39Å; F46-Y53 HydrophobicContact CB-CD1 3.84Å; F46-Y53 HydrophobicContact CB-CE1 3.49Å; F46-Y53 VanDerWaalsContact CB-CE1 3.49Å; F46-Y53 HydrophobicContact CD2-CD1 4.29Å; F46-Y53 AromaticContact CD2-CD2 3.84Å; F46-Y53 HydrophobicContact CD2-CD2 3.84Å; F46-Y53 HydrophobicContact CD2-CE1 4.08Å; F46-Y53 AromaticContact CD2-CE2 3.58Å; F46-Y53 HydrophobicContact CD2-CE2 3.58Å; F46-Y53 HydrophobicContact CD2-CG 4.18Å; F46-Y53 AromaticContact CD2-CZ 3.69Å; F46-Y53 HydrophobicContact CE2-CE2 4.23Å; F46-Y53 HydrophobicContact CG-CE1 4.21Å; F46-Y53 HydrophobicContact CG-CE2 4.43Å
54	F	80.1	Confident	82.9	Confident	84 Å²	84	70.4 Å²	70.4	37%	0.368	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	135.4	175.5	-65.9	-88.6	0	0	0	110.2	N44 E45 N47 L50 M52 K56	N44-F54 CarbonylContact C-O 3.48Å; N44-F54 WeakPolarHBondContact CA-O 3.45Å; E45-F54 PolarHBondContact N-O 3.26Å; E45-F54 PolarHBondContact O-N 3.38Å; N47-F54 HydrophobicContact CB-CD2 3.68Å; N47-F54 HydrophobicContact CB-CE2 3.62Å; L50-F54 HydrophobicContact CB-CE2 4.22Å; L50-F54 HydrophobicContact CB-CZ 4.46Å; L50-F54 HydrophobicContact CD1-CE2 3.74Å; L50-F54 HydrophobicContact CD1-CZ 3.52Å; M52-F54 HydrophobicContact CB-CE2 3.97Å; M52-F54 HydrophobicContact CB-CZ 4.26Å; M52-F54 HydrophobicContact CE-CE1 3.84Å; M52-F54 HydrophobicContact CE-CE2 4.3Å; M52-F54 HydrophobicContact CE-CZ 3.56Å; M52-F54 WeakPolarHBondContact O-CD2 3.35Å; M52-F54 WeakPolarHBondContact O-CE2 3.32Å; F54-K56 PolarHBondContact O-N 3.2Å
55	A	82.6	Confident	82.4	Confident	64 Å²	64	74 Å²	74	53%	0.529	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	117.1	175.5	0	0	0	0	0	110.3	R43	R43-A55 CarbonylContact O-C 3.57Å; R43-A55 WeakPolarHBondContact O-CA 3.24Å
56	K	83.5	Confident	81.7	Confident	93 Å²	93	81.4 Å²	81.4	40%	0.404	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	129.5	174.8	-175.7	170.8	172.1	179.5	0	109.8	R43 E45 F54	R43-K56 PolarHBondContact N-O 3.29Å; R43-K56 PolarHBondContact O-N 3.14Å; E45-K56 HydrophobicContact CB-CB 4.46Å; E45-K56 IonicContact OE1-NZ 3.39Å; E45-K56 WeakPolarHBondContact OE2-CD 3.4Å; E45-K56 WeakPolarHBondContact OE2-CE 3.18Å; E45-K56 IonicContact OE2-NZ 3.42Å; E45-K56 PolarHBondContact OE2-NZ 2.9Å; F54-K56 PolarHBondContact O-N 3.2Å
57	P	90.1	Very high	81.1	Confident	72 Å²	72	83.2 Å²	83.2	47%	0.468	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	133.6	173.4	28.7	-31.4	0	0	0	110.4	R40 V41	R40-P57 HydrophobicContact CG-CB 3.97Å; V41-P57 CarbonylContact O-C 3.49Å; V41-P57 WeakPolarHBondContact O-CA 3.44Å
58	T	90.1	Very high	81.1	Confident	34 Å²	34	86.5 Å²	86.5	21%	0.209	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	136.3	174.3	45.6	0	0	0	0	109	V41 R43 F60	V41-T58 PolarHBondContact N-O 3.38Å; V41-T58 PolarHBondContact O-N 2.88Å; V41-T58 PolarHBondContact O-OG1 3.06Å; R43-T58 WeakPolarHBondContact CD-OG1 3.44Å; R43-T58 VanDerWaalsContact CG-OG1 3.25Å; R43-T58 WeakPolarHBondContact CG-OG1 3.13Å; T58-F60 WeakPolarHBondContact OG1-CE2 3.27Å
59	D	93.7	Very high	81.4	Confident	61 Å²	61	84.1 Å²	84.1	33%	0.326	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	130.5	-174.9	-60.3	-16.8	0	0	0	109.6	Q38 V39 R40	Q38-D59 HydrophobicContact CG-CB 4.41Å; V39-D59 WeakPolarHBondContact O-CA 3.49Å; R40-D59 VanDerWaalsContact CB-OD1 3.31Å; R40-D59 WeakPolarHBondContact CB-OD1 3.49Å; R40-D59 VanDerWaalsContact CG-OD1 3.29Å; R40-D59 WeakPolarHBondContact CG-OD1 3.49Å; R40-D59 IonicContact CZ-OD1 2.62Å; R40-D59 IonicContact CZ-OD2 2.66Å; R40-D59 IonicContact NE-OD1 3.15Å; R40-D59 PolarHBondContact NE-OD1 3.19Å; R40-D59 IonicContact NE-OD2 2.67Å; R40-D59 IonicContact NH2-OD1 3.82Å; R40-D59 PolarHBondContact NH2-OD1 3.38Å; R40-D59 IonicContact NH2-OD2 2.85Å; R40-D59 PolarHBondContact NH2-OD2 2.68Å
60	F	92.1	Very high	82	Confident	33 Å²	33	76 Å²	76	15%	0.145	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	144.7	176.7	-68.9	-84.6	0	0	0	110.1	M19 V39 V41 T58 I77 H90	M19-F60 HydrophobicContact CE-CD2 3.72Å; M19-F60 HydrophobicContact CE-CE1 4.16Å; M19-F60 HydrophobicContact CE-CE2 3.19Å; M19-F60 HydrophobicContact CE-CG 4.4Å; M19-F60 HydrophobicContact CE-CZ 3.45Å; M19-F60 VanDerWaalsContact CE-CZ 3.45Å; V39-F60 PolarHBondContact N-O 3.12Å; V39-F60 PolarHBondContact O-N 3.31Å; V41-F60 HydrophobicContact CB-CD2 4.21Å; V41-F60 HydrophobicContact CB-CE2 4.33Å; V41-F60 HydrophobicContact CG2-CD2 4.03Å; T58-F60 WeakPolarHBondContact OG1-CE2 3.27Å; F60-I77 HydrophobicContact CB-CD1 3.96Å; F60-I77 HydrophobicContact CD2-CD1 4.4Å; F60-I77 HydrophobicContact CG-CD1 4.37Å; F60-H90 AromaticContact CD1-CE1 3.31Å; F60-H90 WeakPolarHBondContact CD1-CE1 3.36Å; F60-H90 AromaticContact CD1-ND1 3.66Å; F60-H90 AromaticContact CE1-CE1 3.7Å
61	W	92.8	Very high	82.7	Confident	69 Å²	69	76.6 Å²	76.6	26%	0.261	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	126.4	167.5	-71.2	100.1	0	0	0	109.6	S27 Q38 V88	S27-W61 VanDerWaalsContact OG-CH2 3.27Å; S27-W61 WeakPolarHBondContact OG-CH2 3.45Å; S27-W61 WeakPolarHBondContact OG-CZ3 3.15Å; Q38-W61 HydrophobicContact CB-CD2 4.33Å; Q38-W61 HydrophobicContact CB-CE3 4.03Å; Q38-W61 HydrophobicContact CB-CH2 3.88Å; Q38-W61 HydrophobicContact CB-CZ2 4.19Å; Q38-W61 HydrophobicContact CB-CZ3 3.77Å; Q38-W61 HydrophobicContact CG-CD2 4.44Å; Q38-W61 HydrophobicContact CG-CH2 4.37Å; Q38-W61 HydrophobicContact CG-CZ2 4.17Å; W61-V88 HydrophobicContact CB-CG2 4.02Å
62	A	92.2	Very high	83.1	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	132.5	-179.3	0	0	0	0	0	111.5	C36 A37 V39 I77 H90 V92	C36-A62 CarbonylContact C-O 3.5Å; C36-A62 VanDerWaalsContact CA-O 3.22Å; C36-A62 WeakPolarHBondContact CA-O 3.38Å; C36-A62 VanDerWaalsContact CB-O 3.3Å; C36-A62 WeakPolarHBondContact CB-O 3.44Å; A37-A62 PolarHBondContact N-O 3.19Å; A37-A62 PolarHBondContact O-N 2.9Å; V39-A62 HydrophobicContact CG2-CB 4.28Å; A62-I77 HydrophobicContact CB-CB 4.41Å; A62-I77 HydrophobicContact CB-CG2 3.63Å; A62-H90 CarbonylContact C-O 2.85Å; A62-H90 VanDerWaalsContact CA-O 3.23Å; A62-H90 WeakPolarHBondContact CA-O 3.37Å; A62-H90 HydrophobicContact CB-CB 4.17Å; A62-V92 HydrophobicContact CB-CG2 3.82Å
63	L	91.4	Very high	83.8	Confident	27 Å²	27	67.1 Å²	67.1	14%	0.141	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	134.5	172.9	-111.8	150.5	0	0	0	110.8	F34 L80 A84 V88 H90 A91 V92	F34-L63 HydrophobicContact CB-CD2 4.07Å; F34-L63 HydrophobicContact CD1-CD2 4.27Å; F34-L63 HydrophobicContact CG-CD2 4.41Å; L63-L80 HydrophobicContact CD1-CD1 4.37Å; L63-A84 HydrophobicContact CD1-CB 3.33Å; L63-V88 HydrophobicContact CB-CG1 4.29Å; L63-V88 HydrophobicContact CD1-CG1 4.07Å; L63-V88 HydrophobicContact CG-CG1 4.08Å; L63-H90 PolarHBondContact N-O 3.47Å; L63-A91 HydrophobicContact CB-CB 4.29Å; L63-A91 WeakPolarHBondContact O-CA 3.43Å; L63-V92 PolarHBondContact O-N 3.33Å
64	T	85.4	Confident	84.4	Confident	14 Å²	14	64.6 Å²	64.6	9%	0.086	35%	0.345	C	S	.	.			trans	-110	100.9	179.8	42.9	0	0	0	0	110.2	P35 A37 I69 V92	P35-T64 PolarHBondContact O-N 2.89Å; P35-T64 PolarHBondContact O-OG1 3.09Å; A37-T64 HydrophobicContact CB-CG2 3.72Å; T64-I69 HydrophobicContact CG2-CD1 3.27Å; T64-V92 HydrophobicContact CG2-CB 4.31Å; T64-V92 HydrophobicContact CG2-CG2 3.72Å
65	K	70.7	Confident	85	Confident	162 Å²	162	60.6 Å²	60.6	70%	0.704	33%	0.327	S	S	*	.			trans	-82.9	113.3	173.5	-70.3	-174.2	176.9	-175.7	0	109.6	L67	K65-L67 WeakPolarHBondContact O-CG 3.31Å; K65-L67 PolarHBondContact O-N 3.5Å
66	Q	67.8	Low	85.4	Confident	208 Å²	208	59.2 Å²	59.2	97%	0.972	31%	0.311	S	S	*	.	S	Bend	trans	48.1	-0.2	166	-68.8	168.1	-14.7	0	0	119.2
67	L	64.9	Low	85.8	Confident	77 Å²	77	54.8 Å²	54.8	40%	0.403	29%	0.292	S	S	.	.			trans	-83.7	125.1	179.4	-71.9	163.8	0	0	0	109.5	K65 I69 V92	K65-L67 WeakPolarHBondContact O-CG 3.31Å; K65-L67 PolarHBondContact O-N 3.5Å; L67-I69 HydrophobicContact CB-CD1 3.87Å; L67-I69 HydrophobicContact CB-CG1 3.89Å; L67-I69 WeakPolarHBondContact O-CG1 3.34Å; L67-I69 PolarHBondContact O-N 2.91Å; L67-V92 HydrophobicContact CD1-CG1 4.42Å
68	T	76.9	Confident	85.9	Confident	126 Å²	126	57 Å²	57	77%	0.773	29%	0.29	S	S	*	.			trans	-66.3	96.2	168.8	49.8	0	0	0	0	108.9
69	I	81.4	Confident	86	Confident	18 Å²	18	60.2 Å²	60.2	9%	0.092	30%	0.301	C	S	.	.			trans	-107.1	127.7	-177.7	-65.2	158.6	0	0	0	108.2	V23 L26 T64 L67 V75 V92 V95	V23-I69 HydrophobicContact CB-CG2 4.42Å; V23-I69 HydrophobicContact CG1-CG2 4.3Å; V23-I69 HydrophobicContact CG2-CG2 3.58Å; L26-I69 WeakPolarHBondContact CD1-O 3.42Å; L26-I69 HydrophobicContact CD2-CG2 4.4Å; T64-I69 HydrophobicContact CG2-CD1 3.27Å; L67-I69 HydrophobicContact CB-CD1 3.87Å; L67-I69 HydrophobicContact CB-CG1 3.89Å; L67-I69 WeakPolarHBondContact O-CG1 3.34Å; L67-I69 PolarHBondContact O-N 2.91Å; I69-V75 HydrophobicContact CG2-CG1 4.35Å; I69-V92 HydrophobicContact CD1-CB 4.27Å; I69-V92 HydrophobicContact CD1-CG1 3.9Å; I69-V92 HydrophobicContact CD1-CG2 4.31Å; I69-V95 HydrophobicContact CG1-CG2 3.71Å
70	G	85.4	Confident	85.7	Confident	30 Å²	30	59.9 Å²	59.9	31%	0.309	30%	0.3	S	S	.	.			trans	-96.2	159	176.4	0	0	0	0	0	113.2	G72 D73	G70-G72 PolarHBondContact O-N 3.41Å; G70-D73 PolarHBondContact N-OD2 3.24Å; G70-D73 WeakPolarHBondContact O-CB 3.43Å; G70-D73 PolarHBondContact O-N 3.13Å
71	I	87.9	Confident	85.4	Confident	118 Å²	118	66.6 Å²	66.6	61%	0.605	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	128.3	169.8	-61.4	171.1	0	0	0	108.4
72	G	85.8	Confident	84.9	Confident	19 Å²	19	69 Å²	69	20%	0.196	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.7	-4.7	-178.8	0	0	0	0	0	115.6	V23 G70 H99	V23-G72 PolarHBondContact O-N 3.5Å; G70-G72 PolarHBondContact O-N 3.41Å; G72-H99 PolarHBondContact O-ND1 3.03Å
73	D	88.4	Confident	84.3	Confident	10 Å²	10	71.5 Å²	71.5	5%	0.053	38%	0.38	C	S	.	.			trans	-64.9	147.1	175.4	-73.4	-3.2	0	0	0	111.5	H22 V23 G70 V95 Q98 H99	H22-D73 WeakPolarHBondContact CA-O 3.32Å; V23-D73 HydrophobicContact CG2-CB 4.33Å; V23-D73 PolarHBondContact N-O 3.5Å; G70-D73 PolarHBondContact N-OD2 3.24Å; G70-D73 WeakPolarHBondContact O-CB 3.43Å; G70-D73 PolarHBondContact O-N 3.13Å; D73-V95 HydrophobicContact CB-CG1 4.31Å; D73-Q98 WeakPolarHBondContact OD1-CA 3.39Å; D73-H99 WeakPolarHBondContact OD1-CB 3.36Å; D73-H99 PolarHBondContact OD1-N 3.35Å
74	I	89.8	Confident	83.6	Confident	38 Å²	38	72.6 Å²	72.6	20%	0.195	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	117.1	171.4	-49.8	-172.1	0	0	0	108.2	L20 G21 I96 M97	L20-I74 HydrophobicContact CD2-CG2 3.5Å; L20-I74 HydrophobicContact CG-CG2 4.09Å; G21-I74 WeakPolarHBondContact O-CA 3.41Å; I74-I96 HydrophobicContact CG2-CB 4.4Å; I74-I96 PolarHBondContact O-N 3.48Å; I74-M97 HydrophobicContact CB-CB 3.94Å; I74-M97 HydrophobicContact CD1-CB 4.05Å; I74-M97 HydrophobicContact CD1-SD 4.04Å; I74-M97 HydrophobicContact CG1-CB 4.05Å; I74-M97 PolarHBondContact N-O 2.96Å; I74-M97 PolarHBondContact O-N 3.44Å
75	V	91.6	Very high	83.4	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	143.5	-176.4	-83.5	0	0	0	0	111.2	G21 V23 V39 I69 V92 V95	G21-V75 PolarHBondContact N-O 3.49Å; G21-V75 PolarHBondContact O-N 2.88Å; V23-V75 HydrophobicContact CG2-CB 4.46Å; V23-V75 HydrophobicContact CG2-CG1 4.14Å; V23-V75 HydrophobicContact CG2-CG2 3.47Å; V23-V75 VanDerWaalsContact CG2-CG2 3.47Å; V39-V75 HydrophobicContact CG1-CG2 3.81Å; V39-V75 HydrophobicContact CG2-CG2 3.82Å; I69-V75 HydrophobicContact CG2-CG1 4.35Å; V75-V92 HydrophobicContact CB-CG1 4.03Å; V75-V92 HydrophobicContact CG1-CG1 3.77Å; V75-V95 HydrophobicContact CG1-CB 4.36Å; V75-V95 HydrophobicContact CG1-CG2 3.9Å
76	L	91.5	Very high	83.9	Confident	35 Å²	35	71.8 Å²	71.8	18%	0.183	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	124.1	167	-155.1	81.1	0	0	0	108.4	L18 M19 L20 E93 K94 I96	L18-L76 HydrophobicContact CD2-CD1 4.26Å; L18-L76 HydrophobicContact CD2-CD2 3.67Å; L18-L76 HydrophobicContact CD2-CG 4.14Å; L18-L76 HydrophobicContact CG-CD2 4.27Å; L18-L76 HydrophobicContact CG-CG 4.44Å; M19-L76 CarbonylContact O-C 3.52Å; M19-L76 WeakPolarHBondContact O-CA 3.35Å; L20-L76 HydrophobicContact CB-CD1 4.35Å; L20-L76 HydrophobicContact CD1-CD1 4.16Å; L76-E93 PolarHBondContact O-N 3.15Å; L76-K94 PolarHBondContact N-O 3.38Å; L76-I96 HydrophobicContact CB-CD1 3.99Å; L76-I96 HydrophobicContact CB-CG1 4.2Å; L76-I96 HydrophobicContact CD1-CD1 3.77Å; L76-I96 HydrophobicContact CG-CD1 4.5Å
77	I	92.3	Very high	84.7	Confident	0 Å²	0	66 Å²	66	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	135.3	176.4	56.3	171	0	0	0	110.3	M19 V39 V41 F60 A62 H90 A91 V92	M19-I77 HydrophobicContact CB-CD1 4.4Å; M19-I77 HydrophobicContact CB-CG1 3.97Å; M19-I77 PolarHBondContact N-O 2.8Å; M19-I77 WeakPolarHBondContact O-CG1 3.36Å; M19-I77 PolarHBondContact O-N 2.72Å; V39-I77 HydrophobicContact CB-CD1 4.3Å; V39-I77 HydrophobicContact CB-CG2 4.33Å; V39-I77 HydrophobicContact CG1-CD1 4.19Å; V39-I77 HydrophobicContact CG1-CG2 4.24Å; V39-I77 HydrophobicContact CG2-CG2 4.02Å; V41-I77 HydrophobicContact CG2-CD1 3.61Å; V41-I77 HydrophobicContact CG2-CG1 4.27Å; F60-I77 HydrophobicContact CB-CD1 3.96Å; F60-I77 HydrophobicContact CD2-CD1 4.4Å; F60-I77 HydrophobicContact CG-CD1 4.37Å; A62-I77 HydrophobicContact CB-CB 4.41Å; A62-I77 HydrophobicContact CB-CG2 3.63Å; I77-H90 HydrophobicContact CB-CB 4.4Å; I77-A91 WeakPolarHBondContact CA-O 3.39Å; I77-V92 HydrophobicContact CG2-CG2 4.02Å
78	R	92.1	Very high	85.7	Confident	118 Å²	118	62.6 Å²	62.6	45%	0.445	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	141.3	178.2	179.5	179.1	-67.1	-110.6	9.4	109.8	Q17 L18 H90 A91 E93	Q17-R78 WeakPolarHBondContact O-CA 3.36Å; L18-R78 HydrophobicContact CD1-CB 4.16Å; L18-R78 HydrophobicContact CD1-CG 4.04Å; L18-R78 VanDerWaalsContact CD1-NH2 3.34Å; R78-H90 CarbonylContact O-C 3.59Å; R78-H90 WeakPolarHBondContact O-CA 3.23Å; R78-H90 WeakPolarHBondContact O-CB 3.42Å; R78-A91 PolarHBondContact N-O 2.65Å; R78-A91 PolarHBondContact O-N 3.08Å; R78-E93 HydrophobicContact CB-CB 4.45Å; R78-E93 IonicContact CZ-OE1 2.8Å; R78-E93 IonicContact CZ-OE2 2.74Å; R78-E93 VanDerWaalsContact NE-CD 3.33Å; R78-E93 IonicContact NE-OE1 3.52Å; R78-E93 PolarHBondContact NE-OE1 3.35Å; R78-E93 IonicContact NE-OE2 3.66Å; R78-E93 PolarHBondContact NE-OE2 3.44Å; R78-E93 IonicContact NH2-OE1 3.66Å; R78-E93 PolarHBondContact NH2-OE1 2.98Å; R78-E93 IonicContact NH2-OE2 2.67Å; R78-E93 PolarHBondContact NH2-OE2 2.69Å
79	K	91.3	Very high	86.3	Confident	101 Å²	101	60 Å²	60	44%	0.439	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	133.6	174.4	-170.5	174.7	179.6	-177.8	0	110.1	D16 Q17	D16-K79 HydrophobicContact CB-CD 4.22Å; D16-K79 WeakPolarHBondContact O-CB 3.3Å; Q17-K79 PolarHBondContact O-N 2.93Å
80	L	88.4	Confident	86.8	Confident	55 Å²	55	59.2 Å²	59.2	29%	0.288	34%	0.343	S	S	.	.			trans	-77.9	144.4	175.7	-72.6	153.2	0	0	0	110.1	L63 T82 L89 A91	L63-L80 HydrophobicContact CD1-CD1 4.37Å; L80-T82 VanDerWaalsContact C-N 3.31Å; L80-T82 VanDerWaalsContact CB-O 3.31Å; L80-T82 WeakPolarHBondContact CB-O 3.41Å; L80-L89 PolarHBondContact N-O 3.03Å; L80-A91 HydrophobicContact CD1-CB 4.26Å; L80-A91 HydrophobicContact CD2-CB 4.06Å; L80-A91 HydrophobicContact CG-CB 4.12Å
81	D	84.8	Confident	87.2	Confident	173 Å²	173	58.7 Å²	58.7	93%	0.925	34%	0.335	S	S	*	.	S	Bend	trans	-66.5	-37.3	174.7	-62.6	-35.9	0	0	0	111.1
82	T	83.3	Confident	87.3	Confident	119 Å²	119	53.6 Å²	53.6	73%	0.73	31%	0.31	S	S	*	.	S	Bend	trans	-119.4	124.5	170.2	45.1	0	0	0	0	110.1	L80 A84	L80-T82 VanDerWaalsContact C-N 3.31Å; L80-T82 VanDerWaalsContact CB-O 3.31Å; L80-T82 WeakPolarHBondContact CB-O 3.41Å; T82-A84 PolarHBondContact O-N 3.48Å
83	A	79.7	Confident	87.5	Confident	53 Å²	53	56.8 Å²	56.8	44%	0.438	32%	0.319	S	S	.	.			trans	-66.8	130.4	179	0	0	0	0	0	110.6	L89	A83-L89 HydrophobicContact CB-CD2 3.63Å
84	A	76.9	Confident	87.5	Confident	51 Å²	51	62.8 Å²	62.8	42%	0.421	35%	0.345	S	S	.	.	S	Bend	trans	-70.3	-35.3	179.1	0	0	0	0	0	112.1	L63 T82 V88	L63-A84 HydrophobicContact CD1-CB 3.33Å; T82-A84 PolarHBondContact O-N 3.48Å; A84-V88 PolarHBondContact N-O 3.3Å
85	T	80.3	Confident	87.4	Confident	32 Å²	32	62.4 Å²	62.4	20%	0.196	34%	0.344	C	S	.	.	S	Bend	trans	-143.8	161.3	170.4	54.2	0	0	0	0	108.2	T87 V88	T85-T87 PolarHBondContact O-N 2.93Å; T85-T87 PolarHBondContact OG1-OG1 3.21Å; T85-V88 PolarHBondContact O-N 3.45Å; T85-V88 VanDerWaalsContact O-N 3.15Å; T85-V88 VanDerWaalsContact OG1-CB 3.24Å; T85-V88 WeakPolarHBondContact OG1-CB 3.42Å; T85-V88 WeakPolarHBondContact OG1-CG2 3.3Å; T85-V88 PolarHBondContact OG1-N 3.13Å; T85-V88 VanDerWaalsContact OG1-N 3.1Å
86	P	80.5	Confident	87.1	Confident	127 Å²	127	66.1 Å²	66.1	83%	0.825	36%	0.364	S	S	*	.	S	Bend	trans	-56.1	-21.7	177.1	18.8	-31.8	0	0	0	113.8
87	T	84.4	Confident	86.5	Confident	87 Å²	87	67.8 Å²	67.8	53%	0.534	37%	0.371	S	S	.	.	S	Bend	trans	-96.5	-31.3	177.3	39.1	0	0	0	0	114.2	T85	T85-T87 PolarHBondContact O-N 2.93Å; T85-T87 PolarHBondContact OG1-OG1 3.21Å
88	V	87.6	Confident	86	Confident	4 Å²	4	72.1 Å²	72.1	2%	0.024	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	92.3	-177.4	-173.1	0	0	0	0	110.5	W61 L63 A84 T85	W61-V88 HydrophobicContact CB-CG2 4.02Å; L63-V88 HydrophobicContact CB-CG1 4.29Å; L63-V88 HydrophobicContact CD1-CG1 4.07Å; L63-V88 HydrophobicContact CG-CG1 4.08Å; A84-V88 PolarHBondContact N-O 3.3Å; T85-V88 PolarHBondContact O-N 3.45Å; T85-V88 VanDerWaalsContact O-N 3.15Å; T85-V88 VanDerWaalsContact OG1-CB 3.24Å; T85-V88 WeakPolarHBondContact OG1-CB 3.42Å; T85-V88 WeakPolarHBondContact OG1-CG2 3.3Å; T85-V88 PolarHBondContact OG1-N 3.13Å; T85-V88 VanDerWaalsContact OG1-N 3.1Å
89	L	89	Confident	85	Confident	71 Å²	71	73.1 Å²	73.1	37%	0.372	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-11	-176.3	-62.1	174.6	0	0	0	114.2	L80 A83	L80-L89 PolarHBondContact N-O 3.03Å; A83-L89 HydrophobicContact CB-CD2 3.63Å
90	H	92.7	Very high	83.8	Confident	3 Å²	3	69.9 Å²	69.9	1%	0.014	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	162.9	-171.8	-58.9	74.7	0	0	0	111.2	F60 A62 L63 I77 R78	F60-H90 AromaticContact CD1-CE1 3.31Å; F60-H90 WeakPolarHBondContact CD1-CE1 3.36Å; F60-H90 AromaticContact CD1-ND1 3.66Å; F60-H90 AromaticContact CE1-CE1 3.7Å; A62-H90 CarbonylContact C-O 2.85Å; A62-H90 VanDerWaalsContact CA-O 3.23Å; A62-H90 WeakPolarHBondContact CA-O 3.37Å; A62-H90 HydrophobicContact CB-CB 4.17Å; L63-H90 PolarHBondContact N-O 3.47Å; I77-H90 HydrophobicContact CB-CB 4.4Å; R78-H90 CarbonylContact O-C 3.59Å; R78-H90 WeakPolarHBondContact O-CA 3.23Å; R78-H90 WeakPolarHBondContact O-CB 3.42Å
91	A	92.4	Very high	82.6	Confident	19 Å²	19	70.8 Å²	70.8	16%	0.157	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	145.2	168.9	0	0	0	0	0	110.1	L63 I77 R78 L80 E93	L63-A91 HydrophobicContact CB-CB 4.29Å; L63-A91 WeakPolarHBondContact O-CA 3.43Å; I77-A91 WeakPolarHBondContact CA-O 3.39Å; R78-A91 PolarHBondContact N-O 2.65Å; R78-A91 PolarHBondContact O-N 3.08Å; L80-A91 HydrophobicContact CD1-CB 4.26Å; L80-A91 HydrophobicContact CD2-CB 4.06Å; L80-A91 HydrophobicContact CG-CB 4.12Å; A91-E93 PolarHBondContact O-N 3.45Å
92	V	91.2	Very high	81.3	Confident	11 Å²	11	68.6 Å²	68.6	7%	0.067	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	117.5	172.2	178.4	0	0	0	0	108.4	A62 L63 T64 L67 I69 V75 I77	A62-V92 HydrophobicContact CB-CG2 3.82Å; L63-V92 PolarHBondContact O-N 3.33Å; T64-V92 HydrophobicContact CG2-CB 4.31Å; T64-V92 HydrophobicContact CG2-CG2 3.72Å; L67-V92 HydrophobicContact CD1-CG1 4.42Å; I69-V92 HydrophobicContact CD1-CB 4.27Å; I69-V92 HydrophobicContact CD1-CG1 3.9Å; I69-V92 HydrophobicContact CD1-CG2 4.31Å; V75-V92 HydrophobicContact CB-CG1 4.03Å; V75-V92 HydrophobicContact CG1-CG1 3.77Å; I77-V92 HydrophobicContact CG2-CG2 4.02Å
93	E	88.7	Confident	80.2	Confident	85 Å²	85	67 Å²	67	40%	0.397	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	-43.7	179.9	-177.2	173.6	179.6	0	0	111.2	L18 L76 R78 A91	L18-E93 WeakPolarHBondContact CD1-OE2 3.49Å; L76-E93 PolarHBondContact O-N 3.15Å; R78-E93 HydrophobicContact CB-CB 4.45Å; R78-E93 IonicContact CZ-OE1 2.8Å; R78-E93 IonicContact CZ-OE2 2.74Å; R78-E93 VanDerWaalsContact NE-CD 3.33Å; R78-E93 IonicContact NE-OE1 3.52Å; R78-E93 PolarHBondContact NE-OE1 3.35Å; R78-E93 IonicContact NE-OE2 3.66Å; R78-E93 PolarHBondContact NE-OE2 3.44Å; R78-E93 IonicContact NH2-OE1 3.66Å; R78-E93 PolarHBondContact NH2-OE1 2.98Å; R78-E93 IonicContact NH2-OE2 2.67Å; R78-E93 PolarHBondContact NH2-OE2 2.69Å; A91-E93 PolarHBondContact O-N 3.45Å
94	K	88.4	Confident	78.9	Confident	136 Å²	136	66.8 Å²	66.8	59%	0.591	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-157.2	140.6	-177.2	-175	171.3	-179.8	173.9	0	112.4	L76 I96	L76-K94 PolarHBondContact N-O 3.38Å; K94-I96 PolarHBondContact O-N 2.9Å
95	V	87.8	Confident	77.7	Confident	30 Å²	30	70.1 Å²	70.1	18%	0.182	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	115.8	164.5	-174.9	0	0	0	0	108.6	I69 D73 V75 Q98	I69-V95 HydrophobicContact CG1-CG2 3.71Å; D73-V95 HydrophobicContact CB-CG1 4.31Å; V75-V95 HydrophobicContact CG1-CB 4.36Å; V75-V95 HydrophobicContact CG1-CG2 3.9Å; V95-Q98 HydrophobicContact CG1-CG 3.98Å
96	I	84.9	Confident	76.5	Confident	79 Å²	79	75.9 Å²	75.9	41%	0.405	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	-43.6	-178.7	-57.5	177.7	0	0	0	110.1	L20 I74 L76 K94	L20-I96 HydrophobicContact CD1-CD1 3.15Å; L20-I96 HydrophobicContact CG-CD1 3.63Å; I74-I96 HydrophobicContact CG2-CB 4.4Å; I74-I96 PolarHBondContact O-N 3.48Å; L76-I96 HydrophobicContact CB-CD1 3.99Å; L76-I96 HydrophobicContact CB-CG1 4.2Å; L76-I96 HydrophobicContact CD1-CD1 3.77Å; L76-I96 HydrophobicContact CG-CD1 4.5Å; K94-I96 PolarHBondContact O-N 2.9Å
97	M	80.3	Confident	76.1	Confident	70 Å²	70	73.3 Å²	73.3	35%	0.345	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	118.2	-174.4	-160.7	176.9	166.4	0	0	110	I74 F101	I74-M97 HydrophobicContact CB-CB 3.94Å; I74-M97 HydrophobicContact CD1-CB 4.05Å; I74-M97 HydrophobicContact CD1-SD 4.04Å; I74-M97 HydrophobicContact CG1-CB 4.05Å; I74-M97 PolarHBondContact N-O 2.96Å; I74-M97 PolarHBondContact O-N 3.44Å; M97-F101 WeakPolarHBondContact CE-O 3.38Å
98	Q	81.9	Confident	74.9	Confident	90 Å²	90	77.8 Å²	77.8	42%	0.421	40%	0.403	S	S	.	.			trans	-74.8	140.2	173.7	-74.2	175.5	-16.3	0	0	110.3	D73 V95 G100 F101	D73-Q98 WeakPolarHBondContact OD1-CA 3.39Å; V95-Q98 HydrophobicContact CG1-CG 3.98Å; Q98-G100 PolarHBondContact O-N 3.43Å; Q98-F101 HydrophobicContact CB-CD2 3.57Å; Q98-F101 HydrophobicContact CB-CE2 3.63Å; Q98-F101 PolarHBondContact O-N 3.17Å; Q98-F101 VanDerWaalsContact OE1-CE2 3.23Å
99	H	70.2	Confident	73.2	Confident	139 Å²	139	85.2 Å²	85.2	64%	0.644	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	129.1	177.2	-163.2	72.5	0	0	0	109.8	G72 D73	G72-H99 PolarHBondContact O-ND1 3.03Å; D73-H99 WeakPolarHBondContact OD1-CB 3.36Å; D73-H99 PolarHBondContact OD1-N 3.35Å
100	G	66.1	Low	71.3	Confident	33 Å²	33	91.1 Å²	91.1	34%	0.34	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.1	-7.8	-178.1	0	0	0	0	0	115.9	Q98 L102	Q98-G100 PolarHBondContact O-N 3.43Å; G100-L102 PolarHBondContact O-N 3.13Å
101	F	63.4	Low	69.4	Low	74 Å²	74	93.1 Å²	93.1	33%	0.325	46%	0.464	S	S	.	.			trans	-92.3	83.7	172	-67.4	-88.4	0	0	0	110.7	M97 Q98 I112	M97-F101 WeakPolarHBondContact CE-O 3.38Å; Q98-F101 HydrophobicContact CB-CD2 3.57Å; Q98-F101 HydrophobicContact CB-CE2 3.63Å; Q98-F101 PolarHBondContact O-N 3.17Å; Q98-F101 VanDerWaalsContact OE1-CE2 3.23Å; F101-I112 HydrophobicContact CD1-CG1 4.35Å; F101-I112 HydrophobicContact CE1-CG1 4.19Å
102	L	57.5	Low	67.5	Low	128 Å²	128	96.2 Å²	96.2	67%	0.67	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.5	132.4	175.4	-124.7	90.5	0	0	0	110.1	G100 V111	G100-L102 PolarHBondContact O-N 3.13Å; L102-V111 WeakPolarHBondContact O-CB 3.22Å; L102-V111 PolarHBondContact O-N 2.96Å
103	I	60.4	Low	65.4	Low	84 Å²	84	102.3 Å²	102.3	43%	0.431	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	121	168.8	-60.5	173.8	0	0	0	106.7
104	D	51.4	Low	63.4	Low	49 Å²	49	106.9 Å²	106.9	26%	0.262	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-63.1	122.2	175.7	170.1	7	0	0	0	109.3	I106 T107 K108 K109 V111	D104-I106 PolarHBondContact O-N 3.06Å; D104-I106 PolarHBondContact OD1-N 2.91Å; D104-T107 VanDerWaalsContact CB-OG1 3.3Å; D104-T107 WeakPolarHBondContact CB-OG1 3.48Å; D104-T107 PolarHBondContact O-N 2.94Å; D104-T107 WeakPolarHBondContact OD2-CB 3.46Å; D104-T107 VanDerWaalsContact OD2-CG2 3.23Å; D104-T107 WeakPolarHBondContact OD2-CG2 3.15Å; D104-T107 PolarHBondContact OD2-OG1 3.28Å; D104-K108 WeakPolarHBondContact O-CA 3.34Å; D104-K108 PolarHBondContact O-N 2.92Å; D104-K109 PolarHBondContact N-O 2.91Å; D104-V111 HydrophobicContact CB-CG2 3.88Å
105	P	52.7	Low	61.3	Low	121 Å²	121	105.6 Å²	105.6	79%	0.786	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-20.4	-174.3	26.3	-35.3	0	0	0	113.5
106	I	55.3	Low	59.1	Low	154 Å²	154	109 Å²	109	79%	0.79	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-45	-179.9	-58.5	175.4	0	0	0	110	D104	D104-I106 PolarHBondContact O-N 3.06Å; D104-I106 PolarHBondContact OD1-N 2.91Å
107	T	71.4	Confident	57.2	Low	73 Å²	73	114 Å²	114	45%	0.448	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.7	-13.2	-172	63	0	0	0	0	114.2	D104 K109	D104-T107 VanDerWaalsContact CB-OG1 3.3Å; D104-T107 WeakPolarHBondContact CB-OG1 3.48Å; D104-T107 PolarHBondContact O-N 2.94Å; D104-T107 WeakPolarHBondContact OD2-CB 3.46Å; D104-T107 VanDerWaalsContact OD2-CG2 3.23Å; D104-T107 WeakPolarHBondContact OD2-CG2 3.15Å; D104-T107 PolarHBondContact OD2-OG1 3.28Å; T107-K109 PolarHBondContact O-N 2.95Å; T107-K109 PolarHBondContact OG1-N 3.25Å
108	K	59.8	Low	55.7	Low	181 Å²	181	116.2 Å²	116.2	79%	0.787	57%	0.57	S	S	*	*			trans	54.1	9.8	-169.5	-64.8	-173.1	177.7	179	0	114.4	D104	D104-K108 WeakPolarHBondContact O-CA 3.34Å; D104-K108 PolarHBondContact O-N 2.92Å
109	K	50.8	Low	54.1	Low	159 Å²	159	115.8 Å²	115.8	69%	0.691	57%	0.574	S	S	*	*			trans	-87.4	143.8	178.7	-70.7	-176.1	178	-177.9	0	110.1	D104 T107 V111	D104-K109 PolarHBondContact N-O 2.91Å; T107-K109 PolarHBondContact O-N 2.95Å; T107-K109 PolarHBondContact OG1-N 3.25Å; K109-V111 PolarHBondContact O-N 3.37Å
110	R	50.8	Low	53.1	Low	195 Å²	195	113.1 Å²	113.1	74%	0.736	57%	0.567	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-69.2	121.4	178.5	-72.3	-179	179.1	-178.5	-0.8	109.4
111	V	52.1	Low	52.2	Low	46 Å²	46	115.9 Å²	115.9	28%	0.279	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.1	108.3	175.1	-177.3	0	0	0	0	108.2	L102 D104 K109 L116	L102-V111 WeakPolarHBondContact O-CB 3.22Å; L102-V111 PolarHBondContact O-N 2.96Å; D104-V111 HydrophobicContact CB-CG2 3.88Å; K109-V111 PolarHBondContact O-N 3.37Å; V111-L116 HydrophobicContact CG1-CD1 3.56Å
112	I	53.1	Low	51.4	Low	84 Å²	84	115.2 Å²	115.2	43%	0.431	58%	0.578	S	S	.	*			trans	-83.5	121.5	172.9	-55.6	173.3	0	0	0	107.1	F101 K114 L115	F101-I112 HydrophobicContact CD1-CG1 4.35Å; F101-I112 HydrophobicContact CE1-CG1 4.19Å; I112-K114 PolarHBondContact O-N 3.27Å; I112-L115 PolarHBondContact O-N 2.89Å
113	L	46.9	Very low	50.9	Low	138 Å²	138	111.2 Å²	111.2	72%	0.723	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.1	-19	-173	-122.8	147.7	0	0	0	114.4
114	K	45.7	Very low	50.2	Low	181 Å²	181	110.3 Å²	110.3	79%	0.787	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-24.5	175.5	-77.1	-176.2	174.7	-179.8	0	115	I112	I112-K114 PolarHBondContact O-N 3.27Å
115	L	45	Very low	49.9	Very low	109 Å²	109	117.1 Å²	117.1	57%	0.571	59%	0.586	S	S	*	*	H	α-helix	trans	-87.3	-23.9	-173.8	-89.2	155.7	0	0	0	114.2	I112 Y117 I118 V119	I112-L115 PolarHBondContact O-N 2.89Å; L115-Y117 VanDerWaalsContact C-N 3.33Å; L115-Y117 PolarHBondContact O-N 3.49Å; L115-I118 PolarHBondContact O-N 2.87Å; L115-V119 WeakPolarHBondContact O-CG2 3.03Å; L115-V119 PolarHBondContact O-N 3.25Å; L115-V119 VanDerWaalsContact O-N 3.15Å
116	L	41.7	Very low	49.5	Very low	102 Å²	102	120.7 Å²	120.7	53%	0.534	58%	0.584	S	S	.	*	H	α-helix	trans	-71.5	-29.1	-174.1	-138.8	122.4	0	0	0	112.7	V111 V120	V111-L116 HydrophobicContact CG1-CD1 3.56Å; L116-V120 HydrophobicContact CD2-CG2 4.09Å; L116-V120 WeakPolarHBondContact O-CB 3.34Å; L116-V120 WeakPolarHBondContact O-CG2 3.27Å; L116-V120 PolarHBondContact O-N 3Å
117	Y	45	Very low	49	Very low	184 Å²	184	119.1 Å²	119.1	72%	0.722	58%	0.577	S	S	*	*	H	α-helix	trans	-69.4	-39.1	178.8	-153.6	-97	0	0	0	111.8	L115 L121	L115-Y117 VanDerWaalsContact C-N 3.33Å; L115-Y117 PolarHBondContact O-N 3.49Å; Y117-L121 HydrophobicContact CD1-CD1 3.8Å; Y117-L121 HydrophobicContact CE1-CD1 3.61Å; Y117-L121 WeakPolarHBondContact O-CB 3.33Å; Y117-L121 WeakPolarHBondContact O-CD1 3.38Å; Y117-L121 PolarHBondContact O-N 2.99Å
118	I	48.5	Very low	47.8	Very low	116 Å²	116	121.6 Å²	121.6	60%	0.595	59%	0.587	S	S	*	*	H	α-helix	trans	-80.8	-36	-177.4	-61.2	172.3	0	0	0	111.6	L115 S122	L115-I118 PolarHBondContact O-N 2.87Å; I118-S122 WeakPolarHBondContact O-CB 3.41Å; I118-S122 PolarHBondContact O-N 3.4Å; I118-S122 PolarHBondContact O-OG 3.48Å
119	V	48.7	Very low	47	Very low	82 Å²	82	118.3 Å²	118.3	50%	0.497	58%	0.577	S	S	.	*	H	α-helix	trans	-73.3	-36.6	179.6	176.4	0	0	0	0	111.6	L115 S122 A123	L115-V119 WeakPolarHBondContact O-CG2 3.03Å; L115-V119 PolarHBondContact O-N 3.25Å; L115-V119 VanDerWaalsContact O-N 3.15Å; V119-S122 WeakPolarHBondContact CA-OG 3.17Å; V119-S122 PolarHBondContact O-OG 3.06Å; V119-A123 WeakPolarHBondContact O-CB 3.22Å; V119-A123 PolarHBondContact O-N 3.49Å
120	V	49.3	Very low	46.6	Very low	82 Å²	82	119.5 Å²	119.5	50%	0.497	58%	0.578	S	S	.	*	H	α-helix	trans	-70.6	-36.8	176.5	174.7	0	0	0	0	111.4	L116 S124	L116-V120 HydrophobicContact CD2-CG2 4.09Å; L116-V120 WeakPolarHBondContact O-CB 3.34Å; L116-V120 WeakPolarHBondContact O-CG2 3.27Å; L116-V120 PolarHBondContact O-N 3Å; V120-S124 VanDerWaalsContact O-CB 3.25Å; V120-S124 WeakPolarHBondContact O-CB 3.36Å; V120-S124 PolarHBondContact O-N 3.19Å; V120-S124 VanDerWaalsContact O-N 3.1Å; V120-S124 PolarHBondContact O-OG 3.38Å
121	L	47.8	Very low	46.2	Very low	92 Å²	92	120.3 Å²	120.3	48%	0.482	58%	0.581	S	S	.	*	H	α-helix	trans	-70.8	-37.7	175.6	-97.1	144.9	0	0	0	113.2	Y117 R125	Y117-L121 HydrophobicContact CD1-CD1 3.8Å; Y117-L121 HydrophobicContact CE1-CD1 3.61Å; Y117-L121 WeakPolarHBondContact O-CB 3.33Å; Y117-L121 WeakPolarHBondContact O-CD1 3.38Å; Y117-L121 PolarHBondContact O-N 2.99Å; L121-R125 PolarHBondContact O-N 2.98Å
122	S	45	Very low	45.6	Very low	60 Å²	60	127.9 Å²	127.9	42%	0.42	61%	0.605	S	S	.	*	H	α-helix	trans	-77.8	-35.6	178.4	58.6	0	0	0	0	113.5	I118 V119 R125 R126	I118-S122 WeakPolarHBondContact O-CB 3.41Å; I118-S122 PolarHBondContact O-N 3.4Å; I118-S122 PolarHBondContact O-OG 3.48Å; V119-S122 WeakPolarHBondContact CA-OG 3.17Å; V119-S122 PolarHBondContact O-OG 3.06Å; S122-R125 PolarHBondContact O-N 3.36Å; S122-R126 PolarHBondContact O-N 2.97Å
123	A	46.6	Very low	45.2	Very low	44 Å²	44	129.1 Å²	129.1	36%	0.364	61%	0.611	S	S	.	*	H	α-helix	trans	-68.7	-35.8	173.3	0	0	0	0	0	112	V119 R125 R126 L127	V119-A123 WeakPolarHBondContact O-CB 3.22Å; V119-A123 PolarHBondContact O-N 3.49Å; A123-R125 VanDerWaalsContact C-N 3.34Å; A123-R125 PolarHBondContact O-N 2.99Å; A123-R126 PolarHBondContact O-N 2.91Å; A123-L127 WeakPolarHBondContact O-CB 3.37Å; A123-L127 PolarHBondContact O-N 3.37Å
124	S	47	Very low	45.1	Very low	64 Å²	64	124 Å²	124	45%	0.448	59%	0.592	S	S	.	*	H	α-helix	trans	-65.9	-35.7	174.9	-59.7	0	0	0	0	112.1	V120 L128	V120-S124 VanDerWaalsContact O-CB 3.25Å; V120-S124 WeakPolarHBondContact O-CB 3.36Å; V120-S124 PolarHBondContact O-N 3.19Å; V120-S124 VanDerWaalsContact O-N 3.1Å; V120-S124 PolarHBondContact O-OG 3.38Å; S124-L128 WeakPolarHBondContact O-CD1 3.04Å; S124-L128 PolarHBondContact O-N 3.48Å
125	R	45.2	Very low	45	Very low	192 Å²	192	122.5 Å²	122.5	73%	0.725	59%	0.586	S	S	*	*	H	α-helix	trans	-72.9	-36.7	174.1	-79.8	-177.5	172.1	-176.8	-2	113.4	L121 S122 A123 L129	L121-R125 PolarHBondContact O-N 2.98Å; S122-R125 PolarHBondContact O-N 3.36Å; A123-R125 VanDerWaalsContact C-N 3.34Å; A123-R125 PolarHBondContact O-N 2.99Å; R125-L129 PolarHBondContact O-N 3.48Å; R125-L129 VanDerWaalsContact O-N 3.15Å
126	R	44.1	Very low	44.7	Very low	196 Å²	196	122.9 Å²	122.9	74%	0.74	59%	0.588	S	S	*	*	H	α-helix	trans	-73	-34.2	177	-82.9	-177.6	178.9	174.1	0.3	113.6	S122 A123 L129 Y130	S122-R126 PolarHBondContact O-N 2.97Å; A123-R126 PolarHBondContact O-N 2.91Å; R126-L129 PolarHBondContact O-N 3.31Å; R126-Y130 PolarHBondContact O-N 3.11Å
127	L	45.5	Very low	44.8	Very low	122 Å²	122	127.8 Å²	127.8	64%	0.639	60%	0.599	S	S	*	*	H	α-helix	trans	-71	-30.4	174	-90.4	152.4	0	0	0	112.9	A123 R131	A123-L127 WeakPolarHBondContact O-CB 3.37Å; A123-L127 PolarHBondContact O-N 3.37Å; L127-R131 PolarHBondContact O-N 3.16Å
128	L	45.2	Very low	44.9	Very low	125 Å²	125	124.6 Å²	124.6	65%	0.654	59%	0.593	S	S	*	*	H	α-helix	trans	-72.8	-32.1	171.8	-84.3	160.8	0	0	0	112.7	S124	S124-L128 WeakPolarHBondContact O-CD1 3.04Å; S124-L128 PolarHBondContact O-N 3.48Å
129	L	42.7	Very low	44.5	Very low	111 Å²	111	124.4 Å²	124.4	58%	0.581	59%	0.591	S	S	*	*	H	α-helix	trans	-75.3	-40	173.9	-116.1	91.9	0	0	0	113	R125 R126 R131 R132 I133	R125-L129 PolarHBondContact O-N 3.48Å; R125-L129 VanDerWaalsContact O-N 3.15Å; R126-L129 PolarHBondContact O-N 3.31Å; L129-R131 VanDerWaalsContact C-N 3.33Å; L129-R131 PolarHBondContact O-N 3.41Å; L129-R132 PolarHBondContact O-N 3.2Å; L129-R132 VanDerWaalsContact O-N 3.12Å; L129-I133 PolarHBondContact O-N 3.33Å
130	Y	43.5	Very low	43.9	Very low	185 Å²	185	126.1 Å²	126.1	73%	0.725	59%	0.592	S	S	*	*	H	α-helix	trans	-70.4	-27.6	178.3	-102.8	-91.2	0	0	0	113.2	R126 R132 G134	R126-Y130 PolarHBondContact O-N 3.11Å; Y130-R132 VanDerWaalsContact C-N 3.31Å; Y130-G134 PolarHBondContact O-N 3.12Å
131	R	40.8	Very low	43.6	Very low	211 Å²	211	133.1 Å²	133.1	80%	0.796	61%	0.61	S	S	*	*	H	α-helix	trans	-70.3	-24.6	169.3	-98.9	-175.7	165.4	-174.6	-4.4	113.5	L127 L129	L127-R131 PolarHBondContact O-N 3.16Å; L129-R131 VanDerWaalsContact C-N 3.33Å; L129-R131 PolarHBondContact O-N 3.41Å
132	R	40.2	Very low	43.2	Very low	206 Å²	206	138.5 Å²	138.5	78%	0.777	63%	0.625	S	S	*	*	H	α-helix	trans	-81.2	-30.3	175.2	-103	179.4	170.3	176.7	-3.5	113.2	L129 Y130	L129-R132 PolarHBondContact O-N 3.2Å; L129-R132 VanDerWaalsContact O-N 3.12Å; Y130-R132 VanDerWaalsContact C-N 3.31Å
133	I	45.4	Very low	42.6	Very low	109 Å²	109	138.4 Å²	138.4	56%	0.559	62%	0.619	S	S	*	*	H	α-helix	trans	-97.6	-26.6	-175	-62.7	165.2	0	0	0	112.4	L129	L129-I133 PolarHBondContact O-N 3.33Å
134	G	45.3	Very low	42.1	Very low	31 Å²	31	141.7 Å²	141.7	32%	0.32	64%	0.64	S	S	.	*	H	α-helix	trans	-77.7	-26.7	177	0	0	0	0	0	114.9	Y130 I138	Y130-G134 PolarHBondContact O-N 3.12Å; G134-I138 PolarHBondContact O-N 3.31Å
135	F	42.7	Very low	41.7	Very low	149 Å²	149	146.3 Å²	146.3	65%	0.654	65%	0.652	S	S	*	*	H	α-helix	trans	-75.7	-30.8	-179.9	-156.3	-97.9	0	0	0	112.3	M139	F135-M139 WeakPolarHBondContact O-CG 3.5Å; F135-M139 PolarHBondContact O-N 2.99Å
136	L	39.2	Very low	41.4	Very low	117 Å²	117	145.9 Å²	145.9	61%	0.613	66%	0.658	S	S	*	*	H	α-helix	trans	-75	-30.2	176.4	-83.5	154.9	0	0	0	112.9	F140	L136-F140 WeakPolarHBondContact O-CD2 3.4Å
137	R	43.8	Very low	40.6	Very low	206 Å²	206	147.4 Å²	147.4	78%	0.777	66%	0.664	S	S	*	*	H	α-helix	trans	-86.1	-21	-176.9	-145.2	172.5	-176.3	173	0.6	114.2
138	I	46.4	Very low	40.4	Very low	117 Å²	117	146 Å²	146	60%	0.6	66%	0.662	S	S	*	*	H	α-helix	trans	-87.5	-30.5	176.5	-66.2	170.4	0	0	0	111.1	G134 F140 R141	G134-I138 PolarHBondContact O-N 3.31Å; I138-F140 VanDerWaalsContact C-N 3.28Å; I138-F140 PolarHBondContact O-N 2.83Å; I138-R141 PolarHBondContact O-N 3.41Å
139	M	39.9	Very low	39.9	Very low	112 Å²	112	148.1 Å²	148.1	55%	0.552	67%	0.666	S	S	*	*	H	α-helix	trans	-65.3	-30.5	170	-80.3	-68.6	-69.8	0	0	112.9	F135	F135-M139 WeakPolarHBondContact O-CG 3.5Å; F135-M139 PolarHBondContact O-N 2.99Å
140	F	37.1	Very low	39.8	Very low	118 Å²	118	152 Å²	152	52%	0.518	67%	0.673	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.8	-11.8	-178.9	-98.5	-83.1	0	0	0	115.3	L136 I138 L143	L136-F140 WeakPolarHBondContact O-CD2 3.4Å; I138-F140 VanDerWaalsContact C-N 3.28Å; I138-F140 PolarHBondContact O-N 2.83Å; F140-L143 HydrophobicContact CD1-CD1 4.02Å; F140-L143 HydrophobicContact CE1-CD1 4.38Å; F140-L143 HydrophobicContact CG-CD1 4.48Å
141	R	41.4	Very low	39.6	Very low	228 Å²	228	150.2 Å²	150.2	86%	0.86	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	-7.3	-175	-122.8	178.3	179.3	179.5	-1.6	114.8	I138	I138-R141 PolarHBondContact O-N 3.41Å
142	Y	39.8	Very low	39.6	Very low	206 Å²	206	147.4 Å²	147.4	81%	0.808	67%	0.667	S	S	*	*	S	Bend	trans	-113.7	17.2	172.7	-78.1	-82.7	0	0	0	112.7	S144	Y142-S144 PolarHBondContact O-N 3.47Å; Y142-S144 VanDerWaalsContact O-N 3.07Å
143	L	32.4	Very low	40.1	Very low	57 Å²	57	142.4 Å²	142.4	30%	0.298	66%	0.664	S	S	.	*			trans	-69.3	95.1	162.5	-85.6	159.4	0	0	0	108.5	F140 F145	F140-L143 HydrophobicContact CD1-CD1 4.02Å; F140-L143 HydrophobicContact CE1-CD1 4.38Å; F140-L143 HydrophobicContact CG-CD1 4.48Å; L143-F145 VanDerWaalsContact C-N 3.32Å; L143-F145 HydrophobicContact CB-CD2 4.17Å; L143-F145 HydrophobicContact CB-CE2 4.39Å; L143-F145 HydrophobicContact CB-CG 4.26Å; L143-F145 WeakPolarHBondContact O-CD2 3.49Å; L143-F145 PolarHBondContact O-N 3.49Å
144	S	36.8	Very low	40.3	Very low	114 Å²	114	143.9 Å²	143.9	80%	0.797	67%	0.668	S	S	*	*			trans	-62.9	107.3	140	-66	0	0	0	0	104.7	Y142 H146	Y142-S144 PolarHBondContact O-N 3.47Å; Y142-S144 VanDerWaalsContact O-N 3.07Å; S144-H146 PolarHBondContact O-N 2.98Å
145	F	38.9	Very low	40.3	Very low	161 Å²	161	146.5 Å²	146.5	71%	0.706	68%	0.681	S	S	*	*	S	Bend	trans	-69.1	34.5	-139.5	-108.7	-89.3	0	0	0	118.1	L143	L143-F145 VanDerWaalsContact C-N 3.32Å; L143-F145 HydrophobicContact CB-CD2 4.17Å; L143-F145 HydrophobicContact CB-CE2 4.39Å; L143-F145 HydrophobicContact CB-CG 4.26Å; L143-F145 WeakPolarHBondContact O-CD2 3.49Å; L143-F145 PolarHBondContact O-N 3.49Å
146	H	39.6	Very low	41	Very low	182 Å²	182	144 Å²	144	84%	0.843	68%	0.68	S	S	*	*			trans	-158.2	85.2	171.2	-109.4	28.5	0	0	0	110.1	S144	S144-H146 PolarHBondContact O-N 2.98Å
147	W	27.3	Very low	42.4	Very low	228 Å²	228	144.7 Å²	144.7	86%	0.864	69%	0.694	S	S	*	*			trans	-138.2	115.9	154.7	-140.4	-75.8	0	0	0	107.6
148	P	41.3	Very low	43.5	Very low	92 Å²	92	143 Å²	143	60%	0.597	70%	0.695	S	S	*	*			trans	-82.2	149.4	-148.4	31	-34.7	0	0	0	112.7	R150	P148-R150 PolarHBondContact O-N 3.21Å
149	F	34.5	Very low	44.5	Very low	171 Å²	171	142.2 Å²	142.2	75%	0.75	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-44.8	8.7	165.9	-114.2	-104.8	0	0	0	117.3	M151	F149-M151 VanDerWaalsContact C-N 3.32Å; F149-M151 PolarHBondContact O-N 2.88Å
150	R	39.5	Very low	46.4	Very low	193 Å²	193	141.5 Å²	141.5	73%	0.728	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-68.5	-21.1	-177.8	-98.4	-175.5	175.7	175.7	-1.3	114.8	P148 S153	P148-R150 PolarHBondContact O-N 3.21Å; R150-S153 PolarHBondContact O-OG 2.96Å
151	M	39.3	Very low	48.5	Very low	147 Å²	147	138.8 Å²	138.8	72%	0.724	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-80.2	-20.7	-175.5	-89.2	-112.8	148.5	0	0	115.3	F149	F149-M151 VanDerWaalsContact C-N 3.32Å; F149-M151 PolarHBondContact O-N 2.88Å
152	F	41.6	Very low	50.6	Low	151 Å²	151	130.5 Å²	130.5	66%	0.662	67%	0.674	S	S	*	*	S	Bend	trans	-89.4	-17.2	-177.2	-83.6	-77.9	0	0	0	114.2	E154	F152-E154 VanDerWaalsContact C-N 3.32Å
153	S	49.6	Very low	52.7	Low	102 Å²	102	124.6 Å²	124.6	71%	0.713	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-9.8	171.8	45	0	0	0	0	113.9	R150	R150-S153 PolarHBondContact O-OG 2.96Å
154	E	49.6	Very low	55.3	Low	139 Å²	139	125.8 Å²	125.8	65%	0.65	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.2	4.3	-178.4	-70.9	178.7	175.9	0	0	113.8	F152 P156	F152-E154 VanDerWaalsContact C-N 3.32Å; E154-P156 WeakPolarHBondContact O-CD 3.4Å
155	C	46.7	Very low	57.7	Low	87 Å²	87	125.8 Å²	125.8	59%	0.588	65%	0.649	S	S	*	*			trans	-73.1	113.8	177.8	-75.7	0	0	0	0	110.3	S157	C155-S157 PolarHBondContact O-N 3.18Å
156	P	55.3	Low	60.1	Low	97 Å²	97	125.5 Å²	125.5	63%	0.63	65%	0.647	S	S	*	*			trans	-67.3	135.2	-177.1	27.8	-33.6	0	0	0	110.6	E154 Q158	E154-P156 WeakPolarHBondContact O-CD 3.4Å; P156-Q158 PolarHBondContact O-N 3.13Å
157	S	69.7	Low	62.4	Low	131 Å²	131	124.5 Å²	124.5	92%	0.916	64%	0.643	S	S	*	*	S	Bend	trans	-66.8	-18.9	179.7	54.1	0	0	0	0	113.2	C155	C155-S157 PolarHBondContact O-N 3.18Å
158	Q	66.1	Low	65.4	Low	170 Å²	170	120.1 Å²	120.1	79%	0.794	63%	0.626	S	S	*	*	S	Bend	trans	-127.5	132	171.1	-82.4	-179.6	-20.9	0	0	110	P156	P156-Q158 PolarHBondContact O-N 3.13Å
159	V	67.3	Low	67.9	Low	100 Å²	100	118.3 Å²	118.3	61%	0.606	62%	0.619	S	S	*	*			trans	-94.7	125	172.2	179.7	0	0	0	0	107.7	A161 F164	V159-A161 PolarHBondContact O-N 3.41Å; V159-F164 HydrophobicContact CG1-CB 3.94Å; V159-F164 HydrophobicContact CG1-CD2 3.94Å; V159-F164 HydrophobicContact CG1-CG 4.18Å
160	D	79.7	Confident	70.5	Confident	97 Å²	97	112.5 Å²	112.5	52%	0.519	61%	0.608	S	S	.	*			trans	-64.1	109.5	170.6	179.9	9	0	0	0	109.4	A162 D163 F164	D160-A162 PolarHBondContact O-N 3.44Å; D160-A162 WeakPolarHBondContact OD1-CB 3.33Å; D160-A162 PolarHBondContact OD1-N 2.87Å; D160-D163 HydrophobicContact CB-CB 4.25Å; D160-D163 PolarHBondContact O-N 2.82Å; D160-F164 WeakPolarHBondContact O-CB 3.22Å; D160-F164 PolarHBondContact O-N 3.33Å
161	A	83.1	Confident	72.9	Confident	61 Å²	61	106.3 Å²	106.3	50%	0.504	60%	0.597	S	S	.	*	H	α-helix	trans	-61.5	-32.8	-178.9	0	0	0	0	0	111.7	V159 I165	V159-A161 PolarHBondContact O-N 3.41Å; A161-I165 VanDerWaalsContact O-CB 3.32Å; A161-I165 WeakPolarHBondContact O-CB 2.89Å; A161-I165 WeakPolarHBondContact O-CD1 3.38Å; A161-I165 WeakPolarHBondContact O-CG1 3.37Å; A161-I165 PolarHBondContact O-N 3.1Å
162	A	85	Confident	75.2	Confident	54 Å²	54	103 Å²	103	45%	0.446	59%	0.585	S	S	.	*	H	α-helix	trans	-67.4	-48.4	-179.6	0	0	0	0	0	110.8	D160 I165 K166	D160-A162 PolarHBondContact O-N 3.44Å; D160-A162 WeakPolarHBondContact OD1-CB 3.33Å; D160-A162 PolarHBondContact OD1-N 2.87Å; A162-I165 PolarHBondContact O-N 3.21Å; A162-K166 WeakPolarHBondContact O-CB 3.4Å; A162-K166 WeakPolarHBondContact O-CG 3.12Å; A162-K166 PolarHBondContact O-N 3.19Å
163	D	84	Confident	77.3	Confident	82 Å²	82	97.5 Å²	97.5	44%	0.439	57%	0.571	S	S	.	*	H	α-helix	trans	-67.6	-39.1	177	-96	3.7	0	0	0	112.6	D160 I165 K166 Q167	D160-D163 HydrophobicContact CB-CB 4.25Å; D160-D163 PolarHBondContact O-N 2.82Å; D163-I165 VanDerWaalsContact C-N 3.34Å; D163-I165 PolarHBondContact O-N 3.4Å; D163-K166 PolarHBondContact O-N 2.93Å; D163-Q167 WeakPolarHBondContact O-CB 3.36Å; D163-Q167 WeakPolarHBondContact O-CG 3.37Å; D163-Q167 PolarHBondContact O-N 2.85Å
164	F	85.9	Confident	79	Confident	83 Å²	83	97.1 Å²	97.1	36%	0.364	56%	0.561	S	S	.	*	H	α-helix	trans	-62.6	-41.3	175.6	-172.4	-98.6	0	0	0	112.5	V159 D160 R168	V159-F164 HydrophobicContact CG1-CB 3.94Å; V159-F164 HydrophobicContact CG1-CD2 3.94Å; V159-F164 HydrophobicContact CG1-CG 4.18Å; D160-F164 WeakPolarHBondContact O-CB 3.22Å; D160-F164 PolarHBondContact O-N 3.33Å; F164-R168 WeakPolarHBondContact O-CB 3.11Å; F164-R168 PolarHBondContact O-N 2.93Å
165	I	87.2	Confident	80.7	Confident	113 Å²	113	95.5 Å²	95.5	58%	0.579	56%	0.557	S	S	*	*	H	α-helix	trans	-68.7	-43.4	174.5	-68.9	167.8	0	0	0	110.1	A161 A162 D163 Q167 R168 A169	A161-I165 VanDerWaalsContact O-CB 3.32Å; A161-I165 WeakPolarHBondContact O-CB 2.89Å; A161-I165 WeakPolarHBondContact O-CD1 3.38Å; A161-I165 WeakPolarHBondContact O-CG1 3.37Å; A161-I165 PolarHBondContact O-N 3.1Å; A162-I165 PolarHBondContact O-N 3.21Å; D163-I165 VanDerWaalsContact C-N 3.34Å; D163-I165 PolarHBondContact O-N 3.4Å; I165-Q167 PolarHBondContact O-N 2.95Å; I165-R168 CarbonylContact O-C 3.57Å; I165-R168 PolarHBondContact O-N 3.13Å; I165-R168 VanDerWaalsContact O-N 3.14Å; I165-A169 WeakPolarHBondContact O-CA 3.47Å; I165-A169 WeakPolarHBondContact O-CB 3.25Å; I165-A169 PolarHBondContact O-N 3.48Å
166	K	90.1	Very high	82.3	Confident	155 Å²	155	95.6 Å²	95.6	67%	0.674	55%	0.551	S	S	*	*	H	α-helix	trans	-57.4	-47.7	176.6	-86.2	177.2	177.9	171.3	0	111.9	A162 D163 R168 A169	A162-K166 WeakPolarHBondContact O-CB 3.4Å; A162-K166 WeakPolarHBondContact O-CG 3.12Å; A162-K166 PolarHBondContact O-N 3.19Å; D163-K166 PolarHBondContact O-N 2.93Å; K166-R168 PolarHBondContact O-N 3.23Å; K166-A169 WeakPolarHBondContact O-CB 3.3Å; K166-A169 PolarHBondContact O-N 2.91Å
167	Q	88.2	Confident	83.2	Confident	162 Å²	162	91.4 Å²	91.4	76%	0.757	52%	0.524	S	S	*	.	H	α-helix	trans	-62.4	-32.6	178	-73.5	-175.3	3.9	0	0	112.4	D163 I165	D163-Q167 WeakPolarHBondContact O-CB 3.36Å; D163-Q167 WeakPolarHBondContact O-CG 3.37Å; D163-Q167 PolarHBondContact O-N 2.85Å; I165-Q167 PolarHBondContact O-N 2.95Å
168	R	90	Very high	83.6	Confident	136 Å²	136	88.9 Å²	88.9	51%	0.513	50%	0.503	S	S	.	.	H	α-helix	trans	-96.8	-4.7	-179.7	-69.1	-175.8	176.8	-174.8	3.1	114.5	F164 I165 K166 G170 A171 V172	F164-R168 WeakPolarHBondContact O-CB 3.11Å; F164-R168 PolarHBondContact O-N 2.93Å; I165-R168 CarbonylContact O-C 3.57Å; I165-R168 PolarHBondContact O-N 3.13Å; I165-R168 VanDerWaalsContact O-N 3.14Å; K166-R168 PolarHBondContact O-N 3.23Å; R168-G170 PolarHBondContact O-N 3.28Å; R168-A171 CarbonylContact O-C 3.55Å; R168-A171 WeakPolarHBondContact O-CA 3.35Å; R168-A171 WeakPolarHBondContact O-CB 3.22Å; R168-A171 PolarHBondContact O-N 2.97Å; R168-V172 WeakPolarHBondContact O-CG2 3.39Å; R168-V172 PolarHBondContact O-N 3.39Å
169	A	92.5	Very high	83.9	Confident	54 Å²	54	85.8 Å²	85.8	45%	0.446	49%	0.491	S	S	.	.	H	α-helix	trans	-57.1	-40.2	-177	0	0	0	0	0	111.1	I165 K166 V172 G173	I165-A169 WeakPolarHBondContact O-CA 3.47Å; I165-A169 WeakPolarHBondContact O-CB 3.25Å; I165-A169 PolarHBondContact O-N 3.48Å; K166-A169 WeakPolarHBondContact O-CB 3.3Å; K166-A169 PolarHBondContact O-N 2.91Å; A169-V172 PolarHBondContact O-N 3.14Å; A169-G173 PolarHBondContact O-N 3.42Å
170	G	89.5	Confident	83.8	Confident	49 Å²	49	85.2 Å²	85.2	51%	0.505	49%	0.485	S	S	.	.	H	α-helix	trans	-64	-38.5	173.8	0	0	0	0	0	113.6	R168 N174	R168-G170 PolarHBondContact O-N 3.28Å; G170-N174 VanDerWaalsContact O-CB 3.32Å; G170-N174 WeakPolarHBondContact O-CB 3.16Å; G170-N174 VanDerWaalsContact O-CG 3.27Å; G170-N174 PolarHBondContact O-N 3.42Å; G170-N174 PolarHBondContact O-ND2 3.14Å; G170-N174 VanDerWaalsContact O-ND2 3.15Å
171	A	89.6	Confident	83.1	Confident	62 Å²	62	83.5 Å²	83.5	51%	0.512	48%	0.475	S	S	.	.	H	α-helix	trans	-71.5	-42.3	177.4	0	0	0	0	0	112.2	R168 N174 L175	R168-A171 CarbonylContact O-C 3.55Å; R168-A171 WeakPolarHBondContact O-CA 3.35Å; R168-A171 WeakPolarHBondContact O-CB 3.22Å; R168-A171 PolarHBondContact O-N 2.97Å; A171-N174 PolarHBondContact O-N 3.01Å; A171-L175 WeakPolarHBondContact O-CB 3.32Å; A171-L175 PolarHBondContact O-N 3.37Å
172	V	87.8	Confident	81.7	Confident	77 Å²	77	87.1 Å²	87.1	47%	0.467	48%	0.482	S	S	.	.	H	α-helix	trans	-64.9	-43.2	174.5	176	0	0	0	0	110.2	R168 A169 N174 L175 L176	R168-V172 WeakPolarHBondContact O-CG2 3.39Å; R168-V172 PolarHBondContact O-N 3.39Å; A169-V172 PolarHBondContact O-N 3.14Å; V172-N174 PolarHBondContact O-N 3.26Å; V172-L175 WeakPolarHBondContact O-CB 3.33Å; V172-L175 PolarHBondContact O-N 3.09Å; V172-L175 VanDerWaalsContact O-N 3.17Å; V172-L176 HydrophobicContact CG1-CD1 4.04Å; V172-L176 HydrophobicContact CG1-CG 4.39Å; V172-L176 WeakPolarHBondContact O-CB 3.25Å; V172-L176 WeakPolarHBondContact O-CG 3.22Å; V172-L176 PolarHBondContact O-N 3.16Å
173	G	86.4	Confident	80.3	Confident	36 Å²	36	91.9 Å²	91.9	37%	0.371	49%	0.493	S	S	.	.	H	α-helix	trans	-58.4	-46.1	172.8	0	0	0	0	0	111.8	A169 L175 L176 A177	A169-G173 PolarHBondContact O-N 3.42Å; G173-L175 VanDerWaalsContact C-N 3.34Å; G173-L175 PolarHBondContact O-N 3.2Å; G173-L176 PolarHBondContact O-N 3.5Å; G173-A177 WeakPolarHBondContact O-CB 3.08Å; G173-A177 PolarHBondContact O-N 3.17Å
174	N	85.3	Confident	78.8	Confident	95 Å²	95	91.2 Å²	91.2	51%	0.508	49%	0.489	S	S	.	.	H	α-helix	trans	-61.6	-39.5	174	-82.3	-37.8	0	0	0	112.8	G170 A171 V172 V178	G170-N174 VanDerWaalsContact O-CB 3.32Å; G170-N174 WeakPolarHBondContact O-CB 3.16Å; G170-N174 VanDerWaalsContact O-CG 3.27Å; G170-N174 PolarHBondContact O-N 3.42Å; G170-N174 PolarHBondContact O-ND2 3.14Å; G170-N174 VanDerWaalsContact O-ND2 3.15Å; A171-N174 PolarHBondContact O-N 3.01Å; V172-N174 PolarHBondContact O-N 3.26Å; N174-V178 VanDerWaalsContact O-CG2 3.26Å; N174-V178 WeakPolarHBondContact O-CG2 3.47Å; N174-V178 PolarHBondContact O-N 2.67Å
175	L	84.3	Confident	77.2	Confident	105 Å²	105	91.2 Å²	91.2	55%	0.55	50%	0.497	S	S	.	.	H	α-helix	trans	-66.4	-48.1	177.9	-174.1	77.4	0	0	0	111.1	A171 V172 G173 A177 V178 I179	A171-L175 WeakPolarHBondContact O-CB 3.32Å; A171-L175 PolarHBondContact O-N 3.37Å; V172-L175 WeakPolarHBondContact O-CB 3.33Å; V172-L175 PolarHBondContact O-N 3.09Å; V172-L175 VanDerWaalsContact O-N 3.17Å; G173-L175 VanDerWaalsContact C-N 3.34Å; G173-L175 PolarHBondContact O-N 3.2Å; L175-A177 VanDerWaalsContact C-N 3.33Å; L175-A177 PolarHBondContact O-N 3.09Å; L175-V178 PolarHBondContact O-N 2.89Å; L175-V178 VanDerWaalsContact O-N 3.12Å; L175-I179 HydrophobicContact CD1-CD1 4.49Å; L175-I179 HydrophobicContact CD2-CD1 4.25Å; L175-I179 HydrophobicContact CG-CD1 3.89Å; L175-I179 WeakPolarHBondContact O-CG1 3.46Å; L175-I179 PolarHBondContact O-N 2.9Å
176	L	80.7	Confident	75	Confident	89 Å²	89	96.4 Å²	96.4	47%	0.466	52%	0.515	S	S	.	.	H	α-helix	trans	-60.3	-44.5	175.5	-71.9	172.9	0	0	0	110.6	V172 G173 V178 I179 D180	V172-L176 HydrophobicContact CG1-CD1 4.04Å; V172-L176 HydrophobicContact CG1-CG 4.39Å; V172-L176 WeakPolarHBondContact O-CB 3.25Å; V172-L176 WeakPolarHBondContact O-CG 3.22Å; V172-L176 PolarHBondContact O-N 3.16Å; G173-L176 PolarHBondContact O-N 3.5Å; L176-V178 VanDerWaalsContact C-N 3.26Å; L176-V178 PolarHBondContact O-N 2.8Å; L176-I179 PolarHBondContact O-N 3.32Å; L176-I179 VanDerWaalsContact O-N 3.15Å; L176-D180 WeakPolarHBondContact O-CB 3.37Å; L176-D180 PolarHBondContact O-N 2.95Å
177	A	75.5	Confident	73.1	Confident	9 Å²	9	91.3 Å²	91.3	7%	0.074	51%	0.507	C	S	.	.	H	α-helix	trans	-58.2	-36.5	174	0	0	0	0	0	112.6	G173 L175 N181 E182	G173-A177 WeakPolarHBondContact O-CB 3.08Å; G173-A177 PolarHBondContact O-N 3.17Å; L175-A177 VanDerWaalsContact C-N 3.33Å; L175-A177 PolarHBondContact O-N 3.09Å; A177-N181 CarbonylContact O-C 3.52Å; A177-N181 VanDerWaalsContact O-CA 3.24Å; A177-N181 WeakPolarHBondContact O-CA 3.47Å; A177-N181 PolarHBondContact O-N 2.79Å; A177-E182 HydrophobicContact CB-CB 4Å; A177-E182 HydrophobicContact CB-CG 4.38Å; A177-E182 WeakPolarHBondContact CB-OE2 3.5Å; A177-E182 PolarHBondContact O-N 2.88Å
178	V	76.8	Confident	71.3	Confident	78 Å²	78	87.7 Å²	87.7	47%	0.473	49%	0.49	S	S	.	.	H	α-helix	trans	-73.5	-43.4	175	170.6	0	0	0	0	111.6	N174 L175 L176 N181 K183	N174-V178 VanDerWaalsContact O-CG2 3.26Å; N174-V178 WeakPolarHBondContact O-CG2 3.47Å; N174-V178 PolarHBondContact O-N 2.67Å; L175-V178 PolarHBondContact O-N 2.89Å; L175-V178 VanDerWaalsContact O-N 3.12Å; L176-V178 VanDerWaalsContact C-N 3.26Å; L176-V178 PolarHBondContact O-N 2.8Å; V178-N181 WeakPolarHBondContact O-CA 3.33Å; V178-N181 PolarHBondContact O-N 2.83Å; V178-N181 VanDerWaalsContact O-N 3.13Å; V178-K183 HydrophobicContact CG2-CD 4.3Å
179	I	73.1	Confident	69.3	Low	105 Å²	105	83.2 Å²	83.2	54%	0.538	48%	0.478	S	S	.	.	H	α-helix	trans	-64.4	-46.5	-179.9	-70	170.5	0	0	0	110.9	L175 L176 N181	L175-I179 HydrophobicContact CD1-CD1 4.49Å; L175-I179 HydrophobicContact CD2-CD1 4.25Å; L175-I179 HydrophobicContact CG-CD1 3.89Å; L175-I179 WeakPolarHBondContact O-CG1 3.46Å; L175-I179 PolarHBondContact O-N 2.9Å; L176-I179 PolarHBondContact O-N 3.32Å; L176-I179 VanDerWaalsContact O-N 3.15Å; I179-N181 PolarHBondContact O-N 2.93Å; I179-N181 PolarHBondContact O-ND2 2.91Å; I179-N181 VanDerWaalsContact O-ND2 3.14Å
180	D	65.7	Low	67.1	Low	88 Å²	88	85.3 Å²	85.3	47%	0.471	49%	0.488	S	S	.	.	H	α-helix	trans	-74.2	-13.5	176.1	-69.9	-23.8	0	0	0	112.1	L176 E182 R194	L176-D180 WeakPolarHBondContact O-CB 3.37Å; L176-D180 PolarHBondContact O-N 2.95Å; D180-E182 HydrophobicContact CB-CG 4.34Å; D180-R194 PolarHBondContact O-NH2 2.82Å
181	N	64	Low	65.1	Low	61 Å²	61	92.4 Å²	92.4	33%	0.326	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	41.5	-173.5	-38.3	-107	0	0	0	112.1	A177 V178 I179 K183 L184 R194	A177-N181 CarbonylContact O-C 3.52Å; A177-N181 VanDerWaalsContact O-CA 3.24Å; A177-N181 WeakPolarHBondContact O-CA 3.47Å; A177-N181 PolarHBondContact O-N 2.79Å; V178-N181 WeakPolarHBondContact O-CA 3.33Å; V178-N181 PolarHBondContact O-N 2.83Å; V178-N181 VanDerWaalsContact O-N 3.13Å; I179-N181 PolarHBondContact O-N 2.93Å; I179-N181 PolarHBondContact O-ND2 2.91Å; I179-N181 VanDerWaalsContact O-ND2 3.14Å; N181-K183 PolarHBondContact O-N 3.27Å; N181-L184 HydrophobicContact CB-CB 4.45Å; N181-L184 HydrophobicContact CB-CD1 3.63Å; N181-L184 HydrophobicContact CB-CG 4.06Å; N181-L184 WeakPolarHBondContact O-CB 3.38Å; N181-L184 PolarHBondContact O-N 2.91Å; N181-R194 PolarHBondContact ND2-NH2 3.2Å
182	E	54.8	Low	63.5	Low	136 Å²	136	91.9 Å²	91.9	64%	0.636	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-28.5	170.2	-69.1	-166.9	138.4	0	0	112.5	A177 D180 L184	A177-E182 HydrophobicContact CB-CB 4Å; A177-E182 HydrophobicContact CB-CG 4.38Å; A177-E182 WeakPolarHBondContact CB-OE2 3.5Å; A177-E182 PolarHBondContact O-N 2.88Å; D180-E182 HydrophobicContact CB-CG 4.34Å; E182-L184 PolarHBondContact O-N 3.19Å
183	K	54.1	Low	62	Low	155 Å²	155	94.6 Å²	94.6	67%	0.674	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-13.2	173.7	-66.4	-170.5	179.6	-176.2	0	113.8	V178 N181	V178-K183 HydrophobicContact CG2-CD 4.3Å; N181-K183 PolarHBondContact O-N 3.27Å
184	L	53.6	Low	60.9	Low	68 Å²	68	95 Å²	95	36%	0.356	52%	0.518	S	S	.	.	S	Bend	trans	-77.9	139.9	169.8	-74.5	171.3	0	0	0	109.8	N181 E182 K186 V189	N181-L184 HydrophobicContact CB-CB 4.45Å; N181-L184 HydrophobicContact CB-CD1 3.63Å; N181-L184 HydrophobicContact CB-CG 4.06Å; N181-L184 WeakPolarHBondContact O-CB 3.38Å; N181-L184 PolarHBondContact O-N 2.91Å; E182-L184 PolarHBondContact O-N 3.19Å; L184-K186 PolarHBondContact O-N 3.24Å; L184-V189 HydrophobicContact CB-CG2 4.13Å; L184-V189 HydrophobicContact CD1-CG2 4.44Å
185	P	52.1	Low	60.2	Low	83 Å²	83	94.4 Å²	94.4	54%	0.539	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-53.2	130.8	-171.2	15.5	-27.5	0	0	0	112.7	G187 E188	P185-G187 PolarHBondContact O-N 3.42Å; P185-G187 VanDerWaalsContact O-N 3.08Å; P185-E188 HydrophobicContact CG-CG 4.2Å; P185-E188 PolarHBondContact O-N 2.97Å
186	K	41.9	Very low	59.7	Low	222 Å²	222	90.6 Å²	90.6	97%	0.965	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.2	117.1	178.6	-83.1	-177.9	176.4	177.7	0	109.6	L184	L184-K186 PolarHBondContact O-N 3.24Å
187	G	48.6	Very low	59.5	Low	48 Å²	48	88.2 Å²	88.2	50%	0.495	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	112.8	-12.3	-175.5	0	0	0	0	0	115.1	P185 R202	P185-G187 PolarHBondContact O-N 3.42Å; P185-G187 VanDerWaalsContact O-N 3.08Å; G187-R202 PolarHBondContact O-NH1 2.76Å; G187-R202 PolarHBondContact O-NH2 3.3Å
188	E	51.5	Low	59.6	Low	86 Å²	86	92 Å²	92	40%	0.402	50%	0.5	S	S	.	.	S	Bend	trans	-80.6	-20.8	167.7	-72.6	-161.9	144.9	0	0	112.9	P185 R202	P185-E188 HydrophobicContact CG-CG 4.2Å; P185-E188 PolarHBondContact O-N 2.97Å; E188-R202 PolarHBondContact O-NE 2.85Å; E188-R202 PolarHBondContact O-NH2 3.36Å
189	V	47.9	Very low	59.5	Low	42 Å²	42	95.7 Å²	95.7	26%	0.255	51%	0.506	S	S	.	.			trans	-119.7	131.9	-170.7	-176.3	0	0	0	0	110.2	L184	L184-V189 HydrophobicContact CB-CG2 4.13Å; L184-V189 HydrophobicContact CD1-CG2 4.44Å
190	C	45	Very low	59.8	Low	97 Å²	97	91.6 Å²	91.6	66%	0.655	49%	0.485	S	S	*	.			trans	-89.8	134.4	162.3	-55.8	0	0	0	0	106.6
191	Q	48.8	Very low	60.6	Low	198 Å²	198	90.5 Å²	90.5	93%	0.925	48%	0.482	S	S	*	.	S	Bend	trans	-59.7	135.7	178.9	-69.7	-175.9	-24.5	0	0	110.6
192	G	55.8	Low	61.4	Low	52 Å²	52	93.3 Å²	93.3	54%	0.536	49%	0.489	S	S	.	.	S	Bend	trans	124.6	166.6	176.9	0	0	0	0	0	116	R194	G192-R194 PolarHBondContact O-N 3.04Å
193	P	55.2	Low	62.6	Low	134 Å²	134	92.1 Å²	92.1	87%	0.87	48%	0.483	S	S	*	.			trans	-65.1	108.3	-176	24.5	-32.1	0	0	0	111.3
194	R	64.9	Low	64.1	Low	45 Å²	45	89.8 Å²	89.8	17%	0.17	48%	0.475	C	S	.	.			trans	-71	133.2	-176	-61.8	-171.1	-159.5	167.7	20	112	D180 N181 G192 Q198 R199	D180-R194 PolarHBondContact O-NH2 2.82Å; N181-R194 PolarHBondContact ND2-NH2 3.2Å; G192-R194 PolarHBondContact O-N 3.04Å; R194-Q198 HydrophobicContact CB-CB 4.2Å; R194-R199 HydrophobicContact CB-CG 4.25Å
195	T	69.7	Low	65.6	Low	81 Å²	81	90.1 Å²	90.1	50%	0.497	47%	0.472	S	S	.	.			trans	-63.2	149.6	161.7	54.6	0	0	0	0	110.2	I197 Q198 R199	T195-I197 PolarHBondContact O-N 3.31Å; T195-Q198 WeakPolarHBondContact O-CA 3.37Å; T195-Q198 WeakPolarHBondContact O-CB 3.05Å; T195-Q198 PolarHBondContact O-N 3.32Å; T195-Q198 VanDerWaalsContact OG1-CG 3.32Å; T195-Q198 WeakPolarHBondContact OG1-CG 3.38Å; T195-Q198 PolarHBondContact OG1-OE1 3.37Å; T195-R199 PolarHBondContact O-N 2.79Å
196	F	74.3	Confident	67.3	Low	26 Å²	26	92.4 Å²	92.4	11%	0.114	47%	0.47	C	S	.	.	G	3₁₀ helix	trans	-47.8	-40.2	-179.1	169.1	-108.1	0	0	0	113.7	Q198 R199 H220 R223 A224 L227	F196-Q198 VanDerWaalsContact C-N 3.33Å; F196-Q198 PolarHBondContact O-N 3.04Å; F196-R199 WeakPolarHBondContact O-CB 3.46Å; F196-R199 PolarHBondContact O-N 3.05Å; F196-H220 HydrophobicContact CE1-CB 3.86Å; F196-H220 VanDerWaalsContact CE1-O 3.29Å; F196-H220 WeakPolarHBondContact CE1-O 3.36Å; F196-H220 HydrophobicContact CE2-CB 4.42Å; F196-H220 AromaticContact CE2-ND1 3.48Å; F196-H220 WeakPolarHBondContact CE2-ND1 3.42Å; F196-H220 HydrophobicContact CZ-CB 3.38Å; F196-H220 AromaticContact CZ-CG 3.54Å; F196-H220 AromaticContact CZ-ND1 3.28Å; F196-H220 VanDerWaalsContact CZ-ND1 3.28Å; F196-H220 WeakPolarHBondContact CZ-ND1 3.38Å; F196-H220 WeakPolarHBondContact CZ-O 3.37Å; F196-R223 HydrophobicContact CD1-CG 4.43Å; F196-R223 HydrophobicContact CD2-CG 4.34Å; F196-R223 HydrophobicContact CE1-CB 4.19Å; F196-R223 HydrophobicContact CE1-CG 4.42Å; F196-R223 HydrophobicContact CE2-CB 4.4Å; F196-R223 HydrophobicContact CE2-CG 4.33Å; F196-R223 HydrophobicContact CG-CG 4.35Å; F196-R223 HydrophobicContact CZ-CB 4Å; F196-R223 HydrophobicContact CZ-CG 4.32Å; F196-A224 HydrophobicContact CE1-CB 4.18Å; F196-L227 HydrophobicContact CB-CD1 4.07Å; F196-L227 HydrophobicContact CD1-CD1 4.37Å
197	I	76.4	Confident	69.3	Low	39 Å²	39	93.8 Å²	93.8	20%	0.2	47%	0.469	C	S	.	.	G	3₁₀ helix	trans	-62.1	-36.9	177.5	-78.2	166.2	0	0	0	112.6	T195 R199 M209	T195-I197 PolarHBondContact O-N 3.31Å; I197-R199 VanDerWaalsContact C-N 3.27Å; I197-R199 PolarHBondContact O-N 3.21Å; I197-M209 HydrophobicContact CB-CE 3.98Å; I197-M209 HydrophobicContact CD1-CG 4.44Å; I197-M209 HydrophobicContact CG1-CE 4.1Å; I197-M209 HydrophobicContact CG1-CG 4.38Å; I197-M209 HydrophobicContact CG2-CE 3.44Å; I197-M209 VanDerWaalsContact CG2-CE 3.44Å; I197-M209 HydrophobicContact CG2-CG 3.69Å; I197-M209 HydrophobicContact CG2-SD 3.53Å; I197-M209 VanDerWaalsContact CG2-SD 3.53Å
198	Q	77.4	Confident	71.1	Confident	87 Å²	87	93.1 Å²	93.1	41%	0.407	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-76.8	-11.1	179.3	-67.7	170.2	-10.5	0	0	112.8	R194 T195 F196 L200 R205	R194-Q198 HydrophobicContact CB-CB 4.2Å; T195-Q198 WeakPolarHBondContact O-CA 3.37Å; T195-Q198 WeakPolarHBondContact O-CB 3.05Å; T195-Q198 PolarHBondContact O-N 3.32Å; T195-Q198 VanDerWaalsContact OG1-CG 3.32Å; T195-Q198 WeakPolarHBondContact OG1-CG 3.38Å; T195-Q198 PolarHBondContact OG1-OE1 3.37Å; F196-Q198 VanDerWaalsContact C-N 3.33Å; F196-Q198 PolarHBondContact O-N 3.04Å; Q198-L200 PolarHBondContact O-N 2.96Å; Q198-R205 VanDerWaalsContact O-CZ 3.25Å; Q198-R205 PolarHBondContact O-NH2 2.81Å
199	R	75.1	Confident	72.7	Confident	156 Å²	156	89.6 Å²	89.6	59%	0.589	44%	0.443	S	S	*	.	G	3₁₀ helix	trans	-71	-19.5	174.8	-64.8	-174.1	179.6	-174.3	-3.8	113.2	R194 T195 F196 I197	R194-R199 HydrophobicContact CB-CG 4.25Å; T195-R199 PolarHBondContact O-N 2.79Å; F196-R199 WeakPolarHBondContact O-CB 3.46Å; F196-R199 PolarHBondContact O-N 3.05Å; I197-R199 VanDerWaalsContact C-N 3.27Å; I197-R199 PolarHBondContact O-N 3.21Å
200	L	79.5	Confident	74.1	Confident	20 Å²	20	89.3 Å²	89.3	11%	0.105	44%	0.442	C	S	.	.	S	Bend	trans	-68.4	145	176.3	-76.8	153.7	0	0	0	112.1	Q198 R205 M209 L216 P217	Q198-L200 PolarHBondContact O-N 2.96Å; L200-R205 HydrophobicContact CB-CG 4.19Å; L200-R205 PolarHBondContact O-NE 2.87Å; L200-R205 PolarHBondContact O-NH2 2.87Å; L200-M209 HydrophobicContact CD1-CE 3.35Å; L200-L216 HydrophobicContact CD1-CD2 3.41Å; L200-L216 VanDerWaalsContact CD1-CD2 3.41Å; L200-P217 HydrophobicContact CD2-CG 4.23Å
201	P	82	Confident	75.7	Confident	64 Å²	64	89.3 Å²	89.3	42%	0.416	43%	0.432	S	S	.	.			trans	-56.4	141.8	174.5	-26.4	34.7	0	0	0	112.5	H203 M204 R205	P201-H203 VanDerWaalsContact C-N 3.26Å; P201-H203 PolarHBondContact O-N 3.07Å; P201-H203 VanDerWaalsContact O-N 3.14Å; P201-M204 WeakPolarHBondContact O-CA 3.46Å; P201-M204 WeakPolarHBondContact O-CB 3.32Å; P201-M204 PolarHBondContact O-N 2.93Å; P201-R205 PolarHBondContact O-N 3.2Å; P201-R205 VanDerWaalsContact O-N 3.15Å
202	R	80.1	Confident	77.4	Confident	121 Å²	121	82.8 Å²	82.8	46%	0.457	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-39.5	-174.2	-70.2	-178	176.4	-159	-4.5	113.5	G187 E188 M204 R205	G187-R202 PolarHBondContact O-NH1 2.76Å; G187-R202 PolarHBondContact O-NH2 3.3Å; E188-R202 PolarHBondContact O-NE 2.85Å; E188-R202 PolarHBondContact O-NH2 3.36Å; R202-M204 VanDerWaalsContact C-N 3.27Å; R202-M204 PolarHBondContact O-N 2.69Å; R202-R205 PolarHBondContact O-N 3.19Å
203	H	81.8	Confident	78.9	Confident	111 Å²	111	81.4 Å²	81.4	51%	0.514	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-24.4	179.8	73.2	-90	0	0	0	113.3	P201	P201-H203 VanDerWaalsContact C-N 3.26Å; P201-H203 PolarHBondContact O-N 3.07Å; P201-H203 VanDerWaalsContact O-N 3.14Å
204	M	84	Confident	80.5	Confident	105 Å²	105	82.7 Å²	82.7	52%	0.517	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-23.7	175.4	-68	-163.9	173.5	0	0	113.5	P201 R202	P201-M204 WeakPolarHBondContact O-CA 3.46Å; P201-M204 WeakPolarHBondContact O-CB 3.32Å; P201-M204 PolarHBondContact O-N 2.93Å; R202-M204 VanDerWaalsContact C-N 3.27Å; R202-M204 PolarHBondContact O-N 2.69Å
205	R	86.1	Confident	81.7	Confident	75 Å²	75	88.1 Å²	88.1	28%	0.283	40%	0.397	S	S	.	.			trans	-59	143.5	-177.9	-66.7	-176	-165.3	165	9.7	111.8	Q198 L200 P201 R202 M209	Q198-R205 VanDerWaalsContact O-CZ 3.25Å; Q198-R205 PolarHBondContact O-NH2 2.81Å; L200-R205 HydrophobicContact CB-CG 4.19Å; L200-R205 PolarHBondContact O-NE 2.87Å; L200-R205 PolarHBondContact O-NH2 2.87Å; P201-R205 PolarHBondContact O-N 3.2Å; P201-R205 VanDerWaalsContact O-N 3.15Å; R202-R205 PolarHBondContact O-N 3.19Å; R205-M209 HydrophobicContact CB-SD 4.4Å
206	R	87.3	Confident	82.6	Confident	132 Å²	132	84.4 Å²	84.4	50%	0.498	38%	0.375	S	S	.	.			trans	-131.9	127.6	177.7	-60.9	-62.5	178.6	-134.2	5.1	109.3	A208 M209 R215	R206-A208 PolarHBondContact O-N 2.96Å; R206-M209 WeakPolarHBondContact O-CB 3.32Å; R206-M209 WeakPolarHBondContact O-CG 3.26Å; R206-M209 PolarHBondContact O-N 2.87Å; R206-R215 HydrophobicContact CB-CB 4.5Å
207	R	85.2	Confident	83.4	Confident	250 Å²	250	86.1 Å²	86.1	94%	0.943	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-52.7	-31.5	179.2	-71.5	-174.2	-82.1	179.6	-5.3	114	M209	R207-M209 VanDerWaalsContact C-N 3.32Å; R207-M209 PolarHBondContact O-N 3.26Å
208	A	85.2	Confident	84	Confident	35 Å²	35	92.7 Å²	92.7	29%	0.289	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-82.2	1.3	-178.8	0	0	0	0	0	115.1	R206 S210 H211 N212 R215	R206-A208 PolarHBondContact O-N 2.96Å; A208-S210 VanDerWaalsContact C-N 3.26Å; A208-S210 PolarHBondContact O-N 3.37Å; A208-H211 PolarHBondContact O-N 3.44Å; A208-N212 PolarHBondContact O-N 3.41Å; A208-R215 HydrophobicContact CB-CG 4.43Å
209	M	85.1	Confident	84.5	Confident	12 Å²	12	100 Å²	100	6%	0.059	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-69.3	-21.2	-177.9	68.7	-155.7	-71.6	0	0	113.8	I197 L200 R205 R206 R207 H211 R215 L216	I197-M209 HydrophobicContact CB-CE 3.98Å; I197-M209 HydrophobicContact CD1-CG 4.44Å; I197-M209 HydrophobicContact CG1-CE 4.1Å; I197-M209 HydrophobicContact CG1-CG 4.38Å; I197-M209 HydrophobicContact CG2-CE 3.44Å; I197-M209 VanDerWaalsContact CG2-CE 3.44Å; I197-M209 HydrophobicContact CG2-CG 3.69Å; I197-M209 HydrophobicContact CG2-SD 3.53Å; I197-M209 VanDerWaalsContact CG2-SD 3.53Å; L200-M209 HydrophobicContact CD1-CE 3.35Å; R205-M209 HydrophobicContact CB-SD 4.4Å; R206-M209 WeakPolarHBondContact O-CB 3.32Å; R206-M209 WeakPolarHBondContact O-CG 3.26Å; R206-M209 PolarHBondContact O-N 2.87Å; R207-M209 VanDerWaalsContact C-N 3.32Å; R207-M209 PolarHBondContact O-N 3.26Å; M209-H211 VanDerWaalsContact C-N 3.32Å; M209-R215 HydrophobicContact CB-CB 4.4Å; M209-L216 HydrophobicContact CB-CD2 4.37Å; M209-L216 HydrophobicContact CB-CG 4.23Å; M209-L216 HydrophobicContact CE-CD2 3.35Å; M209-L216 HydrophobicContact CE-CG 4.38Å
210	S	77.8	Confident	85	Confident	35 Å²	35	95.9 Å²	95.9	25%	0.245	42%	0.422	C	S	.	.	G	3₁₀ helix	trans	-69.7	-24.8	174.4	52.8	0	0	0	0	113.7	A208 I228	A208-S210 VanDerWaalsContact C-N 3.26Å; A208-S210 PolarHBondContact O-N 3.37Å; S210-I228 VanDerWaalsContact O-CD1 3.32Å; S210-I228 WeakPolarHBondContact O-CD1 3.13Å; S210-I228 VanDerWaalsContact O-CG1 3.27Å; S210-I228 WeakPolarHBondContact O-CG1 3.49Å
211	H	77.9	Confident	85.5	Confident	97 Å²	97	98.3 Å²	98.3	45%	0.449	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	-20.1	-178.7	-47.2	-80	0	0	0	113.2	A208 M209 H233	A208-H211 PolarHBondContact O-N 3.44Å; M209-H211 VanDerWaalsContact C-N 3.32Å; H211-H233 VanDerWaalsContact CE1-CB 3.49Å; H211-H233 WeakPolarHBondContact CE1-CB 3.2Å; H211-H233 AromaticContact CE1-CD2 3.25Å; H211-H233 PolarHBondContact CE1-CD2 3.38Å; H211-H233 AromaticContact CE1-CE1 3.64Å; H211-H233 AromaticContact CE1-CG 3.12Å; H211-H233 AromaticContact CE1-ND1 3.39Å; H211-H233 PolarHBondContact CE1-ND1 3.27Å; H211-H233 AromaticContact CE1-NE2 3.55Å; H211-H233 WeakPolarHBondContact ND1-CB 3.29Å; H211-H233 AromaticContact ND1-CD2 3.24Å; H211-H233 PolarHBondContact ND1-CD2 3.14Å; H211-H233 AromaticContact ND1-CG 3.25Å; H211-H233 AromaticContact ND1-NE2 3.96Å
212	N	84.2	Confident	85.8	Confident	61 Å²	61	102.7 Å²	102.7	33%	0.326	44%	0.444	S	S	.	.			trans	-127.7	98.8	-178.1	-173.5	-20.9	0	0	0	110.6	A208 K214 R215	A208-N212 PolarHBondContact O-N 3.41Å; N212-K214 PolarHBondContact O-N 3Å; N212-K214 VanDerWaalsContact O-N 3.1Å; N212-K214 VanDerWaalsContact OD1-CB 3.27Å; N212-K214 WeakPolarHBondContact OD1-CB 3.46Å; N212-K214 PolarHBondContact OD1-N 2.78Å; N212-R215 HydrophobicContact CB-CG 4.2Å; N212-R215 WeakPolarHBondContact O-CB 3.5Å; N212-R215 PolarHBondContact O-N 2.85Å
213	V	88	Confident	86	Confident	23 Å²	23	104 Å²	104	14%	0.139	45%	0.449	C	S	.	.	G	3₁₀ helix	trans	-52	-32.7	177.7	-175.1	0	0	0	0	112.4	R215 L216 R221 E225 I228	V213-R215 PolarHBondContact O-N 2.89Å; V213-L216 WeakPolarHBondContact O-CB 3.48Å; V213-L216 PolarHBondContact O-N 2.8Å; V213-R221 HydrophobicContact CG1-CB 3.38Å; V213-R221 HydrophobicContact CG1-CG 3.59Å; V213-E225 HydrophobicContact CB-CG 4.37Å; V213-E225 HydrophobicContact CG1-CG 3.86Å; V213-E225 HydrophobicContact CG2-CG 3.72Å; V213-I228 HydrophobicContact CG2-CD1 3.51Å
214	K	89.4	Confident	86.2	Confident	162 Å²	162	98.7 Å²	98.7	70%	0.704	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-65.4	-15.1	-178.5	-57.3	-177.4	179.9	-179.1	0	113	N212 L216 R221	N212-K214 PolarHBondContact O-N 3Å; N212-K214 VanDerWaalsContact O-N 3.1Å; N212-K214 VanDerWaalsContact OD1-CB 3.27Å; N212-K214 WeakPolarHBondContact OD1-CB 3.46Å; N212-K214 PolarHBondContact OD1-N 2.78Å; K214-L216 VanDerWaalsContact C-N 3.29Å; K214-R221 PolarHBondContact O-NH2 2.84Å
215	R	90	Very high	86.4	Confident	158 Å²	158	97.5 Å²	97.5	60%	0.596	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-79.1	-10.4	173.6	-60.3	-59.2	-177.2	-175.6	-2.1	113.5	R206 A208 M209 N212 V213	R206-R215 HydrophobicContact CB-CB 4.5Å; A208-R215 HydrophobicContact CB-CG 4.43Å; M209-R215 HydrophobicContact CB-CB 4.4Å; N212-R215 HydrophobicContact CB-CG 4.2Å; N212-R215 WeakPolarHBondContact O-CB 3.5Å; N212-R215 PolarHBondContact O-N 2.85Å; V213-R215 PolarHBondContact O-N 2.89Å
216	L	88.9	Confident	86.3	Confident	3 Å²	3	95.4 Å²	95.4	2%	0.016	42%	0.42	C	S	.	.	S	Bend	trans	-90.1	152.8	171	-70.9	162.7	0	0	0	111.6	L200 M209 V213 K214 H220 R221 A224	L200-L216 HydrophobicContact CD1-CD2 3.41Å; L200-L216 VanDerWaalsContact CD1-CD2 3.41Å; M209-L216 HydrophobicContact CB-CD2 4.37Å; M209-L216 HydrophobicContact CB-CG 4.23Å; M209-L216 HydrophobicContact CE-CD2 3.35Å; M209-L216 HydrophobicContact CE-CG 4.38Å; V213-L216 WeakPolarHBondContact O-CB 3.48Å; V213-L216 PolarHBondContact O-N 2.8Å; K214-L216 VanDerWaalsContact C-N 3.29Å; L216-H220 HydrophobicContact CB-CB 4.43Å; L216-R221 HydrophobicContact CB-CG 4.33Å; L216-R221 PolarHBondContact O-NE 3.08Å; L216-R221 PolarHBondContact O-NH2 3.05Å; L216-A224 HydrophobicContact CD1-CB 3.21Å
217	P	89.5	Confident	86	Confident	62 Å²	62	93.1 Å²	93.1	40%	0.403	42%	0.417	S	S	.	.			trans	-55.5	145.6	167.4	-23.6	34.6	0	0	0	111.3	L200 R219 H220 R221	L200-P217 HydrophobicContact CD2-CG 4.23Å; P217-R219 VanDerWaalsContact C-N 3.32Å; P217-R219 PolarHBondContact O-N 2.83Å; P217-H220 WeakPolarHBondContact O-CA 3.42Å; P217-H220 WeakPolarHBondContact O-CB 3.36Å; P217-H220 PolarHBondContact O-N 3.28Å; P217-R221 WeakPolarHBondContact O-CG 3.43Å; P217-R221 PolarHBondContact O-N 3.08Å
218	R	89.7	Confident	85.8	Confident	178 Å²	178	82.9 Å²	82.9	67%	0.672	38%	0.38	S	S	*	.	H	α-helix	trans	-51.6	-45.6	-173	-70.5	-172.4	-177.8	-161	2	113.5	H220 R221	R218-H220 PolarHBondContact O-N 3.04Å; R218-H220 VanDerWaalsContact O-N 3.12Å; R218-R221 WeakPolarHBondContact O-CB 3.42Å; R218-R221 PolarHBondContact O-N 3.15Å; R218-R221 VanDerWaalsContact O-N 3.1Å
219	R	88.3	Confident	85.7	Confident	241 Å²	241	89 Å²	89	91%	0.909	40%	0.403	S	S	*	.	H	α-helix	trans	-58.9	-24.3	178.5	-66.9	-175.6	179.1	179.3	-2.3	113.8	P217	P217-R219 VanDerWaalsContact C-N 3.32Å; P217-R219 PolarHBondContact O-N 2.83Å
220	H	85.4	Confident	85.5	Confident	69 Å²	69	96.9 Å²	96.9	32%	0.319	44%	0.437	S	S	.	.	H	α-helix	trans	-97.3	-5.2	-177.4	-68.6	-45.5	0	0	0	113.6	F196 L216 P217 R218 A224	F196-H220 HydrophobicContact CE1-CB 3.86Å; F196-H220 VanDerWaalsContact CE1-O 3.29Å; F196-H220 WeakPolarHBondContact CE1-O 3.36Å; F196-H220 HydrophobicContact CE2-CB 4.42Å; F196-H220 AromaticContact CE2-ND1 3.48Å; F196-H220 WeakPolarHBondContact CE2-ND1 3.42Å; F196-H220 HydrophobicContact CZ-CB 3.38Å; F196-H220 AromaticContact CZ-CG 3.54Å; F196-H220 AromaticContact CZ-ND1 3.28Å; F196-H220 VanDerWaalsContact CZ-ND1 3.28Å; F196-H220 WeakPolarHBondContact CZ-ND1 3.38Å; F196-H220 WeakPolarHBondContact CZ-O 3.37Å; L216-H220 HydrophobicContact CB-CB 4.43Å; P217-H220 WeakPolarHBondContact O-CA 3.42Å; P217-H220 WeakPolarHBondContact O-CB 3.36Å; P217-H220 PolarHBondContact O-N 3.28Å; R218-H220 PolarHBondContact O-N 3.04Å; R218-H220 VanDerWaalsContact O-N 3.12Å; H220-A224 PolarHBondContact O-N 3.3Å
221	R	89.6	Confident	85.6	Confident	71 Å²	71	97.1 Å²	97.1	27%	0.268	44%	0.439	S	S	.	.	H	α-helix	trans	-69.5	-47.6	-174.1	-67.8	-170.2	-176.6	170.7	-2.2	112.5	V213 K214 L216 P217 R218 R223 A224 E225	V213-R221 HydrophobicContact CG1-CB 3.38Å; V213-R221 HydrophobicContact CG1-CG 3.59Å; K214-R221 PolarHBondContact O-NH2 2.84Å; L216-R221 HydrophobicContact CB-CG 4.33Å; L216-R221 PolarHBondContact O-NE 3.08Å; L216-R221 PolarHBondContact O-NH2 3.05Å; P217-R221 WeakPolarHBondContact O-CG 3.43Å; P217-R221 PolarHBondContact O-N 3.08Å; R218-R221 WeakPolarHBondContact O-CB 3.42Å; R218-R221 PolarHBondContact O-N 3.15Å; R218-R221 VanDerWaalsContact O-N 3.1Å; R221-R223 PolarHBondContact O-N 2.95Å; R221-A224 CarbonylContact O-C 3.53Å; R221-A224 WeakPolarHBondContact O-CA 3.49Å; R221-A224 WeakPolarHBondContact O-CB 3.46Å; R221-A224 PolarHBondContact O-N 3.07Å; R221-E225 WeakPolarHBondContact O-CG 3.45Å; R221-E225 PolarHBondContact O-N 3.13Å
222	H	88.6	Confident	85.5	Confident	155 Å²	155	99.3 Å²	99.3	72%	0.718	46%	0.459	S	S	*	.	H	α-helix	trans	-56.9	-46.6	-178.5	-175.4	56.5	0	0	0	112.8	A224 E225	H222-A224 VanDerWaalsContact C-N 3.27Å; H222-A224 PolarHBondContact O-N 2.86Å; H222-E225 PolarHBondContact O-N 3.03Å
223	R	84.5	Confident	84.7	Confident	148 Å²	148	101.2 Å²	101.2	56%	0.558	47%	0.466	S	S	*	.	H	α-helix	trans	-65.5	-30.3	176.2	-172.7	169.8	-179.4	169.5	5.3	113.1	F196 R221	F196-R223 HydrophobicContact CD1-CG 4.43Å; F196-R223 HydrophobicContact CD2-CG 4.34Å; F196-R223 HydrophobicContact CE1-CB 4.19Å; F196-R223 HydrophobicContact CE1-CG 4.42Å; F196-R223 HydrophobicContact CE2-CB 4.4Å; F196-R223 HydrophobicContact CE2-CG 4.33Å; F196-R223 HydrophobicContact CG-CG 4.35Å; F196-R223 HydrophobicContact CZ-CB 4Å; F196-R223 HydrophobicContact CZ-CG 4.32Å; R221-R223 PolarHBondContact O-N 2.95Å
224	A	85.9	Confident	83.5	Confident	0 Å²	0	111.8 Å²	111.8	0%	0	50%	0.503	C	S	.	.	H	α-helix	trans	-79.7	-31.8	177.9	0	0	0	0	0	112.8	F196 L216 H220 R221 H222 G226 L227 I228	F196-A224 HydrophobicContact CE1-CB 4.18Å; L216-A224 HydrophobicContact CD1-CB 3.21Å; H220-A224 PolarHBondContact O-N 3.3Å; R221-A224 CarbonylContact O-C 3.53Å; R221-A224 WeakPolarHBondContact O-CA 3.49Å; R221-A224 WeakPolarHBondContact O-CB 3.46Å; R221-A224 PolarHBondContact O-N 3.07Å; H222-A224 VanDerWaalsContact C-N 3.27Å; H222-A224 PolarHBondContact O-N 2.86Å; A224-G226 PolarHBondContact O-N 2.82Å; A224-L227 WeakPolarHBondContact O-CB 3.38Å; A224-L227 PolarHBondContact O-N 3.05Å; A224-I228 VanDerWaalsContact O-CG1 3.32Å; A224-I228 WeakPolarHBondContact O-CG1 3.27Å; A224-I228 PolarHBondContact O-N 2.74Å
225	E	87.3	Confident	82.3	Confident	80 Å²	80	109.5 Å²	109.5	37%	0.374	51%	0.508	S	S	.	.	H	α-helix	trans	-54	-51.8	176.7	-77.7	158.3	-174.1	0	0	110.8	V213 R221 H222 L227 I228 E229	V213-E225 HydrophobicContact CB-CG 4.37Å; V213-E225 HydrophobicContact CG1-CG 3.86Å; V213-E225 HydrophobicContact CG2-CG 3.72Å; R221-E225 WeakPolarHBondContact O-CG 3.45Å; R221-E225 PolarHBondContact O-N 3.13Å; H222-E225 PolarHBondContact O-N 3.03Å; E225-L227 PolarHBondContact O-N 3.37Å; E225-I228 PolarHBondContact O-N 3.08Å; E225-E229 WeakPolarHBondContact O-CG 3.28Å; E225-E229 PolarHBondContact O-N 3.3Å
226	G	84.2	Confident	81.1	Confident	32 Å²	32	110 Å²	110	33%	0.33	51%	0.514	S	S	.	.	H	α-helix	trans	-65.3	-20.9	176.8	0	0	0	0	0	115	A224 K230	A224-G226 PolarHBondContact O-N 2.82Å; G226-K230 WeakPolarHBondContact O-CD 3.14Å; G226-K230 VanDerWaalsContact O-CG 3.29Å; G226-K230 WeakPolarHBondContact O-CG 3.43Å
227	L	81.6	Confident	79.9	Confident	83 Å²	83	115.5 Å²	115.5	44%	0.435	55%	0.55	S	S	.	*	H	α-helix	trans	-81	-34.6	172.1	-69.7	172.8	0	0	0	111.9	F196 A224 E225 S231	F196-L227 HydrophobicContact CB-CD1 4.07Å; F196-L227 HydrophobicContact CD1-CD1 4.37Å; A224-L227 WeakPolarHBondContact O-CB 3.38Å; A224-L227 PolarHBondContact O-N 3.05Å; E225-L227 PolarHBondContact O-N 3.37Å; L227-S231 PolarHBondContact O-N 3.14Å
228	I	81.1	Confident	78.6	Confident	35 Å²	35	122.8 Å²	122.8	18%	0.179	58%	0.576	C	S	.	*	H	α-helix	trans	-76	-37.5	179.5	-65.3	-176.1	0	0	0	110.7	S210 V213 A224 E225 K230 S231	S210-I228 VanDerWaalsContact O-CD1 3.32Å; S210-I228 WeakPolarHBondContact O-CD1 3.13Å; S210-I228 VanDerWaalsContact O-CG1 3.27Å; S210-I228 WeakPolarHBondContact O-CG1 3.49Å; V213-I228 HydrophobicContact CG2-CD1 3.51Å; A224-I228 VanDerWaalsContact O-CG1 3.32Å; A224-I228 WeakPolarHBondContact O-CG1 3.27Å; A224-I228 PolarHBondContact O-N 2.74Å; E225-I228 PolarHBondContact O-N 3.08Å; I228-K230 PolarHBondContact O-N 3.37Å; I228-S231 WeakPolarHBondContact O-CB 3.16Å; I228-S231 PolarHBondContact O-N 3.11Å; I228-S231 PolarHBondContact O-OG 2.85Å
229	E	82.9	Confident	77.5	Confident	164 Å²	164	119.6 Å²	119.6	77%	0.766	58%	0.579	S	S	*	*	H	α-helix	trans	-58.6	-35.1	173	-74.7	172.1	-176.4	0	0	111.9	E225 S231	E225-E229 WeakPolarHBondContact O-CG 3.28Å; E225-E229 PolarHBondContact O-N 3.3Å; E229-S231 PolarHBondContact O-N 2.88Å
230	K	81.8	Confident	77	Confident	177 Å²	177	116.9 Å²	116.9	77%	0.77	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-8.4	174	-67.2	177.2	-175.6	-169.7	0	113.8	G226 I228	G226-K230 WeakPolarHBondContact O-CD 3.14Å; G226-K230 VanDerWaalsContact O-CG 3.29Å; G226-K230 WeakPolarHBondContact O-CG 3.43Å; I228-K230 PolarHBondContact O-N 3.37Å
231	S	78.2	Confident	76.4	Confident	40 Å²	40	123.2 Å²	123.2	28%	0.28	59%	0.59	S	S	.	*			trans	-93.7	132.9	-174.9	77.3	0	0	0	0	112.1	L227 I228 E229 H233	L227-S231 PolarHBondContact O-N 3.14Å; I228-S231 WeakPolarHBondContact O-CB 3.16Å; I228-S231 PolarHBondContact O-N 3.11Å; I228-S231 PolarHBondContact O-OG 2.85Å; E229-S231 PolarHBondContact O-N 2.88Å; S231-H233 PolarHBondContact O-N 2.93Å; S231-H233 PolarHBondContact OG-CD2 3.44Å; S231-H233 VanDerWaalsContact OG-CD2 3.26Å
232	T	75.9	Confident	75.5	Confident	144 Å²	144	126.6 Å²	126.6	88%	0.883	61%	0.609	S	S	*	*			trans	-84.2	37.8	-178.7	50.9	0	0	0	0	113.2
233	H	67.7	Low	74.7	Confident	101 Å²	101	128.8 Å²	128.8	47%	0.468	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-81.9	128.4	-173.6	-70.8	-48.3	0	0	0	113.1	H211 S231	H211-H233 VanDerWaalsContact CE1-CB 3.49Å; H211-H233 WeakPolarHBondContact CE1-CB 3.2Å; H211-H233 AromaticContact CE1-CD2 3.25Å; H211-H233 PolarHBondContact CE1-CD2 3.38Å; H211-H233 AromaticContact CE1-CE1 3.64Å; H211-H233 AromaticContact CE1-CG 3.12Å; H211-H233 AromaticContact CE1-ND1 3.39Å; H211-H233 PolarHBondContact CE1-ND1 3.27Å; H211-H233 AromaticContact CE1-NE2 3.55Å; H211-H233 WeakPolarHBondContact ND1-CB 3.29Å; H211-H233 AromaticContact ND1-CD2 3.24Å; H211-H233 PolarHBondContact ND1-CD2 3.14Å; H211-H233 AromaticContact ND1-CG 3.25Å; H211-H233 AromaticContact ND1-NE2 3.96Å; S231-H233 PolarHBondContact O-N 2.93Å; S231-H233 PolarHBondContact OG-CD2 3.44Å; S231-H233 VanDerWaalsContact OG-CD2 3.26Å
234	R	63.1	Low	74.3	Confident	244 Å²	244	129.6 Å²	129.6	92%	0.921	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-57.8	140.7	176	-72.5	-173.8	179.6	-172.8	0.2	112.3
235	S	64.4	Low	74.1	Confident	114 Å²	114	136.6 Å²	136.6	80%	0.797	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-61.2	146.6	172.3	55.7	0	0	0	0	110.9
236	K	65.6	Low	73.7	Confident	168 Å²	168	138 Å²	138	73%	0.73	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-69.4	141.6	-178.8	-89.2	-178.4	176.7	176.3	0	111.1
237	P	63.5	Low	73.4	Confident	119 Å²	119	139.8 Å²	139.8	77%	0.773	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-63.5	163	174.5	26.5	-33.2	0	0	0	112
238	F	60.5	Low	73.4	Confident	216 Å²	216	138.8 Å²	138.8	95%	0.947	66%	0.659	S	S	*	*			trans	-45.7	143.1	-168.9	-73.8	-81.8	0	0	0	115.7
239	C	67.5	Low	73.6	Confident	110 Å²	110	139.4 Å²	139.4	74%	0.743	66%	0.663	S	S	*	*			trans	-74.7	128.1	-166.9	-169.2	0	0	0	0	112.6	R241	C239-R241 HydrophobicContact CB-CB 4.46Å; C239-R241 PolarHBondContact O-N 2.82Å
240	R	76.8	Confident	73.6	Confident	185 Å²	185	132.6 Å²	132.6	70%	0.698	63%	0.632	S	S	*	*			trans	-68.8	29	172.2	-66	-177.9	178.5	178	0.2	114	Q242 R244	R240-Q242 PolarHBondContact O-N 3.39Å; R240-R244 WeakPolarHBondContact O-CG 3.16Å; R240-R244 PolarHBondContact O-N 3.27Å
241	R	74.4	Confident	73.5	Confident	201 Å²	201	132.2 Å²	132.2	76%	0.758	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	-46.1	-168.1	-167.1	176.7	179.7	-178.7	-1.2	112.6	C239 R244 R245	C239-R241 HydrophobicContact CB-CB 4.46Å; C239-R241 PolarHBondContact O-N 2.82Å; R241-R244 CarbonylContact O-C 3.41Å; R241-R244 PolarHBondContact O-N 3.41Å; R241-R244 VanDerWaalsContact O-N 3.15Å; R241-R245 PolarHBondContact O-N 3.05Å
242	Q	69.5	Low	73.9	Confident	142 Å²	142	133 Å²	133	66%	0.664	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-66	-43.6	-175.4	-167.7	176.1	7.3	0	0	112.9	R240 R244 R245 N248	R240-Q242 PolarHBondContact O-N 3.39Å; Q242-R244 PolarHBondContact O-N 3.35Å; Q242-R245 WeakPolarHBondContact O-CG 3.34Å; Q242-R245 PolarHBondContact O-N 3.25Å; Q242-N248 PolarHBondContact O-ND2 2.72Å
243	R	72.1	Confident	74.4	Confident	202 Å²	202	128.7 Å²	128.7	76%	0.762	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-65.7	-18.6	175.1	-66.7	-173.9	-176.4	-178.9	2.7	113.3
244	R	77.3	Confident	75.1	Confident	164 Å²	164	124.4 Å²	124.4	62%	0.619	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-105.5	17.2	-179	-68.6	-171.6	171.1	-168.8	-1.6	113.2	R240 R241 Q242 L249	R240-R244 WeakPolarHBondContact O-CG 3.16Å; R240-R244 PolarHBondContact O-N 3.27Å; R241-R244 CarbonylContact O-C 3.41Å; R241-R244 PolarHBondContact O-N 3.41Å; R241-R244 VanDerWaalsContact O-N 3.15Å; Q242-R244 PolarHBondContact O-N 3.35Å; R244-L249 HydrophobicContact CB-CD1 4.36Å; R244-L249 VanDerWaalsContact O-CD1 3.29Å; R244-L249 WeakPolarHBondContact O-CD1 3.16Å
245	R	80.1	Confident	76.2	Confident	147 Å²	147	120.7 Å²	120.7	56%	0.555	56%	0.56	S	S	*	*			trans	-61.8	140.7	169.1	-72.8	-176.7	177.6	-168	1.2	109.7	R241 Q242 S247 N248 L249	R241-R245 PolarHBondContact O-N 3.05Å; Q242-R245 WeakPolarHBondContact O-CG 3.34Å; Q242-R245 PolarHBondContact O-N 3.25Å; R245-S247 VanDerWaalsContact C-N 3.35Å; R245-S247 PolarHBondContact O-N 2.78Å; R245-N248 PolarHBondContact O-N 3Å; R245-L249 PolarHBondContact O-N 3.11Å
246	P	78.9	Confident	77.2	Confident	109 Å²	109	122 Å²	122	71%	0.708	55%	0.548	S	S	*	.	H	α-helix	trans	-55.9	-43.3	-174.1	-28	35.4	0	0	0	114.3	N248 L249 L250	P246-N248 PolarHBondContact O-N 2.68Å; P246-L249 WeakPolarHBondContact O-CB 2.98Å; P246-L249 PolarHBondContact O-N 2.85Å; P246-L250 PolarHBondContact O-N 3.43Å
247	S	77.7	Confident	78.2	Confident	70 Å²	70	115.8 Å²	115.8	49%	0.49	52%	0.521	S	S	.	.	H	α-helix	trans	-60.7	-45.6	178	52.9	0	0	0	0	112.4	R245 L249 L250 R251	R245-S247 VanDerWaalsContact C-N 3.35Å; R245-S247 PolarHBondContact O-N 2.78Å; S247-L249 VanDerWaalsContact C-N 3.33Å; S247-L249 PolarHBondContact O-N 3.01Å; S247-L250 PolarHBondContact O-N 3.22Å; S247-R251 PolarHBondContact O-N 2.96Å
248	N	82.4	Confident	79	Confident	62 Å²	62	119 Å²	119	33%	0.332	52%	0.518	S	S	.	.	H	α-helix	trans	-64.4	-38.4	176.1	-71.8	-13.3	0	0	0	111.7	Q242 R245 P246 L252	Q242-N248 PolarHBondContact O-ND2 2.72Å; R245-N248 PolarHBondContact O-N 3Å; P246-N248 PolarHBondContact O-N 2.68Å; N248-L252 WeakPolarHBondContact O-CB 3.35Å; N248-L252 WeakPolarHBondContact O-CD1 3.41Å; N248-L252 WeakPolarHBondContact O-CG 2.9Å; N248-L252 PolarHBondContact O-N 3.49Å
249	L	84.8	Confident	80.2	Confident	48 Å²	48	116.2 Å²	116.2	25%	0.251	51%	0.506	S	S	.	.	H	α-helix	trans	-64.2	-43.7	176.9	-80	164.8	0	0	0	112	R244 R245 P246 S247 L252 Y253	R244-L249 HydrophobicContact CB-CD1 4.36Å; R244-L249 VanDerWaalsContact O-CD1 3.29Å; R244-L249 WeakPolarHBondContact O-CD1 3.16Å; R245-L249 PolarHBondContact O-N 3.11Å; P246-L249 WeakPolarHBondContact O-CB 2.98Å; P246-L249 PolarHBondContact O-N 2.85Å; S247-L249 VanDerWaalsContact C-N 3.33Å; S247-L249 PolarHBondContact O-N 3.01Å; L249-L252 PolarHBondContact O-N 3.47Å; L249-Y253 HydrophobicContact CB-CE2 4.33Å; L249-Y253 HydrophobicContact CD2-CE1 4.21Å; L249-Y253 WeakPolarHBondContact O-CD1 3.38Å; L249-Y253 WeakPolarHBondContact O-CD2 3.31Å; L249-Y253 PolarHBondContact O-N 3.43Å
250	L	82.7	Confident	81.1	Confident	22 Å²	22	111.4 Å²	111.4	12%	0.115	47%	0.474	C	S	.	.	H	α-helix	trans	-60	-50.5	178	-178.5	61.1	0	0	0	111.1	P246 S247 L252 Y253 I254 V424 L427	P246-L250 PolarHBondContact O-N 3.43Å; S247-L250 PolarHBondContact O-N 3.22Å; L250-L252 VanDerWaalsContact C-N 3.29Å; L250-L252 PolarHBondContact O-N 3.14Å; L250-Y253 WeakPolarHBondContact O-CB 3.35Å; L250-Y253 PolarHBondContact O-N 3.46Å; L250-I254 HydrophobicContact CD1-CD1 4.41Å; L250-I254 HydrophobicContact CG-CD1 4.2Å; L250-I254 WeakPolarHBondContact O-CG1 3.5Å; L250-I254 PolarHBondContact O-N 2.67Å; L250-V424 HydrophobicContact CD2-CG1 4.33Å; L250-L427 HydrophobicContact CD1-CD1 3.65Å
251	R	81.5	Confident	81.7	Confident	168 Å²	168	107.4 Å²	107.4	63%	0.634	46%	0.459	S	S	*	.	H	α-helix	trans	-58.9	-40.3	176.1	-69.6	-177.7	-176.3	168.8	0.9	112.3	S247 Y253 R255	S247-R251 PolarHBondContact O-N 2.96Å; R251-Y253 VanDerWaalsContact C-N 3.34Å; R251-Y253 PolarHBondContact O-N 3.18Å; R251-R255 WeakPolarHBondContact O-CB 3.5Å; R251-R255 PolarHBondContact O-N 3.08Å
252	L	85.2	Confident	82.5	Confident	58 Å²	58	99.6 Å²	99.6	30%	0.304	43%	0.429	S	S	.	.	H	α-helix	trans	-65.9	-34.5	175.6	-76.3	170.2	0	0	0	112.7	N248 L249 L250 R256	N248-L252 WeakPolarHBondContact O-CB 3.35Å; N248-L252 WeakPolarHBondContact O-CD1 3.41Å; N248-L252 WeakPolarHBondContact O-CG 2.9Å; N248-L252 PolarHBondContact O-N 3.49Å; L249-L252 PolarHBondContact O-N 3.47Å; L250-L252 VanDerWaalsContact C-N 3.29Å; L250-L252 PolarHBondContact O-N 3.14Å; L252-R256 WeakPolarHBondContact O-CD 3.44Å; L252-R256 WeakPolarHBondContact O-CG 3.49Å; L252-R256 PolarHBondContact O-N 3.15Å; L252-R256 VanDerWaalsContact O-N 3.14Å
253	Y	87.3	Confident	83.5	Confident	53 Å²	53	93.6 Å²	93.6	21%	0.208	40%	0.402	C	S	.	.	H	α-helix	trans	-68.2	-49.5	175.9	-64	-20.9	0	0	0	111.1	L249 L250 R251 R255 R256 Q257 W262 I267	L249-Y253 HydrophobicContact CB-CE2 4.33Å; L249-Y253 HydrophobicContact CD2-CE1 4.21Å; L249-Y253 WeakPolarHBondContact O-CD1 3.38Å; L249-Y253 WeakPolarHBondContact O-CD2 3.31Å; L249-Y253 PolarHBondContact O-N 3.43Å; L250-Y253 WeakPolarHBondContact O-CB 3.35Å; L250-Y253 PolarHBondContact O-N 3.46Å; R251-Y253 VanDerWaalsContact C-N 3.34Å; R251-Y253 PolarHBondContact O-N 3.18Å; Y253-R255 VanDerWaalsContact C-N 3.28Å; Y253-R255 PolarHBondContact O-N 2.86Å; Y253-R256 PolarHBondContact O-N 3.47Å; Y253-Q257 WeakPolarHBondContact O-CG 3.38Å; Y253-Q257 PolarHBondContact O-N 2.84Å; Y253-W262 AromaticContact CD1-CH2 3.98Å; Y253-W262 HydrophobicContact CD1-CH2 3.98Å; Y253-W262 AromaticContact CD1-CZ3 3.7Å; Y253-W262 HydrophobicContact CD1-CZ3 3.7Å; Y253-W262 HydrophobicContact CE1-CZ3 4.37Å; Y253-W262 AromaticContact CG-CZ3 3.92Å; Y253-W262 HydrophobicContact CG-CZ3 3.92Å; Y253-I267 HydrophobicContact CD2-CD1 4.03Å; Y253-I267 HydrophobicContact CE2-CD1 3.52Å; Y253-I267 HydrophobicContact CE2-CG1 4.48Å
254	I	82.5	Confident	84.4	Confident	10 Å²	10	85.2 Å²	85.2	5%	0.051	37%	0.371	C	S	.	.	H	α-helix	trans	-55.1	-46.6	175.5	-64	170	0	0	0	110.3	L250 R256 Q257 R258 T421 V424 F430	L250-I254 HydrophobicContact CD1-CD1 4.41Å; L250-I254 HydrophobicContact CG-CD1 4.2Å; L250-I254 WeakPolarHBondContact O-CG1 3.5Å; L250-I254 PolarHBondContact O-N 2.67Å; I254-R256 VanDerWaalsContact C-N 3.3Å; I254-R256 PolarHBondContact O-N 3.38Å; I254-Q257 PolarHBondContact O-N 2.83Å; I254-R258 PolarHBondContact O-N 3.37Å; I254-T421 HydrophobicContact CG2-CG2 3.65Å; I254-V424 HydrophobicContact CD1-CB 4.27Å; I254-V424 HydrophobicContact CD1-CG1 4.05Å; I254-F430 HydrophobicContact CB-CE2 4.46Å; I254-F430 HydrophobicContact CD1-CD2 3.9Å; I254-F430 HydrophobicContact CD1-CE2 4.21Å; I254-F430 HydrophobicContact CG1-CD2 3.89Å; I254-F430 HydrophobicContact CG1-CE2 3.82Å; I254-F430 HydrophobicContact CG1-CG 4.46Å; I254-F430 HydrophobicContact CG1-CZ 4.33Å; I254-F430 HydrophobicContact CG2-CE2 3.99Å
255	R	85.2	Confident	85.3	Confident	166 Å²	166	77.5 Å²	77.5	63%	0.626	34%	0.342	S	S	*	.	H	α-helix	trans	-59.5	-38.7	178	-165.9	-178.7	86.3	166.2	8.2	112.9	R251 Y253	R251-R255 WeakPolarHBondContact O-CB 3.5Å; R251-R255 PolarHBondContact O-N 3.08Å; Y253-R255 VanDerWaalsContact C-N 3.28Å; Y253-R255 PolarHBondContact O-N 2.86Å
256	R	86.7	Confident	85.9	Confident	143 Å²	143	71 Å²	71	54%	0.54	32%	0.318	S	S	.	.	H	α-helix	trans	-75.9	-30.5	-179.4	-72.9	169.8	-178	-160.2	-1.6	112.8	L252 Y253 I254 R258 K259 W262	L252-R256 WeakPolarHBondContact O-CD 3.44Å; L252-R256 WeakPolarHBondContact O-CG 3.49Å; L252-R256 PolarHBondContact O-N 3.15Å; L252-R256 VanDerWaalsContact O-N 3.14Å; Y253-R256 PolarHBondContact O-N 3.47Å; I254-R256 VanDerWaalsContact C-N 3.3Å; I254-R256 PolarHBondContact O-N 3.38Å; R256-R258 PolarHBondContact O-N 2.99Å; R256-K259 PolarHBondContact O-N 3.48Å; R256-W262 HydrophobicContact CB-CH2 3.96Å; R256-W262 HydrophobicContact CB-CZ2 3.58Å; R256-W262 HydrophobicContact CG-CZ2 4.48Å
257	Q	85.5	Confident	86.6	Confident	37 Å²	37	68.4 Å²	68.4	17%	0.173	30%	0.298	C	S	.	.	H	α-helix	trans	-68.6	-18.8	178.8	-77	173.6	-6.5	0	0	113.1	Y253 I254 K259 A260 W262	Y253-Q257 WeakPolarHBondContact O-CG 3.38Å; Y253-Q257 PolarHBondContact O-N 2.84Å; I254-Q257 PolarHBondContact O-N 2.83Å; Q257-K259 PolarHBondContact O-N 2.77Å; Q257-K259 VanDerWaalsContact O-N 3.14Å; Q257-A260 CarbonylContact C-O 3.3Å; Q257-A260 WeakPolarHBondContact CA-O 3.42Å; Q257-A260 CarbonylContact O-C 3.44Å; Q257-A260 VanDerWaalsContact O-C 3.28Å; Q257-A260 PolarHBondContact O-N 3.2Å; Q257-W262 HydrophobicContact CG-CB 3.93Å; Q257-W262 HydrophobicContact CG-CD2 3.52Å; Q257-W262 HydrophobicContact CG-CE3 3.97Å; Q257-W262 HydrophobicContact CG-CG 3.5Å; Q257-W262 VanDerWaalsContact CG-CG 3.5Å
258	R	81.2	Confident	87.5	Confident	185 Å²	185	66.3 Å²	66.3	70%	0.698	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-29.7	174.2	-66.1	-175.7	179.6	-178.9	-3	114	I254 R256	I254-R258 PolarHBondContact O-N 3.37Å; R256-R258 PolarHBondContact O-N 2.99Å
259	K	84.3	Confident	88.2	Confident	159 Å²	159	63.7 Å²	63.7	69%	0.691	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-40.7	178.1	-167.7	-169.5	-178.1	-157.6	0	112.4	R256 Q257 E277	R256-K259 PolarHBondContact O-N 3.48Å; Q257-K259 PolarHBondContact O-N 2.77Å; Q257-K259 VanDerWaalsContact O-N 3.14Å; K259-E277 WeakPolarHBondContact CE-OE2 3.4Å; K259-E277 IonicContact NZ-OE1 3.59Å; K259-E277 IonicContact NZ-OE2 2.8Å; K259-E277 PolarHBondContact NZ-OE2 2.78Å
260	A	87.5	Confident	88.8	Confident	9 Å²	9	63.4 Å²	63.4	7%	0.074	27%	0.269	C	S	.	.	S	Bend	trans	-155.3	138.6	-175.6	0	0	0	0	0	109.4	Q257 E277 G280 K282	Q257-A260 CarbonylContact C-O 3.3Å; Q257-A260 WeakPolarHBondContact CA-O 3.42Å; Q257-A260 CarbonylContact O-C 3.44Å; Q257-A260 VanDerWaalsContact O-C 3.28Å; Q257-A260 PolarHBondContact O-N 3.2Å; A260-E277 HydrophobicContact CB-CG 4.42Å; A260-G280 WeakPolarHBondContact CA-O 3.28Å; A260-K282 HydrophobicContact CB-CB 4.38Å
261	R	88.3	Confident	89.4	Confident	100 Å²	100	69.3 Å²	69.3	38%	0.377	29%	0.294	S	S	.	.	B	Isolated β-bridge	trans	-68.2	145.2	-179.5	-68.1	-166.4	-177.4	-172.2	14.9	111.5	G280 Y281 K282 E453 D454	R261-G280 PolarHBondContact N-O 3.34Å; R261-Y281 HydrophobicContact CB-CD1 3.57Å; R261-Y281 HydrophobicContact CB-CE1 3.68Å; R261-Y281 HydrophobicContact CB-CG 4.37Å; R261-Y281 HydrophobicContact CG-CE1 4.44Å; R261-Y281 CarbonylContact O-C 3.52Å; R261-Y281 WeakPolarHBondContact O-CA 3.34Å; R261-K282 PolarHBondContact O-N 3.17Å; R261-E453 IonicContact CZ-OE2 3.89Å; R261-E453 IonicContact NH1-OE2 3.05Å; R261-E453 PolarHBondContact NH1-OE2 3.43Å; R261-E453 IonicContact NH2-OE2 3.51Å; R261-E453 PolarHBondContact NH2-OE2 3.01Å; R261-D454 IonicContact CZ-OD2 3.36Å; R261-D454 IonicContact NH1-OD2 3.15Å; R261-D454 PolarHBondContact NH1-OD2 3.49Å
262	W	91.2	Very high	90	Very high	38 Å²	38	66.3 Å²	66.3	14%	0.144	28%	0.283	C	S	.	.			trans	-115.9	125.2	-179.3	-68.9	10	0	0	0	109.5	Y253 R256 Q257 H266	Y253-W262 AromaticContact CD1-CH2 3.98Å; Y253-W262 HydrophobicContact CD1-CH2 3.98Å; Y253-W262 AromaticContact CD1-CZ3 3.7Å; Y253-W262 HydrophobicContact CD1-CZ3 3.7Å; Y253-W262 HydrophobicContact CE1-CZ3 4.37Å; Y253-W262 AromaticContact CG-CZ3 3.92Å; Y253-W262 HydrophobicContact CG-CZ3 3.92Å; R256-W262 HydrophobicContact CB-CH2 3.96Å; R256-W262 HydrophobicContact CB-CZ2 3.58Å; R256-W262 HydrophobicContact CG-CZ2 4.48Å; Q257-W262 HydrophobicContact CG-CB 3.93Å; Q257-W262 HydrophobicContact CG-CD2 3.52Å; Q257-W262 HydrophobicContact CG-CE3 3.97Å; Q257-W262 HydrophobicContact CG-CG 3.5Å; Q257-W262 VanDerWaalsContact CG-CG 3.5Å; W262-H266 HydrophobicContact CB-CB 3.79Å; W262-H266 AromaticContact CD2-CD2 3.26Å; W262-H266 AromaticContact CD2-CG 3.73Å; W262-H266 AromaticContact CD2-NE2 3.52Å; W262-H266 AromaticContact CE2-CD2 3.8Å; W262-H266 AromaticContact CE2-NE2 3.52Å; W262-H266 AromaticContact CE3-CD2 3.22Å; W262-H266 AromaticContact CE3-CG 3.95Å; W262-H266 AromaticContact CE3-NE2 3.81Å; W262-H266 HydrophobicContact CG-CB 4.24Å; W262-H266 AromaticContact CG-CD2 3.72Å; W262-H266 AromaticContact CG-CG 3.65Å; W262-H266 AromaticContact CG-ND1 3.86Å; W262-H266 AromaticContact CZ2-NE2 3.8Å; W262-H266 AromaticContact CZ3-CD2 3.72Å
263	L	92.2	Very high	90.6	Very high	16 Å²	16	63.8 Å²	63.8	8%	0.084	27%	0.269	C	S	.	.			trans	-61.6	161.6	170.2	-56.4	-177	0	0	0	111.4	T265 H266 Y281 L283 Y310	L263-T265 PolarHBondContact O-N 3.5Å; L263-H266 WeakPolarHBondContact O-CB 3.41Å; L263-H266 PolarHBondContact O-N 2.81Å; L263-Y281 HydrophobicContact CD2-CD1 4.08Å; L263-Y281 HydrophobicContact CD2-CE1 4.37Å; L263-L283 HydrophobicContact CD1-CD2 3.61Å; L263-L283 HydrophobicContact CG-CD2 4.06Å; L263-Y310 HydrophobicContact CD1-CD1 4.49Å
264	E	90.7	Very high	91.1	Very high	25 Å²	25	65.9 Å²	65.9	12%	0.117	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-36.4	179.1	-63	-151.4	165	0	0	113.1	H266 R431 L457 G641 G643 M644	E264-H266 VanDerWaalsContact C-N 3.27Å; E264-H266 PolarHBondContact O-N 2.71Å; E264-R431 IonicContact OE1-CZ 3.72Å; E264-R431 VanDerWaalsContact OE1-CZ 3.3Å; E264-R431 IonicContact OE1-NE 2.72Å; E264-R431 IonicContact OE1-NH1 3.79Å; E264-R431 PolarHBondContact OE1-NH1 2.98Å; E264-R431 IonicContact OE1-NH2 2.94Å; E264-R431 IonicContact OE2-CZ 3.59Å; E264-R431 IonicContact OE2-NH1 3.77Å; E264-R431 PolarHBondContact OE2-NH1 2.85Å; E264-R431 IonicContact OE2-NH2 3.77Å; E264-L457 HydrophobicContact CG-CD1 4.44Å; E264-L457 HydrophobicContact CG-CD2 3.89Å; E264-G641 WeakPolarHBondContact OE1-CA 3.48Å; E264-G641 PolarHBondContact OE1-N 3.11Å; E264-G643 WeakPolarHBondContact OE2-CA 3.38Å; E264-G643 PolarHBondContact OE2-N 2.9Å; E264-M644 VanDerWaalsContact O-CG 3.24Å; E264-M644 WeakPolarHBondContact O-CG 3.22Å
265	T	94.6	Very high	91.7	Very high	2 Å²	2	67.2 Å²	67.2	1%	0.012	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	2.9	-179	76.3	0	0	0	0	113.3	L263 I267 W268 H269 D307 F459 M644 W647	L263-T265 PolarHBondContact O-N 3.5Å; T265-I267 VanDerWaalsContact C-N 3.31Å; T265-I267 PolarHBondContact O-N 2.92Å; T265-W268 WeakPolarHBondContact O-CA 3.38Å; T265-W268 WeakPolarHBondContact O-CB 3.47Å; T265-W268 PolarHBondContact O-N 3.39Å; T265-H269 WeakPolarHBondContact CB-ND1 3.27Å; T265-H269 PolarHBondContact O-N 2.92Å; T265-H269 PolarHBondContact O-ND1 3.45Å; T265-H269 VanDerWaalsContact O-ND1 3.09Å; T265-H269 PolarHBondContact OG1-CE1 3.29Å; T265-H269 PolarHBondContact OG1-ND1 3.01Å; T265-D307 WeakPolarHBondContact CB-OD2 3.3Å; T265-D307 VanDerWaalsContact CG2-OD2 3.26Å; T265-D307 WeakPolarHBondContact CG2-OD2 3.31Å; T265-D307 PolarHBondContact OG1-OD2 2.92Å; T265-F459 HydrophobicContact CG2-CE1 3.98Å; T265-F459 HydrophobicContact CG2-CZ 4.15Å; T265-M644 HydrophobicContact CG2-SD 4.26Å; T265-W647 HydrophobicContact CG2-CB 3.94Å; T265-W647 HydrophobicContact CG2-CD2 3.89Å; T265-W647 HydrophobicContact CG2-CE3 4.06Å; T265-W647 HydrophobicContact CG2-CG 3.83Å
266	H	94.2	Very high	92.2	Very high	11 Å²	11	61.9 Å²	61.9	5%	0.051	27%	0.269	C	S	.	.	H	α-helix	trans	-53.5	-44.9	-172.6	177.9	83.9	0	0	0	112.8	W262 L263 E264 W268 H269 A270 M275 K282	W262-H266 HydrophobicContact CB-CB 3.79Å; W262-H266 AromaticContact CD2-CD2 3.26Å; W262-H266 AromaticContact CD2-CG 3.73Å; W262-H266 AromaticContact CD2-NE2 3.52Å; W262-H266 AromaticContact CE2-CD2 3.8Å; W262-H266 AromaticContact CE2-NE2 3.52Å; W262-H266 AromaticContact CE3-CD2 3.22Å; W262-H266 AromaticContact CE3-CG 3.95Å; W262-H266 AromaticContact CE3-NE2 3.81Å; W262-H266 HydrophobicContact CG-CB 4.24Å; W262-H266 AromaticContact CG-CD2 3.72Å; W262-H266 AromaticContact CG-CG 3.65Å; W262-H266 AromaticContact CG-ND1 3.86Å; W262-H266 AromaticContact CZ2-NE2 3.8Å; W262-H266 AromaticContact CZ3-CD2 3.72Å; L263-H266 WeakPolarHBondContact O-CB 3.41Å; L263-H266 PolarHBondContact O-N 2.81Å; E264-H266 VanDerWaalsContact C-N 3.27Å; E264-H266 PolarHBondContact O-N 2.71Å; H266-W268 VanDerWaalsContact C-N 3.26Å; H266-W268 PolarHBondContact O-N 2.74Å; H266-H269 PolarHBondContact O-N 2.89Å; H266-A270 VanDerWaalsContact O-CB 3.26Å; H266-A270 WeakPolarHBondContact O-CB 3.45Å; H266-A270 PolarHBondContact O-N 3.12Å; H266-M275 WeakPolarHBondContact ND1-CE 3.25Å; H266-K282 PolarHBondContact ND1-O 2.98Å
267	I	93.2	Very high	92.6	Very high	54 Å²	54	59.6 Å²	59.6	28%	0.277	27%	0.265	S	S	.	.	H	α-helix	trans	-64.5	-34.4	-179.9	-62.6	173.3	0	0	0	111.1	Y253 T265 K271	Y253-I267 HydrophobicContact CD2-CD1 4.03Å; Y253-I267 HydrophobicContact CE2-CD1 3.52Å; Y253-I267 HydrophobicContact CE2-CG1 4.48Å; T265-I267 VanDerWaalsContact C-N 3.31Å; T265-I267 PolarHBondContact O-N 2.92Å; I267-K271 HydrophobicContact CG2-CD 4.49Å; I267-K271 WeakPolarHBondContact O-CD 3.37Å; I267-K271 VanDerWaalsContact O-CG 3.3Å; I267-K271 WeakPolarHBondContact O-CG 3.16Å
268	W	96.3	Very high	92.8	Very high	27 Å²	27	58.8 Å²	58.8	10%	0.102	27%	0.265	C	S	.	.	H	α-helix	trans	-69.9	-43.8	177.6	-173	106.7	0	0	0	111	T265 H266 R272 F273 M644 W647 Q651 A657	T265-W268 WeakPolarHBondContact O-CA 3.38Å; T265-W268 WeakPolarHBondContact O-CB 3.47Å; T265-W268 PolarHBondContact O-N 3.39Å; H266-W268 VanDerWaalsContact C-N 3.26Å; H266-W268 PolarHBondContact O-N 2.74Å; W268-R272 VanDerWaalsContact CZ2-CD 3.49Å; W268-R272 PolarHBondContact O-NH1 2.73Å; W268-F273 HydrophobicContact CH2-CE2 4.22Å; W268-F273 HydrophobicContact CZ3-CD2 4.26Å; W268-F273 AromaticContact CZ3-CE2 3.66Å; W268-F273 HydrophobicContact CZ3-CE2 3.66Å; W268-M644 HydrophobicContact CB-CE 4.03Å; W268-M644 HydrophobicContact CB-SD 3.87Å; W268-M644 HydrophobicContact CG-CE 4.45Å; W268-W647 AromaticContact CD2-CD1 3.8Å; W268-W647 AromaticContact CD2-NE1 3.28Å; W268-W647 VanDerWaalsContact CD2-NE1 3.28Å; W268-W647 AromaticContact CE2-CD1 3.94Å; W268-W647 AromaticContact CE2-NE1 3.51Å; W268-W647 HydrophobicContact CE3-CZ2 4.31Å; W268-W647 AromaticContact CE3-NE1 3.22Å; W268-W647 AromaticContact CG-CD1 3.96Å; W268-W647 AromaticContact CG-NE1 3.92Å; W268-W647 HydrophobicContact CH2-CZ2 4.5Å; W268-W647 AromaticContact CH2-NE1 3.74Å; W268-W647 AromaticContact CZ2-NE1 3.76Å; W268-W647 AromaticContact CZ3-CZ2 3.96Å; W268-W647 HydrophobicContact CZ3-CZ2 3.96Å; W268-W647 AromaticContact CZ3-NE1 3.45Å; W268-Q651 HydrophobicContact CH2-CG 4.34Å; W268-Q651 HydrophobicContact CZ2-CG 3.77Å; W268-A657 HydrophobicContact CH2-CB 3.38Å; W268-A657 HydrophobicContact CZ3-CB 3.57Å
269	H	97.7	Very high	93.3	Very high	6 Å²	6	53.7 Å²	53.7	3%	0.028	25%	0.245	C	C	.	.	H	α-helix	trans	-67.8	-48.4	178.2	-76	80.4	0	0	0	112	T265 H266 K271 R272 F273 M275 A284 W647	T265-H269 WeakPolarHBondContact CB-ND1 3.27Å; T265-H269 PolarHBondContact O-N 2.92Å; T265-H269 PolarHBondContact O-ND1 3.45Å; T265-H269 VanDerWaalsContact O-ND1 3.09Å; T265-H269 PolarHBondContact OG1-CE1 3.29Å; T265-H269 PolarHBondContact OG1-ND1 3.01Å; H266-H269 PolarHBondContact O-N 2.89Å; H269-K271 PolarHBondContact O-N 2.93Å; H269-R272 CarbonylContact O-C 3.49Å; H269-R272 PolarHBondContact O-N 2.82Å; H269-F273 AromaticContact CD2-CD2 3.93Å; H269-F273 PolarHBondContact O-N 2.96Å; H269-M275 HydrophobicContact CB-CE 4Å; H269-M275 HydrophobicContact CB-SD 3.8Å; H269-A284 HydrophobicContact CB-CB 4.06Å; H269-A284 WeakPolarHBondContact CD2-CB 3.43Å; H269-W647 AromaticContact CE1-CE2 3.51Å; H269-W647 AromaticContact CE1-CH2 3.62Å; H269-W647 AromaticContact CE1-CZ2 3.13Å; H269-W647 WeakPolarHBondContact CE1-CZ2 3.39Å; H269-W647 AromaticContact CE1-NE1 3.97Å; H269-W647 AromaticContact NE2-CH2 3.69Å; H269-W647 AromaticContact NE2-CZ2 3.3Å; H269-W647 VanDerWaalsContact NE2-CZ2 3.3Å; H269-W647 WeakPolarHBondContact NE2-CZ2 3.39Å
270	A	96.2	Very high	93.5	Very high	42 Å²	42	48.7 Å²	48.7	35%	0.347	24%	0.239	S	C	.	.	H	α-helix	trans	-58.5	-21.8	-179.9	0	0	0	0	0	114	H266 M275	H266-A270 VanDerWaalsContact O-CB 3.26Å; H266-A270 WeakPolarHBondContact O-CB 3.45Å; H266-A270 PolarHBondContact O-N 3.12Å; A270-M275 HydrophobicContact CB-CG 3.87Å; A270-M275 HydrophobicContact CB-SD 4.35Å
271	K	95.5	Very high	93.8	Very high	147 Å²	147	48.8 Å²	48.8	64%	0.639	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-16.3	174.5	-71.7	170.8	-174.9	169.9	0	113.8	I267 H269	I267-K271 HydrophobicContact CG2-CD 4.49Å; I267-K271 WeakPolarHBondContact O-CD 3.37Å; I267-K271 VanDerWaalsContact O-CG 3.3Å; I267-K271 WeakPolarHBondContact O-CG 3.16Å; H269-K271 PolarHBondContact O-N 2.93Å
272	R	94.7	Very high	94.2	Very high	104 Å²	104	46.7 Å²	46.7	39%	0.392	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-132.4	-22.3	-165.5	-68.5	172.4	-178.9	84	-6.3	114.1	W268 H269 F288	W268-R272 VanDerWaalsContact CZ2-CD 3.49Å; W268-R272 PolarHBondContact O-NH1 2.73Å; H269-R272 CarbonylContact O-C 3.49Å; H269-R272 PolarHBondContact O-N 2.82Å; R272-F288 WeakPolarHBondContact O-CD2 3.18Å; R272-F288 PolarHBondContact O-N 2.86Å
273	F	97.3	Very high	94.4	Very high	6 Å²	6	45.2 Å²	45.2	3%	0.026	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	152.4	-176	-69.2	-103.2	0	0	0	110.3	W268 H269 M275 A284 K286 C287 F288 A657	W268-F273 HydrophobicContact CH2-CE2 4.22Å; W268-F273 HydrophobicContact CZ3-CD2 4.26Å; W268-F273 AromaticContact CZ3-CE2 3.66Å; W268-F273 HydrophobicContact CZ3-CE2 3.66Å; H269-F273 AromaticContact CD2-CD2 3.93Å; H269-F273 PolarHBondContact O-N 2.96Å; F273-M275 HydrophobicContact CB-SD 4.38Å; F273-A284 HydrophobicContact CB-CB 3.95Å; F273-A284 HydrophobicContact CD1-CB 4.26Å; F273-A284 HydrophobicContact CG-CB 4.13Å; F273-K286 CarbonylContact C-O 3.55Å; F273-K286 VanDerWaalsContact CA-O 3.27Å; F273-K286 WeakPolarHBondContact CA-O 3.36Å; F273-K286 VanDerWaalsContact CD1-C 3.46Å; F273-C287 HydrophobicContact CD1-CB 4Å; F273-C287 HydrophobicContact CE1-CB 3.7Å; F273-C287 HydrophobicContact CZ-CB 4.11Å; F273-F288 VanDerWaalsContact O-CE2 3.28Å; F273-F288 WeakPolarHBondContact O-CE2 3.26Å; F273-F288 WeakPolarHBondContact O-CZ 3.44Å; F273-A657 HydrophobicContact CE2-CB 4.1Å; F273-A657 HydrophobicContact CZ-CB 3.88Å
274	K	97.4	Very high	94.7	Very high	97 Å²	97	45.1 Å²	45.1	42%	0.422	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	127.1	162.7	-170.1	-175.8	177.8	-161	0	107.4	D285 K286 F288	K274-D285 PolarHBondContact O-N 2.88Å; K274-K286 HydrophobicContact CB-CG 4Å; K274-K286 HydrophobicContact CD-CG 4.5Å; K274-K286 PolarHBondContact N-O 2.87Å; K274-F288 HydrophobicContact CB-CE1 4.18Å
275	M	96.5	Very high	94.9	Very high	37 Å²	37	45.3 Å²	45.3	18%	0.182	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	138.7	177.5	-54.5	-56.2	-70.3	0	0	109.8	H266 H269 A270 F273 K282 L283 A284	H266-M275 WeakPolarHBondContact ND1-CE 3.25Å; H269-M275 HydrophobicContact CB-CE 4Å; H269-M275 HydrophobicContact CB-SD 3.8Å; A270-M275 HydrophobicContact CB-CG 3.87Å; A270-M275 HydrophobicContact CB-SD 4.35Å; F273-M275 HydrophobicContact CB-SD 4.38Å; M275-K282 HydrophobicContact CB-CG 4.2Å; M275-K282 VanDerWaalsContact CE-O 3.28Å; M275-K282 WeakPolarHBondContact CE-O 3.45Å; M275-L283 CarbonylContact C-O 3.42Å; M275-L283 VanDerWaalsContact CA-O 3.26Å; M275-L283 WeakPolarHBondContact CA-O 3.43Å; M275-L283 VanDerWaalsContact CE-C 3.47Å; M275-L283 WeakPolarHBondContact CE-O 3.5Å; M275-A284 HydrophobicContact CE-CB 4.35Å; M275-A284 HydrophobicContact SD-CB 4.06Å
276	I	94.9	Very high	94.9	Very high	55 Å²	55	49.8 Å²	49.8	28%	0.282	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	153.7	175	50.8	175.2	0	0	0	109.9	K282 L283 D285 L660	I276-K282 CarbonylContact O-C 3.42Å; I276-K282 WeakPolarHBondContact O-CA 3.32Å; I276-L283 PolarHBondContact N-O 3.25Å; I276-L283 PolarHBondContact O-N 3.1Å; I276-D285 HydrophobicContact CD1-CB 3.72Å; I276-D285 HydrophobicContact CG1-CB 3.85Å; I276-D285 HydrophobicContact CG2-CB 4.01Å; I276-L660 HydrophobicContact CD1-CD1 4.05Å
277	E	94.2	Very high	95	Very high	94 Å²	94	50.9 Å²	50.9	44%	0.439	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	113.7	173	-70.9	170.3	-167.1	0	0	106.8	K259 A260 Y281 K282	K259-E277 WeakPolarHBondContact CE-OE2 3.4Å; K259-E277 IonicContact NZ-OE1 3.59Å; K259-E277 IonicContact NZ-OE2 2.8Å; K259-E277 PolarHBondContact NZ-OE2 2.78Å; A260-E277 HydrophobicContact CB-CG 4.42Å; E277-Y281 CarbonylContact C-O 3.57Å; E277-Y281 WeakPolarHBondContact CA-O 3.26Å; E277-K282 HydrophobicContact CG-CD 4.34Å; E277-K282 HydrophobicContact CG-CG 4.25Å; E277-K282 IonicContact OE1-NZ 2.76Å; E277-K282 PolarHBondContact OE1-NZ 2.95Å
278	A	91.3	Very high	95	Very high	21 Å²	21	54.8 Å²	54.8	17%	0.174	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	133.9	-175.9	0	0	0	0	0	109.5	G280 Y281 L283	A278-G280 PolarHBondContact O-N 3.33Å; A278-G280 VanDerWaalsContact O-N 3.13Å; A278-Y281 PolarHBondContact N-O 2.93Å; A278-Y281 WeakPolarHBondContact O-CA 3.44Å; A278-Y281 PolarHBondContact O-N 3.19Å; A278-Y281 VanDerWaalsContact O-O 3.08Å; A278-L283 HydrophobicContact CB-CD1 4.48Å
279	W	91.4	Very high	94.6	Very high	77 Å²	77	58.2 Å²	58.2	29%	0.292	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	33.3	175.5	-37.3	-59.4	0	0	0	115.1	Y281 L283 Y310 H392 P393 L660 P676	W279-Y281 VanDerWaalsContact C-N 3.28Å; W279-Y281 VanDerWaalsContact O-CD2 3.27Å; W279-Y281 WeakPolarHBondContact O-CD2 3.08Å; W279-Y281 PolarHBondContact O-N 3.11Å; W279-L283 HydrophobicContact CE3-CD1 3.48Å; W279-L283 VanDerWaalsContact CE3-CD1 3.48Å; W279-L283 HydrophobicContact CZ3-CD1 3.39Å; W279-Y310 HydrophobicContact CE3-CD2 4.18Å; W279-Y310 AromaticContact CE3-CE2 3.99Å; W279-Y310 HydrophobicContact CE3-CE2 3.99Å; W279-Y310 HydrophobicContact CZ3-CD2 4.23Å; W279-Y310 AromaticContact CZ3-CE2 3.65Å; W279-Y310 HydrophobicContact CZ3-CE2 3.65Å; W279-Y310 AromaticContact CZ3-CZ 3.93Å; W279-H392 AromaticContact CD1-CE1 3.8Å; W279-H392 AromaticContact CD2-CE1 3.38Å; W279-H392 AromaticContact CD2-NE2 3.55Å; W279-H392 AromaticContact CE2-CE1 3.41Å; W279-H392 VanDerWaalsContact CE2-CE1 3.41Å; W279-H392 AromaticContact CE2-NE2 3.63Å; W279-H392 AromaticContact CE3-CE1 3.82Å; W279-H392 AromaticContact CE3-NE2 3.51Å; W279-H392 AromaticContact CG-CE1 3.67Å; W279-H392 AromaticContact CH2-NE2 3.66Å; W279-H392 AromaticContact CZ2-CE1 3.89Å; W279-H392 AromaticContact CZ2-NE2 3.71Å; W279-H392 AromaticContact CZ3-NE2 3.56Å; W279-H392 AromaticContact NE1-CE1 3.66Å; W279-P393 HydrophobicContact CB-CB 4.09Å; W279-P393 HydrophobicContact CB-CG 3.66Å; W279-P393 HydrophobicContact CE3-CG 4.37Å; W279-P393 HydrophobicContact CG-CG 4.26Å; W279-L660 HydrophobicContact CH2-CD1 4.38Å; W279-L660 HydrophobicContact CH2-CD2 4.28Å; W279-L660 HydrophobicContact CZ3-CD1 4.32Å; W279-L660 HydrophobicContact CZ3-CD2 4.29Å; W279-P676 HydrophobicContact CZ2-CG 4.23Å
280	G	89.1	Confident	94.3	Very high	54 Å²	54	70.3 Å²	70.3	56%	0.557	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	-3.2	-176.4	0	0	0	0	0	115.1	A260 R261 A278	A260-G280 WeakPolarHBondContact CA-O 3.28Å; R261-G280 PolarHBondContact N-O 3.34Å; A278-G280 PolarHBondContact O-N 3.33Å; A278-G280 VanDerWaalsContact O-N 3.13Å
281	Y	93.8	Very high	94	Very high	12 Å²	12	69.3 Å²	69.3	5%	0.047	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	162.9	178.4	-66	-90.4	0	0	0	112.4	R261 L263 E277 A278 W279 P393	R261-Y281 HydrophobicContact CB-CD1 3.57Å; R261-Y281 HydrophobicContact CB-CE1 3.68Å; R261-Y281 HydrophobicContact CB-CG 4.37Å; R261-Y281 HydrophobicContact CG-CE1 4.44Å; R261-Y281 CarbonylContact O-C 3.52Å; R261-Y281 WeakPolarHBondContact O-CA 3.34Å; L263-Y281 HydrophobicContact CD2-CD1 4.08Å; L263-Y281 HydrophobicContact CD2-CE1 4.37Å; E277-Y281 CarbonylContact C-O 3.57Å; E277-Y281 WeakPolarHBondContact CA-O 3.26Å; A278-Y281 PolarHBondContact N-O 2.93Å; A278-Y281 WeakPolarHBondContact O-CA 3.44Å; A278-Y281 PolarHBondContact O-N 3.19Å; A278-Y281 VanDerWaalsContact O-O 3.08Å; W279-Y281 VanDerWaalsContact C-N 3.28Å; W279-Y281 VanDerWaalsContact O-CD2 3.27Å; W279-Y281 WeakPolarHBondContact O-CD2 3.08Å; W279-Y281 PolarHBondContact O-N 3.11Å; Y281-P393 HydrophobicContact CD2-CB 4.37Å; Y281-P393 HydrophobicContact CD2-CG 4.35Å; Y281-P393 HydrophobicContact CE2-CB 3.87Å; Y281-P393 HydrophobicContact CE2-CG 4.21Å
282	K	95.1	Very high	93.8	Very high	56 Å²	56	66.8 Å²	66.8	24%	0.243	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	95.8	170.6	-158.9	164.3	-170.4	132.9	0	111.3	A260 R261 H266 M275 I276 E277	A260-K282 HydrophobicContact CB-CB 4.38Å; R261-K282 PolarHBondContact O-N 3.17Å; H266-K282 PolarHBondContact ND1-O 2.98Å; M275-K282 HydrophobicContact CB-CG 4.2Å; M275-K282 VanDerWaalsContact CE-O 3.28Å; M275-K282 WeakPolarHBondContact CE-O 3.45Å; I276-K282 CarbonylContact O-C 3.42Å; I276-K282 WeakPolarHBondContact O-CA 3.32Å; E277-K282 HydrophobicContact CG-CD 4.34Å; E277-K282 HydrophobicContact CG-CG 4.25Å; E277-K282 IonicContact OE1-NZ 2.76Å; E277-K282 PolarHBondContact OE1-NZ 2.95Å
283	L	96.2	Very high	93.7	Very high	6 Å²	6	71.2 Å²	71.2	3%	0.031	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	162	-167.8	-57.4	-179.8	0	0	0	112.9	L263 M275 I276 A278 W279 Y310 L660	L263-L283 HydrophobicContact CD1-CD2 3.61Å; L263-L283 HydrophobicContact CG-CD2 4.06Å; M275-L283 CarbonylContact C-O 3.42Å; M275-L283 VanDerWaalsContact CA-O 3.26Å; M275-L283 WeakPolarHBondContact CA-O 3.43Å; M275-L283 VanDerWaalsContact CE-C 3.47Å; M275-L283 WeakPolarHBondContact CE-O 3.5Å; I276-L283 PolarHBondContact N-O 3.25Å; I276-L283 PolarHBondContact O-N 3.1Å; A278-L283 HydrophobicContact CB-CD1 4.48Å; W279-L283 HydrophobicContact CE3-CD1 3.48Å; W279-L283 VanDerWaalsContact CE3-CD1 3.48Å; W279-L283 HydrophobicContact CZ3-CD1 3.39Å; L283-Y310 HydrophobicContact CD1-CD1 4.02Å; L283-Y310 HydrophobicContact CD1-CD2 4.33Å; L283-Y310 HydrophobicContact CD1-CE1 4.3Å; L283-Y310 HydrophobicContact CD1-CG 4.03Å; L283-Y310 HydrophobicContact CD2-CD1 3.94Å; L283-Y310 HydrophobicContact CD2-CG 4.15Å; L283-L660 HydrophobicContact CB-CD1 3.65Å; L283-L660 HydrophobicContact CD1-CD1 3.92Å; L283-L660 HydrophobicContact CG-CD1 4.45Å
284	A	97.6	Very high	93.4	Very high	14 Å²	14	71.8 Å²	71.8	12%	0.116	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	118.3	179.6	0	0	0	0	0	111.2	H269 F273 M275 G659 L660	H269-A284 HydrophobicContact CB-CB 4.06Å; H269-A284 WeakPolarHBondContact CD2-CB 3.43Å; F273-A284 HydrophobicContact CB-CB 3.95Å; F273-A284 HydrophobicContact CD1-CB 4.26Å; F273-A284 HydrophobicContact CG-CB 4.13Å; M275-A284 HydrophobicContact CE-CB 4.35Å; M275-A284 HydrophobicContact SD-CB 4.06Å; A284-G659 WeakPolarHBondContact O-CA 3.47Å; A284-L660 WeakPolarHBondContact O-CG 3.36Å; A284-L660 PolarHBondContact O-N 2.75Å
285	D	95.3	Very high	93.2	Very high	30 Å²	30	67.3 Å²	67.3	16%	0.16	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-71.7	-180	174.4	31.5	0	0	0	111.1	K274 I276 G659 L660 Q661	K274-D285 PolarHBondContact O-N 2.88Å; I276-D285 HydrophobicContact CD1-CB 3.72Å; I276-D285 HydrophobicContact CG1-CB 3.85Å; I276-D285 HydrophobicContact CG2-CB 4.01Å; D285-G659 CarbonylContact O-C 3.45Å; D285-G659 VanDerWaalsContact O-C 3.31Å; D285-G659 WeakPolarHBondContact O-CA 3.13Å; D285-L660 PolarHBondContact O-N 3.44Å; D285-Q661 PolarHBondContact O-N 2.78Å
286	K	94.8	Very high	93	Very high	95 Å²	95	65.9 Å²	65.9	41%	0.413	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	147.8	-174.8	67.9	-175.7	177.7	-171.8	0	112.5	F273 K274	F273-K286 CarbonylContact C-O 3.55Å; F273-K286 VanDerWaalsContact CA-O 3.27Å; F273-K286 WeakPolarHBondContact CA-O 3.36Å; F273-K286 VanDerWaalsContact CD1-C 3.46Å; K274-K286 HydrophobicContact CB-CG 4Å; K274-K286 HydrophobicContact CD-CG 4.5Å; K274-K286 PolarHBondContact N-O 2.87Å
287	C	95.6	Very high	92.8	Very high	34 Å²	34	69.9 Å²	69.9	23%	0.23	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	146.2	176.5	-165	0	0	0	0	111.1	F273 Q289 C291	F273-C287 HydrophobicContact CD1-CB 4Å; F273-C287 HydrophobicContact CE1-CB 3.7Å; F273-C287 HydrophobicContact CZ-CB 4.11Å; C287-Q289 PolarHBondContact O-N 2.85Å; C287-Q289 PolarHBondContact SG-N 2.95Å; C287-Q289 VanDerWaalsContact SG-N 3.43Å; C287-C291 VanDerWaalsContact CB-SG 3.53Å
288	F	93.7	Very high	92.7	Very high	136 Å²	136	66.5 Å²	66.5	60%	0.596	30%	0.304	S	S	*	.	S	Bend	trans	-67.9	-23.1	169.5	-63.5	-51.5	0	0	0	112.4	R272 F273 K274	R272-F288 WeakPolarHBondContact O-CD2 3.18Å; R272-F288 PolarHBondContact O-N 2.86Å; F273-F288 VanDerWaalsContact O-CE2 3.28Å; F273-F288 WeakPolarHBondContact O-CE2 3.26Å; F273-F288 WeakPolarHBondContact O-CZ 3.44Å; K274-F288 HydrophobicContact CB-CE1 4.18Å
289	Q	88.9	Confident	92.7	Very high	99 Å²	99	65.5 Å²	65.5	46%	0.463	30%	0.296	S	S	.	.	S	Bend	trans	-83.2	138.1	172.7	-65.3	-171.9	-21.3	0	0	110.3	C287 C291	C287-Q289 PolarHBondContact O-N 2.85Å; C287-Q289 PolarHBondContact SG-N 2.95Å; C287-Q289 VanDerWaalsContact SG-N 3.43Å; Q289-C291 VanDerWaalsContact C-N 3.33Å; Q289-C291 PolarHBondContact O-N 2.72Å; Q289-C291 PolarHBondContact O-SG 2.77Å
290	R	90.5	Very high	92.5	Very high	260 Å²	260	67.9 Å²	67.9	98%	0.981	31%	0.309	S	S	*	.			trans	-69.8	91.8	169.4	-64.9	-176.5	-177.6	-179.9	0.4	108.9
291	C	90.6	Very high	92.5	Very high	21 Å²	21	74 Å²	74	14%	0.142	32%	0.315	C	S	.	.			trans	-123.8	5.6	-174.4	57.4	0	0	0	0	114.1	C287 Q289 R293 A294 S295	C287-C291 VanDerWaalsContact CB-SG 3.53Å; Q289-C291 VanDerWaalsContact C-N 3.33Å; Q289-C291 PolarHBondContact O-N 2.72Å; Q289-C291 PolarHBondContact O-SG 2.77Å; C291-R293 PolarHBondContact O-N 2.99Å; C291-A294 CarbonylContact O-C 3.49Å; C291-A294 WeakPolarHBondContact O-CA 3.38Å; C291-A294 WeakPolarHBondContact O-CB 3.42Å; C291-A294 PolarHBondContact O-N 3.26Å; C291-S295 PolarHBondContact O-N 3.44Å; C291-S295 PolarHBondContact O-OG 2.89Å
292	W	90.5	Very high	92.4	Very high	94 Å²	94	74.3 Å²	74.3	36%	0.356	32%	0.317	S	S	.	.	H	α-helix	trans	-44.6	-61.2	-175.6	-170.3	-102.8	0	0	0	114.3	A294 S295 F296 Q661 F662 T665	W292-A294 VanDerWaalsContact C-N 3.27Å; W292-A294 PolarHBondContact O-N 2.86Å; W292-S295 PolarHBondContact O-N 3.17Å; W292-F296 HydrophobicContact CD2-CE2 4.22Å; W292-F296 AromaticContact CE2-CE2 3.59Å; W292-F296 HydrophobicContact CH2-CE2 4.34Å; W292-F296 AromaticContact CZ2-CE2 3.68Å; W292-F296 HydrophobicContact CZ2-CE2 3.68Å; W292-F296 HydrophobicContact CZ2-CZ 4.39Å; W292-F296 AromaticContact NE1-CD2 3.97Å; W292-F296 AromaticContact NE1-CE2 3.7Å; W292-F296 WeakPolarHBondContact O-CD2 3.38Å; W292-F296 PolarHBondContact O-N 3.17Å; W292-Q661 HydrophobicContact CH2-CG 4.37Å; W292-Q661 HydrophobicContact CZ3-CG 4.11Å; W292-F662 HydrophobicContact CE3-CB 4.36Å; W292-F662 HydrophobicContact CE3-CD2 4.34Å; W292-F662 HydrophobicContact CH2-CB 4.35Å; W292-F662 HydrophobicContact CZ3-CB 3.74Å; W292-F662 HydrophobicContact CZ3-CD2 4.27Å; W292-T665 HydrophobicContact CH2-CG2 3.85Å; W292-T665 WeakPolarHBondContact CH2-OG1 3.03Å; W292-T665 HydrophobicContact CZ2-CG2 3.52Å
293	R	92.3	Very high	92.4	Very high	198 Å²	198	71.6 Å²	71.6	75%	0.747	31%	0.305	S	S	*	.	H	α-helix	trans	-62.3	-33.8	178.5	-67.2	-179.2	177.7	162.9	-1.7	113.2	C291 R297 L907	C291-R293 PolarHBondContact O-N 2.99Å; R293-R297 WeakPolarHBondContact O-CB 3.47Å; R293-R297 PolarHBondContact O-N 3.22Å; R293-L907 HydrophobicContact CB-CD1 4.45Å; R293-L907 HydrophobicContact CG-CD1 3.96Å; R293-L907 HydrophobicContact CG-CD2 4.41Å
294	A	92.1	Very high	92.3	Very high	18 Å²	18	71.5 Å²	71.5	15%	0.149	31%	0.305	C	S	.	.	H	α-helix	trans	-73	-34.6	-180	0	0	0	0	0	111.3	C291 W292 R297 D298	C291-A294 CarbonylContact O-C 3.49Å; C291-A294 WeakPolarHBondContact O-CA 3.38Å; C291-A294 WeakPolarHBondContact O-CB 3.42Å; C291-A294 PolarHBondContact O-N 3.26Å; W292-A294 VanDerWaalsContact C-N 3.27Å; W292-A294 PolarHBondContact O-N 2.86Å; A294-R297 PolarHBondContact O-N 2.76Å; A294-D298 WeakPolarHBondContact O-CB 3.49Å; A294-D298 PolarHBondContact O-N 2.73Å
295	S	93.4	Very high	92.3	Very high	3 Å²	3	70.9 Å²	70.9	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-65.1	-42.1	172.7	-59	0	0	0	0	111.7	C291 W292 D298 S299 T304 R656	C291-S295 PolarHBondContact O-N 3.44Å; C291-S295 PolarHBondContact O-OG 2.89Å; W292-S295 PolarHBondContact O-N 3.17Å; S295-D298 PolarHBondContact O-N 3.29Å; S295-S299 PolarHBondContact O-N 3.49Å; S295-S299 PolarHBondContact O-OG 2.99Å; S295-T304 WeakPolarHBondContact O-CG2 3.3Å; S295-R656 WeakPolarHBondContact OG-CD 3.38Å
296	F	91.7	Very high	92.3	Very high	6 Å²	6	70.4 Å²	70.4	3%	0.026	30%	0.296	C	S	.	.	H	α-helix	trans	-65.7	-38.2	175.1	-88.3	-76	0	0	0	113.2	W292 D298 S299 K300 F662 T665 F666 E669 L907	W292-F296 HydrophobicContact CD2-CE2 4.22Å; W292-F296 AromaticContact CE2-CE2 3.59Å; W292-F296 HydrophobicContact CH2-CE2 4.34Å; W292-F296 AromaticContact CZ2-CE2 3.68Å; W292-F296 HydrophobicContact CZ2-CE2 3.68Å; W292-F296 HydrophobicContact CZ2-CZ 4.39Å; W292-F296 AromaticContact NE1-CD2 3.97Å; W292-F296 AromaticContact NE1-CE2 3.7Å; W292-F296 WeakPolarHBondContact O-CD2 3.38Å; W292-F296 PolarHBondContact O-N 3.17Å; F296-D298 VanDerWaalsContact C-N 3.31Å; F296-S299 WeakPolarHBondContact CA-OG 3.37Å; F296-S299 PolarHBondContact O-OG 3.06Å; F296-K300 PolarHBondContact O-N 2.99Å; F296-F662 HydrophobicContact CB-CE2 4.42Å; F296-F662 HydrophobicContact CD1-CE2 4.15Å; F296-F662 HydrophobicContact CD1-CZ 4.49Å; F296-F662 AromaticContact CD2-CD2 3.91Å; F296-F662 HydrophobicContact CD2-CD2 3.91Å; F296-F662 AromaticContact CD2-CE2 3.39Å; F296-F662 HydrophobicContact CD2-CE2 3.39Å; F296-F662 HydrophobicContact CD2-CZ 4.43Å; F296-F662 HydrophobicContact CE1-CE2 4.18Å; F296-F662 AromaticContact CE2-CD2 3.6Å; F296-F662 HydrophobicContact CE2-CD2 3.6Å; F296-F662 AromaticContact CE2-CE2 3.44Å; F296-F662 HydrophobicContact CE2-CE2 3.44Å; F296-F662 VanDerWaalsContact CE2-CE2 3.44Å; F296-F662 HydrophobicContact CE2-CZ 4.46Å; F296-F662 AromaticContact CG-CE2 3.76Å; F296-F662 HydrophobicContact CG-CE2 3.76Å; F296-F662 HydrophobicContact CG-CZ 4.43Å; F296-F662 HydrophobicContact CZ-CD2 4.14Å; F296-F662 AromaticContact CZ-CE2 3.84Å; F296-F662 HydrophobicContact CZ-CE2 3.84Å; F296-F662 HydrophobicContact CZ-CZ 4.49Å; F296-T665 HydrophobicContact CE2-CG2 4.36Å; F296-T665 HydrophobicContact CZ-CG2 3.86Å; F296-F666 HydrophobicContact CD1-CD2 4.44Å; F296-F666 AromaticContact CE1-CD2 3.98Å; F296-F666 HydrophobicContact CE1-CD2 3.98Å; F296-E669 HydrophobicContact CE1-CG 4.27Å; F296-E669 WeakPolarHBondContact CE1-OE1 3.29Å; F296-E669 WeakPolarHBondContact CE1-OE2 3.44Å; F296-E669 WeakPolarHBondContact CZ-OE1 3.44Å; F296-L907 HydrophobicContact CB-CB 4.33Å; F296-L907 HydrophobicContact CB-CD1 3.98Å; F296-L907 HydrophobicContact CD2-CD1 3.59Å; F296-L907 HydrophobicContact CE2-CD1 4.37Å; F296-L907 HydrophobicContact CG-CB 4.23Å; F296-L907 HydrophobicContact CG-CD1 3.88Å
297	R	91.3	Very high	92.4	Very high	140 Å²	140	66.6 Å²	66.6	53%	0.528	28%	0.28	S	S	.	.	H	α-helix	trans	-64.6	-40.7	173.2	-177.3	177.2	61.1	-144.2	1.1	111.2	R293 A294 K300 R301	R293-R297 WeakPolarHBondContact O-CB 3.47Å; R293-R297 PolarHBondContact O-N 3.22Å; A294-R297 PolarHBondContact O-N 2.76Å; R297-K300 PolarHBondContact O-N 3.02Å; R297-R301 PolarHBondContact O-N 2.92Å
298	D	92.1	Very high	92.4	Very high	22 Å²	22	65 Å²	65	12%	0.118	27%	0.269	C	S	.	.	H	α-helix	trans	-72.7	-34.5	-179.3	-69.3	2.9	0	0	0	111.2	A294 S295 F296 K300 H302 C303 T304 R656	A294-D298 WeakPolarHBondContact O-CB 3.49Å; A294-D298 PolarHBondContact O-N 2.73Å; S295-D298 PolarHBondContact O-N 3.29Å; F296-D298 VanDerWaalsContact C-N 3.31Å; D298-K300 VanDerWaalsContact C-N 3.32Å; D298-K300 PolarHBondContact O-N 3.46Å; D298-H302 HydrophobicContact CB-CB 4.1Å; D298-H302 CarbonylContact O-C 3.5Å; D298-H302 WeakPolarHBondContact O-CA 3.21Å; D298-H302 WeakPolarHBondContact O-CB 3.15Å; D298-H302 PolarHBondContact O-N 3.07Å; D298-C303 PolarHBondContact O-N 2.98Å; D298-T304 HydrophobicContact CB-CG2 4.1Å; D298-R656 IonicContact OD1-NH2 2.69Å; D298-R656 IonicContact OD2-CZ 2.76Å; D298-R656 IonicContact OD2-NE 3.33Å; D298-R656 PolarHBondContact OD2-NE 3.49Å; D298-R656 IonicContact OD2-NH2 3.99Å; D298-R656 PolarHBondContact OD2-NH2 2.83Å
299	S	90.7	Very high	92.4	Very high	1 Å²	1	58.8 Å²	58.8	1%	0.007	24%	0.243	C	C	.	.	H	α-helix	trans	-65.3	-36.1	172.8	61.9	0	0	0	0	111.9	S295 F296 G463 F666	S295-S299 PolarHBondContact O-N 3.49Å; S295-S299 PolarHBondContact O-OG 2.99Å; F296-S299 WeakPolarHBondContact CA-OG 3.37Å; F296-S299 PolarHBondContact O-OG 3.06Å; S299-G463 WeakPolarHBondContact O-CA 3.38Å; S299-F666 WeakPolarHBondContact OG-CE2 3.37Å
300	K	88.1	Confident	92.6	Very high	126 Å²	126	54.8 Å²	54.8	55%	0.548	22%	0.224	S	C	.	.	H	α-helix	trans	-77.2	-43.3	178	-173.9	171	-175.2	168.1	0	114.4	F296 R297 D298 P464 L908	F296-K300 PolarHBondContact O-N 2.99Å; R297-K300 PolarHBondContact O-N 3.02Å; D298-K300 VanDerWaalsContact C-N 3.32Å; D298-K300 PolarHBondContact O-N 3.46Å; K300-P464 WeakPolarHBondContact O-CD 3.4Å; K300-P464 WeakPolarHBondContact O-CG 3.49Å; K300-L908 HydrophobicContact CB-CD2 4.31Å; K300-L908 HydrophobicContact CD-CD2 3.87Å; K300-L908 HydrophobicContact CG-CD2 4.48Å
301	R	88.7	Confident	92.8	Very high	183 Å²	183	44.9 Å²	44.9	69%	0.691	19%	0.188	S	C	*	.	H	α-helix	trans	-111.7	-17.4	-170.8	-64.6	-173.1	179.1	179.6	-1.3	114.6	R297	R297-R301 PolarHBondContact O-N 2.92Å
302	H	92	Very high	92.9	Very high	18 Å²	18	44.1 Å²	44.1	8%	0.083	18%	0.182	C	C	.	.	S	Bend	trans	-129.8	-121	-173.3	-166.4	-80.7	0	0	0	109.6	D298 G463 P464 K465 T654	D298-H302 HydrophobicContact CB-CB 4.1Å; D298-H302 CarbonylContact O-C 3.5Å; D298-H302 WeakPolarHBondContact O-CA 3.21Å; D298-H302 WeakPolarHBondContact O-CB 3.15Å; D298-H302 PolarHBondContact O-N 3.07Å; H302-G463 CarbonylContact O-C 3.31Å; H302-G463 VanDerWaalsContact O-C 3.3Å; H302-G463 WeakPolarHBondContact O-CA 3.41Å; H302-P464 WeakPolarHBondContact O-CD 3.4Å; H302-K465 PolarHBondContact O-N 2.88Å; H302-T654 PolarHBondContact CE1-O 3.08Å; H302-T654 PolarHBondContact CE1-OG1 2.64Å; H302-T654 PolarHBondContact NE2-OG1 3.42Å
303	C	93.5	Very high	93	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	17%	0.166	C	C	.	.			trans	-158.5	134.5	179.7	179.7	0	0	0	0	110.6	D298 S462 I469 R656	D298-C303 PolarHBondContact O-N 2.98Å; C303-S462 CarbonylContact C-O 3.44Å; C303-S462 VanDerWaalsContact CA-O 3.24Å; C303-S462 WeakPolarHBondContact CA-O 3.5Å; C303-I469 HydrophobicContact CB-CD1 3.37Å; C303-R656 PolarHBondContact O-N 2.98Å; C303-R656 VanDerWaalsContact O-N 3.13Å
304	T	95.7	Very high	93.1	Very high	4 Å²	4	30.3 Å²	30.3	3%	0.025	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	151.6	167.6	47.4	0	0	0	0	110.3	S295 D298 L461 S462 R656 V658	S295-T304 WeakPolarHBondContact O-CG2 3.3Å; D298-T304 HydrophobicContact CB-CG2 4.1Å; T304-L461 CarbonylContact O-C 3.32Å; T304-L461 VanDerWaalsContact O-CA 3.27Å; T304-L461 WeakPolarHBondContact O-CA 3.2Å; T304-S462 PolarHBondContact N-O 3.11Å; T304-S462 PolarHBondContact O-N 3.1Å; T304-S462 PolarHBondContact OG1-O 3.27Å; T304-S462 VanDerWaalsContact OG1-O 3.11Å; T304-R656 CarbonylContact C-O 3.53Å; T304-R656 VanDerWaalsContact CA-O 3.26Å; T304-R656 WeakPolarHBondContact CA-O 3.4Å; T304-R656 HydrophobicContact CG2-CB 4.41Å; T304-V658 HydrophobicContact CG2-CG2 3.64Å
305	I	96.6	Very high	93.1	Very high	1 Å²	1	30 Å²	30	1%	0.005	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	138.1	175.5	-177.4	170.4	0	0	0	111.2	F459 R460 L461 W647 I650 A655 R656 A657 V658	I305-F459 HydrophobicContact CD1-CB 4.17Å; I305-F459 HydrophobicContact CD1-CG 4.48Å; I305-R460 CarbonylContact C-O 3.52Å; I305-R460 VanDerWaalsContact CA-O 3.27Å; I305-R460 WeakPolarHBondContact CA-O 3.31Å; I305-L461 HydrophobicContact CB-CG 4.34Å; I305-L461 HydrophobicContact CD1-CD1 4.39Å; I305-L461 HydrophobicContact CD1-CG 4.28Å; I305-L461 HydrophobicContact CG1-CG 4.23Å; I305-W647 HydrophobicContact CD1-CE3 3.84Å; I305-W647 HydrophobicContact CD1-CH2 4.43Å; I305-W647 HydrophobicContact CD1-CZ3 3.71Å; I305-W647 HydrophobicContact CG1-CE3 4.29Å; I305-W647 HydrophobicContact CG1-CH2 4.03Å; I305-W647 HydrophobicContact CG1-CZ3 3.63Å; I305-W647 HydrophobicContact CG2-CH2 4.18Å; I305-W647 HydrophobicContact CG2-CZ2 4.47Å; I305-W647 HydrophobicContact CG2-CZ3 4.49Å; I305-I650 HydrophobicContact CB-CG2 4.49Å; I305-I650 HydrophobicContact CD1-CB 4.18Å; I305-I650 HydrophobicContact CD1-CD1 3.73Å; I305-I650 HydrophobicContact CD1-CG2 3.61Å; I305-I650 HydrophobicContact CG2-CG2 4.37Å; I305-A655 HydrophobicContact CB-CB 4.36Å; I305-A655 HydrophobicContact CG2-CB 4.03Å; I305-R656 PolarHBondContact N-O 3.5Å; I305-A657 CarbonylContact O-C 3.57Å; I305-A657 WeakPolarHBondContact O-CA 3.31Å; I305-V658 PolarHBondContact O-N 3.04Å
306	E	95.9	Very high	93.1	Very high	20 Å²	20	29.9 Å²	29.9	9%	0.093	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	144.6	176.7	-177.7	-177.9	-169.8	0	0	110.3	I308 F459 R460 A663	E306-I308 HydrophobicContact CG-CG2 3.86Å; E306-F459 WeakPolarHBondContact O-CA 3.5Å; E306-R460 HydrophobicContact CB-CB 4.31Å; E306-R460 PolarHBondContact N-O 3.47Å; E306-R460 PolarHBondContact O-N 2.85Å; E306-A663 VanDerWaalsContact CD-CB 3.44Å; E306-A663 WeakPolarHBondContact OE1-CB 3.4Å; E306-A663 WeakPolarHBondContact OE2-CB 3.45Å
307	D	96.6	Very high	93.1	Very high	14 Å²	14	29.9 Å²	29.9	8%	0.075	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	103.7	171.6	-170.6	-3.4	0	0	0	110.1	T265 S309 F459 W647	T265-D307 WeakPolarHBondContact CB-OD2 3.3Å; T265-D307 VanDerWaalsContact CG2-OD2 3.26Å; T265-D307 WeakPolarHBondContact CG2-OD2 3.31Å; T265-D307 PolarHBondContact OG1-OD2 2.92Å; D307-S309 WeakPolarHBondContact OD1-CB 3.47Å; D307-S309 PolarHBondContact OD1-N 3.12Å; D307-S309 VanDerWaalsContact OD1-N 3.08Å; D307-S309 PolarHBondContact OD1-OG 3.26Å; D307-F459 HydrophobicContact CB-CD1 4.26Å; D307-F459 HydrophobicContact CB-CE1 4.2Å; D307-F459 WeakPolarHBondContact OD1-CE1 3.36Å; D307-W647 HydrophobicContact CB-CH2 4Å; D307-W647 HydrophobicContact CB-CZ3 3.75Å
308	I	95.2	Very high	93.1	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.005	10%	0.101	C	C	.	.			trans	-105.9	21.6	177.8	56.4	169.9	0	0	0	111.8	E306 Y310 F311 R458 R460	E306-I308 HydrophobicContact CG-CG2 3.86Å; I308-Y310 HydrophobicContact CB-CE1 4.38Å; I308-Y310 HydrophobicContact CG2-CE1 4.29Å; I308-Y310 PolarHBondContact O-N 3.47Å; I308-F311 HydrophobicContact CB-CD2 3.97Å; I308-F311 HydrophobicContact CB-CE2 4.23Å; I308-F311 HydrophobicContact CG2-CE2 4.44Å; I308-F311 WeakPolarHBondContact O-CD2 3.42Å; I308-F311 PolarHBondContact O-N 2.7Å; I308-F311 VanDerWaalsContact O-N 3.11Å; I308-R458 CarbonylContact C-O 3.6Å; I308-R458 HydrophobicContact CD1-CB 4.35Å; I308-R458 HydrophobicContact CD1-CG 3.71Å; I308-R458 HydrophobicContact CG1-CB 3.99Å; I308-R458 HydrophobicContact CG1-CG 3.88Å; I308-R458 WeakPolarHBondContact CG1-O 3.19Å; I308-R458 PolarHBondContact N-O 2.86Å; I308-R458 VanDerWaalsContact N-O 3.12Å; I308-R460 HydrophobicContact CD1-CB 3.85Å; I308-R460 HydrophobicContact CG1-CB 4.22Å
309	S	94	Very high	93.1	Very high	6 Å²	6	26.8 Å²	26.8	4%	0.042	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-3.7	179.8	-50.8	0	0	0	0	114.1	D307 F311 R458	D307-S309 WeakPolarHBondContact OD1-CB 3.47Å; D307-S309 PolarHBondContact OD1-N 3.12Å; D307-S309 VanDerWaalsContact OD1-N 3.08Å; D307-S309 PolarHBondContact OD1-OG 3.26Å; S309-F311 VanDerWaalsContact C-N 3.29Å; S309-R458 PolarHBondContact N-O 3.49Å; S309-R458 PolarHBondContact OG-N 3.17Å; S309-R458 PolarHBondContact OG-O 2.81Å
310	Y	93.9	Very high	93	Very high	14 Å²	14	28 Å²	28	6%	0.055	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-10.9	173.7	66.3	-92.7	0	0	0	113.2	L263 W279 L283 I308 I312 H392 P393 L660	L263-Y310 HydrophobicContact CD1-CD1 4.49Å; W279-Y310 HydrophobicContact CE3-CD2 4.18Å; W279-Y310 AromaticContact CE3-CE2 3.99Å; W279-Y310 HydrophobicContact CE3-CE2 3.99Å; W279-Y310 HydrophobicContact CZ3-CD2 4.23Å; W279-Y310 AromaticContact CZ3-CE2 3.65Å; W279-Y310 HydrophobicContact CZ3-CE2 3.65Å; W279-Y310 AromaticContact CZ3-CZ 3.93Å; L283-Y310 HydrophobicContact CD1-CD1 4.02Å; L283-Y310 HydrophobicContact CD1-CD2 4.33Å; L283-Y310 HydrophobicContact CD1-CE1 4.3Å; L283-Y310 HydrophobicContact CD1-CG 4.03Å; L283-Y310 HydrophobicContact CD2-CD1 3.94Å; L283-Y310 HydrophobicContact CD2-CG 4.15Å; I308-Y310 HydrophobicContact CB-CE1 4.38Å; I308-Y310 HydrophobicContact CG2-CE1 4.29Å; I308-Y310 PolarHBondContact O-N 3.47Å; Y310-I312 PolarHBondContact O-N 3.35Å; Y310-H392 AromaticContact CE2-CD2 3.74Å; Y310-H392 AromaticContact CE2-NE2 3.7Å; Y310-P393 HydrophobicContact CD2-CG 3.89Å; Y310-L660 HydrophobicContact CE1-CD2 4.26Å
311	F	94.4	Very high	93.1	Very high	53 Å²	53	27.4 Å²	27.4	23%	0.232	12%	0.116	C	C	.	.	S	Bend	trans	-64.4	133.6	168.6	-83.8	-96.5	0	0	0	109.6	I308 S309 W390 H392	I308-F311 HydrophobicContact CB-CD2 3.97Å; I308-F311 HydrophobicContact CB-CE2 4.23Å; I308-F311 HydrophobicContact CG2-CE2 4.44Å; I308-F311 WeakPolarHBondContact O-CD2 3.42Å; I308-F311 PolarHBondContact O-N 2.7Å; I308-F311 VanDerWaalsContact O-N 3.11Å; S309-F311 VanDerWaalsContact C-N 3.29Å; F311-W390 HydrophobicContact CB-CE3 4.02Å; F311-H392 HydrophobicContact CE1-CB 4.04Å
312	I	92.1	Very high	93.1	Very high	5 Å²	5	22.2 Å²	22.2	3%	0.026	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	130.2	-177.3	-60.7	178.5	0	0	0	107.9	Y310 I314 W390 V391 P393 K396 L451 E453	Y310-I312 PolarHBondContact O-N 3.35Å; I312-I314 HydrophobicContact CG2-CG1 4.3Å; I312-W390 WeakPolarHBondContact O-CA 3.21Å; I312-V391 PolarHBondContact N-O 3.08Å; I312-V391 PolarHBondContact O-N 3.29Å; I312-P393 HydrophobicContact CD1-CB 3.97Å; I312-P393 HydrophobicContact CG1-CB 4.37Å; I312-K396 HydrophobicContact CD1-CB 3.8Å; I312-K396 HydrophobicContact CD1-CD 3.63Å; I312-K396 HydrophobicContact CD1-CG 3.66Å; I312-L451 HydrophobicContact CG2-CD1 3.42Å; I312-L451 VanDerWaalsContact CG2-CD1 3.42Å; I312-E453 HydrophobicContact CG2-CG 4.1Å
313	C	93.1	Very high	93.1	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.007	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	124.1	171.8	-172	0	0	0	0	109.1	W390 L452	C313-W390 HydrophobicContact CB-CD2 4.22Å; C313-W390 HydrophobicContact CB-CE3 3.93Å; C313-W390 HydrophobicContact CB-CH2 3.96Å; C313-W390 HydrophobicContact CB-CZ2 4.19Å; C313-W390 HydrophobicContact CB-CZ3 3.8Å; C313-L452 HydrophobicContact CB-CB 4.07Å; C313-L452 WeakPolarHBondContact O-CA 3.04Å; C313-L452 WeakPolarHBondContact O-CB 3.37Å; C313-L452 PolarHBondContact O-N 3.09Å
314	I	93.3	Very high	93.1	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	121.7	172.8	-55.4	174.3	0	0	0	106.7	I312 L316 W388 I389 V391 I399 L400 L403 L449 L451	I312-I314 HydrophobicContact CG2-CG1 4.3Å; I314-L316 HydrophobicContact CG2-CD2 4.44Å; I314-L316 HydrophobicContact CG2-CG 4.5Å; I314-W388 CarbonylContact O-C 3.5Å; I314-W388 WeakPolarHBondContact O-CA 3.47Å; I314-I389 HydrophobicContact CB-CB 4.47Å; I314-I389 PolarHBondContact N-O 3.16Å; I314-I389 PolarHBondContact O-N 2.99Å; I314-V391 HydrophobicContact CD1-CG2 3.93Å; I314-I399 HydrophobicContact CD1-CG2 3.88Å; I314-L400 HydrophobicContact CD1-CD2 4.21Å; I314-L403 HydrophobicContact CD1-CD1 4.41Å; I314-L403 HydrophobicContact CG2-CD1 4.35Å; I314-L449 HydrophobicContact CG2-CD1 4.36Å; I314-L449 HydrophobicContact CG2-CD2 4.42Å; I314-L449 HydrophobicContact CG2-CG 4.08Å; I314-L451 HydrophobicContact CG1-CD1 4.07Å
315	E	93.4	Very high	92.9	Very high	12 Å²	12	27.2 Å²	27.2	6%	0.056	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	122.4	172.2	175.7	173.8	138.8	0	0	108.6	K386 I387 W388 L449 V450 L452	E315-K386 WeakPolarHBondContact OE1-CD 3.45Å; E315-K386 WeakPolarHBondContact OE1-CE 2.81Å; E315-K386 IonicContact OE1-NZ 2.83Å; E315-K386 PolarHBondContact OE1-NZ 3.32Å; E315-I387 WeakPolarHBondContact CA-O 3.46Å; E315-W388 PolarHBondContact OE2-NE1 3.19Å; E315-L449 CarbonylContact O-C 3.56Å; E315-L449 WeakPolarHBondContact O-CA 3.48Å; E315-V450 HydrophobicContact CB-CB 4.18Å; E315-V450 PolarHBondContact N-O 3.36Å; E315-V450 PolarHBondContact O-N 3.02Å; E315-L452 HydrophobicContact CB-CD1 4Å; E315-L452 HydrophobicContact CB-CG 4.33Å
316	L	93.2	Very high	92.6	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	129.7	166.7	-60.9	172.3	0	0	0	107.6	I314 L323 L327 K386 I387 I389 L403 F407 S448 L449	I314-L316 HydrophobicContact CG2-CD2 4.44Å; I314-L316 HydrophobicContact CG2-CG 4.5Å; L316-L323 HydrophobicContact CB-CD2 4.21Å; L316-L327 HydrophobicContact CD1-CD2 4.21Å; L316-K386 CarbonylContact O-C 3.53Å; L316-K386 WeakPolarHBondContact O-CA 3.37Å; L316-I387 HydrophobicContact CB-CG2 3.71Å; L316-I387 HydrophobicContact CD1-CG2 4.4Å; L316-I387 HydrophobicContact CG-CG2 4.47Å; L316-I387 PolarHBondContact N-O 2.82Å; L316-I387 PolarHBondContact O-N 3.32Å; L316-I389 HydrophobicContact CD1-CD1 3.8Å; L316-L403 HydrophobicContact CD1-CD1 4.48Å; L316-L403 HydrophobicContact CD1-CD2 4.11Å; L316-F407 HydrophobicContact CD1-CE2 4.24Å; L316-S448 WeakPolarHBondContact CA-O 3.49Å; L316-L449 HydrophobicContact CD2-CB 3.77Å; L316-L449 HydrophobicContact CD2-CD1 3.72Å; L316-L449 HydrophobicContact CD2-CG 3.7Å
317	A	92	Very high	92.5	Very high	6 Å²	6	26.7 Å²	26.7	5%	0.05	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	130.8	171.8	0	0	0	0	0	109.6	I384 R385 K386 I447 S448	A317-I384 HydrophobicContact CB-CG2 4.05Å; A317-R385 WeakPolarHBondContact CA-O 3.11Å; A317-K386 HydrophobicContact CB-CG 3.83Å; A317-I447 CarbonylContact O-C 3.47Å; A317-I447 WeakPolarHBondContact O-CA 3.1Å; A317-S448 WeakPolarHBondContact CB-OG 3.42Å; A317-S448 PolarHBondContact N-O 3.24Å; A317-S448 PolarHBondContact O-N 3.35Å
318	G	91.6	Very high	92.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.9	-176	179.9	0	0	0	0	0	111.4	Q320 R385 N446	G318-Q320 PolarHBondContact O-N 3.16Å; G318-R385 PolarHBondContact N-O 2.86Å; G318-R385 PolarHBondContact O-N 3.5Å; G318-N446 WeakPolarHBondContact CA-O 2.88Å
319	R	90.4	Very high	92.1	Very high	98 Å²	98	33.8 Å²	33.8	37%	0.37	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	134.6	175.2	-64.9	-178.3	-179.7	167.9	0.6	110.1	K321 Q322 L323	R319-K321 PolarHBondContact O-N 3.28Å; R319-Q322 HydrophobicContact CB-CB 4.37Å; R319-Q322 HydrophobicContact CB-CG 4.23Å; R319-Q322 PolarHBondContact O-N 3.45Å; R319-Q322 VanDerWaalsContact O-N 3.13Å; R319-L323 PolarHBondContact O-N 3.09Å
320	Q	89.6	Confident	92.1	Very high	27 Å²	27	33.7 Å²	33.7	13%	0.126	16%	0.16	C	C	.	.	H	α-helix	trans	-56	-46.8	-173.2	179.5	176.4	-52.5	0	0	112.9	G318 Q322 L323 I324	G318-Q320 PolarHBondContact O-N 3.16Å; Q320-Q322 VanDerWaalsContact C-N 3.34Å; Q320-Q322 PolarHBondContact O-N 3.26Å; Q320-L323 PolarHBondContact O-N 3.19Å; Q320-I324 HydrophobicContact CG-CD1 3.68Å; Q320-I324 HydrophobicContact CG-CG1 4.41Å; Q320-I324 VanDerWaalsContact O-CG1 3.31Å; Q320-I324 WeakPolarHBondContact O-CG1 3.43Å; Q320-I324 PolarHBondContact O-N 3.18Å
321	K	89.3	Confident	92	Very high	113 Å²	113	33.8 Å²	33.8	49%	0.491	16%	0.163	S	C	.	.	H	α-helix	trans	-59.8	-42.8	179.1	-76.6	179.8	165.9	169.5	0	112.4	R319 I324 N325 D381	R319-K321 PolarHBondContact O-N 3.28Å; K321-I324 PolarHBondContact O-N 3.27Å; K321-N325 WeakPolarHBondContact O-CB 3.37Å; K321-N325 PolarHBondContact O-N 2.85Å; K321-N325 PolarHBondContact O-ND2 3.04Å; K321-N325 PolarHBondContact O-OD1 3.48Å; K321-D381 HydrophobicContact CD-CB 4.32Å; K321-D381 VanDerWaalsContact CD-OD1 3.3Å; K321-D381 WeakPolarHBondContact CD-OD1 3.09Å; K321-D381 WeakPolarHBondContact CE-OD1 3.44Å; K321-D381 VanDerWaalsContact CE-OD2 3.31Å; K321-D381 WeakPolarHBondContact CE-OD2 3.3Å; K321-D381 IonicContact NZ-OD1 3.37Å; K321-D381 PolarHBondContact NZ-OD1 2.67Å; K321-D381 IonicContact NZ-OD2 3.34Å; K321-D381 PolarHBondContact NZ-OD2 3.3Å
322	Q	89.8	Confident	91.8	Very high	73 Å²	73	32.1 Å²	32.1	34%	0.341	16%	0.157	S	C	.	.	H	α-helix	trans	-66.1	-44	179.3	-68.6	178	-29	0	0	111.6	R319 Q320 N325 G326	R319-Q322 HydrophobicContact CB-CB 4.37Å; R319-Q322 HydrophobicContact CB-CG 4.23Å; R319-Q322 PolarHBondContact O-N 3.45Å; R319-Q322 VanDerWaalsContact O-N 3.13Å; Q320-Q322 VanDerWaalsContact C-N 3.34Å; Q320-Q322 PolarHBondContact O-N 3.26Å; Q322-N325 PolarHBondContact O-N 2.91Å; Q322-G326 PolarHBondContact O-N 3.31Å
323	L	92	Very high	91.7	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.8	-44.6	176.6	-68.7	178.6	0	0	0	111.5	L316 R319 Q320 L327 W373 I387 F407 I447	L316-L323 HydrophobicContact CB-CD2 4.21Å; R319-L323 PolarHBondContact O-N 3.09Å; Q320-L323 PolarHBondContact O-N 3.19Å; L323-L327 WeakPolarHBondContact O-CB 3.3Å; L323-L327 WeakPolarHBondContact O-CG 3.29Å; L323-L327 PolarHBondContact O-N 2.77Å; L323-W373 HydrophobicContact CB-CH2 4.18Å; L323-W373 HydrophobicContact CD1-CH2 4.33Å; L323-W373 HydrophobicContact CD1-CZ3 4.14Å; L323-I387 HydrophobicContact CD1-CG2 4.37Å; L323-F407 HydrophobicContact CD2-CE1 4.39Å; L323-F407 HydrophobicContact CD2-CZ 4.19Å; L323-I447 HydrophobicContact CD2-CG2 4.24Å
324	I	92.4	Very high	91.4	Very high	21 Å²	21	40.7 Å²	40.7	11%	0.108	21%	0.208	C	C	.	.	H	α-helix	trans	-63.1	-47.4	179	-70.9	169.4	0	0	0	110.9	Q320 K321 G326 L327 N328 A340 L345 W373	Q320-I324 HydrophobicContact CG-CD1 3.68Å; Q320-I324 HydrophobicContact CG-CG1 4.41Å; Q320-I324 VanDerWaalsContact O-CG1 3.31Å; Q320-I324 WeakPolarHBondContact O-CG1 3.43Å; Q320-I324 PolarHBondContact O-N 3.18Å; K321-I324 PolarHBondContact O-N 3.27Å; I324-G326 PolarHBondContact O-N 3.47Å; I324-L327 PolarHBondContact O-N 3.49Å; I324-N328 WeakPolarHBondContact CG2-ND2 3.42Å; I324-N328 WeakPolarHBondContact O-CB 3.43Å; I324-N328 PolarHBondContact O-N 2.69Å; I324-N328 PolarHBondContact O-ND2 2.92Å; I324-A340 HydrophobicContact CG2-CB 3.71Å; I324-L345 HydrophobicContact CD1-CD2 3.77Å; I324-W373 HydrophobicContact CG1-CH2 4.22Å; I324-W373 HydrophobicContact CG1-CZ2 4.06Å
325	N	91.6	Very high	91.1	Very high	106 Å²	106	41.5 Å²	41.5	57%	0.567	21%	0.213	S	C	*	.	H	α-helix	trans	-60.2	-48.6	-178.8	-69.6	-5.5	0	0	0	111.2	K321 Q322 N328	K321-N325 WeakPolarHBondContact O-CB 3.37Å; K321-N325 PolarHBondContact O-N 2.85Å; K321-N325 PolarHBondContact O-ND2 3.04Å; K321-N325 PolarHBondContact O-OD1 3.48Å; Q322-N325 PolarHBondContact O-N 2.91Å; N325-N328 PolarHBondContact O-N 2.76Å
326	G	90.9	Very high	90.8	Very high	10 Å²	10	42 Å²	42	10%	0.103	22%	0.222	C	C	.	.	H	α-helix	trans	-66.7	-40.6	178.5	0	0	0	0	0	113.2	Q322 I324 N328 E329 L406	Q322-G326 PolarHBondContact O-N 3.31Å; I324-G326 PolarHBondContact O-N 3.47Å; G326-N328 VanDerWaalsContact C-N 3.34Å; G326-N328 PolarHBondContact O-N 2.8Å; G326-E329 PolarHBondContact O-N 2.95Å; G326-L406 WeakPolarHBondContact O-CD1 3.22Å
327	L	93.5	Very high	90.5	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-72.5	-26.5	-179.9	-70.3	175.1	0	0	0	113.3	L316 L323 I324 E329 L330 F339 I387 I389 L403 F407	L316-L327 HydrophobicContact CD1-CD2 4.21Å; L323-L327 WeakPolarHBondContact O-CB 3.3Å; L323-L327 WeakPolarHBondContact O-CG 3.29Å; L323-L327 PolarHBondContact O-N 2.77Å; I324-L327 PolarHBondContact O-N 3.49Å; L327-E329 PolarHBondContact O-N 2.86Å; L327-L330 HydrophobicContact CD2-CD1 4.49Å; L327-L330 PolarHBondContact O-N 2.79Å; L327-F339 HydrophobicContact CB-CB 4.4Å; L327-F339 HydrophobicContact CB-CD2 3.53Å; L327-F339 HydrophobicContact CB-CE2 3.87Å; L327-F339 HydrophobicContact CB-CG 4.02Å; L327-F339 HydrophobicContact CD1-CB 4.41Å; L327-F339 HydrophobicContact CD1-CD1 4.03Å; L327-F339 HydrophobicContact CD1-CD2 4.2Å; L327-F339 HydrophobicContact CD1-CE1 4.28Å; L327-F339 HydrophobicContact CD1-CE2 4.4Å; L327-F339 HydrophobicContact CD1-CG 3.97Å; L327-F339 HydrophobicContact CD1-CZ 4.45Å; L327-F339 HydrophobicContact CD2-CE2 4.26Å; L327-F339 HydrophobicContact CD2-CZ 4.41Å; L327-F339 HydrophobicContact CG-CD2 4.35Å; L327-F339 HydrophobicContact CG-CE2 4.41Å; L327-I387 HydrophobicContact CD1-CD1 4.24Å; L327-I389 HydrophobicContact CD2-CD1 4.27Å; L327-L403 HydrophobicContact CD2-CD2 3.91Å; L327-F407 HydrophobicContact CD2-CE2 4.38Å; L327-F407 HydrophobicContact CG-CZ 4.31Å
328	N	92	Very high	90.5	Very high	57 Å²	57	47.7 Å²	47.7	31%	0.305	25%	0.251	S	S	.	.	H	α-helix	trans	-65.3	-26.5	174.6	-78.8	-19	0	0	0	111.9	I324 N325 G326 L330 C331	I324-N328 WeakPolarHBondContact CG2-ND2 3.42Å; I324-N328 WeakPolarHBondContact O-CB 3.43Å; I324-N328 PolarHBondContact O-N 2.69Å; I324-N328 PolarHBondContact O-ND2 2.92Å; N325-N328 PolarHBondContact O-N 2.76Å; G326-N328 VanDerWaalsContact C-N 3.34Å; G326-N328 PolarHBondContact O-N 2.8Å; N328-L330 PolarHBondContact O-N 2.76Å; N328-C331 CarbonylContact O-C 3.21Å; N328-C331 PolarHBondContact O-N 2.88Å; N328-C331 VanDerWaalsContact O-N 3.1Å
329	E	91.9	Very high	90.5	Very high	107 Å²	107	47.7 Å²	47.7	50%	0.5	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-20	175.1	-64.6	-179.8	-170.3	0	0	113.3	G326 L327 G359 L406	G326-E329 PolarHBondContact O-N 2.95Å; L327-E329 PolarHBondContact O-N 2.86Å; E329-G359 PolarHBondContact O-N 3.42Å; E329-G359 VanDerWaalsContact O-N 3.08Å; E329-L406 HydrophobicContact CB-CD2 4.08Å; E329-L406 WeakPolarHBondContact OE2-CD2 3.48Å
330	L	92.6	Very high	90.5	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.021	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-2	176.1	-55.7	177.4	0	0	0	113.1	L327 N328 L355 Y356 Q358 L403 L406	L327-L330 HydrophobicContact CD2-CD1 4.49Å; L327-L330 PolarHBondContact O-N 2.79Å; N328-L330 PolarHBondContact O-N 2.76Å; L330-L355 HydrophobicContact CB-CD2 4.08Å; L330-L355 HydrophobicContact CD1-CD2 4.48Å; L330-L355 WeakPolarHBondContact O-CA 3.23Å; L330-Y356 VanDerWaalsContact CD2-O 3.26Å; L330-Y356 WeakPolarHBondContact CD2-O 3.4Å; L330-Y356 PolarHBondContact O-N 2.65Å; L330-Q358 HydrophobicContact CD2-CG 3.81Å; L330-L403 HydrophobicContact CD1-CD2 4.24Å; L330-L406 HydrophobicContact CD1-CD1 3.52Å; L330-L406 HydrophobicContact CD2-CD1 3.84Å; L330-L406 HydrophobicContact CG-CD1 3.58Å
331	C	92.4	Very high	90.5	Very high	16 Å²	16	43.7 Å²	43.7	11%	0.108	24%	0.244	C	C	.	.			trans	-139.8	135.7	-168.2	-72.4	0	0	0	0	111.6	N328 T338 F339 V353	N328-C331 CarbonylContact O-C 3.21Å; N328-C331 PolarHBondContact O-N 2.88Å; N328-C331 VanDerWaalsContact O-N 3.1Å; C331-T338 HydrophobicContact CB-CG2 4.42Å; C331-F339 WeakPolarHBondContact SG-CE2 3.18Å; C331-V353 HydrophobicContact CB-CG2 4.02Å; C331-V353 WeakPolarHBondContact SG-CG2 3.33Å
332	S	90	Very high	90.5	Very high	17 Å²	17	44.2 Å²	44.2	12%	0.119	26%	0.257	C	S	.	.			trans	-99.7	139.8	170.8	175	0	0	0	0	111	E334 Y361	S332-E334 PolarHBondContact O-N 3.37Å; S332-E334 WeakPolarHBondContact OG-CB 3.46Å; S332-E334 PolarHBondContact OG-N 2.92Å; S332-Y361 WeakPolarHBondContact OG-CE1 3.25Å
333	S	89.8	Confident	90.4	Very high	96 Å²	96	43.3 Å²	43.3	67%	0.671	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-21.4	171.9	54.4	0	0	0	0	112.8	V335 G336	S333-V335 VanDerWaalsContact C-N 3.34Å; S333-V335 PolarHBondContact O-N 2.99Å; S333-G336 PolarHBondContact O-N 2.8Å
334	E	88	Confident	90.3	Very high	90 Å²	90	43.5 Å²	43.5	42%	0.421	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-27.6	-178.6	-60	-173.7	172.8	0	0	113.4	S332 Y361 N752 K753	S332-E334 PolarHBondContact O-N 3.37Å; S332-E334 WeakPolarHBondContact OG-CB 3.46Å; S332-E334 PolarHBondContact OG-N 2.92Å; E334-Y361 WeakPolarHBondContact OE2-CE1 3.36Å; E334-N752 HydrophobicContact CB-CB 4.43Å; E334-N752 PolarHBondContact OE2-ND2 3.43Å; E334-K753 PolarHBondContact O-N 3.48Å
335	V	87.6	Confident	90.2	Very high	17 Å²	17	44 Å²	44	10%	0.103	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-30.7	179.1	178	0	0	0	0	111.1	S333 V354 Y356 Y361 R751 K753	S333-V335 VanDerWaalsContact C-N 3.34Å; S333-V335 PolarHBondContact O-N 2.99Å; V335-V354 HydrophobicContact CG1-CB 4.27Å; V335-V354 HydrophobicContact CG1-CG2 4.15Å; V335-Y356 HydrophobicContact CG2-CE2 4.19Å; V335-Y361 HydrophobicContact CG2-CD2 4.28Å; V335-Y361 HydrophobicContact CG2-CE2 3.34Å; V335-R751 HydrophobicContact CG1-CB 3.91Å; V335-R751 HydrophobicContact CG2-CB 4.19Å; V335-K753 WeakPolarHBondContact O-CE 3.22Å; V335-K753 WeakPolarHBondContact O-CG 3.47Å
336	G	85.3	Confident	90	Very high	24 Å²	24	46.7 Å²	46.7	25%	0.247	26%	0.264	C	S	.	.	S	Bend	trans	157.7	-152	-178.4	0	0	0	0	0	113.4	S333 T338	S333-G336 PolarHBondContact O-N 2.8Å; G336-T338 PolarHBondContact O-N 3.49Å
337	L	88.5	Confident	90	Very high	101 Å²	101	46.3 Å²	46.3	53%	0.529	26%	0.26	S	S	.	.			trans	-69.3	126	-178.1	-61.9	174.4	0	0	0	110.5	A341 V353	L337-A341 HydrophobicContact CB-CB 4.06Å; L337-A341 HydrophobicContact CD2-CB 4.05Å; L337-V353 WeakPolarHBondContact O-CG2 3.15Å
338	T	91.5	Very high	89.8	Confident	23 Å²	23	47.6 Å²	47.6	14%	0.141	27%	0.266	C	S	.	.			trans	-88.1	178.3	175	63.4	0	0	0	0	111.5	C331 G336 A340 A341	C331-T338 HydrophobicContact CB-CG2 4.42Å; G336-T338 PolarHBondContact O-N 3.49Å; T338-A340 PolarHBondContact O-N 3.13Å; T338-A340 PolarHBondContact OG1-N 3.2Å; T338-A341 WeakPolarHBondContact O-CB 3.39Å; T338-A341 PolarHBondContact O-N 3.32Å; T338-A341 VanDerWaalsContact O-N 3.15Å
339	F	91.6	Very high	89.8	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-27	172.8	-66.4	-76.7	0	0	0	113.5	L327 C331 A341 V353 L355 F371 W373 I387 I389	L327-F339 HydrophobicContact CB-CB 4.4Å; L327-F339 HydrophobicContact CB-CD2 3.53Å; L327-F339 HydrophobicContact CB-CE2 3.87Å; L327-F339 HydrophobicContact CB-CG 4.02Å; L327-F339 HydrophobicContact CD1-CB 4.41Å; L327-F339 HydrophobicContact CD1-CD1 4.03Å; L327-F339 HydrophobicContact CD1-CD2 4.2Å; L327-F339 HydrophobicContact CD1-CE1 4.28Å; L327-F339 HydrophobicContact CD1-CE2 4.4Å; L327-F339 HydrophobicContact CD1-CG 3.97Å; L327-F339 HydrophobicContact CD1-CZ 4.45Å; L327-F339 HydrophobicContact CD2-CE2 4.26Å; L327-F339 HydrophobicContact CD2-CZ 4.41Å; L327-F339 HydrophobicContact CG-CD2 4.35Å; L327-F339 HydrophobicContact CG-CE2 4.41Å; C331-F339 WeakPolarHBondContact SG-CE2 3.18Å; F339-A341 VanDerWaalsContact C-N 3.32Å; F339-A341 PolarHBondContact O-N 3.47Å; F339-V353 HydrophobicContact CD2-CG1 4.37Å; F339-V353 HydrophobicContact CE1-CG1 4.15Å; F339-V353 HydrophobicContact CE2-CG1 3.72Å; F339-V353 HydrophobicContact CZ-CG1 3.58Å; F339-L355 HydrophobicContact CE2-CD2 3.9Å; F339-L355 HydrophobicContact CZ-CD2 3.94Å; F339-F371 HydrophobicContact CD1-CB 4.26Å; F339-F371 AromaticContact CD1-CD1 3.63Å; F339-F371 HydrophobicContact CD1-CD1 3.63Å; F339-F371 AromaticContact CD1-CD2 3.74Å; F339-F371 HydrophobicContact CD1-CD2 3.74Å; F339-F371 AromaticContact CD1-CE1 3.8Å; F339-F371 HydrophobicContact CD1-CE1 3.8Å; F339-F371 AromaticContact CD1-CE2 3.89Å; F339-F371 HydrophobicContact CD1-CE2 3.89Å; F339-F371 AromaticContact CD1-CG 3.6Å; F339-F371 HydrophobicContact CD1-CG 3.6Å; F339-F371 AromaticContact CD1-CZ 3.93Å; F339-F371 HydrophobicContact CD1-CZ 3.93Å; F339-F371 HydrophobicContact CE1-CB 3.85Å; F339-F371 AromaticContact CE1-CD1 3.51Å; F339-F371 HydrophobicContact CE1-CD1 3.51Å; F339-F371 HydrophobicContact CE1-CD2 4.2Å; F339-F371 HydrophobicContact CE1-CE1 4.07Å; F339-F371 AromaticContact CE1-CG 3.59Å; F339-F371 HydrophobicContact CE1-CG 3.59Å; F339-F371 HydrophobicContact CG-CE1 4.46Å; F339-F371 HydrophobicContact CG-CZ 4.46Å; F339-F371 HydrophobicContact CZ-CD1 4.45Å; F339-W373 PolarHBondContact O-NE1 2.89Å; F339-I387 HydrophobicContact CD1-CD1 3.75Å; F339-I387 HydrophobicContact CE1-CD1 4.13Å; F339-I389 HydrophobicContact CE1-CD1 4.25Å; F339-I389 HydrophobicContact CE1-CG1 4.44Å; F339-I389 HydrophobicContact CZ-CD1 4.41Å
340	A	90.7	Very high	89.9	Confident	29 Å²	29	44.6 Å²	44.6	24%	0.24	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	4.3	179.7	0	0	0	0	0	114.2	I324 T338 V342 L345	I324-A340 HydrophobicContact CG2-CB 3.71Å; T338-A340 PolarHBondContact O-N 3.13Å; T338-A340 PolarHBondContact OG1-N 3.2Å; A340-V342 PolarHBondContact O-N 3.43Å; A340-L345 WeakPolarHBondContact O-CD1 3.2Å
341	A	89.6	Confident	90	Very high	13 Å²	13	44.5 Å²	44.5	11%	0.107	25%	0.246	C	C	.	.			trans	-62	124.2	-177.2	0	0	0	0	0	112	L337 T338 F339 S343 V344 L345	L337-A341 HydrophobicContact CB-CB 4.06Å; L337-A341 HydrophobicContact CD2-CB 4.05Å; T338-A341 WeakPolarHBondContact O-CB 3.39Å; T338-A341 PolarHBondContact O-N 3.32Å; T338-A341 VanDerWaalsContact O-N 3.15Å; F339-A341 VanDerWaalsContact C-N 3.32Å; F339-A341 PolarHBondContact O-N 3.47Å; A341-S343 PolarHBondContact O-N 2.98Å; A341-S343 VanDerWaalsContact O-N 3.12Å; A341-V344 HydrophobicContact CB-CG2 4.15Å; A341-V344 PolarHBondContact O-N 3.12Å; A341-L345 WeakPolarHBondContact O-CG 3.22Å; A341-L345 PolarHBondContact O-N 3.2Å
342	V	88.7	Confident	90	Very high	124 Å²	124	47.9 Å²	47.9	75%	0.752	26%	0.257	S	S	*	.	H	α-helix	trans	-53	-38.9	-177.2	179.9	0	0	0	0	112.6	A340 V344	A340-V342 PolarHBondContact O-N 3.43Å; V342-V344 PolarHBondContact O-N 3Å
343	S	87.8	Confident	90.1	Very high	53 Å²	53	47.5 Å²	47.5	37%	0.371	25%	0.254	S	S	.	.	H	α-helix	trans	-65	-20.3	179.2	59.9	0	0	0	0	114.4	A341	A341-S343 PolarHBondContact O-N 2.98Å; A341-S343 VanDerWaalsContact O-N 3.12Å
344	V	90.4	Very high	90.3	Very high	4 Å²	4	43.9 Å²	43.9	2%	0.024	23%	0.227	C	C	.	.	H	α-helix	trans	-109.2	-30.5	-176.6	-166	0	0	0	0	110.8	A341 V342 R346 G347 R349 F371	A341-V344 HydrophobicContact CB-CG2 4.15Å; A341-V344 PolarHBondContact O-N 3.12Å; V342-V344 PolarHBondContact O-N 3Å; V344-R346 PolarHBondContact O-N 2.91Å; V344-R346 VanDerWaalsContact O-N 3.09Å; V344-G347 PolarHBondContact O-N 3.24Å; V344-R349 WeakPolarHBondContact CG1-O 3.38Å; V344-F371 HydrophobicContact CB-CE2 4.2Å; V344-F371 HydrophobicContact CB-CZ 4.47Å; V344-F371 HydrophobicContact CG1-CD2 4.14Å; V344-F371 HydrophobicContact CG1-CE2 3.43Å; V344-F371 VanDerWaalsContact CG1-CE2 3.43Å; V344-F371 HydrophobicContact CG1-CZ 3.98Å
345	L	89.1	Confident	90.6	Very high	33 Å²	33	39.8 Å²	39.8	17%	0.173	21%	0.208	C	C	.	.	H	α-helix	trans	-54.3	-29.9	-177	-85.3	178	0	0	0	114.2	I324 A340 A341 W373 R385	I324-L345 HydrophobicContact CD1-CD2 3.77Å; A340-L345 WeakPolarHBondContact O-CD1 3.2Å; A341-L345 WeakPolarHBondContact O-CG 3.22Å; A341-L345 PolarHBondContact O-N 3.2Å; L345-W373 HydrophobicContact CD2-CZ2 4.47Å; L345-R385 PolarHBondContact O-NH1 2.74Å; L345-R385 PolarHBondContact O-NH2 2.97Å
346	R	88	Confident	91	Very high	162 Å²	162	39.1 Å²	39.1	61%	0.611	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-18.8	176.7	-72.5	-168.8	179.9	175.7	-0.5	114	V344 P375 C376 L570	V344-R346 PolarHBondContact O-N 2.91Å; V344-R346 VanDerWaalsContact O-N 3.09Å; R346-P375 WeakPolarHBondContact O-CA 3.49Å; R346-C376 PolarHBondContact O-N 3.12Å; R346-L570 HydrophobicContact CB-CD2 4.15Å; R346-L570 WeakPolarHBondContact O-CD2 3.43Å
347	G	89.9	Confident	91.3	Very high	1 Å²	1	40 Å²	40	1%	0.01	20%	0.201	C	C	.	.	S	Bend	trans	95.9	7.6	-175.9	0	0	0	0	0	115.1	V344 R349 P571	V344-G347 PolarHBondContact O-N 3.24Å; G347-R349 VanDerWaalsContact C-N 3.33Å; G347-R349 PolarHBondContact O-N 3.33Å; G347-P571 WeakPolarHBondContact O-CG 3.17Å
348	H	90.7	Very high	91.4	Very high	29 Å²	29	38.6 Å²	38.6	13%	0.134	19%	0.193	C	C	.	.	S	Bend	trans	-72.5	-22.7	177	-68.7	-68.8	0	0	0	114.4	I536 N568 E569 L570	H348-I536 PolarHBondContact O-N 3.4Å; H348-N568 PolarHBondContact CE1-O 2.96Å; H348-E569 PolarHBondContact CE1-O 3.46Å; H348-E569 PolarHBondContact ND1-O 3.17Å; H348-L570 WeakPolarHBondContact CE1-CD2 3.16Å; H348-L570 WeakPolarHBondContact NE2-CD2 3.34Å
349	R	92.3	Very high	91.1	Very high	93 Å²	93	41 Å²	41	35%	0.351	22%	0.222	S	C	.	.	B	Isolated β-bridge	trans	-134.6	152.4	-172.3	-63.5	-173.2	-176.7	-175.3	1.9	111.4	V344 G347 R534	V344-R349 WeakPolarHBondContact CG1-O 3.38Å; G347-R349 VanDerWaalsContact C-N 3.33Å; G347-R349 PolarHBondContact O-N 3.33Å; R349-R534 CarbonylContact C-O 3.56Å; R349-R534 WeakPolarHBondContact CA-O 3.27Å
350	E	94.1	Very high	91	Very high	8 Å²	8	48.3 Å²	48.3	4%	0.037	25%	0.249	C	C	.	.			trans	-82	123.1	166.8	178.8	-179	-142.3	0	0	109.8	S370 I372 R458 R534 I536 V622	E350-S370 WeakPolarHBondContact OE1-CB 3.32Å; E350-I372 HydrophobicContact CB-CG1 4.12Å; E350-I372 HydrophobicContact CG-CG1 3.97Å; E350-R458 VanDerWaalsContact CD-NH2 3.27Å; E350-R458 IonicContact OE1-CZ 3.48Å; E350-R458 VanDerWaalsContact OE1-CZ 3.23Å; E350-R458 IonicContact OE1-NH1 3.5Å; E350-R458 PolarHBondContact OE1-NH1 3.02Å; E350-R458 IonicContact OE1-NH2 3.61Å; E350-R458 PolarHBondContact OE1-NH2 3.07Å; E350-R458 IonicContact OE2-CZ 3.65Å; E350-R458 IonicContact OE2-NH2 3.41Å; E350-R458 PolarHBondContact OE2-NH2 3.27Å; E350-R534 HydrophobicContact CB-CB 4.21Å; E350-R534 PolarHBondContact N-O 3.44Å; E350-R534 WeakPolarHBondContact O-CB 3.49Å; E350-R534 WeakPolarHBondContact O-CD 3.43Å; E350-R534 PolarHBondContact O-NH1 3.34Å; E350-I536 HydrophobicContact CB-CD1 4.42Å; E350-V622 HydrophobicContact CB-CG1 3.82Å; E350-V622 WeakPolarHBondContact OE2-CG1 3.46Å
351	G	93.3	Very high	90.8	Very high	2 Å²	2	49.8 Å²	49.8	2%	0.021	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	154.7	171.4	0	0	0	0	0	111.9	S370 F371	G351-S370 CarbonylContact O-C 3.58Å; G351-S370 VanDerWaalsContact O-CA 3.26Å; G351-S370 WeakPolarHBondContact O-CA 3.48Å; G351-F371 PolarHBondContact N-O 3.11Å; G351-F371 PolarHBondContact O-N 3.17Å
352	R	92.2	Very high	90.8	Very high	86 Å²	86	50.3 Å²	50.3	33%	0.325	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	134.7	165	174.8	-178.4	-167	-173.3	5.9	107.4	C369 R534	R352-C369 VanDerWaalsContact CA-O 3.32Å; R352-C369 WeakPolarHBondContact CA-O 3.19Å; R352-R534 VanDerWaalsContact N-NH1 3.17Å
353	V	93.7	Very high	90.8	Very high	10 Å²	10	47.2 Å²	47.2	6%	0.061	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	159.3	177.8	78.7	0	0	0	0	109	C331 L337 F339 L355 C369 F371	C331-V353 HydrophobicContact CB-CG2 4.02Å; C331-V353 WeakPolarHBondContact SG-CG2 3.33Å; L337-V353 WeakPolarHBondContact O-CG2 3.15Å; F339-V353 HydrophobicContact CD2-CG1 4.37Å; F339-V353 HydrophobicContact CE1-CG1 4.15Å; F339-V353 HydrophobicContact CE2-CG1 3.72Å; F339-V353 HydrophobicContact CZ-CG1 3.58Å; V353-L355 HydrophobicContact CG1-CD2 4.08Å; V353-C369 WeakPolarHBondContact CG1-SG 3.45Å; V353-C369 PolarHBondContact N-O 3.08Å; V353-C369 PolarHBondContact O-N 3.25Å; V353-C369 VanDerWaalsContact O-O 3.08Å; V353-F371 HydrophobicContact CB-CE1 4.2Å; V353-F371 HydrophobicContact CG1-CD1 4.33Å; V353-F371 HydrophobicContact CG1-CE1 4.3Å
354	V	93.8	Very high	90.9	Very high	19 Å²	19	46 Å²	46	12%	0.115	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	125.2	172.5	-177.5	0	0	0	0	107.2	V335 Y356 W679	V335-V354 HydrophobicContact CG1-CB 4.27Å; V335-V354 HydrophobicContact CG1-CG2 4.15Å; V354-Y356 HydrophobicContact CB-CE2 4.1Å; V354-Y356 HydrophobicContact CG1-CE2 3.81Å; V354-W679 HydrophobicContact CG1-CH2 3.91Å; V354-W679 HydrophobicContact CG1-CZ3 3.71Å; V354-W679 HydrophobicContact CG2-CH2 3.82Å; V354-W679 HydrophobicContact CG2-CZ3 4.48Å
355	L	94.5	Very high	91	Very high	5 Å²	5	46 Å²	46	3%	0.026	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	141	179.8	-62.4	175.4	0	0	0	110.5	L330 F339 V353 I366 G367 C369 I399	L330-L355 HydrophobicContact CB-CD2 4.08Å; L330-L355 HydrophobicContact CD1-CD2 4.48Å; L330-L355 WeakPolarHBondContact O-CA 3.23Å; F339-L355 HydrophobicContact CE2-CD2 3.9Å; F339-L355 HydrophobicContact CZ-CD2 3.94Å; V353-L355 HydrophobicContact CG1-CD2 4.08Å; L355-I366 HydrophobicContact CB-CB 4.08Å; L355-I366 HydrophobicContact CB-CG2 4.25Å; L355-I366 WeakPolarHBondContact O-CB 2.8Å; L355-I366 PolarHBondContact O-N 2.95Å; L355-G367 PolarHBondContact N-O 3.43Å; L355-G367 PolarHBondContact O-N 3.49Å; L355-C369 HydrophobicContact CD1-CB 3.89Å; L355-C369 HydrophobicContact CG-CB 4.29Å; L355-C369 VanDerWaalsContact CG-SG 3.59Å; L355-I399 HydrophobicContact CD1-CD1 3.56Å; L355-I399 HydrophobicContact CD1-CG1 3.95Å
356	Y	94.5	Very high	91.2	Very high	3 Å²	3	44.5 Å²	44.5	1%	0.012	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	162.5	174.3	-67	-92	0	0	0	109.9	L330 V335 V354 Y361 P362 Y363 G364 C365 I366	L330-Y356 VanDerWaalsContact CD2-O 3.26Å; L330-Y356 WeakPolarHBondContact CD2-O 3.4Å; L330-Y356 PolarHBondContact O-N 2.65Å; V335-Y356 HydrophobicContact CG2-CE2 4.19Å; V354-Y356 HydrophobicContact CB-CE2 4.1Å; V354-Y356 HydrophobicContact CG1-CE2 3.81Å; Y356-Y361 HydrophobicContact CD1-CD2 4.15Å; Y356-Y361 HydrophobicContact CD2-CD2 4.05Å; Y356-Y361 AromaticContact CE1-CD2 3.86Å; Y356-Y361 HydrophobicContact CE1-CD2 3.86Å; Y356-Y361 HydrophobicContact CE1-CE2 4.31Å; Y356-Y361 AromaticContact CE2-CD2 3.77Å; Y356-Y361 HydrophobicContact CE2-CD2 3.77Å; Y356-Y361 HydrophobicContact CE2-CE2 4.1Å; Y356-Y361 HydrophobicContact CG-CD2 4.23Å; Y356-Y361 AromaticContact CZ-CD2 3.66Å; Y356-Y361 AromaticContact CZ-CE2 3.82Å; Y356-P362 WeakPolarHBondContact CE1-O 3.36Å; Y356-Y363 WeakPolarHBondContact CD1-O 3.47Å; Y356-G364 WeakPolarHBondContact CA-O 3.05Å; Y356-C365 HydrophobicContact CD1-CB 4.22Å; Y356-C365 HydrophobicContact CE1-CB 3.97Å; Y356-I366 WeakPolarHBondContact O-CD1 3.39Å
357	E	92.4	Very high	91.5	Very high	41 Å²	41	36.8 Å²	36.8	19%	0.192	19%	0.186	C	C	.	.	S	Bend	trans	-62.7	150.9	165.5	-70.3	176.2	-172.6	0	0	110.3	G359 R360 G364 I366 K398	E357-G359 PolarHBondContact O-N 3.03Å; E357-G359 VanDerWaalsContact O-N 3.15Å; E357-R360 HydrophobicContact CB-CB 4.12Å; E357-R360 HydrophobicContact CB-CG 4.34Å; E357-R360 PolarHBondContact O-N 2.8Å; E357-R360 VanDerWaalsContact O-N 3.08Å; E357-R360 WeakPolarHBondContact OE2-CD 3.24Å; E357-R360 IonicContact OE2-CZ 2.87Å; E357-R360 IonicContact OE2-NE 3.3Å; E357-R360 IonicContact OE2-NH1 3.65Å; E357-R360 PolarHBondContact OE2-NH1 3.46Å; E357-G364 PolarHBondContact N-O 2.69Å; E357-I366 HydrophobicContact CG-CD1 4.15Å; E357-I366 HydrophobicContact CG-CG1 4.07Å; E357-K398 IonicContact OE1-NZ 2.89Å; E357-K398 PolarHBondContact OE1-NZ 3.34Å
358	Q	90	Very high	91.7	Very high	73 Å²	73	37.6 Å²	37.6	34%	0.341	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	119.1	-172.3	-59.7	177.1	-5.2	0	0	111.6	L330 R360 S402 S405 L406	L330-Q358 HydrophobicContact CD2-CG 3.81Å; Q358-R360 PolarHBondContact O-N 2.82Å; Q358-S402 PolarHBondContact NE2-O 2.68Å; Q358-S405 PolarHBondContact NE2-OG 3.17Å; Q358-L406 HydrophobicContact CG-CD2 3.78Å; Q358-L406 HydrophobicContact CG-CG 4.14Å; Q358-L406 VanDerWaalsContact NE2-CG 3.25Å
359	G	86.6	Confident	91.9	Very high	73 Å²	73	36.3 Å²	36.3	75%	0.753	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.4	11.5	176.2	0	0	0	0	0	115.7	E329 E357	E329-G359 PolarHBondContact O-N 3.42Å; E329-G359 VanDerWaalsContact O-N 3.08Å; E357-G359 PolarHBondContact O-N 3.03Å; E357-G359 VanDerWaalsContact O-N 3.15Å
360	R	88	Confident	92	Very high	154 Å²	154	33.1 Å²	33.1	58%	0.581	18%	0.177	S	C	*	.			trans	-98.2	3.5	-174	-76	-173.5	174.3	-174.1	-6.9	115.1	E357 Q358 Y363	E357-R360 HydrophobicContact CB-CB 4.12Å; E357-R360 HydrophobicContact CB-CG 4.34Å; E357-R360 PolarHBondContact O-N 2.8Å; E357-R360 VanDerWaalsContact O-N 3.08Å; E357-R360 WeakPolarHBondContact OE2-CD 3.24Å; E357-R360 IonicContact OE2-CZ 2.87Å; E357-R360 IonicContact OE2-NE 3.3Å; E357-R360 IonicContact OE2-NH1 3.65Å; E357-R360 PolarHBondContact OE2-NH1 3.46Å; Q358-R360 PolarHBondContact O-N 2.82Å; R360-Y363 CarbonylContact C-O 3.59Å; R360-Y363 CarbonylContact O-C 3.52Å; R360-Y363 VanDerWaalsContact O-CA 3.32Å; R360-Y363 WeakPolarHBondContact O-CA 3.01Å; R360-Y363 WeakPolarHBondContact O-CB 2.71Å; R360-Y363 PolarHBondContact O-N 3.28Å
361	Y	88	Confident	92.1	Very high	59 Å²	59	32.8 Å²	32.8	23%	0.231	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	131.3	177.2	179	-98.7	0	0	0	111	S332 E334 V335 Y356	S332-Y361 WeakPolarHBondContact OG-CE1 3.25Å; E334-Y361 WeakPolarHBondContact OE2-CE1 3.36Å; V335-Y361 HydrophobicContact CG2-CD2 4.28Å; V335-Y361 HydrophobicContact CG2-CE2 3.34Å; Y356-Y361 HydrophobicContact CD1-CD2 4.15Å; Y356-Y361 HydrophobicContact CD2-CD2 4.05Å; Y356-Y361 AromaticContact CE1-CD2 3.86Å; Y356-Y361 HydrophobicContact CE1-CD2 3.86Å; Y356-Y361 HydrophobicContact CE1-CE2 4.31Å; Y356-Y361 AromaticContact CE2-CD2 3.77Å; Y356-Y361 HydrophobicContact CE2-CD2 3.77Å; Y356-Y361 HydrophobicContact CE2-CE2 4.1Å; Y356-Y361 HydrophobicContact CG-CD2 4.23Å; Y356-Y361 AromaticContact CZ-CD2 3.66Å; Y356-Y361 AromaticContact CZ-CE2 3.82Å
362	P	88.6	Confident	92.2	Very high	24 Å²	24	32.8 Å²	32.8	16%	0.156	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	cis	-88.3	-2	10.7	35.4	-37	0	0	0	116.6	Y356 F748 W768	Y356-P362 WeakPolarHBondContact CE1-O 3.36Å; P362-F748 HydrophobicContact CB-CD2 3.79Å; P362-F748 HydrophobicContact CB-CE2 3.86Å; P362-F748 HydrophobicContact CB-CG 4.27Å; P362-F748 HydrophobicContact CB-CZ 4.37Å; P362-F748 HydrophobicContact CG-CD1 4.38Å; P362-F748 HydrophobicContact CG-CD2 4.16Å; P362-F748 HydrophobicContact CG-CE1 4.17Å; P362-F748 HydrophobicContact CG-CE2 3.97Å; P362-F748 HydrophobicContact CG-CG 4.36Å; P362-F748 HydrophobicContact CG-CZ 3.95Å; P362-W768 HydrophobicContact CG-CZ3 4.39Å
363	Y	89.7	Confident	92.3	Very high	60 Å²	60	28.7 Å²	28.7	24%	0.235	16%	0.159	C	C	.	.	S	Bend	trans	-84.5	169.1	-178.6	-55.4	-73.9	0	0	0	112.9	Y356 R360 E745 P746 F748	Y356-Y363 WeakPolarHBondContact CD1-O 3.47Å; R360-Y363 CarbonylContact C-O 3.59Å; R360-Y363 CarbonylContact O-C 3.52Å; R360-Y363 VanDerWaalsContact O-CA 3.32Å; R360-Y363 WeakPolarHBondContact O-CA 3.01Å; R360-Y363 WeakPolarHBondContact O-CB 2.71Å; R360-Y363 PolarHBondContact O-N 3.28Å; Y363-E745 PolarHBondContact OH-OE2 2.91Å; Y363-P746 HydrophobicContact CD1-CG 4.05Å; Y363-P746 WeakPolarHBondContact CD1-O 3.37Å; Y363-P746 WeakPolarHBondContact CE1-O 3.27Å; Y363-F748 HydrophobicContact CD1-CB 4.13Å; Y363-F748 AromaticContact CD1-CD1 3.87Å; Y363-F748 HydrophobicContact CD1-CD1 3.87Å; Y363-F748 HydrophobicContact CD1-CG 4.34Å; Y363-F748 HydrophobicContact CE1-CB 4.44Å; Y363-F748 AromaticContact CE1-CD1 3.35Å; Y363-F748 HydrophobicContact CE1-CD1 3.35Å; Y363-F748 AromaticContact CE1-CE1 3.91Å; Y363-F748 HydrophobicContact CE1-CE1 3.91Å; Y363-F748 HydrophobicContact CE1-CG 4.25Å; Y363-F748 AromaticContact CZ-CD1 3.99Å
364	G	88.9	Confident	92.3	Very high	27 Å²	27	30 Å²	30	28%	0.278	17%	0.165	S	C	.	.			trans	67.6	40.5	174.1	0	0	0	0	0	113.8	Y356 E357 I366	Y356-G364 WeakPolarHBondContact CA-O 3.05Å; E357-G364 PolarHBondContact N-O 2.69Å; G364-I366 PolarHBondContact O-N 3.34Å; G364-I366 VanDerWaalsContact O-N 3.17Å
365	C	93.2	Very high	92.2	Very high	4 Å²	4	29.5 Å²	29.5	3%	0.027	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	118.8	177.2	176.8	0	0	0	0	110.9	Y356 D681 S682 R751	Y356-C365 HydrophobicContact CD1-CB 4.22Å; Y356-C365 HydrophobicContact CE1-CB 3.97Å; C365-D681 HydrophobicContact CB-CB 4.5Å; C365-D681 WeakPolarHBondContact CB-OD2 3.34Å; C365-S682 WeakPolarHBondContact O-CA 3.48Å; C365-R751 PolarHBondContact SG-NH2 2.79Å
366	I	94	Very high	91.8	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.01	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-52.1	176.8	-68.4	179.1	0	0	0	109.1	L355 Y356 E357 G364 I395 I399 S682	L355-I366 HydrophobicContact CB-CB 4.08Å; L355-I366 HydrophobicContact CB-CG2 4.25Å; L355-I366 WeakPolarHBondContact O-CB 2.8Å; L355-I366 PolarHBondContact O-N 2.95Å; Y356-I366 WeakPolarHBondContact O-CD1 3.39Å; E357-I366 HydrophobicContact CG-CD1 4.15Å; E357-I366 HydrophobicContact CG-CG1 4.07Å; G364-I366 PolarHBondContact O-N 3.34Å; G364-I366 VanDerWaalsContact O-N 3.17Å; I366-I395 HydrophobicContact CB-CG2 4.43Å; I366-I395 HydrophobicContact CG2-CG2 3.12Å; I366-I399 HydrophobicContact CG2-CD1 3.85Å; I366-I399 HydrophobicContact CG2-CG1 3.52Å; I366-S682 PolarHBondContact O-OG 3.35Å
367	G	93.7	Very high	90.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	145.7	-178.9	173.3	0	0	0	0	0	113.6	L355	L355-G367 PolarHBondContact N-O 3.43Å; L355-G367 PolarHBondContact O-N 3.49Å
368	P	94.3	Very high	89.9	Confident	17 Å²	17	37.3 Å²	37.3	11%	0.11	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	140.4	-176.2	31.9	-32.9	0	0	0	111.7	F675 W679	P368-F675 HydrophobicContact CG-CB 3.94Å; P368-F675 HydrophobicContact CG-CD2 3.79Å; P368-F675 HydrophobicContact CG-CG 3.86Å; P368-W679 HydrophobicContact CB-CH2 4Å; P368-W679 HydrophobicContact CB-CZ2 3.91Å; P368-W679 HydrophobicContact CG-CH2 4.05Å; P368-W679 HydrophobicContact CG-CZ2 3.65Å
369	C	94.7	Very high	88.6	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.014	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	153.3	168.7	73.4	0	0	0	0	110.8	R352 V353 L355 I389 W390 V391	R352-C369 VanDerWaalsContact CA-O 3.32Å; R352-C369 WeakPolarHBondContact CA-O 3.19Å; V353-C369 WeakPolarHBondContact CG1-SG 3.45Å; V353-C369 PolarHBondContact N-O 3.08Å; V353-C369 PolarHBondContact O-N 3.25Å; V353-C369 VanDerWaalsContact O-O 3.08Å; L355-C369 HydrophobicContact CD1-CB 3.89Å; L355-C369 HydrophobicContact CG-CB 4.29Å; L355-C369 VanDerWaalsContact CG-SG 3.59Å; C369-I389 HydrophobicContact CB-CG2 3.99Å; C369-W390 WeakPolarHBondContact CA-O 3.18Å; C369-V391 HydrophobicContact CB-CG2 4.49Å
370	S	94.7	Very high	87.6	Confident	27 Å²	27	40.2 Å²	40.2	19%	0.189	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	148.9	167.8	-57.9	0	0	0	0	109	E350 G351 I389 W390	E350-S370 WeakPolarHBondContact OE1-CB 3.32Å; G351-S370 CarbonylContact O-C 3.58Å; G351-S370 VanDerWaalsContact O-CA 3.26Å; G351-S370 WeakPolarHBondContact O-CA 3.48Å; S370-I389 CarbonylContact O-C 3.49Å; S370-W390 PolarHBondContact N-O 3.06Å; S370-W390 VanDerWaalsContact N-O 3.12Å; S370-W390 PolarHBondContact O-N 3.26Å
371	F	96	Very high	86.5	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	152.2	179.9	67.8	-88.5	0	0	0	112.9	F339 V344 G351 V353 W373 I387 W388 I389	F339-F371 HydrophobicContact CD1-CB 4.26Å; F339-F371 AromaticContact CD1-CD1 3.63Å; F339-F371 HydrophobicContact CD1-CD1 3.63Å; F339-F371 AromaticContact CD1-CD2 3.74Å; F339-F371 HydrophobicContact CD1-CD2 3.74Å; F339-F371 AromaticContact CD1-CE1 3.8Å; F339-F371 HydrophobicContact CD1-CE1 3.8Å; F339-F371 AromaticContact CD1-CE2 3.89Å; F339-F371 HydrophobicContact CD1-CE2 3.89Å; F339-F371 AromaticContact CD1-CG 3.6Å; F339-F371 HydrophobicContact CD1-CG 3.6Å; F339-F371 AromaticContact CD1-CZ 3.93Å; F339-F371 HydrophobicContact CD1-CZ 3.93Å; F339-F371 HydrophobicContact CE1-CB 3.85Å; F339-F371 AromaticContact CE1-CD1 3.51Å; F339-F371 HydrophobicContact CE1-CD1 3.51Å; F339-F371 HydrophobicContact CE1-CD2 4.2Å; F339-F371 HydrophobicContact CE1-CE1 4.07Å; F339-F371 AromaticContact CE1-CG 3.59Å; F339-F371 HydrophobicContact CE1-CG 3.59Å; F339-F371 HydrophobicContact CG-CE1 4.46Å; F339-F371 HydrophobicContact CG-CZ 4.46Å; F339-F371 HydrophobicContact CZ-CD1 4.45Å; V344-F371 HydrophobicContact CB-CE2 4.2Å; V344-F371 HydrophobicContact CB-CZ 4.47Å; V344-F371 HydrophobicContact CG1-CD2 4.14Å; V344-F371 HydrophobicContact CG1-CE2 3.43Å; V344-F371 VanDerWaalsContact CG1-CE2 3.43Å; V344-F371 HydrophobicContact CG1-CZ 3.98Å; G351-F371 PolarHBondContact N-O 3.11Å; G351-F371 PolarHBondContact O-N 3.17Å; V353-F371 HydrophobicContact CB-CE1 4.2Å; V353-F371 HydrophobicContact CG1-CD1 4.33Å; V353-F371 HydrophobicContact CG1-CE1 4.3Å; F371-W373 AromaticContact CE2-CD1 3.86Å; F371-W373 AromaticContact CE2-NE1 3.68Å; F371-I387 HydrophobicContact CB-CD1 4.13Å; F371-I387 HydrophobicContact CB-CG1 4.37Å; F371-I387 HydrophobicContact CD2-CD1 3.9Å; F371-I387 HydrophobicContact CG-CD1 4.3Å; F371-W388 CarbonylContact C-O 3.42Å; F371-W388 WeakPolarHBondContact CA-O 3.45Å; F371-W388 WeakPolarHBondContact CB-O 3.48Å; F371-I389 HydrophobicContact CB-CG1 4.35Å
372	I	95.6	Very high	85.7	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	123.9	178.5	-57.9	175.1	0	0	0	107.5	E350 W388 I536 W576 V622 I637	E350-I372 HydrophobicContact CB-CG1 4.12Å; E350-I372 HydrophobicContact CG-CG1 3.97Å; I372-W388 PolarHBondContact N-O 2.65Å; I372-W388 PolarHBondContact O-N 2.99Å; I372-I536 HydrophobicContact CB-CD1 4.41Å; I372-I536 HydrophobicContact CD1-CD1 4.16Å; I372-I536 HydrophobicContact CG1-CD1 4.07Å; I372-I536 HydrophobicContact CG2-CD1 3.57Å; I372-W576 HydrophobicContact CB-CH2 4.34Å; I372-W576 HydrophobicContact CG2-CH2 3.87Å; I372-W576 HydrophobicContact CG2-CZ2 3.85Å; I372-V622 HydrophobicContact CD1-CG2 4.48Å; I372-I637 HydrophobicContact CD1-CD1 3.86Å
373	W	94.3	Very high	85.3	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	140.1	169.6	-75.4	107	0	0	0	110.4	L323 I324 F339 L345 F371 R385 I387	L323-W373 HydrophobicContact CB-CH2 4.18Å; L323-W373 HydrophobicContact CD1-CH2 4.33Å; L323-W373 HydrophobicContact CD1-CZ3 4.14Å; I324-W373 HydrophobicContact CG1-CH2 4.22Å; I324-W373 HydrophobicContact CG1-CZ2 4.06Å; F339-W373 PolarHBondContact O-NE1 2.89Å; L345-W373 HydrophobicContact CD2-CZ2 4.47Å; F371-W373 AromaticContact CE2-CD1 3.86Å; F371-W373 AromaticContact CE2-NE1 3.68Å; W373-R385 HydrophobicContact CE3-CG 4.26Å; W373-R385 HydrophobicContact CZ3-CG 4.48Å; W373-I387 HydrophobicContact CD2-CB 4.17Å; W373-I387 HydrophobicContact CD2-CD1 3.99Å; W373-I387 HydrophobicContact CD2-CG1 4.08Å; W373-I387 HydrophobicContact CE3-CB 3.73Å; W373-I387 HydrophobicContact CE3-CD1 4.32Å; W373-I387 HydrophobicContact CE3-CG1 4.17Å; W373-I387 HydrophobicContact CH2-CB 4.28Å; W373-I387 HydrophobicContact CH2-CD1 4.08Å; W373-I387 HydrophobicContact CZ2-CD1 3.74Å; W373-I387 HydrophobicContact CZ3-CB 3.79Å; W373-I387 HydrophobicContact CZ3-CD1 4.36Å; W373-I387 HydrophobicContact CZ3-CG1 4.46Å; W373-I387 HydrophobicContact CZ3-CG2 4.28Å
374	E	93.2	Very high	85.1	Confident	39 Å²	39	44.6 Å²	44.6	18%	0.182	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-59.6	127.7	168.3	-179	174.6	-144.5	0	0	109.5	C376 R385 K386 W576	E374-C376 PolarHBondContact O-N 3.01Å; E374-R385 HydrophobicContact CB-CG 4.46Å; E374-R385 VanDerWaalsContact O-CZ 3.24Å; E374-R385 PolarHBondContact O-NE 3.37Å; E374-R385 PolarHBondContact O-NH2 3.24Å; E374-K386 HydrophobicContact CB-CB 4.1Å; E374-K386 VanDerWaalsContact CB-O 3.27Å; E374-K386 WeakPolarHBondContact CB-O 3.13Å; E374-K386 PolarHBondContact N-O 2.82Å; E374-K386 WeakPolarHBondContact OE2-CB 3.33Å; E374-K386 WeakPolarHBondContact OE2-CG 3.38Å; E374-K386 PolarHBondContact OE2-N 2.68Å; E374-K386 VanDerWaalsContact OE2-N 3.08Å; E374-W576 HydrophobicContact CB-CD2 4.39Å; E374-W576 HydrophobicContact CB-CE3 4.23Å; E374-W576 HydrophobicContact CB-CH2 4.32Å; E374-W576 HydrophobicContact CB-CZ2 4.47Å; E374-W576 HydrophobicContact CB-CZ3 4.18Å; E374-W576 HydrophobicContact CG-CD2 4.28Å; E374-W576 HydrophobicContact CG-CE3 4.47Å
375	P	91.7	Very high	85.1	Confident	8 Å²	8	43.9 Å²	43.9	5%	0.052	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-58.9	137.6	-177.9	21.8	-31.5	0	0	0	111.7	R346 L570 F572	R346-P375 WeakPolarHBondContact O-CA 3.49Å; P375-L570 HydrophobicContact CB-CB 3.94Å; P375-L570 HydrophobicContact CB-CD1 4.22Å; P375-L570 HydrophobicContact CB-CD2 4.18Å; P375-L570 HydrophobicContact CB-CG 4.38Å; P375-F572 HydrophobicContact CB-CD1 3.99Å; P375-F572 HydrophobicContact CB-CE1 3.87Å; P375-F572 HydrophobicContact CB-CG 4.35Å; P375-F572 HydrophobicContact CB-CZ 4.15Å; P375-F572 HydrophobicContact CG-CD1 3.59Å; P375-F572 HydrophobicContact CG-CE1 3.9Å; P375-F572 HydrophobicContact CG-CG 4.05Å; P375-F572 WeakPolarHBondContact O-CE1 3.33Å
376	C	86.1	Confident	85.1	Confident	26 Å²	26	45.8 Å²	45.8	18%	0.176	25%	0.25	C	C	.	.			trans	-150.1	127.8	178.8	-174	0	0	0	0	110.1	R346 E374 C378 L570	R346-C376 PolarHBondContact O-N 3.12Å; E374-C376 PolarHBondContact O-N 3.01Å; C376-C378 PolarHBondContact SG-O 3.31Å; C376-C378 VanDerWaalsContact SG-O 3.34Å; C376-L570 VanDerWaalsContact C-CD1 3.47Å
377	D	75.1	Confident	85.1	Confident	101 Å²	101	45.7 Å²	45.7	54%	0.54	25%	0.249	S	C	.	.	S	Bend	trans	-76.8	-40.6	-178.6	-72.8	-52.9	0	0	0	112.3	L570	D377-L570 HydrophobicContact CB-CD1 4.42Å; D377-L570 WeakPolarHBondContact OD1-CD1 3.42Å
378	C	70.7	Confident	85.2	Confident	86 Å²	86	45.7 Å²	45.7	58%	0.581	25%	0.249	S	C	*	.	S	Bend	trans	-125	99.6	-179	-62.1	0	0	0	0	109.6	C376 E380	C376-C378 PolarHBondContact SG-O 3.31Å; C376-C378 VanDerWaalsContact SG-O 3.34Å; C378-E380 PolarHBondContact O-N 2.86Å
379	P	62.8	Low	85.3	Confident	78 Å²	78	45 Å²	45	51%	0.506	25%	0.245	S	C	.	.			trans	-75.6	79.1	178.9	31.5	-33.5	0	0	0	109.6
380	E	65.6	Low	85.4	Confident	128 Å²	128	45.1 Å²	45.1	60%	0.598	25%	0.245	S	C	*	.			trans	-72.4	135.2	165.9	-65.5	179.6	-175	0	0	109.1	C378 N382 I383	C378-E380 PolarHBondContact O-N 2.86Å; E380-N382 PolarHBondContact O-N 2.76Å; E380-I383 HydrophobicContact CB-CD1 3.86Å; E380-I383 HydrophobicContact CB-CG1 4.07Å; E380-I383 HydrophobicContact CG-CD1 4.4Å; E380-I383 PolarHBondContact O-N 3.49Å; E380-I383 VanDerWaalsContact O-N 3.13Å
381	D	66.3	Low	85.4	Confident	73 Å²	73	43.9 Å²	43.9	39%	0.39	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-21.8	-172.4	-71	-39.8	0	0	0	114.4	K321	K321-D381 HydrophobicContact CD-CB 4.32Å; K321-D381 VanDerWaalsContact CD-OD1 3.3Å; K321-D381 WeakPolarHBondContact CD-OD1 3.09Å; K321-D381 WeakPolarHBondContact CE-OD1 3.44Å; K321-D381 VanDerWaalsContact CE-OD2 3.31Å; K321-D381 WeakPolarHBondContact CE-OD2 3.3Å; K321-D381 IonicContact NZ-OD1 3.37Å; K321-D381 PolarHBondContact NZ-OD1 2.67Å; K321-D381 IonicContact NZ-OD2 3.34Å; K321-D381 PolarHBondContact NZ-OD2 3.3Å
382	N	71.7	Confident	85.4	Confident	127 Å²	127	44 Å²	44	68%	0.679	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	-11.5	-176.4	-71.6	-23.3	0	0	0	113.6	E380	E380-N382 PolarHBondContact O-N 2.76Å
383	I	79.5	Confident	85.3	Confident	77 Å²	77	44.6 Å²	44.6	40%	0.395	24%	0.241	S	C	.	.	S	Bend	trans	-77.2	129.3	-177.7	-62	173.6	0	0	0	109.8	E380 R385	E380-I383 HydrophobicContact CB-CD1 3.86Å; E380-I383 HydrophobicContact CB-CG1 4.07Å; E380-I383 HydrophobicContact CG-CD1 4.4Å; E380-I383 PolarHBondContact O-N 3.49Å; E380-I383 VanDerWaalsContact O-N 3.13Å; I383-R385 PolarHBondContact O-N 2.84Å
384	I	85.5	Confident	85.3	Confident	113 Å²	113	46.2 Å²	46.2	58%	0.579	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69	118.6	170.5	-61.7	174	0	0	0	107.5	A317	A317-I384 HydrophobicContact CB-CG2 4.05Å
385	R	89.1	Confident	85.3	Confident	11 Å²	11	44.5 Å²	44.5	4%	0.042	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	142.7	-177.8	-168.9	173	-173.3	-165	-0	110.7	A317 G318 L345 W373 E374 I383	A317-R385 WeakPolarHBondContact CA-O 3.11Å; G318-R385 PolarHBondContact N-O 2.86Å; G318-R385 PolarHBondContact O-N 3.5Å; L345-R385 PolarHBondContact O-NH1 2.74Å; L345-R385 PolarHBondContact O-NH2 2.97Å; W373-R385 HydrophobicContact CE3-CG 4.26Å; W373-R385 HydrophobicContact CZ3-CG 4.48Å; E374-R385 HydrophobicContact CB-CG 4.46Å; E374-R385 VanDerWaalsContact O-CZ 3.24Å; E374-R385 PolarHBondContact O-NE 3.37Å; E374-R385 PolarHBondContact O-NH2 3.24Å; I383-R385 PolarHBondContact O-N 2.84Å
386	K	92.6	Very high	85.3	Confident	44 Å²	44	46.4 Å²	46.4	19%	0.191	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	145.2	176.7	-58.9	175.6	175	-147.6	0	112.2	E315 L316 A317 E374 W576	E315-K386 WeakPolarHBondContact OE1-CD 3.45Å; E315-K386 WeakPolarHBondContact OE1-CE 2.81Å; E315-K386 IonicContact OE1-NZ 2.83Å; E315-K386 PolarHBondContact OE1-NZ 3.32Å; L316-K386 CarbonylContact O-C 3.53Å; L316-K386 WeakPolarHBondContact O-CA 3.37Å; A317-K386 HydrophobicContact CB-CG 3.83Å; E374-K386 HydrophobicContact CB-CB 4.1Å; E374-K386 VanDerWaalsContact CB-O 3.27Å; E374-K386 WeakPolarHBondContact CB-O 3.13Å; E374-K386 PolarHBondContact N-O 2.82Å; E374-K386 WeakPolarHBondContact OE2-CB 3.33Å; E374-K386 WeakPolarHBondContact OE2-CG 3.38Å; E374-K386 PolarHBondContact OE2-N 2.68Å; E374-K386 VanDerWaalsContact OE2-N 3.08Å; K386-W576 HydrophobicContact CB-CE3 4.46Å; K386-W576 HydrophobicContact CB-CZ3 4.49Å
387	I	94.5	Very high	85.5	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	133.8	166.9	-173.6	179	0	0	0	109.3	E315 L316 L323 L327 F339 F371 W373 I389	E315-I387 WeakPolarHBondContact CA-O 3.46Å; L316-I387 HydrophobicContact CB-CG2 3.71Å; L316-I387 HydrophobicContact CD1-CG2 4.4Å; L316-I387 HydrophobicContact CG-CG2 4.47Å; L316-I387 PolarHBondContact N-O 2.82Å; L316-I387 PolarHBondContact O-N 3.32Å; L323-I387 HydrophobicContact CD1-CG2 4.37Å; L327-I387 HydrophobicContact CD1-CD1 4.24Å; F339-I387 HydrophobicContact CD1-CD1 3.75Å; F339-I387 HydrophobicContact CE1-CD1 4.13Å; F371-I387 HydrophobicContact CB-CD1 4.13Å; F371-I387 HydrophobicContact CB-CG1 4.37Å; F371-I387 HydrophobicContact CD2-CD1 3.9Å; F371-I387 HydrophobicContact CG-CD1 4.3Å; W373-I387 HydrophobicContact CD2-CB 4.17Å; W373-I387 HydrophobicContact CD2-CD1 3.99Å; W373-I387 HydrophobicContact CD2-CG1 4.08Å; W373-I387 HydrophobicContact CE3-CB 3.73Å; W373-I387 HydrophobicContact CE3-CD1 4.32Å; W373-I387 HydrophobicContact CE3-CG1 4.17Å; W373-I387 HydrophobicContact CH2-CB 4.28Å; W373-I387 HydrophobicContact CH2-CD1 4.08Å; W373-I387 HydrophobicContact CZ2-CD1 3.74Å; W373-I387 HydrophobicContact CZ3-CB 3.79Å; W373-I387 HydrophobicContact CZ3-CD1 4.36Å; W373-I387 HydrophobicContact CZ3-CG1 4.46Å; W373-I387 HydrophobicContact CZ3-CG2 4.28Å; I387-I389 HydrophobicContact CD1-CG1 4.32Å; I387-I389 HydrophobicContact CG1-CG1 4.31Å
388	W	95.7	Very high	86.3	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	123.4	170.7	-74.9	-7.9	0	0	0	110.1	I314 E315 F371 I372 L452 M456 I575 W576 L620	I314-W388 CarbonylContact O-C 3.5Å; I314-W388 WeakPolarHBondContact O-CA 3.47Å; E315-W388 PolarHBondContact OE2-NE1 3.19Å; F371-W388 CarbonylContact C-O 3.42Å; F371-W388 WeakPolarHBondContact CA-O 3.45Å; F371-W388 WeakPolarHBondContact CB-O 3.48Å; I372-W388 PolarHBondContact N-O 2.65Å; I372-W388 PolarHBondContact O-N 2.99Å; W388-L452 HydrophobicContact CZ2-CD1 4.45Å; W388-M456 HydrophobicContact CE3-CE 4.38Å; W388-M456 HydrophobicContact CH2-CE 3.42Å; W388-M456 VanDerWaalsContact CH2-CE 3.42Å; W388-M456 HydrophobicContact CH2-SD 4.19Å; W388-M456 HydrophobicContact CZ2-CE 4.32Å; W388-M456 HydrophobicContact CZ3-CE 3.47Å; W388-M456 VanDerWaalsContact CZ3-CE 3.47Å; W388-I575 HydrophobicContact CH2-CB 4.46Å; W388-I575 HydrophobicContact CH2-CG1 4.3Å; W388-I575 HydrophobicContact CH2-CG2 3.76Å; W388-I575 HydrophobicContact CZ3-CG2 4.1Å; W388-W576 HydrophobicContact CB-CH2 4.3Å; W388-W576 HydrophobicContact CB-CZ3 4.18Å; W388-W576 AromaticContact CD1-CZ3 3.55Å; W388-W576 AromaticContact CD2-CE3 3.71Å; W388-W576 HydrophobicContact CD2-CE3 3.71Å; W388-W576 AromaticContact CD2-CH2 3.65Å; W388-W576 HydrophobicContact CD2-CH2 3.65Å; W388-W576 HydrophobicContact CD2-CZ2 4.48Å; W388-W576 AromaticContact CD2-CZ3 3.21Å; W388-W576 HydrophobicContact CD2-CZ3 3.21Å; W388-W576 AromaticContact CE2-CE3 3.32Å; W388-W576 AromaticContact CE2-CZ3 3.33Å; W388-W576 HydrophobicContact CE3-CE3 4.17Å; W388-W576 AromaticContact CE3-CH2 3.72Å; W388-W576 HydrophobicContact CE3-CH2 3.72Å; W388-W576 HydrophobicContact CE3-CZ2 4.17Å; W388-W576 AromaticContact CE3-CZ3 3.73Å; W388-W576 HydrophobicContact CE3-CZ3 3.73Å; W388-W576 HydrophobicContact CG-CE3 4.24Å; W388-W576 AromaticContact CG-CH2 3.9Å; W388-W576 HydrophobicContact CG-CH2 3.9Å; W388-W576 AromaticContact CG-CZ3 3.4Å; W388-W576 HydrophobicContact CG-CZ3 3.4Å; W388-W576 VanDerWaalsContact CG-CZ3 3.4Å; W388-W576 HydrophobicContact CH2-CD2 4.06Å; W388-W576 HydrophobicContact CH2-CE3 4Å; W388-W576 HydrophobicContact CH2-CZ3 4.4Å; W388-W576 AromaticContact CZ2-CD2 3.97Å; W388-W576 HydrophobicContact CZ2-CD2 3.97Å; W388-W576 AromaticContact CZ2-CE3 3.51Å; W388-W576 HydrophobicContact CZ2-CE3 3.51Å; W388-W576 AromaticContact CZ2-CZ3 3.97Å; W388-W576 HydrophobicContact CZ2-CZ3 3.97Å; W388-W576 HydrophobicContact CZ3-CD2 4.37Å; W388-W576 HydrophobicContact CZ3-CE3 4.3Å; W388-W576 HydrophobicContact CZ3-CH2 4.31Å; W388-W576 HydrophobicContact CZ3-CZ2 4.37Å; W388-W576 HydrophobicContact CZ3-CZ3 4.29Å; W388-W576 AromaticContact NE1-CE3 3.62Å; W388-W576 AromaticContact NE1-CZ3 3.52Å; W388-L620 HydrophobicContact CZ3-CD1 4.03Å
389	I	96	Very high	87.4	Confident	4 Å²	4	44.1 Å²	44.1	2%	0.021	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	117.2	176.2	-53.1	177.6	0	0	0	108.2	I314 L316 L327 F339 C369 S370 F371 I387 V391	I314-I389 HydrophobicContact CB-CB 4.47Å; I314-I389 PolarHBondContact N-O 3.16Å; I314-I389 PolarHBondContact O-N 2.99Å; L316-I389 HydrophobicContact CD1-CD1 3.8Å; L327-I389 HydrophobicContact CD2-CD1 4.27Å; F339-I389 HydrophobicContact CE1-CD1 4.25Å; F339-I389 HydrophobicContact CE1-CG1 4.44Å; F339-I389 HydrophobicContact CZ-CD1 4.41Å; C369-I389 HydrophobicContact CB-CG2 3.99Å; S370-I389 CarbonylContact O-C 3.49Å; F371-I389 HydrophobicContact CB-CG1 4.35Å; I387-I389 HydrophobicContact CD1-CG1 4.32Å; I387-I389 HydrophobicContact CG1-CG1 4.31Å; I389-V391 HydrophobicContact CG2-CG2 3.76Å
390	W	96.1	Very high	88.7	Confident	4 Å²	4	41.1 Å²	41.1	2%	0.015	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	121.5	176.4	-67	93.3	0	0	0	110.4	F311 I312 C313 C369 S370 M456 R458 I637	F311-W390 HydrophobicContact CB-CE3 4.02Å; I312-W390 WeakPolarHBondContact O-CA 3.21Å; C313-W390 HydrophobicContact CB-CD2 4.22Å; C313-W390 HydrophobicContact CB-CE3 3.93Å; C313-W390 HydrophobicContact CB-CH2 3.96Å; C313-W390 HydrophobicContact CB-CZ2 4.19Å; C313-W390 HydrophobicContact CB-CZ3 3.8Å; C369-W390 WeakPolarHBondContact CA-O 3.18Å; S370-W390 PolarHBondContact N-O 3.06Å; S370-W390 VanDerWaalsContact N-O 3.12Å; S370-W390 PolarHBondContact O-N 3.26Å; W390-M456 HydrophobicContact CH2-CB 3.65Å; W390-M456 HydrophobicContact CZ2-CB 4.38Å; W390-M456 HydrophobicContact CZ3-CB 4.47Å; W390-R458 HydrophobicContact CH2-CB 4.46Å; W390-R458 HydrophobicContact CZ3-CB 4.47Å; W390-I637 HydrophobicContact CH2-CG2 4.48Å; W390-I637 HydrophobicContact CZ2-CD1 4.11Å; W390-I637 HydrophobicContact CZ2-CG1 4.43Å; W390-I637 HydrophobicContact CZ2-CG2 4.1Å
391	V	95.2	Very high	89.9	Confident	1 Å²	1	38 Å²	38	1%	0.006	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	142.8	-171	-171.7	0	0	0	0	110.3	I312 I314 C369 I389 I395 I399	I312-V391 PolarHBondContact N-O 3.08Å; I312-V391 PolarHBondContact O-N 3.29Å; I314-V391 HydrophobicContact CD1-CG2 3.93Å; C369-V391 HydrophobicContact CB-CG2 4.49Å; I389-V391 HydrophobicContact CG2-CG2 3.76Å; V391-I395 HydrophobicContact CG1-CB 4Å; V391-I395 HydrophobicContact CG1-CD1 4.45Å; V391-I399 HydrophobicContact CB-CD1 4.33Å; V391-I399 HydrophobicContact CG1-CD1 3.23Å; V391-I399 HydrophobicContact CG2-CD1 4.09Å
392	H	96	Very high	91.1	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	19%	0.191	C	C	.	.			trans	-70.6	138.3	171.4	-173.8	-89.6	0	0	0	111.1	W279 Y310 F311 S394 I395 F675	W279-H392 AromaticContact CD1-CE1 3.8Å; W279-H392 AromaticContact CD2-CE1 3.38Å; W279-H392 AromaticContact CD2-NE2 3.55Å; W279-H392 AromaticContact CE2-CE1 3.41Å; W279-H392 VanDerWaalsContact CE2-CE1 3.41Å; W279-H392 AromaticContact CE2-NE2 3.63Å; W279-H392 AromaticContact CE3-CE1 3.82Å; W279-H392 AromaticContact CE3-NE2 3.51Å; W279-H392 AromaticContact CG-CE1 3.67Å; W279-H392 AromaticContact CH2-NE2 3.66Å; W279-H392 AromaticContact CZ2-CE1 3.89Å; W279-H392 AromaticContact CZ2-NE2 3.71Å; W279-H392 AromaticContact CZ3-NE2 3.56Å; W279-H392 AromaticContact NE1-CE1 3.66Å; Y310-H392 AromaticContact CE2-CD2 3.74Å; Y310-H392 AromaticContact CE2-NE2 3.7Å; F311-H392 HydrophobicContact CE1-CB 4.04Å; H392-S394 PolarHBondContact CE1-OG 3.3Å; H392-S394 WeakPolarHBondContact ND1-CB 3.46Å; H392-S394 PolarHBondContact ND1-N 2.81Å; H392-S394 PolarHBondContact ND1-OG 2.78Å; H392-S394 PolarHBondContact O-N 3Å; H392-S394 VanDerWaalsContact O-N 3.08Å; H392-I395 HydrophobicContact CB-CD1 4.31Å; H392-I395 HydrophobicContact CB-CG1 4.3Å; H392-I395 PolarHBondContact O-N 2.6Å; H392-F675 HydrophobicContact CB-CD1 3.56Å; H392-F675 HydrophobicContact CB-CE1 3.58Å; H392-F675 AromaticContact CG-CD1 3.52Å; H392-F675 AromaticContact CG-CE1 3.62Å; H392-F675 AromaticContact ND1-CD1 3.8Å; H392-F675 AromaticContact ND1-CE1 3.54Å
393	P	93.8	Very high	92	Very high	15 Å²	15	29.3 Å²	29.3	10%	0.097	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-59.6	-26.3	-173.3	21.7	-35.7	0	0	0	115.3	W279 Y281 Y310 I312 I395 K396	W279-P393 HydrophobicContact CB-CB 4.09Å; W279-P393 HydrophobicContact CB-CG 3.66Å; W279-P393 HydrophobicContact CE3-CG 4.37Å; W279-P393 HydrophobicContact CG-CG 4.26Å; Y281-P393 HydrophobicContact CD2-CB 4.37Å; Y281-P393 HydrophobicContact CD2-CG 4.35Å; Y281-P393 HydrophobicContact CE2-CB 3.87Å; Y281-P393 HydrophobicContact CE2-CG 4.21Å; Y310-P393 HydrophobicContact CD2-CG 3.89Å; I312-P393 HydrophobicContact CD1-CB 3.97Å; I312-P393 HydrophobicContact CG1-CB 4.37Å; P393-I395 PolarHBondContact O-N 3.29Å; P393-K396 VanDerWaalsContact O-CB 3.27Å; P393-K396 WeakPolarHBondContact O-CB 3.46Å; P393-K396 PolarHBondContact O-N 3.05Å
394	S	94.4	Very high	92.4	Very high	34 Å²	34	29.5 Å²	29.5	24%	0.238	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-65.5	-21.5	176.6	65.4	0	0	0	0	113.8	H392 F675 A684	H392-S394 PolarHBondContact CE1-OG 3.3Å; H392-S394 WeakPolarHBondContact ND1-CB 3.46Å; H392-S394 PolarHBondContact ND1-N 2.81Å; H392-S394 PolarHBondContact ND1-OG 2.78Å; H392-S394 PolarHBondContact O-N 3Å; H392-S394 VanDerWaalsContact O-N 3.08Å; S394-F675 VanDerWaalsContact OG-CE1 3.31Å; S394-F675 WeakPolarHBondContact OG-CE1 3.44Å; S394-A684 WeakPolarHBondContact OG-CB 3.3Å
395	I	94	Very high	92.6	Very high	3 Å²	3	27.1 Å²	27.1	2%	0.015	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-98.7	-6.7	-177.9	-36	179.9	0	0	0	111.8	I366 V391 H392 P393 T397 K398 I399 F675	I366-I395 HydrophobicContact CB-CG2 4.43Å; I366-I395 HydrophobicContact CG2-CG2 3.12Å; V391-I395 HydrophobicContact CG1-CB 4Å; V391-I395 HydrophobicContact CG1-CD1 4.45Å; H392-I395 HydrophobicContact CB-CD1 4.31Å; H392-I395 HydrophobicContact CB-CG1 4.3Å; H392-I395 PolarHBondContact O-N 2.6Å; P393-I395 PolarHBondContact O-N 3.29Å; I395-T397 VanDerWaalsContact C-N 3.29Å; I395-T397 PolarHBondContact O-N 3.46Å; I395-T397 VanDerWaalsContact O-N 3.16Å; I395-K398 PolarHBondContact O-N 3.46Å; I395-I399 HydrophobicContact CB-CD1 3.88Å; I395-I399 HydrophobicContact CG2-CD1 3.41Å; I395-I399 VanDerWaalsContact CG2-CD1 3.41Å; I395-I399 HydrophobicContact CG2-CG1 3.77Å; I395-I399 PolarHBondContact O-N 2.84Å; I395-F675 HydrophobicContact CD1-CD1 4.25Å; I395-F675 HydrophobicContact CD1-CE1 3.36Å; I395-F675 HydrophobicContact CD1-CE2 3.97Å; I395-F675 HydrophobicContact CD1-CZ 3.2Å; I395-F675 HydrophobicContact CG1-CE1 3.41Å; I395-F675 VanDerWaalsContact CG1-CE1 3.41Å; I395-F675 HydrophobicContact CG1-CE2 4.46Å; I395-F675 HydrophobicContact CG1-CZ 3.33Å
396	K	91.2	Very high	92.5	Very high	48 Å²	48	27.6 Å²	27.6	21%	0.209	15%	0.152	C	C	.	.	H	α-helix	trans	-48.9	-49.8	-172.3	-176.5	-161.8	171.3	178.3	0	112.4	I312 P393 L400 E453	I312-K396 HydrophobicContact CD1-CB 3.8Å; I312-K396 HydrophobicContact CD1-CD 3.63Å; I312-K396 HydrophobicContact CD1-CG 3.66Å; P393-K396 VanDerWaalsContact O-CB 3.27Å; P393-K396 WeakPolarHBondContact O-CB 3.46Å; P393-K396 PolarHBondContact O-N 3.05Å; K396-L400 HydrophobicContact CD-CD1 4.44Å; K396-L400 HydrophobicContact CG-CD1 3.87Å; K396-L400 WeakPolarHBondContact O-CB 3.45Å; K396-L400 WeakPolarHBondContact O-CG 3.43Å; K396-L400 PolarHBondContact O-N 3.39Å; K396-E453 WeakPolarHBondContact CE-OE1 3.37Å; K396-E453 IonicContact NZ-OE1 2.65Å; K396-E453 PolarHBondContact NZ-OE1 3.47Å; K396-E453 IonicContact NZ-OE2 3.08Å
397	T	90.2	Very high	92.3	Very high	108 Å²	108	26.2 Å²	26.2	66%	0.663	15%	0.146	S	C	*	.	H	α-helix	trans	-62.7	-48.8	-175.4	48.5	0	0	0	0	111.5	I395 L400 S401	I395-T397 VanDerWaalsContact C-N 3.29Å; I395-T397 PolarHBondContact O-N 3.46Å; I395-T397 VanDerWaalsContact O-N 3.16Å; T397-L400 PolarHBondContact O-N 2.66Å; T397-S401 PolarHBondContact O-N 2.68Å; T397-S401 PolarHBondContact O-OG 3.07Å
398	K	92	Very high	91.8	Very high	53 Å²	53	32.9 Å²	32.9	23%	0.23	18%	0.177	C	C	.	.	H	α-helix	trans	-65	-41	179.4	-93.8	-171.6	141.7	172.5	0	113.7	E357 I395 S401 S402 E683	E357-K398 IonicContact OE1-NZ 2.89Å; E357-K398 PolarHBondContact OE1-NZ 3.34Å; I395-K398 PolarHBondContact O-N 3.46Å; K398-S401 WeakPolarHBondContact CA-OG 3.24Å; K398-S401 PolarHBondContact O-N 3.37Å; K398-S401 PolarHBondContact O-OG 3.03Å; K398-S402 WeakPolarHBondContact O-CB 3.49Å; K398-S402 PolarHBondContact O-N 2.84Å; K398-S402 PolarHBondContact O-OG 2.62Å; K398-E683 HydrophobicContact CD-CB 4.41Å; K398-E683 WeakPolarHBondContact CD-OE2 3.27Å; K398-E683 WeakPolarHBondContact CE-OE2 3.26Å; K398-E683 IonicContact NZ-OE2 3.68Å; K398-E683 PolarHBondContact NZ-OE2 3.05Å
399	I	92.4	Very high	91.2	Very high	5 Å²	5	33.6 Å²	33.6	3%	0.026	18%	0.181	C	C	.	.	H	α-helix	trans	-70.2	-40.9	179.2	-76.3	165.4	0	0	0	110.5	I314 L355 I366 V391 I395 S401 S402 L403	I314-I399 HydrophobicContact CD1-CG2 3.88Å; L355-I399 HydrophobicContact CD1-CD1 3.56Å; L355-I399 HydrophobicContact CD1-CG1 3.95Å; I366-I399 HydrophobicContact CG2-CD1 3.85Å; I366-I399 HydrophobicContact CG2-CG1 3.52Å; V391-I399 HydrophobicContact CB-CD1 4.33Å; V391-I399 HydrophobicContact CG1-CD1 3.23Å; V391-I399 HydrophobicContact CG2-CD1 4.09Å; I395-I399 HydrophobicContact CB-CD1 3.88Å; I395-I399 HydrophobicContact CG2-CD1 3.41Å; I395-I399 VanDerWaalsContact CG2-CD1 3.41Å; I395-I399 HydrophobicContact CG2-CG1 3.77Å; I395-I399 PolarHBondContact O-N 2.84Å; I399-S401 PolarHBondContact O-N 3.01Å; I399-S402 PolarHBondContact O-N 2.68Å; I399-L403 HydrophobicContact CG2-CD1 3.68Å; I399-L403 HydrophobicContact CG2-CG 4.13Å; I399-L403 WeakPolarHBondContact O-CB 3.48Å; I399-L403 VanDerWaalsContact O-CG 3.28Å; I399-L403 WeakPolarHBondContact O-CG 3.47Å; I399-L403 PolarHBondContact O-N 3.17Å
400	L	90.2	Very high	90.2	Very high	15 Å²	15	35 Å²	35	8%	0.079	20%	0.196	C	C	.	.	H	α-helix	trans	-64.7	-39.5	176.4	-70.2	176.1	0	0	0	111.9	I314 K396 T397 R404 L449	I314-L400 HydrophobicContact CD1-CD2 4.21Å; K396-L400 HydrophobicContact CD-CD1 4.44Å; K396-L400 HydrophobicContact CG-CD1 3.87Å; K396-L400 WeakPolarHBondContact O-CB 3.45Å; K396-L400 WeakPolarHBondContact O-CG 3.43Å; K396-L400 PolarHBondContact O-N 3.39Å; T397-L400 PolarHBondContact O-N 2.66Å; L400-R404 WeakPolarHBondContact O-CB 3.04Å; L400-R404 WeakPolarHBondContact O-CG 3.44Å; L400-R404 PolarHBondContact O-N 3.35Å; L400-L449 HydrophobicContact CD2-CD1 4.24Å; L400-L449 HydrophobicContact CD2-CD2 4.09Å
401	S	90.7	Very high	88.7	Confident	63 Å²	63	43.3 Å²	43.3	44%	0.441	24%	0.235	S	C	.	.	H	α-helix	trans	-63.6	-44	174.1	60.5	0	0	0	0	111.5	T397 K398 I399 R404 S405	T397-S401 PolarHBondContact O-N 2.68Å; T397-S401 PolarHBondContact O-OG 3.07Å; K398-S401 WeakPolarHBondContact CA-OG 3.24Å; K398-S401 PolarHBondContact O-N 3.37Å; K398-S401 PolarHBondContact O-OG 3.03Å; I399-S401 PolarHBondContact O-N 3.01Å; S401-R404 PolarHBondContact O-N 3.36Å; S401-S405 PolarHBondContact O-N 3.23Å; S401-S405 PolarHBondContact O-OG 2.84Å; S401-S405 VanDerWaalsContact O-OG 3.13Å
402	S	91.6	Very high	87.1	Confident	13 Å²	13	45.7 Å²	45.7	9%	0.091	25%	0.245	C	C	.	.	H	α-helix	trans	-65.2	-40.8	179.7	-53.5	0	0	0	0	112.6	Q358 K398 I399 S405 L406	Q358-S402 PolarHBondContact NE2-O 2.68Å; K398-S402 WeakPolarHBondContact O-CB 3.49Å; K398-S402 PolarHBondContact O-N 2.84Å; K398-S402 PolarHBondContact O-OG 2.62Å; I399-S402 PolarHBondContact O-N 2.68Å; S402-S405 WeakPolarHBondContact CA-OG 3.43Å; S402-S405 PolarHBondContact O-OG 2.97Å; S402-L406 WeakPolarHBondContact O-CB 3.4Å; S402-L406 VanDerWaalsContact O-CG 3.27Å; S402-L406 WeakPolarHBondContact O-CG 3.49Å; S402-L406 PolarHBondContact O-N 2.77Å
403	L	91.2	Very high	85	Confident	3 Å²	3	54.5 Å²	54.5	2%	0.016	28%	0.283	C	S	.	.	H	α-helix	trans	-69.8	-34.3	176.4	-70.8	174.2	0	0	0	112	I314 L316 L327 L330 I399 L406 F407 L449	I314-L403 HydrophobicContact CD1-CD1 4.41Å; I314-L403 HydrophobicContact CG2-CD1 4.35Å; L316-L403 HydrophobicContact CD1-CD1 4.48Å; L316-L403 HydrophobicContact CD1-CD2 4.11Å; L327-L403 HydrophobicContact CD2-CD2 3.91Å; L330-L403 HydrophobicContact CD1-CD2 4.24Å; I399-L403 HydrophobicContact CG2-CD1 3.68Å; I399-L403 HydrophobicContact CG2-CG 4.13Å; I399-L403 WeakPolarHBondContact O-CB 3.48Å; I399-L403 VanDerWaalsContact O-CG 3.28Å; I399-L403 WeakPolarHBondContact O-CG 3.47Å; I399-L403 PolarHBondContact O-N 3.17Å; L403-L406 HydrophobicContact CD2-CD1 4.46Å; L403-F407 HydrophobicContact CD2-CD2 4.3Å; L403-F407 HydrophobicContact CD2-CE2 3.92Å; L403-F407 WeakPolarHBondContact O-CD2 3.43Å; L403-F407 PolarHBondContact O-N 3.35Å; L403-L449 HydrophobicContact CB-CD1 4.05Å; L403-L449 HydrophobicContact CD1-CD1 4.06Å
404	R	88.2	Confident	82.8	Confident	82 Å²	82	56.7 Å²	56.7	31%	0.309	30%	0.299	S	S	.	.	H	α-helix	trans	-65.4	-45.1	175	-76.4	172	-166.2	175.7	7	111.8	L400 S401 H408 L409	L400-R404 WeakPolarHBondContact O-CB 3.04Å; L400-R404 WeakPolarHBondContact O-CG 3.44Å; L400-R404 PolarHBondContact O-N 3.35Å; S401-R404 PolarHBondContact O-N 3.36Å; R404-H408 CarbonylContact O-C 3.57Å; R404-H408 WeakPolarHBondContact O-CA 3.27Å; R404-H408 PolarHBondContact O-N 2.92Å; R404-L409 HydrophobicContact CB-CB 4.49Å; R404-L409 HydrophobicContact CG-CB 4.14Å; R404-L409 PolarHBondContact O-N 3.47Å; R404-L409 VanDerWaalsContact O-N 3.08Å
405	S	88.8	Confident	80.6	Confident	62 Å²	62	58.4 Å²	58.4	43%	0.434	32%	0.315	S	S	.	.	H	α-helix	trans	-66.7	-37.7	177.7	50.2	0	0	0	0	111.9	Q358 S401 S402	Q358-S405 PolarHBondContact NE2-OG 3.17Å; S401-S405 PolarHBondContact O-N 3.23Å; S401-S405 PolarHBondContact O-OG 2.84Å; S401-S405 VanDerWaalsContact O-OG 3.13Å; S402-S405 WeakPolarHBondContact CA-OG 3.43Å; S402-S405 PolarHBondContact O-OG 2.97Å
406	L	87.8	Confident	78	Confident	21 Å²	21	65 Å²	65	11%	0.11	35%	0.35	C	S	.	.	H	α-helix	trans	-64.5	-49.5	177.1	-78.4	175.1	0	0	0	113.3	G326 E329 L330 Q358 S402 L403	G326-L406 WeakPolarHBondContact O-CD1 3.22Å; E329-L406 HydrophobicContact CB-CD2 4.08Å; E329-L406 WeakPolarHBondContact OE2-CD2 3.48Å; L330-L406 HydrophobicContact CD1-CD1 3.52Å; L330-L406 HydrophobicContact CD2-CD1 3.84Å; L330-L406 HydrophobicContact CG-CD1 3.58Å; Q358-L406 HydrophobicContact CG-CD2 3.78Å; Q358-L406 HydrophobicContact CG-CG 4.14Å; Q358-L406 VanDerWaalsContact NE2-CG 3.25Å; S402-L406 WeakPolarHBondContact O-CB 3.4Å; S402-L406 VanDerWaalsContact O-CG 3.27Å; S402-L406 WeakPolarHBondContact O-CG 3.49Å; S402-L406 PolarHBondContact O-N 2.77Å; L403-L406 HydrophobicContact CD2-CD1 4.46Å
407	F	87.6	Confident	75.7	Confident	16 Å²	16	66.2 Å²	66.2	7%	0.07	37%	0.369	C	S	.	.	H	α-helix	trans	-102.2	12.9	-171.1	-62.5	-62.9	0	0	0	112.8	L316 L323 L327 L403 L409 I447	L316-F407 HydrophobicContact CD1-CE2 4.24Å; L323-F407 HydrophobicContact CD2-CE1 4.39Å; L323-F407 HydrophobicContact CD2-CZ 4.19Å; L327-F407 HydrophobicContact CD2-CE2 4.38Å; L327-F407 HydrophobicContact CG-CZ 4.31Å; L403-F407 HydrophobicContact CD2-CD2 4.3Å; L403-F407 HydrophobicContact CD2-CE2 3.92Å; L403-F407 WeakPolarHBondContact O-CD2 3.43Å; L403-F407 PolarHBondContact O-N 3.35Å; F407-L409 HydrophobicContact CB-CD1 4.05Å; F407-L409 HydrophobicContact CB-CD2 4.3Å; F407-L409 HydrophobicContact CB-CG 3.82Å; F407-L409 PolarHBondContact O-N 2.8Å; F407-L409 VanDerWaalsContact O-N 3.13Å; F407-I447 HydrophobicContact CB-CD1 4.41Å; F407-I447 HydrophobicContact CB-CG2 4.4Å; F407-I447 HydrophobicContact CD1-CD1 3.32Å; F407-I447 HydrophobicContact CD1-CG2 4.47Å; F407-I447 HydrophobicContact CE1-CD1 3.78Å; F407-I447 HydrophobicContact CG-CD1 4.09Å; F407-I447 HydrophobicContact CG-CG2 4.31Å
408	H	85.4	Confident	73.6	Confident	140 Å²	140	68.8 Å²	68.8	65%	0.648	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	37.3	-178.2	-56.4	93.5	0	0	0	113.6	R404 P443	R404-H408 CarbonylContact O-C 3.57Å; R404-H408 WeakPolarHBondContact O-CA 3.27Å; R404-H408 PolarHBondContact O-N 2.92Å; H408-P443 HydrophobicContact CB-CG 4.43Å; H408-P443 WeakPolarHBondContact O-CD 3.27Å
409	L	81.9	Confident	71.7	Confident	14 Å²	14	70.7 Å²	70.7	7%	0.073	39%	0.388	C	S	.	.			trans	-73	142.7	-173.3	-62.4	163.9	0	0	0	111.6	R404 F407 V440 A442 L449	R404-L409 HydrophobicContact CB-CB 4.49Å; R404-L409 HydrophobicContact CG-CB 4.14Å; R404-L409 PolarHBondContact O-N 3.47Å; R404-L409 VanDerWaalsContact O-N 3.08Å; F407-L409 HydrophobicContact CB-CD1 4.05Å; F407-L409 HydrophobicContact CB-CD2 4.3Å; F407-L409 HydrophobicContact CB-CG 3.82Å; F407-L409 PolarHBondContact O-N 2.8Å; F407-L409 VanDerWaalsContact O-N 3.13Å; L409-V440 HydrophobicContact CB-CG1 3.96Å; L409-A442 HydrophobicContact CD2-CB 3.8Å; L409-L449 HydrophobicContact CD1-CB 3.72Å; L409-L449 HydrophobicContact CD1-CD1 3.58Å; L409-L449 HydrophobicContact CD1-CG 4.29Å; L409-L449 HydrophobicContact CD2-CB 4.5Å
410	G	75.9	Confident	69.8	Low	34 Å²	34	74.9 Å²	74.9	35%	0.351	41%	0.41	S	S	.	.			trans	-63.7	174.5	179.8	0	0	0	0	0	115.2	V440 L441	G410-V440 WeakPolarHBondContact O-CG1 3.5Å; G410-L441 PolarHBondContact N-O 2.87Å
411	E	64.7	Low	68.4	Low	178 Å²	178	76 Å²	76	83%	0.832	42%	0.418	S	S	*	.			trans	-67.6	138.1	177.9	-80.6	-165.1	161.8	0	0	112.6	K413	E411-K413 PolarHBondContact O-N 3.43Å; E411-K413 VanDerWaalsContact O-N 3.07Å
412	Y	61.2	Low	67	Low	52 Å²	52	81.3 Å²	81.3	20%	0.204	43%	0.433	C	S	.	.			trans	-75.9	98.2	173.7	-179.1	-107.1	0	0	0	109.7	S414 N438 V440	Y412-S414 VanDerWaalsContact C-N 3.27Å; Y412-S414 WeakPolarHBondContact CE1-OG 3.47Å; Y412-S414 PolarHBondContact O-N 2.87Å; Y412-N438 HydrophobicContact CE2-CB 3.45Å; Y412-N438 VanDerWaalsContact CE2-CB 3.45Å; Y412-N438 WeakPolarHBondContact CE2-OD1 3.1Å; Y412-N438 WeakPolarHBondContact OH-CB 3.39Å; Y412-N438 PolarHBondContact OH-ND2 2.62Å; Y412-N438 PolarHBondContact OH-OD1 2.81Å; Y412-V440 HydrophobicContact CD2-CG2 3.75Å
413	K	51.4	Low	65.7	Low	186 Å²	186	88.3 Å²	88.3	81%	0.809	46%	0.462	S	S	*	.			trans	-70.9	92.8	161.3	-66	-176.3	-177.7	179.3	0	106.6	E411 A415	E411-K413 PolarHBondContact O-N 3.43Å; E411-K413 VanDerWaalsContact O-N 3.07Å; K413-A415 PolarHBondContact O-N 3.17Å
414	S	49	Very low	64.6	Low	61 Å²	61	89 Å²	89	43%	0.427	47%	0.466	S	S	.	.			trans	-47	115.1	156.1	-68.3	0	0	0	0	104.6	Y412 D416	Y412-S414 VanDerWaalsContact C-N 3.27Å; Y412-S414 WeakPolarHBondContact CE1-OG 3.47Å; Y412-S414 PolarHBondContact O-N 2.87Å; S414-D416 PolarHBondContact O-N 3.25Å
415	A	46.3	Very low	63.8	Low	69 Å²	69	91.7 Å²	91.7	57%	0.57	49%	0.487	S	S	*	.			trans	-65	84.1	164.3	0	0	0	0	0	105.3	K413 A417	K413-A415 PolarHBondContact O-N 3.17Å; A415-A417 PolarHBondContact O-N 3.38Å
416	D	41.2	Very low	62.9	Low	143 Å²	143	91 Å²	91	77%	0.765	48%	0.481	S	S	*	.			trans	-67.3	51.3	155.3	-76	-19.8	0	0	0	106.9	S414 I418	S414-D416 PolarHBondContact O-N 3.25Å; D416-I418 PolarHBondContact O-N 3.15Å
417	A	43	Very low	62.3	Low	73 Å²	73	93.1 Å²	93.1	60%	0.603	49%	0.492	S	S	*	.			trans	-58.9	100.7	154.2	0	0	0	0	0	103.2	A415 M419	A415-A417 PolarHBondContact O-N 3.38Å; A417-M419 WeakPolarHBondContact O-CA 3.42Å; A417-M419 PolarHBondContact O-N 3.48Å
418	I	45	Very low	61.4	Low	162 Å²	162	94.1 Å²	94.1	83%	0.831	50%	0.501	S	S	*	.			trans	-42.3	98.8	165.2	-66.1	169.1	0	0	0	104.6	D416 D420	D416-I418 PolarHBondContact O-N 3.15Å; I418-D420 PolarHBondContact O-N 2.88Å
419	M	51.7	Low	60.6	Low	92 Å²	92	90.1 Å²	90.1	45%	0.453	49%	0.485	S	S	.	.			trans	-57.6	113.4	-171.6	-79.5	-157.9	-59.2	0	0	105.3	A417 T421 F430	A417-M419 WeakPolarHBondContact O-CA 3.42Å; A417-M419 PolarHBondContact O-N 3.48Å; M419-T421 HydrophobicContact CB-CG2 3.97Å; M419-T421 HydrophobicContact CE-CG2 4.35Å; M419-T421 WeakPolarHBondContact O-CG2 3.47Å; M419-T421 PolarHBondContact O-N 3.18Å; M419-F430 HydrophobicContact CE-CE2 3.83Å; M419-F430 HydrophobicContact CE-CZ 4.21Å; M419-F430 HydrophobicContact SD-CE2 3.98Å
420	D	53.5	Low	60.2	Low	93 Å²	93	91 Å²	91	50%	0.497	49%	0.488	S	S	.	.			trans	-76.2	71.1	179.9	-152.3	9.6	0	0	0	107	I418 K422 K423	I418-D420 PolarHBondContact O-N 2.88Å; D420-K422 PolarHBondContact O-N 3.03Å; D420-K423 PolarHBondContact O-N 3.26Å
421	T	59.6	Low	60	Low	40 Å²	40	91.4 Å²	91.4	25%	0.245	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-11	-172.1	50.4	0	0	0	0	112.4	I254 M419	I254-T421 HydrophobicContact CG2-CG2 3.65Å; M419-T421 HydrophobicContact CB-CG2 3.97Å; M419-T421 HydrophobicContact CE-CG2 4.35Å; M419-T421 WeakPolarHBondContact O-CG2 3.47Å; M419-T421 PolarHBondContact O-N 3.18Å
422	K	62.2	Low	60.2	Low	174 Å²	174	84.7 Å²	84.7	76%	0.757	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-30	173.4	-66.3	-179.1	-179.7	175.3	0	112.7	D420	D420-K422 PolarHBondContact O-N 3.03Å
423	K	64.6	Low	60.4	Low	160 Å²	160	86.3 Å²	86.3	70%	0.696	46%	0.46	S	S	*	.	S	Bend	trans	-87	-5.4	-177.7	-69.3	-176.1	-179.2	176.7	0	114.9	D420 N425	D420-K423 PolarHBondContact O-N 3.26Å; K423-N425 PolarHBondContact O-N 3.22Å
424	V	68.7	Low	60.9	Low	16 Å²	16	79.5 Å²	79.5	10%	0.097	44%	0.443	C	S	.	.			trans	-81.6	103.1	-176.7	-177.6	0	0	0	0	110.5	L250 I254 C426 D429 F430 L433	L250-V424 HydrophobicContact CD2-CG1 4.33Å; I254-V424 HydrophobicContact CD1-CB 4.27Å; I254-V424 HydrophobicContact CD1-CG1 4.05Å; V424-C426 VanDerWaalsContact CG1-O 3.31Å; V424-C426 WeakPolarHBondContact CG1-O 3.49Å; V424-D429 HydrophobicContact CG1-CB 4.42Å; V424-F430 HydrophobicContact CG1-CB 3.66Å; V424-F430 HydrophobicContact CG1-CD2 4.24Å; V424-F430 HydrophobicContact CG1-CG 4.41Å; V424-F430 HydrophobicContact CG2-CD2 4.38Å; V424-L433 HydrophobicContact CG2-CD1 3.65Å
425	N	70.3	Confident	61.3	Low	140 Å²	140	78 Å²	78	75%	0.749	43%	0.432	S	S	*	.			trans	-87.8	-33.8	-179.2	-71.4	-29.3	0	0	0	112.3	K423 D429	K423-N425 PolarHBondContact O-N 3.22Å; N425-D429 PolarHBondContact N-OD2 3.33Å
426	C	70.9	Confident	61.4	Low	47 Å²	47	78.8 Å²	78.8	32%	0.318	43%	0.43	S	S	.	.	S	Bend	trans	-136.4	170.5	178.5	73.5	0	0	0	0	113.4	V424 S428 D429 F430	V424-C426 VanDerWaalsContact CG1-O 3.31Å; V424-C426 WeakPolarHBondContact CG1-O 3.49Å; C426-S428 VanDerWaalsContact C-N 3.29Å; C426-S428 PolarHBondContact O-N 3.11Å; C426-S428 PolarHBondContact SG-OG 3.43Å; C426-D429 PolarHBondContact N-OD2 3.14Å; C426-D429 VanDerWaalsContact N-OD2 3.08Å; C426-D429 PolarHBondContact O-N 2.88Å; C426-D429 PolarHBondContact SG-OD1 3.03Å; C426-D429 PolarHBondContact SG-OD2 2.85Å; C426-F430 PolarHBondContact O-N 3.4Å
427	L	73.6	Confident	61.9	Low	65 Å²	65	79.9 Å²	79.9	34%	0.34	42%	0.423	S	S	.	.	H	α-helix	trans	-69.3	-27.7	-177.7	-156.5	88.8	0	0	0	112.2	L250 F430 R431	L250-L427 HydrophobicContact CD1-CD1 3.65Å; L427-F430 WeakPolarHBondContact O-CB 3.26Å; L427-R431 VanDerWaalsContact O-CG 3.31Å; L427-R431 WeakPolarHBondContact O-CG 3.32Å; L427-R431 PolarHBondContact O-N 2.67Å
428	S	68.6	Low	62.6	Low	38 Å²	38	77.7 Å²	77.7	27%	0.266	40%	0.402	S	S	.	.	H	α-helix	trans	-69.1	-41.5	174.5	26.3	0	0	0	0	111.4	C426 F430 R431 L432	C426-S428 VanDerWaalsContact C-N 3.29Å; C426-S428 PolarHBondContact O-N 3.11Å; C426-S428 PolarHBondContact SG-OG 3.43Å; S428-F430 VanDerWaalsContact C-N 3.28Å; S428-F430 PolarHBondContact O-N 2.78Å; S428-R431 PolarHBondContact O-N 2.85Å; S428-L432 PolarHBondContact O-N 3.28Å
429	D	69.8	Low	63.3	Low	55 Å²	55	73 Å²	73	29%	0.294	38%	0.383	S	S	.	.	H	α-helix	trans	-60	-42.2	174.6	-52.2	-23.4	0	0	0	111	V424 N425 C426 R431 L432 L433	V424-D429 HydrophobicContact CG1-CB 4.42Å; N425-D429 PolarHBondContact N-OD2 3.33Å; C426-D429 PolarHBondContact N-OD2 3.14Å; C426-D429 VanDerWaalsContact N-OD2 3.08Å; C426-D429 PolarHBondContact O-N 2.88Å; C426-D429 PolarHBondContact SG-OD1 3.03Å; C426-D429 PolarHBondContact SG-OD2 2.85Å; D429-R431 PolarHBondContact O-N 2.6Å; D429-L432 PolarHBondContact O-N 3.37Å; D429-L433 WeakPolarHBondContact O-CG 3.31Å; D429-L433 PolarHBondContact O-N 3.39Å
430	F	73	Confident	63.9	Low	34 Å²	34	69.2 Å²	69.2	15%	0.149	36%	0.364	C	S	.	.	H	α-helix	trans	-58.5	-38.6	175.5	-172.8	-107.2	0	0	0	112.3	I254 M419 V424 C426 L427 S428 G434	I254-F430 HydrophobicContact CB-CE2 4.46Å; I254-F430 HydrophobicContact CD1-CD2 3.9Å; I254-F430 HydrophobicContact CD1-CE2 4.21Å; I254-F430 HydrophobicContact CG1-CD2 3.89Å; I254-F430 HydrophobicContact CG1-CE2 3.82Å; I254-F430 HydrophobicContact CG1-CG 4.46Å; I254-F430 HydrophobicContact CG1-CZ 4.33Å; I254-F430 HydrophobicContact CG2-CE2 3.99Å; M419-F430 HydrophobicContact CE-CE2 3.83Å; M419-F430 HydrophobicContact CE-CZ 4.21Å; M419-F430 HydrophobicContact SD-CE2 3.98Å; V424-F430 HydrophobicContact CG1-CB 3.66Å; V424-F430 HydrophobicContact CG1-CD2 4.24Å; V424-F430 HydrophobicContact CG1-CG 4.41Å; V424-F430 HydrophobicContact CG2-CD2 4.38Å; C426-F430 PolarHBondContact O-N 3.4Å; L427-F430 WeakPolarHBondContact O-CB 3.26Å; S428-F430 VanDerWaalsContact C-N 3.28Å; S428-F430 PolarHBondContact O-N 2.78Å; F430-G434 PolarHBondContact O-N 3.07Å; F430-G434 VanDerWaalsContact O-N 3.07Å
431	R	71.2	Confident	64.3	Low	42 Å²	42	69.8 Å²	69.8	16%	0.158	37%	0.367	C	S	.	.	H	α-helix	trans	-76.4	-39.1	179.7	-70.3	170.9	-173.3	-170.8	-7.3	112.4	E264 L427 S428 D429 L433 G434 S435 L585 G641	E264-R431 IonicContact OE1-CZ 3.72Å; E264-R431 VanDerWaalsContact OE1-CZ 3.3Å; E264-R431 IonicContact OE1-NE 2.72Å; E264-R431 IonicContact OE1-NH1 3.79Å; E264-R431 PolarHBondContact OE1-NH1 2.98Å; E264-R431 IonicContact OE1-NH2 2.94Å; E264-R431 IonicContact OE2-CZ 3.59Å; E264-R431 IonicContact OE2-NH1 3.77Å; E264-R431 PolarHBondContact OE2-NH1 2.85Å; E264-R431 IonicContact OE2-NH2 3.77Å; L427-R431 VanDerWaalsContact O-CG 3.31Å; L427-R431 WeakPolarHBondContact O-CG 3.32Å; L427-R431 PolarHBondContact O-N 2.67Å; S428-R431 PolarHBondContact O-N 2.85Å; D429-R431 PolarHBondContact O-N 2.6Å; R431-L433 PolarHBondContact O-N 3.48Å; R431-G434 CarbonylContact O-C 3.57Å; R431-G434 WeakPolarHBondContact O-CA 3.46Å; R431-G434 PolarHBondContact O-N 3.14Å; R431-S435 PolarHBondContact O-N 2.97Å; R431-L585 HydrophobicContact CB-CD2 4.45Å; R431-G641 PolarHBondContact NH1-O 3.44Å; R431-G641 VanDerWaalsContact NH1-O 3.14Å
432	L	69.5	Low	64.5	Low	37 Å²	37	68.2 Å²	68.2	19%	0.194	36%	0.358	C	S	.	.	H	α-helix	trans	-56.8	-41.9	172.9	-78.1	165.6	0	0	0	110.6	S428 D429 S435 L582 L585 R586	S428-L432 PolarHBondContact O-N 3.28Å; D429-L432 PolarHBondContact O-N 3.37Å; L432-S435 PolarHBondContact O-N 3.5Å; L432-L582 HydrophobicContact CD2-CD2 4.05Å; L432-L585 HydrophobicContact CD2-CB 4.19Å; L432-L585 HydrophobicContact CD2-CD2 3.66Å; L432-L585 HydrophobicContact CD2-CG 4Å; L432-L585 HydrophobicContact CG-CD2 3.72Å; L432-L585 HydrophobicContact CG-CG 4.09Å; L432-R586 HydrophobicContact CD1-CG 4.3Å; L432-R586 HydrophobicContact CD2-CG 4.4Å
433	L	66.1	Low	64.5	Low	86 Å²	86	64.7 Å²	64.7	45%	0.45	35%	0.353	S	S	.	.	H	α-helix	trans	-64.6	-42	173	-69.7	163.9	0	0	0	112	V424 D429 R431 S435 T436	V424-L433 HydrophobicContact CG2-CD1 3.65Å; D429-L433 WeakPolarHBondContact O-CG 3.31Å; D429-L433 PolarHBondContact O-N 3.39Å; R431-L433 PolarHBondContact O-N 3.48Å; L433-S435 VanDerWaalsContact C-N 3.34Å; L433-S435 PolarHBondContact O-N 2.91Å; L433-T436 PolarHBondContact O-N 3.1Å; L433-T436 PolarHBondContact O-OG1 3.04Å
434	G	61	Low	64.5	Low	43 Å²	43	63 Å²	63	44%	0.443	35%	0.352	S	S	.	.	H	α-helix	trans	-66.7	-29.4	177.4	0	0	0	0	0	114.6	F430 R431 T436	F430-G434 PolarHBondContact O-N 3.07Å; F430-G434 VanDerWaalsContact O-N 3.07Å; R431-G434 CarbonylContact O-C 3.57Å; R431-G434 WeakPolarHBondContact O-CA 3.46Å; R431-G434 PolarHBondContact O-N 3.14Å; G434-T436 PolarHBondContact O-N 3.23Å
435	S	56.8	Low	64.6	Low	29 Å²	29	64.7 Å²	64.7	20%	0.203	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-0.7	175.9	-84.8	0	0	0	0	114	R431 L432 L433 R437	R431-S435 PolarHBondContact O-N 2.97Å; L432-S435 PolarHBondContact O-N 3.5Å; L433-S435 VanDerWaalsContact C-N 3.34Å; L433-S435 PolarHBondContact O-N 2.91Å; S435-R437 PolarHBondContact O-N 3.24Å
436	T	49.4	Very low	65.1	Low	85 Å²	85	61.3 Å²	61.3	52%	0.521	35%	0.354	S	S	.	.			trans	-74.1	114.8	-174.4	54.9	0	0	0	0	113.4	L433 G434	L433-T436 PolarHBondContact O-N 3.1Å; L433-T436 PolarHBondContact O-OG1 3.04Å; G434-T436 PolarHBondContact O-N 3.23Å
437	R	51.8	Low	65.9	Low	166 Å²	166	59.8 Å²	59.8	63%	0.626	34%	0.343	S	S	*	.			trans	18.8	94.3	155	-64.6	-175.2	-178.7	171.2	-1.5	118.4	S435 E578	S435-R437 PolarHBondContact O-N 3.24Å; R437-E578 IonicContact NE-OE1 3.93Å; R437-E578 PolarHBondContact NE-OE1 3.24Å; R437-E578 IonicContact NH2-OE1 2.83Å
438	N	57.9	Low	66.7	Low	27 Å²	27	57.9 Å²	57.9	14%	0.144	34%	0.335	C	S	.	.			trans	-106.4	58.7	162.1	-75.3	-34.8	0	0	0	108.8	Y412 L451	Y412-N438 HydrophobicContact CE2-CB 3.45Å; Y412-N438 VanDerWaalsContact CE2-CB 3.45Å; Y412-N438 WeakPolarHBondContact CE2-OD1 3.1Å; Y412-N438 WeakPolarHBondContact OH-CB 3.39Å; Y412-N438 PolarHBondContact OH-ND2 2.62Å; Y412-N438 PolarHBondContact OH-OD1 2.81Å; N438-L451 HydrophobicContact CB-CB 3.88Å; N438-L451 PolarHBondContact O-N 3.01Å
439	C	59.2	Low	67.7	Low	65 Å²	65	56.4 Å²	56.4	44%	0.439	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	128.1	-179.7	-175.3	0	0	0	0	109.3	L449 V450	C439-L449 CarbonylContact C-O 3.5Å; C439-L449 WeakPolarHBondContact CA-O 3.5Å; C439-V450 HydrophobicContact CB-CG2 4.08Å
440	V	65.1	Low	68.6	Low	11 Å²	11	54.7 Å²	54.7	7%	0.067	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	130.9	173.3	-177.6	0	0	0	0	107.6	L409 G410 Y412 L449	L409-V440 HydrophobicContact CB-CG1 3.96Å; G410-V440 WeakPolarHBondContact O-CG1 3.5Å; Y412-V440 HydrophobicContact CD2-CG2 3.75Å; V440-L449 PolarHBondContact N-O 3.18Å; V440-L449 PolarHBondContact O-N 2.88Å
441	L	60.9	Low	69.3	Low	106 Å²	106	53.5 Å²	53.5	56%	0.555	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.3	145.2	177.3	-63.3	170.6	0	0	0	109.6	G410	G410-L441 PolarHBondContact N-O 2.87Å
442	A	64.4	Low	70	Confident	7 Å²	7	52.1 Å²	52.1	6%	0.058	31%	0.307	C	S	.	.			trans	-67.9	151.8	165.1	0	0	0	0	0	109.8	L409 D444 G445 I447	L409-A442 HydrophobicContact CD2-CB 3.8Å; A442-D444 PolarHBondContact O-N 3.22Å; A442-G445 PolarHBondContact O-N 2.79Å; A442-I447 HydrophobicContact CB-CB 4.24Å; A442-I447 WeakPolarHBondContact CB-O 3.32Å; A442-I447 PolarHBondContact N-O 3.05Å
443	P	61.1	Low	70.5	Confident	100 Å²	100	51 Å²	51	65%	0.649	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-32.4	174.7	21.2	-31	0	0	0	111.9	H408 G445	H408-P443 HydrophobicContact CB-CG 4.43Å; H408-P443 WeakPolarHBondContact O-CD 3.27Å; P443-G445 PolarHBondContact O-N 3.42Å
444	D	65.9	Low	71.1	Confident	124 Å²	124	49.6 Å²	49.6	66%	0.663	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-7.7	177.4	-56.2	-17	0	0	0	113.6	A442 N446	A442-D444 PolarHBondContact O-N 3.22Å; D444-N446 PolarHBondContact O-N 2.99Å
445	G	69.8	Low	72.2	Confident	52 Å²	52	47.8 Å²	47.8	54%	0.536	27%	0.274	S	S	.	.	S	Bend	trans	68.9	-11.1	-177.4	0	0	0	0	0	115.8	A442 P443	A442-G445 PolarHBondContact O-N 2.79Å; P443-G445 PolarHBondContact O-N 3.42Å
446	N	81.2	Confident	73.8	Confident	69 Å²	69	46.6 Å²	46.6	37%	0.369	27%	0.265	S	S	.	.	S	Bend	trans	-79.2	-24.6	-173.3	-70.2	-35.5	0	0	0	114.5	G318 D444	G318-N446 WeakPolarHBondContact CA-O 2.88Å; D444-N446 PolarHBondContact O-N 2.99Å
447	I	87.5	Confident	75.9	Confident	15 Å²	15	42.8 Å²	42.8	8%	0.077	24%	0.242	C	C	.	.			trans	-121.3	129.9	-178.4	-57.6	177.3	0	0	0	109.2	A317 L323 F407 A442	A317-I447 CarbonylContact O-C 3.47Å; A317-I447 WeakPolarHBondContact O-CA 3.1Å; L323-I447 HydrophobicContact CD2-CG2 4.24Å; F407-I447 HydrophobicContact CB-CD1 4.41Å; F407-I447 HydrophobicContact CB-CG2 4.4Å; F407-I447 HydrophobicContact CD1-CD1 3.32Å; F407-I447 HydrophobicContact CD1-CG2 4.47Å; F407-I447 HydrophobicContact CE1-CD1 3.78Å; F407-I447 HydrophobicContact CG-CD1 4.09Å; F407-I447 HydrophobicContact CG-CG2 4.31Å; A442-I447 HydrophobicContact CB-CB 4.24Å; A442-I447 WeakPolarHBondContact CB-O 3.32Å; A442-I447 PolarHBondContact N-O 3.05Å
448	S	89.6	Confident	78	Confident	25 Å²	25	35.2 Å²	35.2	18%	0.175	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	137.9	174.8	65.7	0	0	0	0	110.1	L316 A317	L316-S448 WeakPolarHBondContact CA-O 3.49Å; A317-S448 WeakPolarHBondContact CB-OG 3.42Å; A317-S448 PolarHBondContact N-O 3.24Å; A317-S448 PolarHBondContact O-N 3.35Å
449	L	90.8	Very high	79.9	Confident	7 Å²	7	34 Å²	34	4%	0.037	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	119.1	173.2	-177.5	156.4	0	0	0	108.5	I314 E315 L316 L400 L403 L409 C439 V440	I314-L449 HydrophobicContact CG2-CD1 4.36Å; I314-L449 HydrophobicContact CG2-CD2 4.42Å; I314-L449 HydrophobicContact CG2-CG 4.08Å; E315-L449 CarbonylContact O-C 3.56Å; E315-L449 WeakPolarHBondContact O-CA 3.48Å; L316-L449 HydrophobicContact CD2-CB 3.77Å; L316-L449 HydrophobicContact CD2-CD1 3.72Å; L316-L449 HydrophobicContact CD2-CG 3.7Å; L400-L449 HydrophobicContact CD2-CD1 4.24Å; L400-L449 HydrophobicContact CD2-CD2 4.09Å; L403-L449 HydrophobicContact CB-CD1 4.05Å; L403-L449 HydrophobicContact CD1-CD1 4.06Å; L409-L449 HydrophobicContact CD1-CB 3.72Å; L409-L449 HydrophobicContact CD1-CD1 3.58Å; L409-L449 HydrophobicContact CD1-CG 4.29Å; L409-L449 HydrophobicContact CD2-CB 4.5Å; C439-L449 CarbonylContact C-O 3.5Å; C439-L449 WeakPolarHBondContact CA-O 3.5Å; V440-L449 PolarHBondContact N-O 3.18Å; V440-L449 PolarHBondContact O-N 2.88Å
450	V	88.1	Confident	81.6	Confident	19 Å²	19	33 Å²	33	12%	0.115	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	120.6	177	-175.8	0	0	0	0	109.5	E315 C439 L452	E315-V450 HydrophobicContact CB-CB 4.18Å; E315-V450 PolarHBondContact N-O 3.36Å; E315-V450 PolarHBondContact O-N 3.02Å; C439-V450 HydrophobicContact CB-CG2 4.08Å; V450-L452 HydrophobicContact CG1-CD2 3.82Å; V450-L452 HydrophobicContact CG1-CG 4.34Å; V450-L452 PolarHBondContact O-N 3.1Å
451	L	87.6	Confident	83.1	Confident	8 Å²	8	32.4 Å²	32.4	4%	0.042	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	107	174.6	-176.3	70.5	0	0	0	110.1	I312 I314 N438 E453	I312-L451 HydrophobicContact CG2-CD1 3.42Å; I312-L451 VanDerWaalsContact CG2-CD1 3.42Å; I314-L451 HydrophobicContact CG1-CD1 4.07Å; N438-L451 HydrophobicContact CB-CB 3.88Å; N438-L451 PolarHBondContact O-N 3.01Å; L451-E453 VanDerWaalsContact C-N 3.28Å; L451-E453 HydrophobicContact CD1-CG 4.23Å; L451-E453 HydrophobicContact CD2-CG 3.96Å; L451-E453 HydrophobicContact CG-CG 3.86Å; L451-E453 PolarHBondContact O-N 2.99Å
452	L	86.2	Confident	84.6	Confident	14 Å²	14	27.9 Å²	27.9	7%	0.073	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	53.4	-178.6	-62.9	178.2	0	0	0	112	C313 E315 W388 V450 A455 M456	C313-L452 HydrophobicContact CB-CB 4.07Å; C313-L452 WeakPolarHBondContact O-CA 3.04Å; C313-L452 WeakPolarHBondContact O-CB 3.37Å; C313-L452 PolarHBondContact O-N 3.09Å; E315-L452 HydrophobicContact CB-CD1 4Å; E315-L452 HydrophobicContact CB-CG 4.33Å; W388-L452 HydrophobicContact CZ2-CD1 4.45Å; V450-L452 HydrophobicContact CG1-CD2 3.82Å; V450-L452 HydrophobicContact CG1-CG 4.34Å; V450-L452 PolarHBondContact O-N 3.1Å; L452-A455 HydrophobicContact CB-CB 4.28Å; L452-A455 HydrophobicContact CD2-CB 4.49Å; L452-M456 HydrophobicContact CD1-CG 4.41Å
453	E	80.3	Confident	85.9	Confident	13 Å²	13	27.6 Å²	27.6	6%	0.061	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	133.8	174.6	-84.1	-178	176.4	0	0	111.8	R261 I312 K396 L451 A455	R261-E453 IonicContact CZ-OE2 3.89Å; R261-E453 IonicContact NH1-OE2 3.05Å; R261-E453 PolarHBondContact NH1-OE2 3.43Å; R261-E453 IonicContact NH2-OE2 3.51Å; R261-E453 PolarHBondContact NH2-OE2 3.01Å; I312-E453 HydrophobicContact CG2-CG 4.1Å; K396-E453 WeakPolarHBondContact CE-OE1 3.37Å; K396-E453 IonicContact NZ-OE1 2.65Å; K396-E453 PolarHBondContact NZ-OE1 3.47Å; K396-E453 IonicContact NZ-OE2 3.08Å; L451-E453 VanDerWaalsContact C-N 3.28Å; L451-E453 HydrophobicContact CD1-CG 4.23Å; L451-E453 HydrophobicContact CD2-CG 3.96Å; L451-E453 HydrophobicContact CG-CG 3.86Å; L451-E453 PolarHBondContact O-N 2.99Å; E453-A455 PolarHBondContact O-N 3.39Å
454	D	77.7	Confident	87.2	Confident	57 Å²	57	24.7 Å²	24.7	31%	0.305	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	7	178.2	-60.7	-51.1	0	0	0	114.9	R261 A640	R261-D454 IonicContact CZ-OD2 3.36Å; R261-D454 IonicContact NH1-OD2 3.15Å; R261-D454 PolarHBondContact NH1-OD2 3.49Å; D454-A640 WeakPolarHBondContact O-CB 3.47Å
455	A	85.1	Confident	88.4	Confident	5 Å²	5	20.1 Å²	20.1	4%	0.041	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-22.3	-178.1	0	0	0	0	0	112.9	L452 E453 A640	L452-A455 HydrophobicContact CB-CB 4.28Å; L452-A455 HydrophobicContact CD2-CB 4.49Å; E453-A455 PolarHBondContact O-N 3.39Å; A455-A640 VanDerWaalsContact O-CB 3.28Å; A455-A640 WeakPolarHBondContact O-CB 3.41Å; A455-A640 PolarHBondContact O-N 2.97Å
456	M	89.7	Confident	89.6	Confident	4 Å²	4	17.7 Å²	17.7	2%	0.02	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	139.3	178.4	-60.2	-64.8	-69.1	0	0	109.4	W388 W390 L452 I575 I637	W388-M456 HydrophobicContact CE3-CE 4.38Å; W388-M456 HydrophobicContact CH2-CE 3.42Å; W388-M456 VanDerWaalsContact CH2-CE 3.42Å; W388-M456 HydrophobicContact CH2-SD 4.19Å; W388-M456 HydrophobicContact CZ2-CE 4.32Å; W388-M456 HydrophobicContact CZ3-CE 3.47Å; W388-M456 VanDerWaalsContact CZ3-CE 3.47Å; W390-M456 HydrophobicContact CH2-CB 3.65Å; W390-M456 HydrophobicContact CZ2-CB 4.38Å; W390-M456 HydrophobicContact CZ3-CB 4.47Å; L452-M456 HydrophobicContact CD1-CG 4.41Å; M456-I575 HydrophobicContact CE-CD1 3.48Å; M456-I575 VanDerWaalsContact CE-CD1 3.48Å; M456-I575 HydrophobicContact CE-CG1 3.76Å; M456-I575 HydrophobicContact SD-CD1 4.43Å; M456-I575 HydrophobicContact SD-CG1 4.26Å; M456-I637 HydrophobicContact CE-CG2 3.45Å; M456-I637 VanDerWaalsContact CE-CG2 3.45Å
457	L	93.6	Very high	90.1	Very high	5 Å²	5	14.4 Å²	14.4	3%	0.026	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	143.8	178.9	-57.5	174	0	0	0	108.8	E264 I637 A638	E264-L457 HydrophobicContact CG-CD1 4.44Å; E264-L457 HydrophobicContact CG-CD2 3.89Å; L457-I637 CarbonylContact O-C 3.59Å; L457-I637 VanDerWaalsContact O-CA 3.27Å; L457-I637 WeakPolarHBondContact O-CA 3.43Å; L457-A638 PolarHBondContact N-O 3.09Å; L457-A638 PolarHBondContact O-N 3.43Å
458	R	96.2	Very high	90.3	Very high	6 Å²	6	15.4 Å²	15.4	2%	0.023	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	120.6	177.4	-166.2	175.1	175.8	152.2	2	109.4	I308 S309 E350 W390 D635 V636 I637	I308-R458 CarbonylContact C-O 3.6Å; I308-R458 HydrophobicContact CD1-CB 4.35Å; I308-R458 HydrophobicContact CD1-CG 3.71Å; I308-R458 HydrophobicContact CG1-CB 3.99Å; I308-R458 HydrophobicContact CG1-CG 3.88Å; I308-R458 WeakPolarHBondContact CG1-O 3.19Å; I308-R458 PolarHBondContact N-O 2.86Å; I308-R458 VanDerWaalsContact N-O 3.12Å; S309-R458 PolarHBondContact N-O 3.49Å; S309-R458 PolarHBondContact OG-N 3.17Å; S309-R458 PolarHBondContact OG-O 2.81Å; E350-R458 VanDerWaalsContact CD-NH2 3.27Å; E350-R458 IonicContact OE1-CZ 3.48Å; E350-R458 VanDerWaalsContact OE1-CZ 3.23Å; E350-R458 IonicContact OE1-NH1 3.5Å; E350-R458 PolarHBondContact OE1-NH1 3.02Å; E350-R458 IonicContact OE1-NH2 3.61Å; E350-R458 PolarHBondContact OE1-NH2 3.07Å; E350-R458 IonicContact OE2-CZ 3.65Å; E350-R458 IonicContact OE2-NH2 3.41Å; E350-R458 PolarHBondContact OE2-NH2 3.27Å; W390-R458 HydrophobicContact CH2-CB 4.46Å; W390-R458 HydrophobicContact CZ3-CB 4.47Å; R458-D635 HydrophobicContact CG-CB 4.44Å; R458-D635 IonicContact CZ-OD2 2.82Å; R458-D635 IonicContact NE-OD2 4Å; R458-D635 PolarHBondContact NE-OD2 3.19Å; R458-D635 IonicContact NH2-OD2 2.72Å; R458-D635 PolarHBondContact NH2-OD2 3.09Å; R458-V636 WeakPolarHBondContact CA-O 3.46Å; R458-I637 HydrophobicContact CG-CG1 4.06Å
459	F	97.3	Very high	90.5	Very high	1 Å²	1	14.2 Å²	14.2	0%	0.004	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	130.2	175.1	-62.4	-56.3	0	0	0	109.9	T265 I305 E306 D307 D635 V636 F646 W647	T265-F459 HydrophobicContact CG2-CE1 3.98Å; T265-F459 HydrophobicContact CG2-CZ 4.15Å; I305-F459 HydrophobicContact CD1-CB 4.17Å; I305-F459 HydrophobicContact CD1-CG 4.48Å; E306-F459 WeakPolarHBondContact O-CA 3.5Å; D307-F459 HydrophobicContact CB-CD1 4.26Å; D307-F459 HydrophobicContact CB-CE1 4.2Å; D307-F459 WeakPolarHBondContact OD1-CE1 3.36Å; F459-D635 CarbonylContact O-C 3.59Å; F459-D635 VanDerWaalsContact O-CA 3.3Å; F459-D635 WeakPolarHBondContact O-CA 3.48Å; F459-V636 HydrophobicContact CB-CB 4.46Å; F459-V636 PolarHBondContact N-O 3.3Å; F459-V636 PolarHBondContact O-N 3.14Å; F459-F646 HydrophobicContact CE2-CB 4.19Å; F459-W647 AromaticContact CD1-CE3 3.59Å; F459-W647 HydrophobicContact CD1-CE3 3.59Å; F459-W647 AromaticContact CD1-CZ3 3.64Å; F459-W647 HydrophobicContact CD1-CZ3 3.64Å; F459-W647 AromaticContact CE1-CE3 3.49Å; F459-W647 HydrophobicContact CE1-CE3 3.49Å; F459-W647 VanDerWaalsContact CE1-CE3 3.49Å; F459-W647 AromaticContact CE1-CZ3 3.9Å; F459-W647 HydrophobicContact CE1-CZ3 3.9Å; F459-W647 HydrophobicContact CG-CE3 4.36Å; F459-W647 HydrophobicContact CZ-CE3 4.18Å
460	R	95.8	Very high	90.6	Very high	44 Å²	44	13.9 Å²	13.9	17%	0.166	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	119.1	177.8	177.6	163.4	-63.1	166.6	-6.5	110.3	I305 E306 I308 D635	I305-R460 CarbonylContact C-O 3.52Å; I305-R460 VanDerWaalsContact CA-O 3.27Å; I305-R460 WeakPolarHBondContact CA-O 3.31Å; E306-R460 HydrophobicContact CB-CB 4.31Å; E306-R460 PolarHBondContact N-O 3.47Å; E306-R460 PolarHBondContact O-N 2.85Å; I308-R460 HydrophobicContact CD1-CB 3.85Å; I308-R460 HydrophobicContact CG1-CB 4.22Å; R460-D635 VanDerWaalsContact CA-OD1 3.29Å; R460-D635 WeakPolarHBondContact CA-OD1 3.24Å; R460-D635 WeakPolarHBondContact CB-OD1 3.38Å; R460-D635 VanDerWaalsContact CG-OD1 3.22Å; R460-D635 WeakPolarHBondContact CG-OD1 3.48Å; R460-D635 IonicContact CZ-OD1 2.67Å; R460-D635 IonicContact CZ-OD2 2.66Å; R460-D635 IonicContact NE-OD1 3.49Å; R460-D635 PolarHBondContact NE-OD1 2.78Å; R460-D635 IonicContact NE-OD2 4Å; R460-D635 IonicContact NH2-OD1 2.93Å; R460-D635 IonicContact NH2-OD2 3.98Å; R460-D635 PolarHBondContact NH2-OD2 3.06Å; R460-D635 VanDerWaalsContact NH2-OD2 3.12Å
461	L	95.8	Very high	90.8	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	127.5	171.2	-66.1	92.2	0	0	0	108.8	T304 I305 L470 G633 W634 V636 I650	T304-L461 CarbonylContact O-C 3.32Å; T304-L461 VanDerWaalsContact O-CA 3.27Å; T304-L461 WeakPolarHBondContact O-CA 3.2Å; I305-L461 HydrophobicContact CB-CG 4.34Å; I305-L461 HydrophobicContact CD1-CD1 4.39Å; I305-L461 HydrophobicContact CD1-CG 4.28Å; I305-L461 HydrophobicContact CG1-CG 4.23Å; L461-L470 HydrophobicContact CD1-CD2 4.18Å; L461-L470 HydrophobicContact CD2-CD2 3.92Å; L461-L470 HydrophobicContact CD2-CG 4.08Å; L461-G633 CarbonylContact O-C 3.57Å; L461-G633 WeakPolarHBondContact O-CA 3.41Å; L461-W634 WeakPolarHBondContact CB-O 3.31Å; L461-W634 PolarHBondContact N-O 2.96Å; L461-W634 PolarHBondContact O-N 3.21Å; L461-V636 HydrophobicContact CD1-CG2 3.57Å; L461-I650 HydrophobicContact CD2-CG2 4.19Å
462	S	93	Very high	90.9	Very high	11 Å²	11	22.8 Å²	22.8	8%	0.077	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	131.3	177.4	-47.1	0	0	0	0	109.8	C303 T304 C632	C303-S462 CarbonylContact C-O 3.44Å; C303-S462 VanDerWaalsContact CA-O 3.24Å; C303-S462 WeakPolarHBondContact CA-O 3.5Å; T304-S462 PolarHBondContact N-O 3.11Å; T304-S462 PolarHBondContact O-N 3.1Å; T304-S462 PolarHBondContact OG1-O 3.27Å; T304-S462 VanDerWaalsContact OG1-O 3.11Å; S462-C632 CarbonylContact C-O 3.58Å
463	G	91.1	Very high	91.2	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.01	11%	0.107	C	C	.	.	S	Bend	trans	128.3	158.8	175.8	0	0	0	0	0	113.2	S299 H302 K465 S466 C632	S299-G463 WeakPolarHBondContact O-CA 3.38Å; H302-G463 CarbonylContact O-C 3.31Å; H302-G463 VanDerWaalsContact O-C 3.3Å; H302-G463 WeakPolarHBondContact O-CA 3.41Å; G463-K465 VanDerWaalsContact C-N 3.26Å; G463-K465 PolarHBondContact O-N 3.39Å; G463-S466 WeakPolarHBondContact O-CB 3.31Å; G463-S466 PolarHBondContact O-N 3.36Å; G463-S466 VanDerWaalsContact O-N 3.12Å; G463-S466 PolarHBondContact O-OG 3.5Å; G463-C632 VanDerWaalsContact C-SG 3.6Å; G463-C632 WeakPolarHBondContact CA-O 3.22Å; G463-C632 PolarHBondContact N-O 3.37Å
464	P	89.6	Confident	91.8	Very high	38 Å²	38	22.4 Å²	22.4	25%	0.247	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-27	-172.2	25.8	-35.4	0	0	0	112.9	K300 H302 S466 P527 C632	K300-P464 WeakPolarHBondContact O-CD 3.4Å; K300-P464 WeakPolarHBondContact O-CG 3.49Å; H302-P464 WeakPolarHBondContact O-CD 3.4Å; P464-S466 PolarHBondContact O-N 2.74Å; P464-P527 HydrophobicContact CB-CB 4.46Å; P464-C632 VanDerWaalsContact CA-SG 3.55Å; P464-C632 VanDerWaalsContact N-SG 3.41Å
465	K	91.1	Very high	92.4	Very high	29 Å²	29	21 Å²	21	13%	0.126	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	3.8	178.6	-63.6	-166.8	174	-165.9	0	114	H302 G463 S467 F468 I469 P555 D557	H302-K465 PolarHBondContact O-N 2.88Å; G463-K465 VanDerWaalsContact C-N 3.26Å; G463-K465 PolarHBondContact O-N 3.39Å; K465-S467 PolarHBondContact O-N 2.9Å; K465-F468 PolarHBondContact O-N 3.23Å; K465-I469 VanDerWaalsContact O-CG1 3.3Å; K465-I469 WeakPolarHBondContact O-CG1 3.45Å; K465-I469 PolarHBondContact O-N 3.15Å; K465-I469 VanDerWaalsContact O-N 3.09Å; K465-P555 HydrophobicContact CD-CB 4.19Å; K465-P555 HydrophobicContact CD-CG 4.16Å; K465-P555 PolarHBondContact NZ-O 3.1Å; K465-P555 VanDerWaalsContact NZ-O 3.17Å; K465-D557 IonicContact NZ-OD1 3.69Å; K465-D557 PolarHBondContact NZ-OD1 2.82Å
466	S	93.4	Very high	92.6	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-59.1	-44.6	-179.8	54.5	0	0	0	0	112.3	G463 P464 F468 I469 L470	G463-S466 WeakPolarHBondContact O-CB 3.31Å; G463-S466 PolarHBondContact O-N 3.36Å; G463-S466 VanDerWaalsContact O-N 3.12Å; G463-S466 PolarHBondContact O-OG 3.5Å; P464-S466 PolarHBondContact O-N 2.74Å; S466-F468 PolarHBondContact O-N 2.83Å; S466-I469 PolarHBondContact O-N 2.84Å; S466-L470 WeakPolarHBondContact O-CG 3.44Å; S466-L470 PolarHBondContact O-N 3.09Å
467	S	92.6	Very high	92.4	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-57.1	-48.6	176.3	-54.7	0	0	0	0	112.3	K465 I469 L470 R471 Q526 W634	K465-S467 PolarHBondContact O-N 2.9Å; S467-I469 VanDerWaalsContact C-N 3.32Å; S467-I469 PolarHBondContact O-N 3.01Å; S467-L470 PolarHBondContact O-N 2.89Å; S467-R471 WeakPolarHBondContact O-CB 3.12Å; S467-R471 PolarHBondContact O-N 3.43Å; S467-Q526 WeakPolarHBondContact CB-O 3.07Å; S467-Q526 PolarHBondContact OG-O 3.19Å; S467-W634 PolarHBondContact OG-NE1 2.91Å
468	F	91.7	Very high	91.8	Very high	36 Å²	36	31 Å²	31	16%	0.158	14%	0.137	C	C	.	.	H	α-helix	trans	-65.1	-35.7	-179.3	-60.6	-81.3	0	0	0	112.8	K465 S466 Q472 L525 P555	K465-F468 PolarHBondContact O-N 3.23Å; S466-F468 PolarHBondContact O-N 2.83Å; F468-Q472 WeakPolarHBondContact O-CG 3.36Å; F468-Q472 PolarHBondContact O-N 3.36Å; F468-L525 WeakPolarHBondContact CE1-O 3.23Å; F468-L525 WeakPolarHBondContact CZ-O 3.49Å; F468-P555 HydrophobicContact CB-CB 4.02Å; F468-P555 HydrophobicContact CB-CG 4.44Å
469	I	93.1	Very high	91	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-69.7	-44.7	176.2	-69.3	173	0	0	0	110.3	C303 K465 S466 S467 R471 Q472 V473 P555 I650 A653 A655	C303-I469 HydrophobicContact CB-CD1 3.37Å; K465-I469 VanDerWaalsContact O-CG1 3.3Å; K465-I469 WeakPolarHBondContact O-CG1 3.45Å; K465-I469 PolarHBondContact O-N 3.15Å; K465-I469 VanDerWaalsContact O-N 3.09Å; S466-I469 PolarHBondContact O-N 2.84Å; S467-I469 VanDerWaalsContact C-N 3.32Å; S467-I469 PolarHBondContact O-N 3.01Å; I469-R471 VanDerWaalsContact C-N 3.29Å; I469-R471 PolarHBondContact O-N 3.03Å; I469-Q472 PolarHBondContact O-N 3.01Å; I469-Q472 VanDerWaalsContact O-N 3.16Å; I469-V473 WeakPolarHBondContact O-CG2 3.35Å; I469-V473 PolarHBondContact O-N 3.05Å; I469-P555 HydrophobicContact CG1-CG 3.99Å; I469-I650 HydrophobicContact CG2-CG2 4.36Å; I469-A653 WeakPolarHBondContact CG1-O 3.49Å; I469-A653 HydrophobicContact CG2-CB 3.73Å; I469-A655 HydrophobicContact CD1-CB 4.19Å; I469-A655 HydrophobicContact CG2-CB 4.3Å
470	L	94.4	Very high	90.4	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-62	-38.7	175.5	-72.3	179	0	0	0	111.1	L461 S466 S467 Q472 V473 L474 W519 L621 W634 V636 I650	L461-L470 HydrophobicContact CD1-CD2 4.18Å; L461-L470 HydrophobicContact CD2-CD2 3.92Å; L461-L470 HydrophobicContact CD2-CG 4.08Å; S466-L470 WeakPolarHBondContact O-CG 3.44Å; S466-L470 PolarHBondContact O-N 3.09Å; S467-L470 PolarHBondContact O-N 2.89Å; L470-Q472 PolarHBondContact O-N 3.1Å; L470-V473 PolarHBondContact O-N 3Å; L470-L474 HydrophobicContact CB-CD1 4.17Å; L470-L474 HydrophobicContact CB-CG 4.47Å; L470-L474 HydrophobicContact CD2-CD1 4.28Å; L470-L474 HydrophobicContact CD2-CG 4.49Å; L470-L474 VanDerWaalsContact O-CB 3.31Å; L470-L474 WeakPolarHBondContact O-CB 3.43Å; L470-L474 WeakPolarHBondContact O-CG 3.34Å; L470-L474 PolarHBondContact O-N 3.12Å; L470-W519 HydrophobicContact CB-CH2 3.84Å; L470-W519 HydrophobicContact CB-CZ2 3.87Å; L470-W519 HydrophobicContact CD1-CH2 4.28Å; L470-L621 HydrophobicContact CD1-CD2 4.47Å; L470-W634 HydrophobicContact CD1-CB 3.67Å; L470-W634 HydrophobicContact CD1-CD2 4.47Å; L470-W634 HydrophobicContact CD1-CG 3.71Å; L470-V636 HydrophobicContact CD1-CG2 4.12Å; L470-V636 HydrophobicContact CD2-CG2 3.85Å; L470-I650 HydrophobicContact CD2-CD1 4.48Å
471	R	92.2	Very high	89.9	Confident	108 Å²	108	34 Å²	34	41%	0.408	16%	0.159	S	C	.	.	H	α-helix	trans	-57.3	-36.4	174.1	-163.8	-179.1	-177.2	-175	4.4	113.5	S467 I469 V473 S524	S467-R471 WeakPolarHBondContact O-CB 3.12Å; S467-R471 PolarHBondContact O-N 3.43Å; I469-R471 VanDerWaalsContact C-N 3.29Å; I469-R471 PolarHBondContact O-N 3.03Å; R471-V473 VanDerWaalsContact C-N 3.33Å; R471-S524 VanDerWaalsContact CD-OG 3.3Å; R471-S524 WeakPolarHBondContact CD-OG 3.42Å; R471-S524 PolarHBondContact NE-OG 3.28Å
472	Q	89.8	Confident	89.1	Confident	106 Å²	106	35.4 Å²	35.4	50%	0.495	17%	0.166	S	C	.	.	H	α-helix	trans	-75.4	-24	178.1	-69.9	178.1	9.8	0	0	113	F468 I469 L470	F468-Q472 WeakPolarHBondContact O-CG 3.36Å; F468-Q472 PolarHBondContact O-N 3.36Å; I469-Q472 PolarHBondContact O-N 3.01Å; I469-Q472 VanDerWaalsContact O-N 3.16Å; L470-Q472 PolarHBondContact O-N 3.1Å
473	V	92.3	Very high	88.6	Confident	13 Å²	13	35 Å²	35	8%	0.079	16%	0.163	C	C	.	.	H	α-helix	trans	-97.1	-39.8	-175.2	173.6	0	0	0	0	111.8	I469 L470 R471 D475 P544 A649 I650 A653	I469-V473 WeakPolarHBondContact O-CG2 3.35Å; I469-V473 PolarHBondContact O-N 3.05Å; L470-V473 PolarHBondContact O-N 3Å; R471-V473 VanDerWaalsContact C-N 3.33Å; V473-D475 PolarHBondContact O-N 3.28Å; V473-P544 HydrophobicContact CG1-CB 4.22Å; V473-A649 HydrophobicContact CG1-CB 3.66Å; V473-A649 HydrophobicContact CG2-CB 4.35Å; V473-I650 HydrophobicContact CB-CG1 4.49Å; V473-I650 HydrophobicContact CG1-CG1 4.05Å; V473-I650 HydrophobicContact CG2-CG1 4.11Å; V473-A653 HydrophobicContact CG2-CB 3.46Å; V473-A653 VanDerWaalsContact CG2-CB 3.46Å
474	L	93.2	Very high	88.1	Confident	6 Å²	6	38.8 Å²	38.8	3%	0.031	18%	0.183	C	C	.	.			trans	-91	97.3	-175.2	-57.2	-176.6	0	0	0	109.1	L470 W519 L539 C541 L619 L621 F646	L470-L474 HydrophobicContact CB-CD1 4.17Å; L470-L474 HydrophobicContact CB-CG 4.47Å; L470-L474 HydrophobicContact CD2-CD1 4.28Å; L470-L474 HydrophobicContact CD2-CG 4.49Å; L470-L474 VanDerWaalsContact O-CB 3.31Å; L470-L474 WeakPolarHBondContact O-CB 3.43Å; L470-L474 WeakPolarHBondContact O-CG 3.34Å; L470-L474 PolarHBondContact O-N 3.12Å; L474-W519 HydrophobicContact CD1-CZ2 4.25Å; L474-L539 HydrophobicContact CD1-CD1 4.33Å; L474-C541 WeakPolarHBondContact CA-SG 3.43Å; L474-C541 HydrophobicContact CD2-CB 4.38Å; L474-L619 HydrophobicContact CD1-CD1 4.3Å; L474-L619 HydrophobicContact CD2-CD1 3.49Å; L474-L619 VanDerWaalsContact CD2-CD1 3.49Å; L474-L619 HydrophobicContact CG-CD1 4.49Å; L474-L621 HydrophobicContact CD1-CD1 4.12Å; L474-L621 HydrophobicContact CD1-CD2 4.17Å; L474-F646 HydrophobicContact CD2-CD1 4.18Å; L474-F646 HydrophobicContact CD2-CE1 3.76Å
475	D	89.1	Confident	87.5	Confident	27 Å²	27	41.6 Å²	41.6	14%	0.144	19%	0.192	C	C	.	.			trans	-88.1	113.1	173.1	-168.8	6.8	0	0	0	110.7	V473 R477 C541 S542	V473-D475 PolarHBondContact O-N 3.28Å; D475-R477 WeakPolarHBondContact OD1-CB 3.21Å; D475-R477 WeakPolarHBondContact OD1-CG 3.3Å; D475-R477 IonicContact OD1-CZ 2.82Å; D475-R477 PolarHBondContact OD1-N 3.08Å; D475-R477 IonicContact OD1-NE 2.78Å; D475-R477 PolarHBondContact OD1-NE 2.65Å; D475-R477 IonicContact OD1-NH2 3.43Å; D475-R477 IonicContact OD2-CZ 3.74Å; D475-R477 IonicContact OD2-NE 3.83Å; D475-R477 PolarHBondContact OD2-NE 3.14Å; D475-R477 IonicContact OD2-NH2 3.28Å; D475-R477 PolarHBondContact OD2-NH2 3.06Å; D475-C541 PolarHBondContact N-SG 3.07Å; D475-C541 VanDerWaalsContact N-SG 3.43Å; D475-C541 WeakPolarHBondContact O-CA 3.41Å; D475-S542 PolarHBondContact O-N 3.37Å; D475-S542 PolarHBondContact O-OG 2.97Å
476	V	90.6	Very high	86.5	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.006	20%	0.199	C	C	.	.			trans	-114	4.5	-178.5	-109.2	0	0	0	0	111.7	M479 A480 V516 L520 L539 L540	V476-M479 WeakPolarHBondContact O-CB 3.48Å; V476-M479 PolarHBondContact O-N 3.11Å; V476-A480 PolarHBondContact O-N 3.29Å; V476-V516 HydrophobicContact CB-CG1 4.3Å; V476-V516 HydrophobicContact CG1-CG1 4.47Å; V476-V516 HydrophobicContact CG1-CG2 4.39Å; V476-L520 HydrophobicContact CG2-CD2 4.07Å; V476-L520 HydrophobicContact CG2-CG 4.5Å; V476-L539 HydrophobicContact CG1-CB 4.31Å; V476-L539 HydrophobicContact CG1-CD2 4.39Å; V476-L540 WeakPolarHBondContact CG1-O 3.39Å
477	R	84.8	Confident	85.1	Confident	146 Å²	146	46.1 Å²	46.1	55%	0.551	23%	0.23	S	C	*	.	H	α-helix	trans	-67.5	-44.3	-174.9	-66.6	172.7	-68.9	170.9	4	112.3	D475 M479 A480 I481	D475-R477 WeakPolarHBondContact OD1-CB 3.21Å; D475-R477 WeakPolarHBondContact OD1-CG 3.3Å; D475-R477 IonicContact OD1-CZ 2.82Å; D475-R477 PolarHBondContact OD1-N 3.08Å; D475-R477 IonicContact OD1-NE 2.78Å; D475-R477 PolarHBondContact OD1-NE 2.65Å; D475-R477 IonicContact OD1-NH2 3.43Å; D475-R477 IonicContact OD2-CZ 3.74Å; D475-R477 IonicContact OD2-NE 3.83Å; D475-R477 PolarHBondContact OD2-NE 3.14Å; D475-R477 IonicContact OD2-NH2 3.28Å; D475-R477 PolarHBondContact OD2-NH2 3.06Å; R477-M479 PolarHBondContact O-N 2.64Å; R477-A480 PolarHBondContact O-N 2.87Å; R477-I481 WeakPolarHBondContact O-CG1 3.43Å; R477-I481 PolarHBondContact O-N 2.99Å; R477-I481 VanDerWaalsContact O-N 3.09Å
478	E	79.9	Confident	83.6	Confident	76 Å²	76	50.7 Å²	50.7	36%	0.355	26%	0.258	S	S	.	.	H	α-helix	trans	-59.6	-39.7	176.1	-173.7	171.8	-159.8	0	0	111.1	I481 L482 V614	E478-I481 PolarHBondContact O-N 3.23Å; E478-L482 HydrophobicContact CG-CD1 4.39Å; E478-L482 WeakPolarHBondContact O-CG 3.46Å; E478-L482 PolarHBondContact O-N 3.24Å; E478-V614 VanDerWaalsContact CD-CG1 3.44Å; E478-V614 HydrophobicContact CG-CG1 4.48Å; E478-V614 VanDerWaalsContact OE1-CG1 3.32Å; E478-V614 WeakPolarHBondContact OE1-CG1 3.12Å; E478-V614 WeakPolarHBondContact OE1-CG2 3.06Å; E478-V614 WeakPolarHBondContact OE2-CG1 3.43Å
479	M	81.2	Confident	81.8	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-63.5	-45.3	175.3	-177	64.8	-172.1	0	0	112.4	V476 R477 I481 L482 L483 F498 L512 V516 L540 L616	V476-M479 WeakPolarHBondContact O-CB 3.48Å; V476-M479 PolarHBondContact O-N 3.11Å; R477-M479 PolarHBondContact O-N 2.64Å; M479-I481 VanDerWaalsContact C-N 3.28Å; M479-I481 PolarHBondContact O-N 3.17Å; M479-L482 PolarHBondContact O-N 3.13Å; M479-L483 HydrophobicContact CE-CD1 3.51Å; M479-L483 HydrophobicContact CE-CD2 3.66Å; M479-L483 HydrophobicContact CE-CG 3.52Å; M479-L483 HydrophobicContact CG-CD1 4Å; M479-L483 HydrophobicContact CG-CG 4.42Å; M479-L483 WeakPolarHBondContact O-CG 3.46Å; M479-L483 PolarHBondContact O-N 3.48Å; M479-L483 HydrophobicContact SD-CD1 4.45Å; M479-L483 HydrophobicContact SD-CG 4.37Å; M479-F498 HydrophobicContact CE-CD2 4.49Å; M479-F498 HydrophobicContact CE-CE1 3.66Å; M479-F498 HydrophobicContact CE-CE2 3.57Å; M479-F498 HydrophobicContact CE-CZ 3.09Å; M479-F498 HydrophobicContact SD-CE1 4Å; M479-F498 HydrophobicContact SD-CE2 4.44Å; M479-F498 HydrophobicContact SD-CZ 3.99Å; M479-L512 HydrophobicContact CE-CD2 3.68Å; M479-L512 HydrophobicContact CE-CG 4.22Å; M479-V516 HydrophobicContact CG-CG2 4.37Å; M479-L540 HydrophobicContact CE-CB 4.02Å; M479-L540 HydrophobicContact CE-CD1 3.4Å; M479-L540 HydrophobicContact CE-CG 4.35Å; M479-L540 HydrophobicContact CG-CB 3.92Å; M479-L540 HydrophobicContact SD-CB 3.76Å; M479-L540 HydrophobicContact SD-CD1 4.04Å; M479-L616 HydrophobicContact SD-CD1 3.75Å; M479-L616 HydrophobicContact SD-CD2 4.44Å
480	A	83.7	Confident	79.7	Confident	17 Å²	17	60 Å²	60	14%	0.14	32%	0.322	C	S	.	.	H	α-helix	trans	-57.5	-44	176.8	0	0	0	0	0	111.2	V476 R477 L482 L483 D484 V516 L520	V476-A480 PolarHBondContact O-N 3.29Å; R477-A480 PolarHBondContact O-N 2.87Å; A480-L482 PolarHBondContact O-N 3.3Å; A480-L483 PolarHBondContact O-N 2.79Å; A480-D484 PolarHBondContact O-N 3.22Å; A480-V516 HydrophobicContact CB-CG1 4.02Å; A480-L520 HydrophobicContact CB-CD1 4.09Å
481	I	84.4	Confident	77.9	Confident	96 Å²	96	62.6 Å²	62.6	49%	0.492	35%	0.35	S	S	.	.	H	α-helix	trans	-63	-43.3	176.8	-63.2	163.7	0	0	0	111.3	R477 E478 M479 D484 K485	R477-I481 WeakPolarHBondContact O-CG1 3.43Å; R477-I481 PolarHBondContact O-N 2.99Å; R477-I481 VanDerWaalsContact O-N 3.09Å; E478-I481 PolarHBondContact O-N 3.23Å; M479-I481 VanDerWaalsContact C-N 3.28Å; M479-I481 PolarHBondContact O-N 3.17Å; I481-D484 PolarHBondContact O-N 3.39Å; I481-K485 HydrophobicContact CG2-CD 4.46Å; I481-K485 WeakPolarHBondContact O-CG 3.4Å; I481-K485 PolarHBondContact O-N 3.38Å; I481-K485 VanDerWaalsContact O-N 3.1Å
482	L	81	Confident	76.3	Confident	30 Å²	30	59.9 Å²	59.9	16%	0.157	34%	0.343	C	S	.	.	H	α-helix	trans	-65.1	-41.3	178.7	-72.7	171.8	0	0	0	111.9	E478 M479 A480 D484 K485 T486 L492 L616	E478-L482 HydrophobicContact CG-CD1 4.39Å; E478-L482 WeakPolarHBondContact O-CG 3.46Å; E478-L482 PolarHBondContact O-N 3.24Å; M479-L482 PolarHBondContact O-N 3.13Å; A480-L482 PolarHBondContact O-N 3.3Å; L482-D484 VanDerWaalsContact C-N 3.34Å; L482-K485 PolarHBondContact O-N 3.05Å; L482-T486 WeakPolarHBondContact O-CG2 3.48Å; L482-T486 PolarHBondContact O-N 3.45Å; L482-L492 HydrophobicContact CD2-CD1 4.15Å; L482-L616 HydrophobicContact CD1-CD1 4Å
483	L	81.4	Confident	75	Confident	2 Å²	2	58.2 Å²	58.2	1%	0.01	34%	0.341	C	S	.	.	H	α-helix	trans	-65.5	-36.5	176.1	-72.4	170.2	0	0	0	112.3	M479 A480 T486 F498 V509 L512 K513 V516	M479-L483 HydrophobicContact CE-CD1 3.51Å; M479-L483 HydrophobicContact CE-CD2 3.66Å; M479-L483 HydrophobicContact CE-CG 3.52Å; M479-L483 HydrophobicContact CG-CD1 4Å; M479-L483 HydrophobicContact CG-CG 4.42Å; M479-L483 WeakPolarHBondContact O-CG 3.46Å; M479-L483 PolarHBondContact O-N 3.48Å; M479-L483 HydrophobicContact SD-CD1 4.45Å; M479-L483 HydrophobicContact SD-CG 4.37Å; A480-L483 PolarHBondContact O-N 2.79Å; L483-T486 WeakPolarHBondContact CA-OG1 3.42Å; L483-T486 PolarHBondContact O-N 3.24Å; L483-T486 PolarHBondContact O-OG1 3.21Å; L483-F498 HydrophobicContact CD2-CZ 4.12Å; L483-V509 HydrophobicContact CD2-CG1 3.73Å; L483-L512 HydrophobicContact CD1-CG 4.43Å; L483-L512 HydrophobicContact CD2-CD2 4.41Å; L483-K513 HydrophobicContact CB-CB 4.45Å; L483-K513 HydrophobicContact CB-CD 4.42Å; L483-K513 HydrophobicContact CB-CG 4.47Å; L483-K513 HydrophobicContact CD1-CB 4.06Å; L483-V516 HydrophobicContact CD1-CG2 4.28Å
484	D	80.6	Confident	73.4	Confident	82 Å²	82	62.7 Å²	62.7	44%	0.439	37%	0.374	S	S	.	.	H	α-helix	trans	-64.2	-41.3	174.1	-73.6	-22.4	0	0	0	111.7	A480 I481 L482 T486 A487 K513	A480-D484 PolarHBondContact O-N 3.22Å; I481-D484 PolarHBondContact O-N 3.39Å; L482-D484 VanDerWaalsContact C-N 3.34Å; D484-T486 VanDerWaalsContact C-N 3.35Å; D484-T486 PolarHBondContact O-N 2.99Å; D484-A487 WeakPolarHBondContact O-CB 3.44Å; D484-A487 PolarHBondContact O-N 3.09Å; D484-K513 WeakPolarHBondContact OD1-CE 3.2Å; D484-K513 IonicContact OD1-NZ 3.86Å; D484-K513 PolarHBondContact OD1-NZ 3.16Å
485	K	77.1	Confident	72.2	Confident	97 Å²	97	70.9 Å²	70.9	42%	0.422	41%	0.411	S	S	.	.	H	α-helix	trans	-65.6	-34.1	176.3	-70.8	176.9	179.5	-174.4	0	113.4	I481 L482 A487 T488	I481-K485 HydrophobicContact CG2-CD 4.46Å; I481-K485 WeakPolarHBondContact O-CG 3.4Å; I481-K485 PolarHBondContact O-N 3.38Å; I481-K485 VanDerWaalsContact O-N 3.1Å; L482-K485 PolarHBondContact O-N 3.05Å; K485-A487 PolarHBondContact O-N 3.26Å; K485-T488 PolarHBondContact O-N 3.34Å; K485-T488 VanDerWaalsContact O-N 3.08Å; K485-T488 PolarHBondContact O-OG1 2.84Å
486	T	70	Confident	71.7	Confident	45 Å²	45	71 Å²	71	28%	0.276	41%	0.413	S	S	.	.	H	α-helix	trans	-62.5	-23.3	176.2	54.1	0	0	0	0	113.2	L482 L483 D484 L492 I502	L482-T486 WeakPolarHBondContact O-CG2 3.48Å; L482-T486 PolarHBondContact O-N 3.45Å; L483-T486 WeakPolarHBondContact CA-OG1 3.42Å; L483-T486 PolarHBondContact O-N 3.24Å; L483-T486 PolarHBondContact O-OG1 3.21Å; D484-T486 VanDerWaalsContact C-N 3.35Å; D484-T486 PolarHBondContact O-N 2.99Å; T486-L492 HydrophobicContact CG2-CD1 3.6Å; T486-L492 HydrophobicContact CG2-CD2 4.1Å; T486-L492 HydrophobicContact CG2-CG 4.44Å; T486-I502 HydrophobicContact CG2-CD1 3.89Å
487	A	64.5	Low	71.3	Confident	79 Å²	79	72.2 Å²	72.2	65%	0.653	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-19.8	176.4	0	0	0	0	0	113.2	D484 K485	D484-A487 WeakPolarHBondContact O-CB 3.44Å; D484-A487 PolarHBondContact O-N 3.09Å; K485-A487 PolarHBondContact O-N 3.26Å
488	T	60.2	Low	71.3	Confident	96 Å²	96	65.6 Å²	65.6	59%	0.589	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	18.5	-173.2	50.2	0	0	0	0	114.3	K485 D490	K485-T488 PolarHBondContact O-N 3.34Å; K485-T488 VanDerWaalsContact O-N 3.08Å; K485-T488 PolarHBondContact O-OG1 2.84Å; T488-D490 PolarHBondContact O-N 3.15Å
489	A	55.3	Low	71.4	Confident	96 Å²	96	62.7 Å²	62.7	79%	0.793	38%	0.384	S	S	*	.	S	Bend	trans	60.5	-22.2	-179.1	0	0	0	0	0	117.1
490	D	49.1	Very low	71.6	Confident	134 Å²	134	69.5 Å²	69.5	72%	0.717	41%	0.41	S	S	*	.	S	Bend	trans	-109.8	121.4	-174.4	-67.6	-31.8	0	0	0	113.6	T488	T488-D490 PolarHBondContact O-N 3.15Å
491	G	56.1	Low	71.8	Confident	57 Å²	57	69.3 Å²	69.3	59%	0.588	41%	0.405	S	S	*	.			trans	110.9	33.5	149.8	0	0	0	0	0	119.2
492	L	59	Low	71.8	Confident	51 Å²	51	65.8 Å²	65.8	27%	0.267	39%	0.387	S	S	.	.			trans	-85.4	131.1	164.8	-135.2	74.1	0	0	0	110.5	L482 T486 S494 A499 I502	L482-L492 HydrophobicContact CD2-CD1 4.15Å; T486-L492 HydrophobicContact CG2-CD1 3.6Å; T486-L492 HydrophobicContact CG2-CD2 4.1Å; T486-L492 HydrophobicContact CG2-CG 4.44Å; L492-S494 PolarHBondContact O-N 2.99Å; L492-S494 VanDerWaalsContact O-N 3.14Å; L492-A499 HydrophobicContact CD2-CB 3.5Å; L492-A499 HydrophobicContact CG-CB 4.28Å; L492-I502 HydrophobicContact CD2-CD1 3.77Å
493	P	61.9	Low	72	Confident	70 Å²	70	72.6 Å²	72.6	46%	0.455	41%	0.411	S	S	.	.			trans	-63.1	118.4	174.4	-13.2	25.1	0	0	0	109.7	E495 T496	P493-E495 PolarHBondContact O-N 3.33Å; P493-T496 HydrophobicContact CB-CG2 4.18Å; P493-T496 HydrophobicContact CG-CG2 4.49Å; P493-T496 PolarHBondContact O-N 2.89Å; P493-T496 PolarHBondContact O-OG1 2.91Å
494	S	59.1	Low	72.3	Confident	108 Å²	108	76.8 Å²	76.8	76%	0.755	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-12.1	-170.4	33.6	0	0	0	0	114.9	L492	L492-S494 PolarHBondContact O-N 2.99Å; L492-S494 VanDerWaalsContact O-N 3.14Å
495	E	68.4	Low	72.6	Confident	177 Å²	177	76.5 Å²	76.5	83%	0.827	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-4.4	-175.7	-62.5	-169.4	163.3	0	0	115.3	P493	P493-E495 PolarHBondContact O-N 3.33Å
496	T	78.1	Confident	72.9	Confident	30 Å²	30	76.2 Å²	76.2	18%	0.184	44%	0.436	C	S	.	.			trans	-79	144.5	-175.5	61.5	0	0	0	0	112.6	P493 F498 A499 R500	P493-T496 HydrophobicContact CB-CG2 4.18Å; P493-T496 HydrophobicContact CG-CG2 4.49Å; P493-T496 PolarHBondContact O-N 2.89Å; P493-T496 PolarHBondContact O-OG1 2.91Å; T496-F498 PolarHBondContact O-N 3.38Å; T496-A499 WeakPolarHBondContact O-CB 3.37Å; T496-A499 PolarHBondContact O-N 2.91Å; T496-A499 VanDerWaalsContact O-N 3.11Å; T496-A499 VanDerWaalsContact OG1-CB 3.27Å; T496-A499 WeakPolarHBondContact OG1-CB 3.29Å; T496-A499 PolarHBondContact OG1-N 2.92Å; T496-R500 PolarHBondContact O-N 3.32Å; T496-R500 VanDerWaalsContact O-N 3.12Å
497	L	82	Confident	73.7	Confident	26 Å²	26	78 Å²	78	14%	0.136	46%	0.455	C	S	.	.	H	α-helix	trans	-56.2	-35.5	175.9	-68.3	175.9	0	0	0	112.3	R500 W501 Y580 D583 L584 Q587	L497-R500 PolarHBondContact O-N 3.37Å; L497-W501 PolarHBondContact O-N 3.38Å; L497-Y580 HydrophobicContact CB-CE2 4.06Å; L497-D583 HydrophobicContact CD1-CB 3.9Å; L497-D583 HydrophobicContact CD2-CB 3.68Å; L497-D583 HydrophobicContact CG-CB 4.47Å; L497-L584 HydrophobicContact CD1-CB 4.46Å; L497-Q587 HydrophobicContact CD1-CG 4.44Å
498	F	83.6	Confident	74.7	Confident	7 Å²	7	74.8 Å²	74.8	3%	0.031	43%	0.428	C	S	.	.	H	α-helix	trans	-68.7	-41.8	177.9	-177.7	-115.6	0	0	0	112.4	M479 L483 T496 R500 W501 I502 L512 L540 L616	M479-F498 HydrophobicContact CE-CD2 4.49Å; M479-F498 HydrophobicContact CE-CE1 3.66Å; M479-F498 HydrophobicContact CE-CE2 3.57Å; M479-F498 HydrophobicContact CE-CZ 3.09Å; M479-F498 HydrophobicContact SD-CE1 4Å; M479-F498 HydrophobicContact SD-CE2 4.44Å; M479-F498 HydrophobicContact SD-CZ 3.99Å; L483-F498 HydrophobicContact CD2-CZ 4.12Å; T496-F498 PolarHBondContact O-N 3.38Å; F498-R500 VanDerWaalsContact C-N 3.3Å; F498-R500 PolarHBondContact O-N 3.35Å; F498-W501 HydrophobicContact CD2-CE3 4.02Å; F498-W501 AromaticContact CE2-CE3 3.66Å; F498-W501 HydrophobicContact CE2-CE3 3.66Å; F498-W501 AromaticContact CE2-CZ3 3.83Å; F498-W501 HydrophobicContact CE2-CZ3 3.83Å; F498-W501 PolarHBondContact O-N 3.39Å; F498-W501 VanDerWaalsContact O-N 3.16Å; F498-I502 HydrophobicContact CD1-CD1 3.67Å; F498-I502 HydrophobicContact CD1-CG1 4.44Å; F498-I502 HydrophobicContact CD2-CG1 4.48Å; F498-I502 HydrophobicContact CE1-CD1 3.13Å; F498-I502 HydrophobicContact CE1-CG1 3.97Å; F498-I502 HydrophobicContact CE2-CD1 4.08Å; F498-I502 HydrophobicContact CE2-CG1 3.97Å; F498-I502 HydrophobicContact CG-CD1 4.32Å; F498-I502 HydrophobicContact CZ-CD1 3.32Å; F498-I502 HydrophobicContact CZ-CG1 3.66Å; F498-I502 WeakPolarHBondContact O-CG1 3.34Å; F498-I502 PolarHBondContact O-N 3.27Å; F498-L512 HydrophobicContact CE2-CD2 4.21Å; F498-L512 HydrophobicContact CZ-CD2 4.36Å; F498-L540 HydrophobicContact CD2-CD1 3.9Å; F498-L540 HydrophobicContact CE2-CD1 3.51Å; F498-L540 HydrophobicContact CZ-CD1 4.32Å; F498-L616 HydrophobicContact CB-CD1 3.9Å; F498-L616 HydrophobicContact CD1-CD1 3.78Å; F498-L616 HydrophobicContact CD2-CD1 4.42Å; F498-L616 HydrophobicContact CE1-CD1 4.48Å; F498-L616 HydrophobicContact CG-CD1 3.76Å
499	A	82.6	Confident	76	Confident	15 Å²	15	71.3 Å²	71.3	12%	0.124	41%	0.407	C	S	.	.	H	α-helix	trans	-59.1	-42.6	173.7	0	0	0	0	0	111.9	L492 T496 W501 I502 R503	L492-A499 HydrophobicContact CD2-CB 3.5Å; L492-A499 HydrophobicContact CG-CB 4.28Å; T496-A499 WeakPolarHBondContact O-CB 3.37Å; T496-A499 PolarHBondContact O-N 2.91Å; T496-A499 VanDerWaalsContact O-N 3.11Å; T496-A499 VanDerWaalsContact OG1-CB 3.27Å; T496-A499 WeakPolarHBondContact OG1-CB 3.29Å; T496-A499 PolarHBondContact OG1-N 2.92Å; A499-W501 PolarHBondContact O-N 3.23Å; A499-I502 PolarHBondContact O-N 2.92Å; A499-R503 PolarHBondContact O-N 2.92Å; A499-R503 VanDerWaalsContact O-N 3.13Å
500	R	85.5	Confident	77.6	Confident	145 Å²	145	71.1 Å²	71.1	55%	0.547	40%	0.4	S	S	.	.	H	α-helix	trans	-60.1	-46.3	174.5	-176.7	176.5	-177.3	169.9	4	111.5	T496 L497 F498 I502 R503 D504	T496-R500 PolarHBondContact O-N 3.32Å; T496-R500 VanDerWaalsContact O-N 3.12Å; L497-R500 PolarHBondContact O-N 3.37Å; F498-R500 VanDerWaalsContact C-N 3.3Å; F498-R500 PolarHBondContact O-N 3.35Å; R500-I502 PolarHBondContact O-N 3.32Å; R500-R503 PolarHBondContact O-N 2.67Å; R500-D504 VanDerWaalsContact O-CG 3.25Å; R500-D504 PolarHBondContact O-N 2.83Å; R500-D504 VanDerWaalsContact O-N 3.13Å
501	W	87.4	Confident	79.5	Confident	13 Å²	13	65.5 Å²	65.5	5%	0.049	37%	0.37	C	S	.	.	H	α-helix	trans	-63.9	-40.2	179.1	-179.8	77.2	0	0	0	113.1	L497 F498 A499 R503 D504 F505 L512 P574 Y580	L497-W501 PolarHBondContact O-N 3.38Å; F498-W501 HydrophobicContact CD2-CE3 4.02Å; F498-W501 AromaticContact CE2-CE3 3.66Å; F498-W501 HydrophobicContact CE2-CE3 3.66Å; F498-W501 AromaticContact CE2-CZ3 3.83Å; F498-W501 HydrophobicContact CE2-CZ3 3.83Å; F498-W501 PolarHBondContact O-N 3.39Å; F498-W501 VanDerWaalsContact O-N 3.16Å; A499-W501 PolarHBondContact O-N 3.23Å; W501-R503 VanDerWaalsContact C-N 3.32Å; W501-R503 PolarHBondContact O-N 2.99Å; W501-D504 PolarHBondContact O-N 3.24Å; W501-F505 AromaticContact CD1-CD2 3.54Å; W501-F505 AromaticContact CD1-CE2 3.89Å; W501-F505 HydrophobicContact CG-CD2 4.28Å; W501-F505 HydrophobicContact CZ2-CB 4.5Å; W501-F505 AromaticContact NE1-CD2 3.34Å; W501-F505 VanDerWaalsContact NE1-CD2 3.34Å; W501-F505 AromaticContact NE1-CE2 3.82Å; W501-F505 PolarHBondContact O-N 3.2Å; W501-L512 HydrophobicContact CH2-CD2 4.17Å; W501-L512 HydrophobicContact CZ3-CD2 3.87Å; W501-P574 HydrophobicContact CD2-CB 4.05Å; W501-P574 HydrophobicContact CD2-CG 3.66Å; W501-P574 HydrophobicContact CE3-CG 3.86Å; W501-P574 HydrophobicContact CG-CB 4.15Å; W501-P574 HydrophobicContact CG-CG 4.21Å; W501-P574 HydrophobicContact CH2-CG 4.08Å; W501-P574 HydrophobicContact CZ2-CB 4.4Å; W501-P574 HydrophobicContact CZ2-CG 3.89Å; W501-P574 HydrophobicContact CZ3-CG 4.06Å; W501-Y580 HydrophobicContact CB-CD2 4.07Å; W501-Y580 HydrophobicContact CB-CE2 3.98Å; W501-Y580 HydrophobicContact CG-CD2 4.35Å; W501-Y580 HydrophobicContact CG-CE2 4.42Å
502	I	85.7	Confident	81.2	Confident	22 Å²	22	62.8 Å²	62.8	11%	0.113	34%	0.342	C	S	.	.	H	α-helix	trans	-60.4	-43.8	175.5	-70.7	165.3	0	0	0	111.1	T486 L492 F498 A499 R500 D504 F505 P506 V509	T486-I502 HydrophobicContact CG2-CD1 3.89Å; L492-I502 HydrophobicContact CD2-CD1 3.77Å; F498-I502 HydrophobicContact CD1-CD1 3.67Å; F498-I502 HydrophobicContact CD1-CG1 4.44Å; F498-I502 HydrophobicContact CD2-CG1 4.48Å; F498-I502 HydrophobicContact CE1-CD1 3.13Å; F498-I502 HydrophobicContact CE1-CG1 3.97Å; F498-I502 HydrophobicContact CE2-CD1 4.08Å; F498-I502 HydrophobicContact CE2-CG1 3.97Å; F498-I502 HydrophobicContact CG-CD1 4.32Å; F498-I502 HydrophobicContact CZ-CD1 3.32Å; F498-I502 HydrophobicContact CZ-CG1 3.66Å; F498-I502 WeakPolarHBondContact O-CG1 3.34Å; F498-I502 PolarHBondContact O-N 3.27Å; A499-I502 PolarHBondContact O-N 2.92Å; R500-I502 PolarHBondContact O-N 3.32Å; I502-D504 VanDerWaalsContact C-N 3.25Å; I502-D504 PolarHBondContact O-N 3.45Å; I502-F505 CarbonylContact O-C 3.5Å; I502-F505 PolarHBondContact O-N 2.83Å; I502-P506 WeakPolarHBondContact O-CA 3.26Å; I502-V509 HydrophobicContact CB-CG2 4.39Å; I502-V509 HydrophobicContact CG1-CG2 4.06Å; I502-V509 HydrophobicContact CG2-CG2 3.71Å
503	R	85.4	Confident	82.7	Confident	172 Å²	172	63.4 Å²	63.4	65%	0.649	34%	0.343	S	S	*	.	H	α-helix	trans	-61	-37.9	177.9	175.2	175.2	50.6	-159.9	-12.8	111.7	A499 R500 W501	A499-R503 PolarHBondContact O-N 2.92Å; A499-R503 VanDerWaalsContact O-N 3.13Å; R500-R503 PolarHBondContact O-N 2.67Å; W501-R503 VanDerWaalsContact C-N 3.32Å; W501-R503 PolarHBondContact O-N 2.99Å
504	D	86.4	Confident	84.1	Confident	90 Å²	90	61.1 Å²	61.1	48%	0.481	33%	0.33	S	S	.	.	H	α-helix	trans	-74.6	-29	178.1	-59.4	-17.1	0	0	0	111.7	R500 W501 I502	R500-D504 VanDerWaalsContact O-CG 3.25Å; R500-D504 PolarHBondContact O-N 2.83Å; R500-D504 VanDerWaalsContact O-N 3.13Å; W501-D504 PolarHBondContact O-N 3.24Å; I502-D504 VanDerWaalsContact C-N 3.25Å; I502-D504 PolarHBondContact O-N 3.45Å
505	F	86.5	Confident	85.8	Confident	77 Å²	77	56 Å²	56	34%	0.338	29%	0.294	S	S	.	.			trans	-136.9	66.6	-175.4	-56.9	-79.5	0	0	0	113.8	W501 I502 A507 S508 Q577	W501-F505 AromaticContact CD1-CD2 3.54Å; W501-F505 AromaticContact CD1-CE2 3.89Å; W501-F505 HydrophobicContact CG-CD2 4.28Å; W501-F505 HydrophobicContact CZ2-CB 4.5Å; W501-F505 AromaticContact NE1-CD2 3.34Å; W501-F505 VanDerWaalsContact NE1-CD2 3.34Å; W501-F505 AromaticContact NE1-CE2 3.82Å; W501-F505 PolarHBondContact O-N 3.2Å; I502-F505 CarbonylContact O-C 3.5Å; I502-F505 PolarHBondContact O-N 2.83Å; F505-A507 VanDerWaalsContact C-N 3.34Å; F505-A507 PolarHBondContact O-N 3.17Å; F505-S508 PolarHBondContact O-N 3.18Å; F505-Q577 HydrophobicContact CE2-CG 4.28Å
506	P	85.2	Confident	86.9	Confident	91 Å²	91	47.7 Å²	47.7	59%	0.591	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-65.4	-34.1	-173.6	24	-33.7	0	0	0	113.5	I502 S508 V509	I502-P506 WeakPolarHBondContact O-CA 3.26Å; P506-S508 PolarHBondContact O-N 3.31Å; P506-V509 WeakPolarHBondContact O-CG2 3.33Å; P506-V509 PolarHBondContact O-N 3.07Å
507	A	85.5	Confident	87.6	Confident	81 Å²	81	48.2 Å²	48.2	67%	0.669	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-62.7	-24.8	179.4	0	0	0	0	0	113.4	F505 V509 P511	F505-A507 VanDerWaalsContact C-N 3.34Å; F505-A507 PolarHBondContact O-N 3.17Å; A507-V509 VanDerWaalsContact C-N 3.3Å; A507-V509 PolarHBondContact O-N 3.02Å; A507-P511 WeakPolarHBondContact O-CD 3.13Å
508	S	86	Confident	88.2	Confident	13 Å²	13	48.1 Å²	48.1	9%	0.091	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-77.5	-11	-177.5	-63.1	0	0	0	0	114.2	F505 P506 L512	F505-S508 PolarHBondContact O-N 3.18Å; P506-S508 PolarHBondContact O-N 3.31Å; S508-L512 VanDerWaalsContact O-CB 3.24Å; S508-L512 WeakPolarHBondContact O-CB 3.3Å; S508-L512 PolarHBondContact O-N 2.91Å
509	V	86.3	Confident	88.7	Confident	23 Å²	23	47.8 Å²	47.8	14%	0.139	25%	0.254	C	S	.	.	H	α-helix	trans	-69.9	-45.1	-174.1	178.7	0	0	0	0	112.2	L483 I502 P506 A507 L512 K513	L483-V509 HydrophobicContact CD2-CG1 3.73Å; I502-V509 HydrophobicContact CB-CG2 4.39Å; I502-V509 HydrophobicContact CG1-CG2 4.06Å; I502-V509 HydrophobicContact CG2-CG2 3.71Å; P506-V509 WeakPolarHBondContact O-CG2 3.33Å; P506-V509 PolarHBondContact O-N 3.07Å; A507-V509 VanDerWaalsContact C-N 3.3Å; A507-V509 PolarHBondContact O-N 3.02Å; V509-L512 PolarHBondContact O-N 3.23Å; V509-K513 PolarHBondContact O-N 2.8Å
510	S	88.8	Confident	89.1	Confident	92 Å²	92	49.3 Å²	49.3	64%	0.643	26%	0.26	S	S	*	.	H	α-helix	trans	-62.9	-50.2	-178.5	170.9	0	0	0	0	112.4	L512 K513 A514	S510-L512 VanDerWaalsContact C-N 3.34Å; S510-L512 PolarHBondContact O-N 3.01Å; S510-K513 WeakPolarHBondContact O-CB 3.13Å; S510-K513 PolarHBondContact O-N 3.45Å; S510-A514 PolarHBondContact O-N 2.88Å
511	P	90.6	Very high	89.3	Confident	15 Å²	15	50.8 Å²	50.8	10%	0.097	27%	0.265	C	S	.	.	H	α-helix	trans	-58.5	-43.6	174.5	-25.4	34.2	0	0	0	112.9	A507 K513 A514 H515 E569 L570 F572	A507-P511 WeakPolarHBondContact O-CD 3.13Å; P511-K513 VanDerWaalsContact C-N 3.3Å; P511-K513 PolarHBondContact O-N 2.96Å; P511-A514 WeakPolarHBondContact O-CB 3.29Å; P511-A514 PolarHBondContact O-N 2.81Å; P511-H515 PolarHBondContact O-CD2 2.82Å; P511-H515 PolarHBondContact O-N 3.34Å; P511-E569 HydrophobicContact CB-CB 4.23Å; P511-L570 VanDerWaalsContact CB-O 3.32Å; P511-L570 WeakPolarHBondContact CB-O 3.42Å; P511-F572 HydrophobicContact CB-CD2 3.89Å; P511-F572 HydrophobicContact CG-CD2 3.89Å; P511-F572 HydrophobicContact CG-CE2 4.21Å
512	L	90.4	Very high	89.4	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.8	-39.6	178.6	178.1	63.5	0	0	0	112	M479 L483 F498 W501 S508 V509 S510 H515 V516 L540	M479-L512 HydrophobicContact CE-CD2 3.68Å; M479-L512 HydrophobicContact CE-CG 4.22Å; L483-L512 HydrophobicContact CD1-CG 4.43Å; L483-L512 HydrophobicContact CD2-CD2 4.41Å; F498-L512 HydrophobicContact CE2-CD2 4.21Å; F498-L512 HydrophobicContact CZ-CD2 4.36Å; W501-L512 HydrophobicContact CH2-CD2 4.17Å; W501-L512 HydrophobicContact CZ3-CD2 3.87Å; S508-L512 VanDerWaalsContact O-CB 3.24Å; S508-L512 WeakPolarHBondContact O-CB 3.3Å; S508-L512 PolarHBondContact O-N 2.91Å; V509-L512 PolarHBondContact O-N 3.23Å; S510-L512 VanDerWaalsContact C-N 3.34Å; S510-L512 PolarHBondContact O-N 3.01Å; L512-H515 PolarHBondContact O-N 3.44Å; L512-V516 WeakPolarHBondContact O-CG2 3.19Å; L512-V516 PolarHBondContact O-N 3.19Å; L512-L540 HydrophobicContact CD1-CD1 4.29Å; L512-L540 HydrophobicContact CD2-CD1 3.72Å
513	K	90.9	Very high	89.5	Confident	65 Å²	65	51 Å²	51	28%	0.283	27%	0.271	S	S	.	.	H	α-helix	trans	-62.8	-47	173.6	179.6	171.8	167.8	167.6	0	112	L483 D484 V509 S510 P511 H515 V516 D517	L483-K513 HydrophobicContact CB-CB 4.45Å; L483-K513 HydrophobicContact CB-CD 4.42Å; L483-K513 HydrophobicContact CB-CG 4.47Å; L483-K513 HydrophobicContact CD1-CB 4.06Å; D484-K513 WeakPolarHBondContact OD1-CE 3.2Å; D484-K513 IonicContact OD1-NZ 3.86Å; D484-K513 PolarHBondContact OD1-NZ 3.16Å; V509-K513 PolarHBondContact O-N 2.8Å; S510-K513 WeakPolarHBondContact O-CB 3.13Å; S510-K513 PolarHBondContact O-N 3.45Å; P511-K513 VanDerWaalsContact C-N 3.3Å; P511-K513 PolarHBondContact O-N 2.96Å; K513-H515 VanDerWaalsContact C-N 3.27Å; K513-H515 PolarHBondContact O-N 2.66Å; K513-V516 PolarHBondContact O-N 3.34Å; K513-V516 VanDerWaalsContact O-N 3.15Å; K513-D517 PolarHBondContact O-N 3.1Å
514	A	92.5	Very high	89.6	Confident	22 Å²	22	42.8 Å²	42.8	18%	0.182	24%	0.24	C	C	.	.	H	α-helix	trans	-57.3	-41	176.6	0	0	0	0	0	112.1	S510 P511 D517 F518 E569	S510-A514 PolarHBondContact O-N 2.88Å; P511-A514 WeakPolarHBondContact O-CB 3.29Å; P511-A514 PolarHBondContact O-N 2.81Å; A514-D517 PolarHBondContact O-N 3.41Å; A514-F518 VanDerWaalsContact O-CB 3.23Å; A514-F518 WeakPolarHBondContact O-CB 3.45Å; A514-F518 PolarHBondContact O-N 3.4Å; A514-E569 HydrophobicContact CB-CB 4.12Å; A514-E569 HydrophobicContact CB-CG 3.6Å
515	H	93.7	Very high	89.8	Confident	1 Å²	1	41 Å²	41	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-65	-42.2	176.2	-81.9	-114.8	0	0	0	113.2	P511 L512 K513 F518 W519 S538 I567 E569 L570 P571	P511-H515 PolarHBondContact O-CD2 2.82Å; P511-H515 PolarHBondContact O-N 3.34Å; L512-H515 PolarHBondContact O-N 3.44Å; K513-H515 VanDerWaalsContact C-N 3.27Å; K513-H515 PolarHBondContact O-N 2.66Å; H515-F518 PolarHBondContact O-N 3.3Å; H515-W519 WeakPolarHBondContact O-CB 3.45Å; H515-W519 PolarHBondContact O-N 2.81Å; H515-S538 WeakPolarHBondContact CB-O 3.44Å; H515-S538 PolarHBondContact ND1-N 2.67Å; H515-I567 HydrophobicContact CB-CD1 4.23Å; H515-I567 WeakPolarHBondContact CD2-CD1 3.48Å; H515-E569 PolarHBondContact NE2-O 3.11Å; H515-E569 VanDerWaalsContact NE2-O 3.09Å; H515-L570 PolarHBondContact NE2-O 3.22Å; H515-P571 VanDerWaalsContact CE1-CA 3.48Å; H515-P571 WeakPolarHBondContact CE1-CA 3.36Å
516	V	92.8	Very high	89.8	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.012	22%	0.219	C	C	.	.	H	α-helix	trans	-64.8	-45.2	176.5	170.4	0	0	0	0	110.9	V476 M479 A480 L483 L512 K513 W519 L520 L539	V476-V516 HydrophobicContact CB-CG1 4.3Å; V476-V516 HydrophobicContact CG1-CG1 4.47Å; V476-V516 HydrophobicContact CG1-CG2 4.39Å; M479-V516 HydrophobicContact CG-CG2 4.37Å; A480-V516 HydrophobicContact CB-CG1 4.02Å; L483-V516 HydrophobicContact CD1-CG2 4.28Å; L512-V516 WeakPolarHBondContact O-CG2 3.19Å; L512-V516 PolarHBondContact O-N 3.19Å; K513-V516 PolarHBondContact O-N 3.34Å; K513-V516 VanDerWaalsContact O-N 3.15Å; V516-W519 PolarHBondContact O-N 3.33Å; V516-L520 HydrophobicContact CG1-CD1 3.98Å; V516-L520 WeakPolarHBondContact O-CG 3.4Å; V516-L520 PolarHBondContact O-N 2.78Å; V516-L539 HydrophobicContact CG2-CD2 4.24Å
517	D	92.6	Very high	89.9	Confident	40 Å²	40	35.7 Å²	35.7	21%	0.214	20%	0.201	C	C	.	.	H	α-helix	trans	-61.5	-46	176.1	-90.5	-45.4	0	0	0	111.6	K513 A514 W519 L520 R521	K513-D517 PolarHBondContact O-N 3.1Å; A514-D517 PolarHBondContact O-N 3.41Å; D517-W519 VanDerWaalsContact C-N 3.29Å; D517-W519 PolarHBondContact O-N 3.07Å; D517-L520 PolarHBondContact O-N 3.13Å; D517-R521 WeakPolarHBondContact O-CB 3.4Å; D517-R521 WeakPolarHBondContact O-CG 3.34Å; D517-R521 PolarHBondContact O-N 2.96Å; D517-R521 IonicContact OD1-CZ 2.64Å; D517-R521 IonicContact OD1-NE 2.63Å; D517-R521 PolarHBondContact OD1-NE 3.01Å; D517-R521 IonicContact OD1-NH2 3.43Å; D517-R521 PolarHBondContact OD1-NH2 3.02Å; D517-R521 IonicContact OD2-NH2 2.89Å
518	F	93.5	Very high	90.1	Very high	24 Å²	24	31.8 Å²	31.8	11%	0.105	17%	0.169	C	C	.	.	H	α-helix	trans	-59.5	-39.9	176.3	-179.9	-107.7	0	0	0	112	A514 H515 S522 A523 L537 M565 I567	A514-F518 VanDerWaalsContact O-CB 3.23Å; A514-F518 WeakPolarHBondContact O-CB 3.45Å; A514-F518 PolarHBondContact O-N 3.4Å; H515-F518 PolarHBondContact O-N 3.3Å; F518-S522 CarbonylContact O-C 3.19Å; F518-S522 WeakPolarHBondContact O-CA 3.44Å; F518-S522 VanDerWaalsContact O-CB 3.3Å; F518-S522 WeakPolarHBondContact O-CB 2.95Å; F518-S522 PolarHBondContact O-N 2.91Å; F518-A523 HydrophobicContact CD1-CB 3.96Å; F518-A523 HydrophobicContact CE1-CB 3.7Å; F518-A523 HydrophobicContact CZ-CB 4.35Å; F518-A523 PolarHBondContact O-N 3.11Å; F518-L537 HydrophobicContact CD1-CD1 4.2Å; F518-L537 HydrophobicContact CD1-CD2 3.79Å; F518-L537 HydrophobicContact CE1-CD1 4.21Å; F518-L537 HydrophobicContact CE1-CD2 3.99Å; F518-M565 HydrophobicContact CE2-CB 3.99Å; F518-M565 HydrophobicContact CZ-CB 3.88Å; F518-M565 HydrophobicContact CZ-CE 4.49Å; F518-I567 HydrophobicContact CB-CD1 3.74Å; F518-I567 HydrophobicContact CD1-CB 4.25Å; F518-I567 HydrophobicContact CD1-CD1 4.15Å; F518-I567 HydrophobicContact CE1-CB 4.36Å; F518-I567 HydrophobicContact CG-CB 4.33Å; F518-I567 HydrophobicContact CG-CD1 3.98Å
519	W	93.7	Very high	90	Very high	1 Å²	1	34 Å²	34	0%	0.004	18%	0.18	C	C	.	.	H	α-helix	trans	-64	-49.2	175.3	177.4	-98.4	0	0	0	112.4	L470 L474 H515 V516 D517 A523 S524 L537 L539 L621 W634	L470-W519 HydrophobicContact CB-CH2 3.84Å; L470-W519 HydrophobicContact CB-CZ2 3.87Å; L470-W519 HydrophobicContact CD1-CH2 4.28Å; L474-W519 HydrophobicContact CD1-CZ2 4.25Å; H515-W519 WeakPolarHBondContact O-CB 3.45Å; H515-W519 PolarHBondContact O-N 2.81Å; V516-W519 PolarHBondContact O-N 3.33Å; D517-W519 VanDerWaalsContact C-N 3.29Å; D517-W519 PolarHBondContact O-N 3.07Å; W519-A523 HydrophobicContact CE3-CB 3.88Å; W519-A523 HydrophobicContact CZ3-CB 4.4Å; W519-S524 WeakPolarHBondContact O-CB 3.26Å; W519-S524 PolarHBondContact O-N 2.92Å; W519-S524 VanDerWaalsContact O-N 3.14Å; W519-S524 PolarHBondContact O-OG 2.95Å; W519-L537 HydrophobicContact CE3-CD1 4.05Å; W519-L539 HydrophobicContact CB-CD1 4.44Å; W519-L539 HydrophobicContact CB-CD2 3.7Å; W519-L539 HydrophobicContact CD2-CD1 3.77Å; W519-L539 HydrophobicContact CE3-CD1 4.18Å; W519-L539 HydrophobicContact CG-CD1 3.88Å; W519-L539 HydrophobicContact CG-CD2 3.96Å; W519-L621 HydrophobicContact CD2-CD1 4.4Å; W519-L621 HydrophobicContact CE3-CD1 3.81Å; W519-L621 HydrophobicContact CH2-CD1 3.57Å; W519-L621 HydrophobicContact CZ2-CD1 4.17Å; W519-L621 HydrophobicContact CZ3-CD1 3.37Å; W519-W634 HydrophobicContact CZ3-CH2 4.24Å; W519-W634 AromaticContact CZ3-CZ2 3.94Å; W519-W634 HydrophobicContact CZ3-CZ2 3.94Å
520	L	92.1	Very high	90	Very high	46 Å²	46	33.4 Å²	33.4	24%	0.241	18%	0.176	C	C	.	.	H	α-helix	trans	-67	-39.8	-176.1	-73	172.6	0	0	0	112.9	V476 A480 V516 D517	V476-L520 HydrophobicContact CG2-CD2 4.07Å; V476-L520 HydrophobicContact CG2-CG 4.5Å; A480-L520 HydrophobicContact CB-CD1 4.09Å; V516-L520 HydrophobicContact CG1-CD1 3.98Å; V516-L520 WeakPolarHBondContact O-CG 3.4Å; V516-L520 PolarHBondContact O-N 2.78Å; D517-L520 PolarHBondContact O-N 3.13Å
521	R	89.7	Confident	89.8	Confident	176 Å²	176	29.2 Å²	29.2	66%	0.664	15%	0.147	S	C	*	.	H	α-helix	trans	-92.9	-25.3	-173.2	-59.5	-179.5	-162.4	-164.7	5.6	113.9	D517 L525	D517-R521 WeakPolarHBondContact O-CB 3.4Å; D517-R521 WeakPolarHBondContact O-CG 3.34Å; D517-R521 PolarHBondContact O-N 2.96Å; D517-R521 IonicContact OD1-CZ 2.64Å; D517-R521 IonicContact OD1-NE 2.63Å; D517-R521 PolarHBondContact OD1-NE 3.01Å; D517-R521 IonicContact OD1-NH2 3.43Å; D517-R521 PolarHBondContact OD1-NH2 3.02Å; D517-R521 IonicContact OD2-NH2 2.89Å; R521-L525 WeakPolarHBondContact O-CD1 3.24Å
522	S	88.4	Confident	89.4	Confident	39 Å²	39	29.8 Å²	29.8	27%	0.273	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-134.2	-69.2	-165.8	-51.8	0	0	0	0	113.1	F518 S524 L525 M565	F518-S522 CarbonylContact O-C 3.19Å; F518-S522 WeakPolarHBondContact O-CA 3.44Å; F518-S522 VanDerWaalsContact O-CB 3.3Å; F518-S522 WeakPolarHBondContact O-CB 2.95Å; F518-S522 PolarHBondContact O-N 2.91Å; S522-S524 PolarHBondContact O-N 2.84Å; S522-L525 PolarHBondContact O-N 2.74Å; S522-L525 VanDerWaalsContact O-N 3.14Å; S522-M565 VanDerWaalsContact CB-SD 3.59Å
523	A	88.1	Confident	89.2	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-61	-39.1	-168.8	0	0	0	0	0	114	F518 W519 L525 I531 L537	F518-A523 HydrophobicContact CD1-CB 3.96Å; F518-A523 HydrophobicContact CE1-CB 3.7Å; F518-A523 HydrophobicContact CZ-CB 4.35Å; F518-A523 PolarHBondContact O-N 3.11Å; W519-A523 HydrophobicContact CE3-CB 3.88Å; W519-A523 HydrophobicContact CZ3-CB 4.4Å; A523-L525 VanDerWaalsContact C-N 3.25Å; A523-L525 PolarHBondContact O-N 3.26Å; A523-I531 HydrophobicContact CB-CD1 3.61Å; A523-L537 HydrophobicContact CB-CD1 4.02Å
524	S	89	Confident	89.2	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-75.9	-12.9	-177	70.9	0	0	0	0	114.2	R471 W519 S522	R471-S524 VanDerWaalsContact CD-OG 3.3Å; R471-S524 WeakPolarHBondContact CD-OG 3.42Å; R471-S524 PolarHBondContact NE-OG 3.28Å; W519-S524 WeakPolarHBondContact O-CB 3.26Å; W519-S524 PolarHBondContact O-N 2.92Å; W519-S524 VanDerWaalsContact O-N 3.14Å; W519-S524 PolarHBondContact O-OG 2.95Å; S522-S524 PolarHBondContact O-N 2.84Å
525	L	89	Confident	89.2	Confident	53 Å²	53	33 Å²	33	28%	0.277	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-93.9	-15.7	-179.6	-82.3	166.2	0	0	0	113.4	F468 R521 S522 A523 L560	F468-L525 WeakPolarHBondContact CE1-O 3.23Å; F468-L525 WeakPolarHBondContact CZ-O 3.49Å; R521-L525 WeakPolarHBondContact O-CD1 3.24Å; S522-L525 PolarHBondContact O-N 2.74Å; S522-L525 VanDerWaalsContact O-N 3.14Å; A523-L525 VanDerWaalsContact C-N 3.25Å; A523-L525 PolarHBondContact O-N 3.26Å; L525-L560 WeakPolarHBondContact O-CD1 3.32Å
526	Q	87.8	Confident	89.2	Confident	23 Å²	23	33.2 Å²	33.2	11%	0.107	17%	0.165	C	C	.	.	S	Bend	trans	-116.1	156.9	-174.9	-67.2	-66.1	-18.6	0	0	111.1	S467 C530 M565	S467-Q526 WeakPolarHBondContact CB-O 3.07Å; S467-Q526 PolarHBondContact OG-O 3.19Å; Q526-C530 HydrophobicContact CB-CB 4.22Å; Q526-M565 HydrophobicContact CB-CE 3.77Å; Q526-M565 HydrophobicContact CG-CE 3.9Å; Q526-M565 HydrophobicContact CG-SD 4.04Å
527	P	87.1	Confident	89.3	Confident	33 Å²	33	33.1 Å²	33.1	21%	0.214	17%	0.165	C	C	.	.			trans	-63.3	149.4	170.5	28.2	-33.2	0	0	0	110.3	P464 D529 C530	P464-P527 HydrophobicContact CB-CB 4.46Å; P527-D529 PolarHBondContact O-N 3.43Å; P527-D529 VanDerWaalsContact O-N 3.11Å; P527-C530 WeakPolarHBondContact O-CB 3.34Å; P527-C530 PolarHBondContact O-N 2.74Å; P527-C530 VanDerWaalsContact O-N 3.16Å
528	P	88.5	Confident	89.4	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-57.9	-29.9	-173.7	17.6	-28.2	0	0	0	113.9	C530 I531 C623 C632 G633 W634	P528-C530 PolarHBondContact O-N 2.95Å; P528-I531 PolarHBondContact O-N 2.88Å; P528-I531 VanDerWaalsContact O-N 3.14Å; P528-C623 PolarHBondContact O-SG 2.99Å; P528-C632 HydrophobicContact CG-CB 3.92Å; P528-G633 WeakPolarHBondContact CB-O 3.44Å; P528-G633 VanDerWaalsContact CG-N 3.31Å; P528-W634 HydrophobicContact CB-CZ2 4.46Å
529	D	84	Confident	89.4	Confident	59 Å²	59	30.1 Å²	30.1	32%	0.316	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	-56.1	-24.2	179.6	-65.1	-37.1	0	0	0	114.1	P527 I531 S625 C632	P527-D529 PolarHBondContact O-N 3.43Å; P527-D529 VanDerWaalsContact O-N 3.11Å; D529-I531 VanDerWaalsContact C-N 3.31Å; D529-I531 PolarHBondContact O-N 2.86Å; D529-S625 WeakPolarHBondContact OD1-CB 3.46Å; D529-S625 PolarHBondContact OD1-OG 3.27Å; D529-C632 WeakPolarHBondContact OD1-CB 3.09Å; D529-C632 WeakPolarHBondContact OD2-CB 3.48Å
530	C	86	Confident	89.3	Confident	10 Å²	10	30 Å²	30	7%	0.068	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-69.2	-24.1	-178.9	-69.1	0	0	0	0	114.3	Q526 P527 P528 P562 V563 S564 M565	Q526-C530 HydrophobicContact CB-CB 4.22Å; P527-C530 WeakPolarHBondContact O-CB 3.34Å; P527-C530 PolarHBondContact O-N 2.74Å; P527-C530 VanDerWaalsContact O-N 3.16Å; P528-C530 PolarHBondContact O-N 2.95Å; C530-P562 WeakPolarHBondContact SG-CB 3.23Å; C530-V563 VanDerWaalsContact CB-O 3.25Å; C530-V563 WeakPolarHBondContact CB-O 3.11Å; C530-S564 WeakPolarHBondContact O-CA 3.32Å; C530-M565 HydrophobicContact CB-CE 4.35Å; C530-M565 PolarHBondContact O-N 2.65Å
531	I	85.5	Confident	89.3	Confident	5 Å²	5	27.9 Å²	27.9	3%	0.026	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-21.2	-170.9	-60.4	166.1	0	0	0	111.5	A523 P528 D529 R535 M565 W634	A523-I531 HydrophobicContact CB-CD1 3.61Å; P528-I531 PolarHBondContact O-N 2.88Å; P528-I531 VanDerWaalsContact O-N 3.14Å; D529-I531 VanDerWaalsContact C-N 3.31Å; D529-I531 PolarHBondContact O-N 2.86Å; I531-R535 HydrophobicContact CG2-CB 3.92Å; I531-R535 HydrophobicContact CG2-CG 4.2Å; I531-M565 WeakPolarHBondContact CA-O 3.41Å; I531-M565 HydrophobicContact CD1-CE 4.42Å; I531-M565 HydrophobicContact CG1-CE 3.82Å; I531-W634 HydrophobicContact CD1-CH2 3.43Å; I531-W634 VanDerWaalsContact CD1-CH2 3.43Å; I531-W634 HydrophobicContact CD1-CZ2 3.39Å
532	G	82.1	Confident	89.3	Confident	26 Å²	26	20 Å²	20	27%	0.268	11%	0.11	S	C	.	.			trans	94.4	154.5	-175	0	0	0	0	0	113.2	R534	G532-R534 PolarHBondContact O-N 2.93Å
533	Q	86	Confident	89.4	Confident	82 Å²	82	18.4 Å²	18.4	38%	0.383	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	134.2	-171.2	-169.4	179.8	32.6	0	0	112.5	R535 S625	Q533-R535 PolarHBondContact O-N 2.94Å; Q533-R535 VanDerWaalsContact O-N 3.09Å; Q533-S625 VanDerWaalsContact CD-O 3.3Å; Q533-S625 WeakPolarHBondContact CG-O 3.28Å; Q533-S625 PolarHBondContact NE2-O 2.97Å
534	R	90.6	Very high	89.5	Confident	42 Å²	42	18.8 Å²	18.8	16%	0.158	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	14.8	172	-66.2	148.7	175.6	-110.3	16.7	115.9	R349 E350 R352 G532 C623	R349-R534 CarbonylContact C-O 3.56Å; R349-R534 WeakPolarHBondContact CA-O 3.27Å; E350-R534 HydrophobicContact CB-CB 4.21Å; E350-R534 PolarHBondContact N-O 3.44Å; E350-R534 WeakPolarHBondContact O-CB 3.49Å; E350-R534 WeakPolarHBondContact O-CD 3.43Å; E350-R534 PolarHBondContact O-NH1 3.34Å; R352-R534 VanDerWaalsContact N-NH1 3.17Å; G532-R534 PolarHBondContact O-N 2.93Å; R534-C623 WeakPolarHBondContact CA-O 3.37Å; R534-C623 PolarHBondContact N-O 3.27Å
535	R	92	Very high	89.4	Confident	32 Å²	32	19.5 Å²	19.5	12%	0.121	10%	0.104	C	C	.	.	B	Isolated β-bridge	trans	-60.1	138.1	170.4	-78.8	-88.8	-165.3	176.7	3.8	110.5	I531 Q533 I567 V622 C623	I531-R535 HydrophobicContact CG2-CB 3.92Å; I531-R535 HydrophobicContact CG2-CG 4.2Å; Q533-R535 PolarHBondContact O-N 2.94Å; Q533-R535 VanDerWaalsContact O-N 3.09Å; R535-I567 PolarHBondContact NH1-O 3.43Å; R535-V622 WeakPolarHBondContact O-CA 3.3Å; R535-C623 HydrophobicContact CB-CB 4.44Å; R535-C623 PolarHBondContact O-N 2.89Å
536	I	95	Very high	89.2	Confident	4 Å²	4	18.9 Å²	18.9	2%	0.021	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	132.3	179.9	-55.4	177.4	0	0	0	109.4	H348 E350 I372 P571 L620 L621 V622	H348-I536 PolarHBondContact O-N 3.4Å; E350-I536 HydrophobicContact CB-CD1 4.42Å; I372-I536 HydrophobicContact CB-CD1 4.41Å; I372-I536 HydrophobicContact CD1-CD1 4.16Å; I372-I536 HydrophobicContact CG1-CD1 4.07Å; I372-I536 HydrophobicContact CG2-CD1 3.57Å; I536-P571 HydrophobicContact CB-CB 4.38Å; I536-P571 HydrophobicContact CB-CG 4.09Å; I536-P571 HydrophobicContact CG2-CB 3.93Å; I536-P571 HydrophobicContact CG2-CG 3.99Å; I536-L620 HydrophobicContact CG2-CB 4.36Å; I536-L620 HydrophobicContact CG2-CD2 4.03Å; I536-L621 CarbonylContact C-O 3.56Å; I536-L621 WeakPolarHBondContact CA-O 3.26Å; I536-V622 HydrophobicContact CG1-CG1 4.5Å; I536-V622 HydrophobicContact CG1-CG2 4.26Å
537	L	94.5	Very high	88.8	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	128.9	169.3	-60.2	175.7	0	0	0	109.6	F518 W519 A523 I567 L620 L621 W634	F518-L537 HydrophobicContact CD1-CD1 4.2Å; F518-L537 HydrophobicContact CD1-CD2 3.79Å; F518-L537 HydrophobicContact CE1-CD1 4.21Å; F518-L537 HydrophobicContact CE1-CD2 3.99Å; W519-L537 HydrophobicContact CE3-CD1 4.05Å; A523-L537 HydrophobicContact CB-CD1 4.02Å; L537-I567 HydrophobicContact CD2-CG2 3.87Å; L537-L620 WeakPolarHBondContact O-CA 3.31Å; L537-L621 HydrophobicContact CB-CB 4.31Å; L537-L621 PolarHBondContact N-O 2.89Å; L537-L621 PolarHBondContact O-N 2.9Å; L537-W634 HydrophobicContact CD1-CH2 3.7Å; L537-W634 HydrophobicContact CD1-CZ3 4.13Å
538	S	94.2	Very high	88.5	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	134.7	168.5	54.5	0	0	0	0	110.7	H515 P571 F572	H515-S538 WeakPolarHBondContact CB-O 3.44Å; H515-S538 PolarHBondContact ND1-N 2.67Å; S538-P571 WeakPolarHBondContact OG-CA 3.43Å; S538-F572 WeakPolarHBondContact CB-O 3.47Å; S538-F572 PolarHBondContact OG-O 3.43Å
539	L	93.9	Very high	88	Confident	1 Å²	1	23.5 Å²	23.5	1%	0.005	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	152	175.6	-61.6	175.5	0	0	0	109.9	L474 V476 V516 W519 L619 L621	L474-L539 HydrophobicContact CD1-CD1 4.33Å; V476-L539 HydrophobicContact CG1-CB 4.31Å; V476-L539 HydrophobicContact CG1-CD2 4.39Å; V516-L539 HydrophobicContact CG2-CD2 4.24Å; W519-L539 HydrophobicContact CB-CD1 4.44Å; W519-L539 HydrophobicContact CB-CD2 3.7Å; W519-L539 HydrophobicContact CD2-CD1 3.77Å; W519-L539 HydrophobicContact CE3-CD1 4.18Å; W519-L539 HydrophobicContact CG-CD1 3.88Å; W519-L539 HydrophobicContact CG-CD2 3.96Å; L539-L619 PolarHBondContact N-O 3.34Å; L539-L619 PolarHBondContact O-N 2.96Å; L539-L621 HydrophobicContact CD1-CD1 3.41Å; L539-L621 VanDerWaalsContact CD1-CD1 3.41Å; L539-L621 HydrophobicContact CD1-CG 4.01Å; L539-L621 HydrophobicContact CG-CD1 4.46Å
540	L	91.9	Very high	87.8	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	108.5	169.1	-85.3	157	0	0	0	108.6	V476 M479 F498 L512 P574 L616 I617 P618	V476-L540 WeakPolarHBondContact CG1-O 3.39Å; M479-L540 HydrophobicContact CE-CB 4.02Å; M479-L540 HydrophobicContact CE-CD1 3.4Å; M479-L540 HydrophobicContact CE-CG 4.35Å; M479-L540 HydrophobicContact CG-CB 3.92Å; M479-L540 HydrophobicContact SD-CB 3.76Å; M479-L540 HydrophobicContact SD-CD1 4.04Å; F498-L540 HydrophobicContact CD2-CD1 3.9Å; F498-L540 HydrophobicContact CE2-CD1 3.51Å; F498-L540 HydrophobicContact CZ-CD1 4.32Å; L512-L540 HydrophobicContact CD1-CD1 4.29Å; L512-L540 HydrophobicContact CD2-CD1 3.72Å; L540-P574 HydrophobicContact CD1-CG 4.04Å; L540-P574 HydrophobicContact CD2-CG 4.14Å; L540-L616 HydrophobicContact CD2-CB 4.01Å; L540-I617 WeakPolarHBondContact CA-O 3.4Å; L540-P618 HydrophobicContact CD2-CB 3.75Å
541	C	91.8	Very high	87.7	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	143.5	-173.5	-179.7	0	0	0	0	110.3	L474 D475 I617 L619	L474-C541 WeakPolarHBondContact CA-SG 3.43Å; L474-C541 HydrophobicContact CD2-CB 4.38Å; D475-C541 PolarHBondContact N-SG 3.07Å; D475-C541 VanDerWaalsContact N-SG 3.43Å; D475-C541 WeakPolarHBondContact O-CA 3.41Å; C541-I617 PolarHBondContact N-O 3.2Å; C541-I617 PolarHBondContact O-N 3.09Å; C541-L619 HydrophobicContact CB-CD1 3.64Å; C541-L619 HydrophobicContact CB-CG 4.44Å
542	S	89.8	Confident	87.8	Confident	10 Å²	10	38.6 Å²	38.6	7%	0.07	19%	0.192	C	C	.	.			trans	-66.8	166.9	167.7	66.8	0	0	0	0	111.3	D475 P544	D475-S542 PolarHBondContact O-N 3.37Å; D475-S542 PolarHBondContact O-OG 2.97Å; S542-P544 VanDerWaalsContact O-CD 3.3Å; S542-P544 WeakPolarHBondContact O-CD 3.45Å
543	D	89.8	Confident	87.9	Confident	6 Å²	6	45.5 Å²	45.5	3%	0.032	21%	0.21	C	C	.	.			trans	-59.3	114.5	178	179.4	-3.9	0	0	0	110.7	R545 I546 I617 W642	D543-R545 PolarHBondContact O-N 3.16Å; D543-R545 WeakPolarHBondContact OD1-CB 3.35Å; D543-R545 VanDerWaalsContact OD1-CG 3.23Å; D543-R545 WeakPolarHBondContact OD1-CG 3.47Å; D543-R545 IonicContact OD1-CZ 2.92Å; D543-R545 PolarHBondContact OD1-N 3.09Å; D543-R545 IonicContact OD1-NE 2.8Å; D543-R545 PolarHBondContact OD1-NE 3.34Å; D543-R545 IonicContact OD1-NH2 3.11Å; D543-R545 IonicContact OD2-CZ 3.9Å; D543-R545 IonicContact OD2-NE 2.99Å; D543-R545 PolarHBondContact OD2-NE 3.26Å; D543-R545 IonicContact OD2-NH2 3.89Å; D543-R545 PolarHBondContact OD2-NH2 2.94Å; D543-I546 HydrophobicContact CB-CD1 3.87Å; D543-I546 HydrophobicContact CB-CG1 4.02Å; D543-I546 PolarHBondContact O-N 2.87Å; D543-I617 HydrophobicContact CB-CD1 4.45Å; D543-W642 HydrophobicContact CB-CH2 4.35Å; D543-W642 HydrophobicContact CB-CZ3 3.99Å; D543-W642 VanDerWaalsContact CG-CZ3 3.44Å; D543-W642 WeakPolarHBondContact OD2-CZ3 3.43Å
544	P	90.7	Very high	87.8	Confident	8 Å²	8	47.9 Å²	47.9	5%	0.052	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-12.5	-175.4	31.1	-40.4	0	0	0	111.7	V473 S542 I548 A645 F646 A649	V473-P544 HydrophobicContact CG1-CB 4.22Å; S542-P544 VanDerWaalsContact O-CD 3.3Å; S542-P544 WeakPolarHBondContact O-CD 3.45Å; P544-I548 WeakPolarHBondContact O-CG1 3.42Å; P544-A645 HydrophobicContact CG-CB 4.02Å; P544-F646 HydrophobicContact CB-CD1 4.09Å; P544-F646 HydrophobicContact CB-CE1 4.11Å; P544-F646 HydrophobicContact CG-CD1 3.63Å; P544-F646 HydrophobicContact CG-CE1 3.63Å; P544-F646 HydrophobicContact CG-CG 4.08Å; P544-F646 HydrophobicContact CG-CZ 4.11Å; P544-A649 HydrophobicContact CB-CB 3.91Å
545	R	88	Confident	87.5	Confident	16 Å²	16	46.1 Å²	46.1	6%	0.06	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-34.9	173.4	-62.1	174.9	-66.2	168.8	4.2	111.4	D543 D547 L589 I594 R598 A645	D543-R545 PolarHBondContact O-N 3.16Å; D543-R545 WeakPolarHBondContact OD1-CB 3.35Å; D543-R545 VanDerWaalsContact OD1-CG 3.23Å; D543-R545 WeakPolarHBondContact OD1-CG 3.47Å; D543-R545 IonicContact OD1-CZ 2.92Å; D543-R545 PolarHBondContact OD1-N 3.09Å; D543-R545 IonicContact OD1-NE 2.8Å; D543-R545 PolarHBondContact OD1-NE 3.34Å; D543-R545 IonicContact OD1-NH2 3.11Å; D543-R545 IonicContact OD2-CZ 3.9Å; D543-R545 IonicContact OD2-NE 2.99Å; D543-R545 PolarHBondContact OD2-NE 3.26Å; D543-R545 IonicContact OD2-NH2 3.89Å; D543-R545 PolarHBondContact OD2-NH2 2.94Å; R545-D547 PolarHBondContact O-N 3.09Å; R545-L589 PolarHBondContact NH1-O 3.14Å; R545-L589 PolarHBondContact NH2-O 3.09Å; R545-L589 VanDerWaalsContact NH2-O 3.11Å; R545-I594 HydrophobicContact CB-CD1 4.16Å; R545-I594 VanDerWaalsContact CZ-CD1 3.42Å; R545-R598 PolarHBondContact O-NH2 2.97Å; R545-A645 HydrophobicContact CG-CB 3.69Å
546	I	84.7	Confident	86.9	Confident	40 Å²	40	47.9 Å²	47.9	21%	0.205	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-52.3	-169.4	-61	172.7	0	0	0	110	D543 I548 R598 V608 L610	D543-I546 HydrophobicContact CB-CD1 3.87Å; D543-I546 HydrophobicContact CB-CG1 4.02Å; D543-I546 PolarHBondContact O-N 2.87Å; I546-I548 PolarHBondContact O-N 2.91Å; I546-R598 PolarHBondContact O-NE 3.2Å; I546-V608 HydrophobicContact CG2-CB 4.17Å; I546-L610 HydrophobicContact CD1-CD1 3.74Å; I546-L610 HydrophobicContact CG1-CD1 3.75Å; I546-L610 HydrophobicContact CG2-CD1 4.43Å
547	D	79.1	Confident	85.9	Confident	64 Å²	64	54.4 Å²	54.4	34%	0.342	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	29.7	-172.7	-73.8	-8.9	0	0	0	114.5	R545 A549 S607	R545-D547 PolarHBondContact O-N 3.09Å; D547-A549 PolarHBondContact O-N 2.52Å; D547-A549 VanDerWaalsContact O-N 3.09Å; D547-S607 PolarHBondContact OD1-OG 3.28Å; D547-S607 PolarHBondContact OD2-OG 3.05Å
548	I	79.6	Confident	84.7	Confident	23 Å²	23	59.2 Å²	59.2	12%	0.118	30%	0.3	C	S	.	.			trans	-63.9	115.6	178.1	-64	-176.6	0	0	0	111.8	P544 I546 Y550 A649 Y652	P544-I548 WeakPolarHBondContact O-CG1 3.42Å; I546-I548 PolarHBondContact O-N 2.91Å; I548-Y550 HydrophobicContact CB-CE2 4.5Å; I548-Y550 HydrophobicContact CG2-CD1 4.21Å; I548-Y550 HydrophobicContact CG2-CE1 4.07Å; I548-Y550 HydrophobicContact CG2-CE2 4.4Å; I548-Y550 HydrophobicContact CG2-CG 4.43Å; I548-Y550 PolarHBondContact O-N 3.19Å; I548-A649 HydrophobicContact CD1-CB 4.3Å; I548-A649 HydrophobicContact CG1-CB 4.3Å; I548-Y652 HydrophobicContact CG2-CD2 3.94Å; I548-Y652 HydrophobicContact CG2-CG 4.23Å
549	A	78.6	Confident	83.4	Confident	65 Å²	65	68.7 Å²	68.7	54%	0.537	34%	0.344	S	S	.	.			trans	-74.8	99.9	164.8	0	0	0	0	0	111.5	D547 K551	D547-A549 PolarHBondContact O-N 2.52Å; D547-A549 VanDerWaalsContact O-N 3.09Å; A549-K551 PolarHBondContact O-N 2.99Å; A549-K551 VanDerWaalsContact O-N 3.16Å
550	Y	80.7	Confident	82.2	Confident	115 Å²	115	72.2 Å²	72.2	45%	0.451	36%	0.362	S	S	.	.			trans	-66.5	-15.5	177.1	-69.2	-75.8	0	0	0	114.5	I548 R598 Y652	I548-Y550 HydrophobicContact CB-CE2 4.5Å; I548-Y550 HydrophobicContact CG2-CD1 4.21Å; I548-Y550 HydrophobicContact CG2-CE1 4.07Å; I548-Y550 HydrophobicContact CG2-CE2 4.4Å; I548-Y550 HydrophobicContact CG2-CG 4.43Å; I548-Y550 PolarHBondContact O-N 3.19Å; Y550-R598 PolarHBondContact OH-NH1 3.35Å; Y550-R598 PolarHBondContact OH-NH2 2.9Å; Y550-Y652 HydrophobicContact CD1-CE1 4Å; Y550-Y652 HydrophobicContact CD1-CE2 4.04Å; Y550-Y652 AromaticContact CD1-CZ 3.74Å; Y550-Y652 HydrophobicContact CE1-CE2 4.14Å
551	K	83.7	Confident	81.3	Confident	154 Å²	154	81.1 Å²	81.1	67%	0.67	40%	0.401	S	S	*	.	S	Bend	trans	-89.1	110.6	172.5	-173.6	-179.3	179.3	-172.7	0	108.6	A549 R553	A549-K551 PolarHBondContact O-N 2.99Å; A549-K551 VanDerWaalsContact O-N 3.16Å; K551-R553 PolarHBondContact O-N 2.93Å
552	K	86.6	Confident	80.4	Confident	123 Å²	123	85.9 Å²	85.9	54%	0.535	43%	0.432	S	S	.	.			trans	-58.3	116.5	172.4	-62.4	-159.6	179	-140.6	0	110	Q651 Y652 T654	K552-Q651 PolarHBondContact NZ-O 3.37Å; K552-Y652 HydrophobicContact CG-CD1 4.47Å; K552-T654 HydrophobicContact CB-CG2 3.92Å
553	R	84.4	Confident	79.9	Confident	171 Å²	171	89.5 Å²	89.5	65%	0.645	45%	0.453	S	S	*	.			trans	-115.7	130.1	172.3	-64.8	-176.5	-172.2	-169	1.9	107.5	K551 T654	K551-R553 PolarHBondContact O-N 2.93Å; R553-T654 WeakPolarHBondContact O-CG2 3.46Å
554	L	85.5	Confident	79.4	Confident	131 Å²	131	94.7 Å²	94.7	69%	0.686	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-72.6	141.9	173.9	-72.9	161.6	0	0	0	108.6
555	P	83.4	Confident	79	Confident	6 Å²	6	95.5 Å²	95.5	4%	0.039	49%	0.494	C	S	.	.	P	Polyproline II helix	trans	-60.1	136.7	169.6	-16.5	28.6	0	0	0	109.7	K465 F468 I469	K465-P555 HydrophobicContact CD-CB 4.19Å; K465-P555 HydrophobicContact CD-CG 4.16Å; K465-P555 PolarHBondContact NZ-O 3.1Å; K465-P555 VanDerWaalsContact NZ-O 3.17Å; F468-P555 HydrophobicContact CB-CB 4.02Å; F468-P555 HydrophobicContact CB-CG 4.44Å; I469-P555 HydrophobicContact CG1-CG 3.99Å
556	A	79.4	Confident	78.7	Confident	69 Å²	69	98.3 Å²	98.3	57%	0.57	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-56	142.6	176.8	0	0	0	0	0	110.6	I558	A556-I558 VanDerWaalsContact C-N 3.31Å; A556-I558 HydrophobicContact CB-CD1 4.3Å; A556-I558 HydrophobicContact CB-CG1 3.92Å; A556-I558 PolarHBondContact O-N 2.99Å; A556-I558 VanDerWaalsContact O-N 3.08Å
557	D	73.2	Confident	78.7	Confident	140 Å²	140	96.8 Å²	96.8	75%	0.749	51%	0.507	S	S	*	.			trans	-79.1	85.1	171.7	-66.4	-39	0	0	0	107.5	K465	K465-D557 IonicContact NZ-OD1 3.69Å; K465-D557 PolarHBondContact NZ-OD1 2.82Å
558	I	70.6	Confident	79	Confident	102 Å²	102	99.9 Å²	99.9	52%	0.523	52%	0.524	S	S	.	.			trans	-100.8	110.2	173.1	-48.1	176.8	0	0	0	106.8	A556 L560	A556-I558 VanDerWaalsContact C-N 3.31Å; A556-I558 HydrophobicContact CB-CD1 4.3Å; A556-I558 HydrophobicContact CB-CG1 3.92Å; A556-I558 PolarHBondContact O-N 2.99Å; A556-I558 VanDerWaalsContact O-N 3.08Å; I558-L560 VanDerWaalsContact C-N 3.34Å; I558-L560 HydrophobicContact CB-CG 4.41Å; I558-L560 HydrophobicContact CG2-CD1 4.27Å; I558-L560 HydrophobicContact CG2-CD2 3.86Å; I558-L560 HydrophobicContact CG2-CG 3.7Å; I558-L560 PolarHBondContact O-N 3.05Å
559	E	65.7	Low	79.5	Confident	198 Å²	198	102.8 Å²	102.8	93%	0.925	54%	0.537	S	S	*	.			trans	-76.3	87	172.2	-66.1	-173.6	174.8	0	0	108.7
560	L	68.9	Low	80	Confident	75 Å²	75	100 Å²	100	39%	0.393	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-87.8	136.8	173.1	-67.2	168.2	0	0	0	109.5	L525 I558	L525-L560 WeakPolarHBondContact O-CD1 3.32Å; I558-L560 VanDerWaalsContact C-N 3.34Å; I558-L560 HydrophobicContact CB-CG 4.41Å; I558-L560 HydrophobicContact CG2-CD1 4.27Å; I558-L560 HydrophobicContact CG2-CD2 3.86Å; I558-L560 HydrophobicContact CG2-CG 3.7Å; I558-L560 PolarHBondContact O-N 3.05Å
561	K	73.5	Confident	80.5	Confident	187 Å²	187	94.6 Å²	94.6	81%	0.813	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-64	126.1	168	-72.7	-175.7	178.7	179.9	0	108	V563	K561-V563 PolarHBondContact O-N 3.07Å
562	P	72.1	Confident	80.8	Confident	101 Å²	101	88.7 Å²	88.7	66%	0.656	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-65.6	123.7	180	26.4	-32.5	0	0	0	109.3	C530	C530-P562 WeakPolarHBondContact SG-CB 3.23Å
563	V	79.8	Confident	81	Confident	86 Å²	86	83.2 Å²	83.2	52%	0.521	44%	0.444	S	S	.	.			trans	-108.1	127	175	178.3	0	0	0	0	107	C530 K561 M565	C530-V563 VanDerWaalsContact CB-O 3.25Å; C530-V563 WeakPolarHBondContact CB-O 3.11Å; K561-V563 PolarHBondContact O-N 3.07Å; V563-M565 HydrophobicContact CG1-CG 4.49Å; V563-M565 WeakPolarHBondContact O-CG 3.49Å; V563-M565 PolarHBondContact O-N 3.19Å
564	S	80.4	Confident	81.3	Confident	114 Å²	114	75.1 Å²	75.1	80%	0.797	41%	0.413	S	S	*	.			trans	-66	130.4	173.4	-173.4	0	0	0	0	109.5	C530	C530-S564 WeakPolarHBondContact O-CA 3.32Å
565	M	82	Confident	81.7	Confident	26 Å²	26	68.9 Å²	68.9	13%	0.128	38%	0.381	C	S	.	.			trans	-130.1	143.5	-176.2	-56.9	-179	-52.1	0	0	110	F518 S522 Q526 C530 I531 V563	F518-M565 HydrophobicContact CE2-CB 3.99Å; F518-M565 HydrophobicContact CZ-CB 3.88Å; F518-M565 HydrophobicContact CZ-CE 4.49Å; S522-M565 VanDerWaalsContact CB-SD 3.59Å; Q526-M565 HydrophobicContact CB-CE 3.77Å; Q526-M565 HydrophobicContact CG-CE 3.9Å; Q526-M565 HydrophobicContact CG-SD 4.04Å; C530-M565 HydrophobicContact CB-CE 4.35Å; C530-M565 PolarHBondContact O-N 2.65Å; I531-M565 WeakPolarHBondContact CA-O 3.41Å; I531-M565 HydrophobicContact CD1-CE 4.42Å; I531-M565 HydrophobicContact CG1-CE 3.82Å; V563-M565 HydrophobicContact CG1-CG 4.49Å; V563-M565 WeakPolarHBondContact O-CG 3.49Å; V563-M565 PolarHBondContact O-N 3.19Å
566	S	80.5	Confident	82	Confident	74 Å²	74	68.9 Å²	68.9	52%	0.517	38%	0.38	S	S	.	.			trans	-141	148.8	174	56.2	0	0	0	0	110.7
567	I	84.5	Confident	82.5	Confident	8 Å²	8	68.4 Å²	68.4	4%	0.041	37%	0.366	C	S	.	.			trans	-113	138.2	169.2	-166.9	166.3	0	0	0	108.5	H515 F518 R535 L537 E569	H515-I567 HydrophobicContact CB-CD1 4.23Å; H515-I567 WeakPolarHBondContact CD2-CD1 3.48Å; F518-I567 HydrophobicContact CB-CD1 3.74Å; F518-I567 HydrophobicContact CD1-CB 4.25Å; F518-I567 HydrophobicContact CD1-CD1 4.15Å; F518-I567 HydrophobicContact CE1-CB 4.36Å; F518-I567 HydrophobicContact CG-CB 4.33Å; F518-I567 HydrophobicContact CG-CD1 3.98Å; R535-I567 PolarHBondContact NH1-O 3.43Å; L537-I567 HydrophobicContact CD2-CG2 3.87Å; I567-E569 HydrophobicContact CG1-CB 4.32Å; I567-E569 WeakPolarHBondContact CG1-OE2 3.36Å
568	N	85.7	Confident	83.2	Confident	130 Å²	130	64.4 Å²	64.4	70%	0.695	34%	0.343	S	S	*	.			trans	-101.1	-18.6	-177.7	-71.6	-16	0	0	0	111.9	H348	H348-N568 PolarHBondContact CE1-O 2.96Å
569	E	89.5	Confident	84	Confident	83 Å²	83	64.3 Å²	64.3	39%	0.388	34%	0.341	S	S	.	.	S	Bend	trans	-70	155.6	176.8	-62.6	85.6	170.6	0	0	111.9	H348 P511 A514 H515 I567	H348-E569 PolarHBondContact CE1-O 3.46Å; H348-E569 PolarHBondContact ND1-O 3.17Å; P511-E569 HydrophobicContact CB-CB 4.23Å; A514-E569 HydrophobicContact CB-CB 4.12Å; A514-E569 HydrophobicContact CB-CG 3.6Å; H515-E569 PolarHBondContact NE2-O 3.11Å; H515-E569 VanDerWaalsContact NE2-O 3.09Å; I567-E569 HydrophobicContact CG1-CB 4.32Å; I567-E569 WeakPolarHBondContact CG1-OE2 3.36Å
570	L	89.7	Confident	85.2	Confident	6 Å²	6	55.7 Å²	55.7	3%	0.031	30%	0.3	C	S	.	.			trans	-85.7	140	-179.8	-76.7	178.7	0	0	0	112.1	R346 H348 P375 C376 D377 P511 H515 F572	R346-L570 HydrophobicContact CB-CD2 4.15Å; R346-L570 WeakPolarHBondContact O-CD2 3.43Å; H348-L570 WeakPolarHBondContact CE1-CD2 3.16Å; H348-L570 WeakPolarHBondContact NE2-CD2 3.34Å; P375-L570 HydrophobicContact CB-CB 3.94Å; P375-L570 HydrophobicContact CB-CD1 4.22Å; P375-L570 HydrophobicContact CB-CD2 4.18Å; P375-L570 HydrophobicContact CB-CG 4.38Å; C376-L570 VanDerWaalsContact C-CD1 3.47Å; D377-L570 HydrophobicContact CB-CD1 4.42Å; D377-L570 WeakPolarHBondContact OD1-CD1 3.42Å; P511-L570 VanDerWaalsContact CB-O 3.32Å; P511-L570 WeakPolarHBondContact CB-O 3.42Å; H515-L570 PolarHBondContact NE2-O 3.22Å; L570-F572 HydrophobicContact CB-CD2 3.79Å; L570-F572 HydrophobicContact CB-CE2 3.53Å; L570-F572 HydrophobicContact CB-CZ 4.25Å; L570-F572 HydrophobicContact CD1-CE2 3.81Å; L570-F572 HydrophobicContact CD1-CZ 3.86Å; L570-F572 HydrophobicContact CG-CE2 4.32Å; L570-F572 PolarHBondContact O-N 2.93Å
571	P	91.5	Very high	86.1	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.013	29%	0.285	C	S	.	.			trans	-79.2	59	-177.6	33.2	-36.5	0	0	0	112.7	G347 H515 I536 S538 S573	G347-P571 WeakPolarHBondContact O-CG 3.17Å; H515-P571 VanDerWaalsContact CE1-CA 3.48Å; H515-P571 WeakPolarHBondContact CE1-CA 3.36Å; I536-P571 HydrophobicContact CB-CB 4.38Å; I536-P571 HydrophobicContact CB-CG 4.09Å; I536-P571 HydrophobicContact CG2-CB 3.93Å; I536-P571 HydrophobicContact CG2-CG 3.99Å; S538-P571 WeakPolarHBondContact OG-CA 3.43Å; P571-S573 PolarHBondContact O-N 3.5Å
572	F	90	Very high	86.7	Confident	31 Å²	31	45.5 Å²	45.5	14%	0.136	25%	0.254	C	S	.	.			trans	-60.9	137	173.4	-70.5	-76.4	0	0	0	110.5	P375 P511 S538 L570	P375-F572 HydrophobicContact CB-CD1 3.99Å; P375-F572 HydrophobicContact CB-CE1 3.87Å; P375-F572 HydrophobicContact CB-CG 4.35Å; P375-F572 HydrophobicContact CB-CZ 4.15Å; P375-F572 HydrophobicContact CG-CD1 3.59Å; P375-F572 HydrophobicContact CG-CE1 3.9Å; P375-F572 HydrophobicContact CG-CG 4.05Å; P375-F572 WeakPolarHBondContact O-CE1 3.33Å; P511-F572 HydrophobicContact CB-CD2 3.89Å; P511-F572 HydrophobicContact CG-CD2 3.89Å; P511-F572 HydrophobicContact CG-CE2 4.21Å; S538-F572 WeakPolarHBondContact CB-O 3.47Å; S538-F572 PolarHBondContact OG-O 3.43Å; L570-F572 HydrophobicContact CB-CD2 3.79Å; L570-F572 HydrophobicContact CB-CE2 3.53Å; L570-F572 HydrophobicContact CB-CZ 4.25Å; L570-F572 HydrophobicContact CD1-CE2 3.81Å; L570-F572 HydrophobicContact CD1-CZ 3.86Å; L570-F572 HydrophobicContact CG-CE2 4.32Å; L570-F572 PolarHBondContact O-N 2.93Å
573	S	90.4	Very high	87.5	Confident	8 Å²	8	42.1 Å²	42.1	6%	0.056	23%	0.23	C	C	.	.			trans	-151.4	150.3	178.9	66.9	0	0	0	0	112.6	P571 I575	P571-S573 PolarHBondContact O-N 3.5Å; S573-I575 PolarHBondContact O-N 2.76Å; S573-I575 VanDerWaalsContact O-N 3.13Å; S573-I575 WeakPolarHBondContact OG-CG2 3.36Å
574	P	91.4	Very high	88	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-65.8	-11.1	175.1	-18.9	28.7	0	0	0	114.5	W501 L540 W576 Q577 Y580 P618	W501-P574 HydrophobicContact CD2-CB 4.05Å; W501-P574 HydrophobicContact CD2-CG 3.66Å; W501-P574 HydrophobicContact CE3-CG 3.86Å; W501-P574 HydrophobicContact CG-CB 4.15Å; W501-P574 HydrophobicContact CG-CG 4.21Å; W501-P574 HydrophobicContact CH2-CG 4.08Å; W501-P574 HydrophobicContact CZ2-CB 4.4Å; W501-P574 HydrophobicContact CZ2-CG 3.89Å; W501-P574 HydrophobicContact CZ3-CG 4.06Å; L540-P574 HydrophobicContact CD1-CG 4.04Å; L540-P574 HydrophobicContact CD2-CG 4.14Å; P574-W576 PolarHBondContact O-N 3.08Å; P574-Q577 PolarHBondContact O-N 2.86Å; P574-Y580 HydrophobicContact CB-CD1 3.75Å; P574-Y580 HydrophobicContact CB-CD2 3.91Å; P574-Y580 HydrophobicContact CB-CE1 3.79Å; P574-Y580 HydrophobicContact CB-CE2 3.92Å; P574-Y580 HydrophobicContact CB-CG 3.82Å; P574-Y580 HydrophobicContact CG-CE1 4.47Å; P574-Y580 HydrophobicContact CG-CE2 4.4Å; P574-P618 HydrophobicContact CB-CB 4.3Å; P574-P618 HydrophobicContact CB-CG 4.49Å; P574-P618 HydrophobicContact CG-CB 4.34Å
575	I	92.6	Very high	88.3	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-65.1	-24.2	-171.9	-155.5	172.3	0	0	0	113.2	W388 M456 S573 Q577 R581 P618 L620 I637	W388-I575 HydrophobicContact CH2-CB 4.46Å; W388-I575 HydrophobicContact CH2-CG1 4.3Å; W388-I575 HydrophobicContact CH2-CG2 3.76Å; W388-I575 HydrophobicContact CZ3-CG2 4.1Å; M456-I575 HydrophobicContact CE-CD1 3.48Å; M456-I575 VanDerWaalsContact CE-CD1 3.48Å; M456-I575 HydrophobicContact CE-CG1 3.76Å; M456-I575 HydrophobicContact SD-CD1 4.43Å; M456-I575 HydrophobicContact SD-CG1 4.26Å; S573-I575 PolarHBondContact O-N 2.76Å; S573-I575 VanDerWaalsContact O-N 3.13Å; S573-I575 WeakPolarHBondContact OG-CG2 3.36Å; I575-Q577 PolarHBondContact O-N 3.13Å; I575-R581 VanDerWaalsContact O-CD 3.29Å; I575-R581 WeakPolarHBondContact O-CD 3.49Å; I575-R581 PolarHBondContact O-NE 2.88Å; I575-P618 HydrophobicContact CB-CB 3.99Å; I575-P618 HydrophobicContact CB-CG 4.05Å; I575-P618 HydrophobicContact CG1-CG 4.25Å; I575-L620 HydrophobicContact CG2-CD1 3.8Å; I575-L620 HydrophobicContact CG2-CG 3.99Å; I575-I637 HydrophobicContact CD1-CG2 4.24Å
576	W	91	Very high	88.4	Confident	7 Å²	7	39.3 Å²	39.3	3%	0.027	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-67.8	-20.6	176.2	-63.1	102.9	0	0	0	112.9	I372 E374 K386 W388 P574	I372-W576 HydrophobicContact CB-CH2 4.34Å; I372-W576 HydrophobicContact CG2-CH2 3.87Å; I372-W576 HydrophobicContact CG2-CZ2 3.85Å; E374-W576 HydrophobicContact CB-CD2 4.39Å; E374-W576 HydrophobicContact CB-CE3 4.23Å; E374-W576 HydrophobicContact CB-CH2 4.32Å; E374-W576 HydrophobicContact CB-CZ2 4.47Å; E374-W576 HydrophobicContact CB-CZ3 4.18Å; E374-W576 HydrophobicContact CG-CD2 4.28Å; E374-W576 HydrophobicContact CG-CE3 4.47Å; K386-W576 HydrophobicContact CB-CE3 4.46Å; K386-W576 HydrophobicContact CB-CZ3 4.49Å; W388-W576 HydrophobicContact CB-CH2 4.3Å; W388-W576 HydrophobicContact CB-CZ3 4.18Å; W388-W576 AromaticContact CD1-CZ3 3.55Å; W388-W576 AromaticContact CD2-CE3 3.71Å; W388-W576 HydrophobicContact CD2-CE3 3.71Å; W388-W576 AromaticContact CD2-CH2 3.65Å; W388-W576 HydrophobicContact CD2-CH2 3.65Å; W388-W576 HydrophobicContact CD2-CZ2 4.48Å; W388-W576 AromaticContact CD2-CZ3 3.21Å; W388-W576 HydrophobicContact CD2-CZ3 3.21Å; W388-W576 AromaticContact CE2-CE3 3.32Å; W388-W576 AromaticContact CE2-CZ3 3.33Å; W388-W576 HydrophobicContact CE3-CE3 4.17Å; W388-W576 AromaticContact CE3-CH2 3.72Å; W388-W576 HydrophobicContact CE3-CH2 3.72Å; W388-W576 HydrophobicContact CE3-CZ2 4.17Å; W388-W576 AromaticContact CE3-CZ3 3.73Å; W388-W576 HydrophobicContact CE3-CZ3 3.73Å; W388-W576 HydrophobicContact CG-CE3 4.24Å; W388-W576 AromaticContact CG-CH2 3.9Å; W388-W576 HydrophobicContact CG-CH2 3.9Å; W388-W576 AromaticContact CG-CZ3 3.4Å; W388-W576 HydrophobicContact CG-CZ3 3.4Å; W388-W576 VanDerWaalsContact CG-CZ3 3.4Å; W388-W576 HydrophobicContact CH2-CD2 4.06Å; W388-W576 HydrophobicContact CH2-CE3 4Å; W388-W576 HydrophobicContact CH2-CZ3 4.4Å; W388-W576 AromaticContact CZ2-CD2 3.97Å; W388-W576 HydrophobicContact CZ2-CD2 3.97Å; W388-W576 AromaticContact CZ2-CE3 3.51Å; W388-W576 HydrophobicContact CZ2-CE3 3.51Å; W388-W576 AromaticContact CZ2-CZ3 3.97Å; W388-W576 HydrophobicContact CZ2-CZ3 3.97Å; W388-W576 HydrophobicContact CZ3-CD2 4.37Å; W388-W576 HydrophobicContact CZ3-CE3 4.3Å; W388-W576 HydrophobicContact CZ3-CH2 4.31Å; W388-W576 HydrophobicContact CZ3-CZ2 4.37Å; W388-W576 HydrophobicContact CZ3-CZ3 4.29Å; W388-W576 AromaticContact NE1-CE3 3.62Å; W388-W576 AromaticContact NE1-CZ3 3.52Å; P574-W576 PolarHBondContact O-N 3.08Å
577	Q	89.9	Confident	88.7	Confident	58 Å²	58	39.5 Å²	39.5	27%	0.271	18%	0.184	S	C	.	.			trans	-89.7	116.5	-178.7	-58.3	-58.4	-19.1	0	0	111	F505 P574 I575 M579 Y580 R581	F505-Q577 HydrophobicContact CE2-CG 4.28Å; P574-Q577 PolarHBondContact O-N 2.86Å; I575-Q577 PolarHBondContact O-N 3.13Å; Q577-M579 VanDerWaalsContact C-N 3.35Å; Q577-M579 PolarHBondContact O-N 3.01Å; Q577-Y580 PolarHBondContact O-N 2.7Å; Q577-R581 PolarHBondContact O-N 3.03Å
578	E	86.5	Confident	88.8	Confident	57 Å²	57	41.5 Å²	41.5	27%	0.266	19%	0.193	S	C	.	.	H	α-helix	trans	-57.8	-47	178.7	-176.4	-172.3	156.8	0	0	111.5	R437 Y580 R581 L582	R437-E578 IonicContact NE-OE1 3.93Å; R437-E578 PolarHBondContact NE-OE1 3.24Å; R437-E578 IonicContact NH2-OE1 2.83Å; E578-Y580 VanDerWaalsContact C-N 3.33Å; E578-Y580 PolarHBondContact O-N 2.97Å; E578-R581 PolarHBondContact O-N 3.08Å; E578-R581 VanDerWaalsContact O-N 3.14Å; E578-L582 HydrophobicContact CG-CD1 4.04Å; E578-L582 HydrophobicContact CG-CG 4.42Å; E578-L582 WeakPolarHBondContact O-CG 3.15Å; E578-L582 PolarHBondContact O-N 3.03Å
579	M	87.8	Confident	88.9	Confident	100 Å²	100	37.4 Å²	37.4	49%	0.493	17%	0.171	S	C	.	.	H	α-helix	trans	-61.4	-41.3	-177.8	-66.4	-58.8	-65.8	0	0	111.9	Q577 R581 L582 D583	Q577-M579 VanDerWaalsContact C-N 3.35Å; Q577-M579 PolarHBondContact O-N 3.01Å; M579-R581 VanDerWaalsContact C-N 3.33Å; M579-R581 PolarHBondContact O-N 3.46Å; M579-L582 PolarHBondContact O-N 3.36Å; M579-D583 WeakPolarHBondContact O-CB 3.22Å; M579-D583 PolarHBondContact O-N 3.07Å
580	Y	90.4	Very high	88.7	Confident	17 Å²	17	37.1 Å²	37.1	7%	0.067	18%	0.176	C	C	.	.	H	α-helix	trans	-59.7	-44.4	175.9	-169.5	-80.8	0	0	0	111.4	L497 W501 P574 Q577 E578 L584 L616 P618	L497-Y580 HydrophobicContact CB-CE2 4.06Å; W501-Y580 HydrophobicContact CB-CD2 4.07Å; W501-Y580 HydrophobicContact CB-CE2 3.98Å; W501-Y580 HydrophobicContact CG-CD2 4.35Å; W501-Y580 HydrophobicContact CG-CE2 4.42Å; P574-Y580 HydrophobicContact CB-CD1 3.75Å; P574-Y580 HydrophobicContact CB-CD2 3.91Å; P574-Y580 HydrophobicContact CB-CE1 3.79Å; P574-Y580 HydrophobicContact CB-CE2 3.92Å; P574-Y580 HydrophobicContact CB-CG 3.82Å; P574-Y580 HydrophobicContact CG-CE1 4.47Å; P574-Y580 HydrophobicContact CG-CE2 4.4Å; Q577-Y580 PolarHBondContact O-N 2.7Å; E578-Y580 VanDerWaalsContact C-N 3.33Å; E578-Y580 PolarHBondContact O-N 2.97Å; Y580-L584 WeakPolarHBondContact O-CB 3.29Å; Y580-L584 PolarHBondContact O-N 3.19Å; Y580-L616 PolarHBondContact OH-O 2.96Å; Y580-P618 HydrophobicContact CD1-CG 4.2Å; Y580-P618 HydrophobicContact CE1-CG 3.91Å
581	R	89.5	Confident	88.5	Confident	20 Å²	20	42.7 Å²	42.7	8%	0.075	20%	0.202	C	C	.	.	H	α-helix	trans	-63.3	-42.7	177.8	-67.6	-174	-75.7	127.4	-1.4	112.1	I575 Q577 E578 M579 L585 P639	I575-R581 VanDerWaalsContact O-CD 3.29Å; I575-R581 WeakPolarHBondContact O-CD 3.49Å; I575-R581 PolarHBondContact O-NE 2.88Å; Q577-R581 PolarHBondContact O-N 3.03Å; E578-R581 PolarHBondContact O-N 3.08Å; E578-R581 VanDerWaalsContact O-N 3.14Å; M579-R581 VanDerWaalsContact C-N 3.33Å; M579-R581 PolarHBondContact O-N 3.46Å; R581-L585 PolarHBondContact O-N 3.23Å; R581-L585 VanDerWaalsContact O-N 3.11Å; R581-P639 HydrophobicContact CB-CB 4.49Å; R581-P639 HydrophobicContact CG-CB 4.09Å
582	L	86.4	Confident	88.2	Confident	28 Å²	28	49.5 Å²	49.5	15%	0.147	23%	0.231	C	C	.	.	H	α-helix	trans	-67.1	-44.7	179.4	-68.7	176.1	0	0	0	111.8	L432 E578 M579 L585 R586	L432-L582 HydrophobicContact CD2-CD2 4.05Å; E578-L582 HydrophobicContact CG-CD1 4.04Å; E578-L582 HydrophobicContact CG-CG 4.42Å; E578-L582 WeakPolarHBondContact O-CG 3.15Å; E578-L582 PolarHBondContact O-N 3.03Å; M579-L582 PolarHBondContact O-N 3.36Å; L582-L585 PolarHBondContact O-N 2.85Å; L582-R586 WeakPolarHBondContact O-CG 3.46Å; L582-R586 PolarHBondContact O-N 2.95Å
583	D	87.8	Confident	88.2	Confident	29 Å²	29	50.9 Å²	50.9	16%	0.155	24%	0.242	C	C	.	.	H	α-helix	trans	-68.3	-38.9	179.7	-69.5	-23.7	0	0	0	111.6	L497 M579 L585 R586 Q587	L497-D583 HydrophobicContact CD1-CB 3.9Å; L497-D583 HydrophobicContact CD2-CB 3.68Å; L497-D583 HydrophobicContact CG-CB 4.47Å; M579-D583 WeakPolarHBondContact O-CB 3.22Å; M579-D583 PolarHBondContact O-N 3.07Å; D583-L585 VanDerWaalsContact C-N 3.25Å; D583-L585 PolarHBondContact O-N 2.67Å; D583-R586 PolarHBondContact O-N 2.96Å; D583-R586 VanDerWaalsContact O-N 3.17Å; D583-R586 IonicContact OD1-CZ 3.1Å; D583-R586 IonicContact OD1-NH1 2.74Å; D583-R586 PolarHBondContact OD1-NH1 3.43Å; D583-Q587 WeakPolarHBondContact O-CG 3.07Å; D583-Q587 PolarHBondContact O-N 2.76Å
584	L	89.6	Confident	88	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-58.6	-38.3	171.6	-177.6	69.6	0	0	0	111.8	L497 Y580 K588 N615 I617 P639 W642	L497-L584 HydrophobicContact CD1-CB 4.46Å; Y580-L584 WeakPolarHBondContact O-CB 3.29Å; Y580-L584 PolarHBondContact O-N 3.19Å; L584-K588 PolarHBondContact O-N 2.93Å; L584-N615 HydrophobicContact CD1-CB 4.11Å; L584-I617 HydrophobicContact CD2-CB 4.47Å; L584-I617 HydrophobicContact CD2-CG1 4.41Å; L584-I617 HydrophobicContact CD2-CG2 4.26Å; L584-P639 HydrophobicContact CD2-CG 3.99Å; L584-W642 HydrophobicContact CD1-CZ2 4.27Å; L584-W642 HydrophobicContact CG-CZ2 4.22Å
585	L	87.2	Confident	87.8	Confident	8 Å²	8	53.8 Å²	53.8	4%	0.042	26%	0.257	C	S	.	.	H	α-helix	trans	-72.3	-36.6	177.5	-173.9	57.2	0	0	0	112.2	R431 L432 R581 L582 D583 K588	R431-L585 HydrophobicContact CB-CD2 4.45Å; L432-L585 HydrophobicContact CD2-CB 4.19Å; L432-L585 HydrophobicContact CD2-CD2 3.66Å; L432-L585 HydrophobicContact CD2-CG 4Å; L432-L585 HydrophobicContact CG-CD2 3.72Å; L432-L585 HydrophobicContact CG-CG 4.09Å; R581-L585 PolarHBondContact O-N 3.23Å; R581-L585 VanDerWaalsContact O-N 3.11Å; L582-L585 PolarHBondContact O-N 2.85Å; D583-L585 VanDerWaalsContact C-N 3.25Å; D583-L585 PolarHBondContact O-N 2.67Å; L585-K588 HydrophobicContact CD1-CD 4.24Å; L585-K588 VanDerWaalsContact O-CB 3.24Å; L585-K588 WeakPolarHBondContact O-CB 3.43Å; L585-K588 PolarHBondContact O-N 3.48Å
586	R	85.5	Confident	87.6	Confident	158 Å²	158	57.3 Å²	57.3	60%	0.596	27%	0.273	S	S	*	.	H	α-helix	trans	-65	-40.4	175.1	-71.3	168.3	-178.9	166.7	-5.5	111.8	L432 L582 D583 K588	L432-R586 HydrophobicContact CD1-CG 4.3Å; L432-R586 HydrophobicContact CD2-CG 4.4Å; L582-R586 WeakPolarHBondContact O-CG 3.46Å; L582-R586 PolarHBondContact O-N 2.95Å; D583-R586 PolarHBondContact O-N 2.96Å; D583-R586 VanDerWaalsContact O-N 3.17Å; D583-R586 IonicContact OD1-CZ 3.1Å; D583-R586 IonicContact OD1-NH1 2.74Å; D583-R586 PolarHBondContact OD1-NH1 3.43Å; R586-K588 PolarHBondContact O-N 3.44Å
587	Q	86.7	Confident	87.3	Confident	78 Å²	78	57.6 Å²	57.6	36%	0.364	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	2.7	178.8	-65.9	-176.7	-0.9	0	0	113.6	L497 D583 L589 N615	L497-Q587 HydrophobicContact CD1-CG 4.44Å; D583-Q587 WeakPolarHBondContact O-CG 3.07Å; D583-Q587 PolarHBondContact O-N 2.76Å; Q587-L589 PolarHBondContact O-N 3Å; Q587-L589 VanDerWaalsContact O-N 3.17Å; Q587-N615 PolarHBondContact O-ND2 3.28Å
588	K	86.3	Confident	86.9	Confident	50 Å²	50	57.2 Å²	57.2	22%	0.217	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-66.1	117.4	-177.6	-176	-178.7	177.5	-169	0	111.9	L584 L585 R586 G641 W642	L584-K588 PolarHBondContact O-N 2.93Å; L585-K588 HydrophobicContact CD1-CD 4.24Å; L585-K588 VanDerWaalsContact O-CB 3.24Å; L585-K588 WeakPolarHBondContact O-CB 3.43Å; L585-K588 PolarHBondContact O-N 3.48Å; R586-K588 PolarHBondContact O-N 3.44Å; K588-G641 PolarHBondContact NZ-O 2.85Å; K588-W642 HydrophobicContact CB-CZ2 4.23Å; K588-W642 HydrophobicContact CD-CH2 4.5Å; K588-W642 HydrophobicContact CD-CZ2 4.36Å; K588-W642 HydrophobicContact CG-CH2 3.91Å; K588-W642 HydrophobicContact CG-CZ2 3.95Å; K588-W642 HydrophobicContact CG-CZ3 4.35Å
589	L	86.5	Confident	86.7	Confident	45 Å²	45	62.4 Å²	62.4	24%	0.236	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-63	134.5	176.6	-68.5	172.3	0	0	0	112.8	R545 Q587 I594 L610	R545-L589 PolarHBondContact NH1-O 3.14Å; R545-L589 PolarHBondContact NH2-O 3.09Å; R545-L589 VanDerWaalsContact NH2-O 3.11Å; Q587-L589 PolarHBondContact O-N 3Å; Q587-L589 VanDerWaalsContact O-N 3.17Å; L589-I594 HydrophobicContact CB-CD1 4.41Å; L589-I594 HydrophobicContact CB-CG1 4.37Å; L589-L610 HydrophobicContact CD1-CD1 4.31Å
590	P	85.6	Confident	86.6	Confident	77 Å²	77	66.5 Å²	66.5	50%	0.5	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-69.4	144.3	175.7	28.7	-33.8	0	0	0	110.8	K592 V593 I594	P590-K592 PolarHBondContact O-N 3.25Å; P590-K592 VanDerWaalsContact O-N 3.09Å; P590-V593 HydrophobicContact CG-CB 4.19Å; P590-V593 HydrophobicContact CG-CG2 3.67Å; P590-V593 PolarHBondContact O-N 3.13Å; P590-I594 PolarHBondContact O-N 3.17Å
591	E	85.1	Confident	86	Confident	122 Å²	122	68.4 Å²	68.4	57%	0.57	32%	0.318	S	S	*	.	H	α-helix	trans	-63.5	-23	-173.8	-169.3	162.1	-178.8	0	0	113.6	N595	E591-N595 WeakPolarHBondContact O-CB 3.32Å; E591-N595 VanDerWaalsContact O-CG 3.27Å; E591-N595 PolarHBondContact O-N 3.12Å; E591-N595 VanDerWaalsContact O-N 3.11Å; E591-N595 PolarHBondContact O-ND2 3.19Å
592	K	86.8	Confident	85.1	Confident	146 Å²	146	74 Å²	74	64%	0.635	35%	0.354	S	S	*	.	H	α-helix	trans	-62	-46	173.5	-169.6	-171.3	-177.3	-128.3	0	111.5	P590 N595 E596	P590-K592 PolarHBondContact O-N 3.25Å; P590-K592 VanDerWaalsContact O-N 3.09Å; K592-N595 PolarHBondContact O-N 2.94Å; K592-E596 WeakPolarHBondContact CE-OE1 3.38Å; K592-E596 WeakPolarHBondContact CG-OE1 3.36Å; K592-E596 IonicContact NZ-OE1 3.57Å; K592-E596 PolarHBondContact NZ-OE1 3.08Å; K592-E596 WeakPolarHBondContact O-CG 3.47Å; K592-E596 PolarHBondContact O-N 3.45Å
593	V	88.6	Confident	84.4	Confident	60 Å²	60	78.4 Å²	78.4	36%	0.364	38%	0.377	S	S	.	.	H	α-helix	trans	-65.2	-44.2	-177.7	172.3	0	0	0	0	110.6	P590 N595 E596 A597	P590-V593 HydrophobicContact CG-CB 4.19Å; P590-V593 HydrophobicContact CG-CG2 3.67Å; P590-V593 PolarHBondContact O-N 3.13Å; V593-N595 VanDerWaalsContact C-N 3.32Å; V593-N595 PolarHBondContact O-N 3.3Å; V593-E596 PolarHBondContact O-N 3.11Å; V593-A597 WeakPolarHBondContact O-CB 3.3Å; V593-A597 PolarHBondContact O-N 3.08Å
594	I	87.2	Confident	83.3	Confident	1 Å²	1	87.1 Å²	87.1	1%	0.005	41%	0.408	C	S	.	.	H	α-helix	trans	-59.9	-44.8	176	-59.2	173.5	0	0	0	110.5	R545 L589 P590 A597 R598 L610	R545-I594 HydrophobicContact CB-CD1 4.16Å; R545-I594 VanDerWaalsContact CZ-CD1 3.42Å; L589-I594 HydrophobicContact CB-CD1 4.41Å; L589-I594 HydrophobicContact CB-CG1 4.37Å; P590-I594 PolarHBondContact O-N 3.17Å; I594-A597 PolarHBondContact O-N 3.16Å; I594-R598 HydrophobicContact CG2-CG 4.38Å; I594-R598 WeakPolarHBondContact O-CG 3.31Å; I594-R598 PolarHBondContact O-N 2.84Å; I594-L610 HydrophobicContact CG1-CD1 4.44Å
595	N	86.4	Confident	82.1	Confident	68 Å²	68	91.1 Å²	91.1	36%	0.364	45%	0.449	S	S	.	.	H	α-helix	trans	-67.6	-35.8	178.9	-72.3	-38.4	0	0	0	113	E591 K592 V593 R598 H599	E591-N595 WeakPolarHBondContact O-CB 3.32Å; E591-N595 VanDerWaalsContact O-CG 3.27Å; E591-N595 PolarHBondContact O-N 3.12Å; E591-N595 VanDerWaalsContact O-N 3.11Å; E591-N595 PolarHBondContact O-ND2 3.19Å; K592-N595 PolarHBondContact O-N 2.94Å; V593-N595 VanDerWaalsContact C-N 3.32Å; V593-N595 PolarHBondContact O-N 3.3Å; N595-R598 PolarHBondContact OD1-NH1 2.86Å; N595-H599 WeakPolarHBondContact O-CB 3.43Å; N595-H599 PolarHBondContact O-N 2.89Å
596	E	88	Confident	81.3	Confident	73 Å²	73	94.2 Å²	94.2	34%	0.341	47%	0.469	S	S	.	.	H	α-helix	trans	-64.6	-44.4	173.2	-75.5	172.7	-172	0	0	110.7	K592 V593 R598 H599 R600	K592-E596 WeakPolarHBondContact CE-OE1 3.38Å; K592-E596 WeakPolarHBondContact CG-OE1 3.36Å; K592-E596 IonicContact NZ-OE1 3.57Å; K592-E596 PolarHBondContact NZ-OE1 3.08Å; K592-E596 WeakPolarHBondContact O-CG 3.47Å; K592-E596 PolarHBondContact O-N 3.45Å; V593-E596 PolarHBondContact O-N 3.11Å; E596-R598 PolarHBondContact O-N 3.16Å; E596-H599 WeakPolarHBondContact O-CB 3.42Å; E596-H599 PolarHBondContact O-N 3.04Å; E596-H599 VanDerWaalsContact O-N 3.1Å; E596-R600 WeakPolarHBondContact O-CG 3.42Å; E596-R600 PolarHBondContact O-N 2.85Å
597	A	85.3	Confident	80.5	Confident	13 Å²	13	90 Å²	90	11%	0.107	46%	0.464	C	S	.	.	H	α-helix	trans	-60.9	-45.1	174.7	0	0	0	0	0	111.9	V593 I594 H599 R600 N601 V608 L610	V593-A597 WeakPolarHBondContact O-CB 3.3Å; V593-A597 PolarHBondContact O-N 3.08Å; I594-A597 PolarHBondContact O-N 3.16Å; A597-H599 PolarHBondContact O-N 3.24Å; A597-R600 PolarHBondContact O-N 3.46Å; A597-R600 VanDerWaalsContact O-N 3.14Å; A597-N601 PolarHBondContact O-N 3.32Å; A597-V608 HydrophobicContact CB-CG1 3.56Å; A597-L610 HydrophobicContact CB-CD2 3.54Å
598	R	82.4	Confident	79.7	Confident	50 Å²	50	87 Å²	87	19%	0.189	45%	0.45	C	S	.	.	H	α-helix	trans	-60.3	-32.4	173.7	-55.6	-125.2	-157.4	74.4	-0.8	112.9	R545 I546 Y550 I594 N595 E596 V608	R545-R598 PolarHBondContact O-NH2 2.97Å; I546-R598 PolarHBondContact O-NE 3.2Å; Y550-R598 PolarHBondContact OH-NH1 3.35Å; Y550-R598 PolarHBondContact OH-NH2 2.9Å; I594-R598 HydrophobicContact CG2-CG 4.38Å; I594-R598 WeakPolarHBondContact O-CG 3.31Å; I594-R598 PolarHBondContact O-N 2.84Å; N595-R598 PolarHBondContact OD1-NH1 2.86Å; E596-R598 PolarHBondContact O-N 3.16Å; R598-V608 HydrophobicContact CB-CG2 4.49Å; R598-V608 HydrophobicContact CG-CG2 3.95Å
599	H	82.4	Confident	78.8	Confident	166 Å²	166	93.2 Å²	93.2	77%	0.769	48%	0.48	S	S	*	.	H	α-helix	trans	-75.8	-32.6	179	-173.1	-72.9	0	0	0	111.8	N595 E596 A597 N601	N595-H599 WeakPolarHBondContact O-CB 3.43Å; N595-H599 PolarHBondContact O-N 2.89Å; E596-H599 WeakPolarHBondContact O-CB 3.42Å; E596-H599 PolarHBondContact O-N 3.04Å; E596-H599 VanDerWaalsContact O-N 3.1Å; A597-H599 PolarHBondContact O-N 3.24Å; H599-N601 VanDerWaalsContact C-N 3.34Å
600	R	84.4	Confident	77.8	Confident	186 Å²	186	93 Å²	93	70%	0.702	48%	0.479	S	S	*	.	H	α-helix	trans	-68.7	-34.8	173.5	-68.8	176.2	-169.4	167.3	3.5	111.4	E596 A597 V602	E596-R600 WeakPolarHBondContact O-CG 3.42Å; E596-R600 PolarHBondContact O-N 2.85Å; A597-R600 PolarHBondContact O-N 3.46Å; A597-R600 VanDerWaalsContact O-N 3.14Å; R600-V602 PolarHBondContact O-N 3.21Å
601	N	78.7	Confident	76.6	Confident	57 Å²	57	92.5 Å²	92.5	31%	0.305	49%	0.487	S	S	.	.			trans	-69.1	103.1	173.7	-77.7	8.9	0	0	0	111.2	A597 H599 V608	A597-N601 PolarHBondContact O-N 3.32Å; H599-N601 VanDerWaalsContact C-N 3.34Å; N601-V608 WeakPolarHBondContact ND2-CA 3.28Å
602	V	70	Confident	75.3	Confident	137 Å²	137	95.1 Å²	95.1	83%	0.83	50%	0.5	S	S	*	.			trans	-67.9	-37.1	-178.3	-176.6	0	0	0	0	111.3	R600 R604	R600-V602 PolarHBondContact O-N 3.21Å; V602-R604 PolarHBondContact O-N 3.26Å
603	I	73	Confident	73.9	Confident	121 Å²	121	92 Å²	92	62%	0.621	49%	0.493	S	S	*	.	S	Bend	trans	-76.8	117.7	179.8	-54.7	176	0	0	0	108.9	G605 T606	I603-G605 PolarHBondContact O-N 2.82Å; I603-T606 HydrophobicContact CB-CG2 4.22Å; I603-T606 HydrophobicContact CG2-CG2 3.74Å; I603-T606 PolarHBondContact O-OG1 2.91Å
604	R	64.4	Low	72.9	Confident	213 Å²	213	91.4 Å²	91.4	80%	0.804	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	118.6	177.1	-70.6	-172	-177.8	159.9	11.7	110.1	V602	V602-R604 PolarHBondContact O-N 3.26Å
605	G	64.2	Low	72.4	Confident	85 Å²	85	92 Å²	92	88%	0.876	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	106.2	0.2	170.1	0	0	0	0	0	114.9	I603	I603-G605 PolarHBondContact O-N 2.82Å
606	T	70.1	Confident	72.5	Confident	73 Å²	73	89 Å²	89	45%	0.448	48%	0.476	S	S	.	.	S	Bend	trans	-80.3	145.4	164.8	49.8	0	0	0	0	110	I603	I603-T606 HydrophobicContact CB-CG2 4.22Å; I603-T606 HydrophobicContact CG2-CG2 3.74Å; I603-T606 PolarHBondContact O-OG1 2.91Å
607	S	68.5	Low	72.7	Confident	70 Å²	70	85.5 Å²	85.5	49%	0.49	46%	0.46	S	S	.	.			trans	-59.1	145.9	174.8	-65.4	0	0	0	0	110.2	D547	D547-S607 PolarHBondContact OD1-OG 3.28Å; D547-S607 PolarHBondContact OD2-OG 3.05Å
608	V	70.6	Confident	73.2	Confident	14 Å²	14	84.9 Å²	84.9	9%	0.085	46%	0.455	C	S	.	.			trans	-91	111.1	-175.1	-175.3	0	0	0	0	109.1	I546 A597 R598 N601 L610	I546-V608 HydrophobicContact CG2-CB 4.17Å; A597-V608 HydrophobicContact CB-CG1 3.56Å; R598-V608 HydrophobicContact CB-CG2 4.49Å; R598-V608 HydrophobicContact CG-CG2 3.95Å; N601-V608 WeakPolarHBondContact ND2-CA 3.28Å; V608-L610 HydrophobicContact CG1-CD2 4.38Å; V608-L610 HydrophobicContact CG1-CG 4.15Å; V608-L610 PolarHBondContact O-N 3.08Å
609	E	66.6	Low	73.8	Confident	181 Å²	181	82.5 Å²	82.5	85%	0.846	45%	0.446	S	S	*	.			trans	-68.8	113.8	173.9	-65.3	180	-173.9	0	0	109.6
610	L	66.3	Low	74.5	Confident	41 Å²	41	74.7 Å²	74.7	22%	0.215	41%	0.41	C	S	.	.			trans	-112.7	44	-177.8	-77.4	169.1	0	0	0	111.3	I546 L589 I594 A597 V608	I546-L610 HydrophobicContact CD1-CD1 3.74Å; I546-L610 HydrophobicContact CG1-CD1 3.75Å; I546-L610 HydrophobicContact CG2-CD1 4.43Å; L589-L610 HydrophobicContact CD1-CD1 4.31Å; I594-L610 HydrophobicContact CG1-CD1 4.44Å; A597-L610 HydrophobicContact CB-CD2 3.54Å; V608-L610 HydrophobicContact CG1-CD2 4.38Å; V608-L610 HydrophobicContact CG1-CG 4.15Å; V608-L610 PolarHBondContact O-N 3.08Å
611	G	60.2	Low	75	Confident	65 Å²	65	65.8 Å²	65.8	67%	0.67	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	-167.5	178.1	0	0	0	0	0	114.3	V613	G611-V613 VanDerWaalsContact C-N 3.29Å; G611-V613 PolarHBondContact O-N 2.84Å
612	Q	57.5	Low	75.8	Confident	177 Å²	177	63.1 Å²	63.1	83%	0.827	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-10.5	-167.7	-75.9	172.1	-32.2	0	0	116.3	V614	Q612-V614 PolarHBondContact O-N 3.1Å
613	V	58	Low	76.9	Confident	82 Å²	82	56.6 Å²	56.6	50%	0.497	32%	0.322	S	S	.	.			trans	-93.1	84.4	-173.6	-169.1	0	0	0	0	110.7	G611 N615	G611-V613 VanDerWaalsContact C-N 3.29Å; G611-V613 PolarHBondContact O-N 2.84Å; V613-N615 PolarHBondContact O-N 2.94Å
614	V	66	Low	77.5	Confident	47 Å²	47	52.2 Å²	52.2	29%	0.285	30%	0.299	S	S	.	.			trans	-85.2	106.2	174.3	-175.3	0	0	0	0	109.1	E478 Q612 L616	E478-V614 VanDerWaalsContact CD-CG1 3.44Å; E478-V614 HydrophobicContact CG-CG1 4.48Å; E478-V614 VanDerWaalsContact OE1-CG1 3.32Å; E478-V614 WeakPolarHBondContact OE1-CG1 3.12Å; E478-V614 WeakPolarHBondContact OE1-CG2 3.06Å; E478-V614 WeakPolarHBondContact OE2-CG1 3.43Å; Q612-V614 PolarHBondContact O-N 3.1Å; V614-L616 HydrophobicContact CG1-CD2 4.18Å; V614-L616 HydrophobicContact CG1-CG 4.3Å; V614-L616 PolarHBondContact O-N 2.98Å
615	N	77.8	Confident	78.2	Confident	12 Å²	12	43.2 Å²	43.2	6%	0.064	27%	0.269	C	S	.	.			trans	-81.2	105.2	173.4	-73.7	-30.8	0	0	0	109.9	L584 Q587 V613 W642	L584-N615 HydrophobicContact CD1-CB 4.11Å; Q587-N615 PolarHBondContact O-ND2 3.28Å; V613-N615 PolarHBondContact O-N 2.94Å; N615-W642 HydrophobicContact CB-CH2 4.37Å
616	L	87.6	Confident	78.5	Confident	6 Å²	6	40 Å²	40	3%	0.031	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-87.4	119.4	170.9	-64	170.8	0	0	0	109.6	M479 L482 F498 L540 Y580 V614	M479-L616 HydrophobicContact SD-CD1 3.75Å; M479-L616 HydrophobicContact SD-CD2 4.44Å; L482-L616 HydrophobicContact CD1-CD1 4Å; F498-L616 HydrophobicContact CB-CD1 3.9Å; F498-L616 HydrophobicContact CD1-CD1 3.78Å; F498-L616 HydrophobicContact CD2-CD1 4.42Å; F498-L616 HydrophobicContact CE1-CD1 4.48Å; F498-L616 HydrophobicContact CG-CD1 3.76Å; L540-L616 HydrophobicContact CD2-CB 4.01Å; Y580-L616 PolarHBondContact OH-O 2.96Å; V614-L616 HydrophobicContact CG1-CD2 4.18Å; V614-L616 HydrophobicContact CG1-CG 4.3Å; V614-L616 PolarHBondContact O-N 2.98Å
617	I	93.2	Very high	78	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	119.2	-175.9	-54.7	162	0	0	0	108.6	L540 C541 D543 L584 L619 P639 W642 F646	L540-I617 WeakPolarHBondContact CA-O 3.4Å; C541-I617 PolarHBondContact N-O 3.2Å; C541-I617 PolarHBondContact O-N 3.09Å; D543-I617 HydrophobicContact CB-CD1 4.45Å; L584-I617 HydrophobicContact CD2-CB 4.47Å; L584-I617 HydrophobicContact CD2-CG1 4.41Å; L584-I617 HydrophobicContact CD2-CG2 4.26Å; I617-L619 HydrophobicContact CG2-CD2 4.27Å; I617-P639 HydrophobicContact CG2-CG 3.94Å; I617-W642 HydrophobicContact CD1-CD2 3.52Å; I617-W642 HydrophobicContact CD1-CE3 3.34Å; I617-W642 HydrophobicContact CD1-CG 4.2Å; I617-W642 HydrophobicContact CD1-CH2 3.84Å; I617-W642 HydrophobicContact CD1-CZ2 4.02Å; I617-W642 HydrophobicContact CD1-CZ3 3.52Å; I617-W642 HydrophobicContact CG1-CD2 4.01Å; I617-W642 HydrophobicContact CG1-CE3 4.26Å; I617-W642 HydrophobicContact CG1-CH2 4.17Å; I617-W642 HydrophobicContact CG1-CZ2 3.95Å; I617-W642 HydrophobicContact CG1-CZ3 4.34Å; I617-W642 HydrophobicContact CG2-CG 4.32Å; I617-F646 HydrophobicContact CB-CZ 4.39Å; I617-F646 HydrophobicContact CD1-CE2 4.25Å; I617-F646 HydrophobicContact CD1-CZ 3.99Å; I617-F646 HydrophobicContact CG2-CE2 3.99Å; I617-F646 HydrophobicContact CG2-CZ 4.04Å
618	P	94.7	Very high	77.3	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	134.4	179.4	31.6	-34.5	0	0	0	109.6	L540 P574 I575 Y580 P639	L540-P618 HydrophobicContact CD2-CB 3.75Å; P574-P618 HydrophobicContact CB-CB 4.3Å; P574-P618 HydrophobicContact CB-CG 4.49Å; P574-P618 HydrophobicContact CG-CB 4.34Å; I575-P618 HydrophobicContact CB-CB 3.99Å; I575-P618 HydrophobicContact CB-CG 4.05Å; I575-P618 HydrophobicContact CG1-CG 4.25Å; Y580-P618 HydrophobicContact CD1-CG 4.2Å; Y580-P618 HydrophobicContact CE1-CG 3.91Å; P618-P639 HydrophobicContact CG-CG 4.44Å; P618-P639 WeakPolarHBondContact O-CD 3.18Å
619	L	95.7	Very high	76.4	Confident	0 Å²	0	47 Å²	47	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	142.5	-179.4	-61.1	176.2	0	0	0	109.8	L474 L539 C541 I617 V636 I637 A638 F646	L474-L619 HydrophobicContact CD1-CD1 4.3Å; L474-L619 HydrophobicContact CD2-CD1 3.49Å; L474-L619 VanDerWaalsContact CD2-CD1 3.49Å; L474-L619 HydrophobicContact CG-CD1 4.49Å; L539-L619 PolarHBondContact N-O 3.34Å; L539-L619 PolarHBondContact O-N 2.96Å; C541-L619 HydrophobicContact CB-CD1 3.64Å; C541-L619 HydrophobicContact CB-CG 4.44Å; I617-L619 HydrophobicContact CG2-CD2 4.27Å; L619-V636 HydrophobicContact CD2-CG1 4.31Å; L619-I637 WeakPolarHBondContact CA-O 3.42Å; L619-A638 HydrophobicContact CD2-CB 3.45Å; L619-A638 VanDerWaalsContact CD2-CB 3.45Å; L619-F646 HydrophobicContact CD1-CE1 3.94Å; L619-F646 HydrophobicContact CD1-CZ 3.9Å; L619-F646 HydrophobicContact CD2-CE1 4.44Å; L619-F646 HydrophobicContact CD2-CE2 3.94Å; L619-F646 HydrophobicContact CD2-CZ 3.78Å; L619-F646 HydrophobicContact CG-CZ 4.3Å
620	L	96.2	Very high	76.1	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.005	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	125.9	163.8	-61.9	170.6	0	0	0	108.3	W388 I536 L537 I575 I637	W388-L620 HydrophobicContact CZ3-CD1 4.03Å; I536-L620 HydrophobicContact CG2-CB 4.36Å; I536-L620 HydrophobicContact CG2-CD2 4.03Å; L537-L620 WeakPolarHBondContact O-CA 3.31Å; I575-L620 HydrophobicContact CG2-CD1 3.8Å; I575-L620 HydrophobicContact CG2-CG 3.99Å; L620-I637 HydrophobicContact CB-CB 4.14Å; L620-I637 HydrophobicContact CB-CD1 4.47Å; L620-I637 PolarHBondContact N-O 2.81Å; L620-I637 PolarHBondContact O-N 3.04Å
621	L	96.1	Very high	76.5	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	123.3	172.5	-58.7	-173.3	0	0	0	108.9	L470 L474 W519 I536 L537 L539 W634 D635 V636	L470-L621 HydrophobicContact CD1-CD2 4.47Å; L474-L621 HydrophobicContact CD1-CD1 4.12Å; L474-L621 HydrophobicContact CD1-CD2 4.17Å; W519-L621 HydrophobicContact CD2-CD1 4.4Å; W519-L621 HydrophobicContact CE3-CD1 3.81Å; W519-L621 HydrophobicContact CH2-CD1 3.57Å; W519-L621 HydrophobicContact CZ2-CD1 4.17Å; W519-L621 HydrophobicContact CZ3-CD1 3.37Å; I536-L621 CarbonylContact C-O 3.56Å; I536-L621 WeakPolarHBondContact CA-O 3.26Å; L537-L621 HydrophobicContact CB-CB 4.31Å; L537-L621 PolarHBondContact N-O 2.89Å; L537-L621 PolarHBondContact O-N 2.9Å; L539-L621 HydrophobicContact CD1-CD1 3.41Å; L539-L621 VanDerWaalsContact CD1-CD1 3.41Å; L539-L621 HydrophobicContact CD1-CG 4.01Å; L539-L621 HydrophobicContact CG-CD1 4.46Å; L621-W634 HydrophobicContact CB-CE3 3.72Å; L621-W634 HydrophobicContact CB-CZ3 3.8Å; L621-D635 CarbonylContact C-O 3.6Å; L621-D635 WeakPolarHBondContact CA-O 3.35Å; L621-V636 HydrophobicContact CD2-CB 4.15Å; L621-V636 HydrophobicContact CD2-CG1 4.02Å; L621-V636 HydrophobicContact CD2-CG2 3.71Å
622	V	95.3	Very high	77.7	Confident	0 Å²	0	36 Å²	36	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	119.6	175.6	-170.6	0	0	0	0	109.1	E350 I372 R535 I536 Q624 W634 D635 I637	E350-V622 HydrophobicContact CB-CG1 3.82Å; E350-V622 WeakPolarHBondContact OE2-CG1 3.46Å; I372-V622 HydrophobicContact CD1-CG2 4.48Å; R535-V622 WeakPolarHBondContact O-CA 3.3Å; I536-V622 HydrophobicContact CG1-CG1 4.5Å; I536-V622 HydrophobicContact CG1-CG2 4.26Å; V622-Q624 PolarHBondContact O-N 2.97Å; V622-W634 CarbonylContact O-C 3.52Å; V622-W634 WeakPolarHBondContact O-CA 3.48Å; V622-D635 HydrophobicContact CB-CB 4.23Å; V622-D635 PolarHBondContact N-O 2.9Å; V622-D635 PolarHBondContact O-N 2.9Å; V622-I637 HydrophobicContact CG2-CD1 4.08Å
623	C	93.1	Very high	79.4	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	128.7	178.6	-176.1	0	0	0	0	110.6	P528 R534 R535 W634	P528-C623 PolarHBondContact O-SG 2.99Å; R534-C623 WeakPolarHBondContact CA-O 3.37Å; R534-C623 PolarHBondContact N-O 3.27Å; R535-C623 HydrophobicContact CB-CB 4.44Å; R535-C623 PolarHBondContact O-N 2.89Å; C623-W634 HydrophobicContact CB-CE3 4.17Å; C623-W634 HydrophobicContact CB-CH2 4.16Å; C623-W634 HydrophobicContact CB-CZ3 3.81Å
624	Q	86.4	Confident	81.1	Confident	30 Å²	30	23.6 Å²	23.6	14%	0.14	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	120.6	168.6	-70.9	-177.7	-7.6	0	0	108.7	V622 C632 G633 D635	V622-Q624 PolarHBondContact O-N 2.97Å; Q624-C632 CarbonylContact O-C 3.59Å; Q624-C632 WeakPolarHBondContact O-CA 3.28Å; Q624-G633 PolarHBondContact N-O 3.18Å; Q624-G633 PolarHBondContact O-N 3.3Å; Q624-D635 PolarHBondContact NE2-OD1 2.73Å; Q624-D635 PolarHBondContact NE2-OD2 2.81Å
625	S	79	Confident	82.6	Confident	23 Å²	23	21.4 Å²	21.4	16%	0.161	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	133.6	169.1	-173.9	0	0	0	0	107.5	D529 Q533	D529-S625 WeakPolarHBondContact OD1-CB 3.46Å; D529-S625 PolarHBondContact OD1-OG 3.27Å; Q533-S625 VanDerWaalsContact CD-O 3.3Å; Q533-S625 WeakPolarHBondContact CG-O 3.28Å; Q533-S625 PolarHBondContact NE2-O 2.97Å
626	S	70.3	Confident	83.5	Confident	17 Å²	17	20.9 Å²	20.9	12%	0.119	14%	0.137	C	C	.	.			trans	-107	142.5	170.7	178.8	0	0	0	0	107.9	E628 S631	S626-E628 CarbonylContact O-C 3.54Å; S626-E628 PolarHBondContact O-N 3.45Å; S626-E628 PolarHBondContact OG-N 3.03Å; S626-S631 PolarHBondContact N-O 3.34Å
627	S	57.8	Low	83.9	Confident	110 Å²	110	20.6 Å²	20.6	77%	0.769	14%	0.136	S	C	*	.	S	Bend	trans	-56.4	-34.9	176.7	-170.2	0	0	0	0	111.6	A629	S627-A629 PolarHBondContact O-N 2.86Å
628	E	55.8	Low	84	Confident	105 Å²	105	20.6 Å²	20.6	49%	0.491	14%	0.136	S	C	.	.	S	Bend	trans	-82.2	112.3	166.6	-64.6	-167.6	167.9	0	0	109.4	S626 A630 S631	S626-E628 CarbonylContact O-C 3.54Å; S626-E628 PolarHBondContact O-N 3.45Å; S626-E628 PolarHBondContact OG-N 3.03Å; E628-A630 PolarHBondContact O-N 2.85Å; E628-S631 PolarHBondContact O-N 3.48Å
629	A	50.3	Low	84	Confident	90 Å²	90	20.7 Å²	20.7	74%	0.744	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.5	10.2	-174.1	0	0	0	0	0	117.6	S627	S627-A629 PolarHBondContact O-N 2.86Å
630	A	60.8	Low	83.7	Confident	27 Å²	27	21 Å²	21	22%	0.223	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-23.1	176.3	0	0	0	0	0	114.1	E628 F666 L908	E628-A630 PolarHBondContact O-N 2.85Å; A630-F666 WeakPolarHBondContact O-CZ 3.27Å; A630-L908 HydrophobicContact CB-CD1 3.78Å
631	S	73.7	Confident	83.3	Confident	21 Å²	21	21 Å²	21	15%	0.147	14%	0.139	C	C	.	.			trans	-126.3	81.6	-172.1	155.6	0	0	0	0	111.8	S626 E628 C670	S626-S631 PolarHBondContact N-O 3.34Å; E628-S631 PolarHBondContact O-N 3.48Å; S631-C670 WeakPolarHBondContact CB-SG 3.26Å
632	C	87	Confident	83.1	Confident	7 Å²	7	21 Å²	21	5%	0.047	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	146.1	169	70.1	0	0	0	0	110.3	S462 G463 P464 P528 D529 Q624	S462-C632 CarbonylContact C-O 3.58Å; G463-C632 VanDerWaalsContact C-SG 3.6Å; G463-C632 WeakPolarHBondContact CA-O 3.22Å; G463-C632 PolarHBondContact N-O 3.37Å; P464-C632 VanDerWaalsContact CA-SG 3.55Å; P464-C632 VanDerWaalsContact N-SG 3.41Å; P528-C632 HydrophobicContact CG-CB 3.92Å; D529-C632 WeakPolarHBondContact OD1-CB 3.09Å; D529-C632 WeakPolarHBondContact OD2-CB 3.48Å; Q624-C632 CarbonylContact O-C 3.59Å; Q624-C632 WeakPolarHBondContact O-CA 3.28Å
633	G	92.4	Very high	82.9	Confident	0 Å²	0	21 Å²	21	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.2	-173.3	-171.2	0	0	0	0	0	116.3	L461 P528 Q624	L461-G633 CarbonylContact O-C 3.57Å; L461-G633 WeakPolarHBondContact O-CA 3.41Å; P528-G633 WeakPolarHBondContact CB-O 3.44Å; P528-G633 VanDerWaalsContact CG-N 3.31Å; Q624-G633 PolarHBondContact N-O 3.18Å; Q624-G633 PolarHBondContact O-N 3.3Å
634	W	94.8	Very high	82.9	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	131.7	178.3	-71.3	102.4	0	0	0	110.3	L461 S467 L470 W519 P528 I531 L537 L621 V622 C623	L461-W634 WeakPolarHBondContact CB-O 3.31Å; L461-W634 PolarHBondContact N-O 2.96Å; L461-W634 PolarHBondContact O-N 3.21Å; S467-W634 PolarHBondContact OG-NE1 2.91Å; L470-W634 HydrophobicContact CD1-CB 3.67Å; L470-W634 HydrophobicContact CD1-CD2 4.47Å; L470-W634 HydrophobicContact CD1-CG 3.71Å; W519-W634 HydrophobicContact CZ3-CH2 4.24Å; W519-W634 AromaticContact CZ3-CZ2 3.94Å; W519-W634 HydrophobicContact CZ3-CZ2 3.94Å; P528-W634 HydrophobicContact CB-CZ2 4.46Å; I531-W634 HydrophobicContact CD1-CH2 3.43Å; I531-W634 VanDerWaalsContact CD1-CH2 3.43Å; I531-W634 HydrophobicContact CD1-CZ2 3.39Å; L537-W634 HydrophobicContact CD1-CH2 3.7Å; L537-W634 HydrophobicContact CD1-CZ3 4.13Å; L621-W634 HydrophobicContact CB-CE3 3.72Å; L621-W634 HydrophobicContact CB-CZ3 3.8Å; V622-W634 CarbonylContact O-C 3.52Å; V622-W634 WeakPolarHBondContact O-CA 3.48Å; C623-W634 HydrophobicContact CB-CE3 4.17Å; C623-W634 HydrophobicContact CB-CH2 4.16Å; C623-W634 HydrophobicContact CB-CZ3 3.81Å
635	D	96	Very high	83.2	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	125.4	160.4	-79.1	-2.3	0	0	0	109.1	R458 F459 R460 L621 V622 Q624	R458-D635 HydrophobicContact CG-CB 4.44Å; R458-D635 IonicContact CZ-OD2 2.82Å; R458-D635 IonicContact NE-OD2 4Å; R458-D635 PolarHBondContact NE-OD2 3.19Å; R458-D635 IonicContact NH2-OD2 2.72Å; R458-D635 PolarHBondContact NH2-OD2 3.09Å; F459-D635 CarbonylContact O-C 3.59Å; F459-D635 VanDerWaalsContact O-CA 3.3Å; F459-D635 WeakPolarHBondContact O-CA 3.48Å; R460-D635 VanDerWaalsContact CA-OD1 3.29Å; R460-D635 WeakPolarHBondContact CA-OD1 3.24Å; R460-D635 WeakPolarHBondContact CB-OD1 3.38Å; R460-D635 VanDerWaalsContact CG-OD1 3.22Å; R460-D635 WeakPolarHBondContact CG-OD1 3.48Å; R460-D635 IonicContact CZ-OD1 2.67Å; R460-D635 IonicContact CZ-OD2 2.66Å; R460-D635 IonicContact NE-OD1 3.49Å; R460-D635 PolarHBondContact NE-OD1 2.78Å; R460-D635 IonicContact NE-OD2 4Å; R460-D635 IonicContact NH2-OD1 2.93Å; R460-D635 IonicContact NH2-OD2 3.98Å; R460-D635 PolarHBondContact NH2-OD2 3.06Å; R460-D635 VanDerWaalsContact NH2-OD2 3.12Å; L621-D635 CarbonylContact C-O 3.6Å; L621-D635 WeakPolarHBondContact CA-O 3.35Å; V622-D635 HydrophobicContact CB-CB 4.23Å; V622-D635 PolarHBondContact N-O 2.9Å; V622-D635 PolarHBondContact O-N 2.9Å; Q624-D635 PolarHBondContact NE2-OD1 2.73Å; Q624-D635 PolarHBondContact NE2-OD2 2.81Å
636	V	96.9	Very high	84	Confident	1 Å²	1	21.7 Å²	21.7	1%	0.006	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	115.2	175.5	-176.8	0	0	0	0	108.1	R458 F459 L461 L470 L619 L621	R458-V636 WeakPolarHBondContact CA-O 3.46Å; F459-V636 HydrophobicContact CB-CB 4.46Å; F459-V636 PolarHBondContact N-O 3.3Å; F459-V636 PolarHBondContact O-N 3.14Å; L461-V636 HydrophobicContact CD1-CG2 3.57Å; L470-V636 HydrophobicContact CD1-CG2 4.12Å; L470-V636 HydrophobicContact CD2-CG2 3.85Å; L619-V636 HydrophobicContact CD2-CG1 4.31Å; L621-V636 HydrophobicContact CD2-CB 4.15Å; L621-V636 HydrophobicContact CD2-CG1 4.02Å; L621-V636 HydrophobicContact CD2-CG2 3.71Å
637	I	96.8	Very high	85.2	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	126.1	173	-58.7	171.1	0	0	0	108.4	I372 W390 M456 L457 R458 I575 L619 L620 V622	I372-I637 HydrophobicContact CD1-CD1 3.86Å; W390-I637 HydrophobicContact CH2-CG2 4.48Å; W390-I637 HydrophobicContact CZ2-CD1 4.11Å; W390-I637 HydrophobicContact CZ2-CG1 4.43Å; W390-I637 HydrophobicContact CZ2-CG2 4.1Å; M456-I637 HydrophobicContact CE-CG2 3.45Å; M456-I637 VanDerWaalsContact CE-CG2 3.45Å; L457-I637 CarbonylContact O-C 3.59Å; L457-I637 VanDerWaalsContact O-CA 3.27Å; L457-I637 WeakPolarHBondContact O-CA 3.43Å; R458-I637 HydrophobicContact CG-CG1 4.06Å; I575-I637 HydrophobicContact CD1-CG2 4.24Å; L619-I637 WeakPolarHBondContact CA-O 3.42Å; L620-I637 HydrophobicContact CB-CB 4.14Å; L620-I637 HydrophobicContact CB-CD1 4.47Å; L620-I637 PolarHBondContact N-O 2.81Å; L620-I637 PolarHBondContact O-N 3.04Å; V622-I637 HydrophobicContact CG2-CD1 4.08Å
638	A	95.1	Very high	87	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	154.2	-177.8	0	0	0	0	0	111	L457 L619 F646	L457-A638 PolarHBondContact N-O 3.09Å; L457-A638 PolarHBondContact O-N 3.43Å; L619-A638 HydrophobicContact CD2-CB 3.45Å; L619-A638 VanDerWaalsContact CD2-CB 3.45Å; A638-F646 HydrophobicContact CB-CD2 4.33Å; A638-F646 HydrophobicContact CB-CE2 4.22Å
639	P	93.6	Very high	88.8	Confident	2 Å²	2	12.8 Å²	12.8	1%	0.013	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	149.4	171.5	27.1	-33.8	0	0	0	111.4	R581 L584 I617 P618	R581-P639 HydrophobicContact CB-CB 4.49Å; R581-P639 HydrophobicContact CG-CB 4.09Å; L584-P639 HydrophobicContact CD2-CG 3.99Å; I617-P639 HydrophobicContact CG2-CG 3.94Å; P618-P639 HydrophobicContact CG-CG 4.44Å; P618-P639 WeakPolarHBondContact O-CD 3.18Å
640	A	89.7	Confident	91	Very high	7 Å²	7	8.6 Å²	8.6	6%	0.058	6%	0.055	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	154	172	0	0	0	0	0	112.2	D454 A455	D454-A640 WeakPolarHBondContact O-CB 3.47Å; A455-A640 VanDerWaalsContact O-CB 3.28Å; A455-A640 WeakPolarHBondContact O-CB 3.41Å; A455-A640 PolarHBondContact O-N 2.97Å
641	G	88.4	Confident	92.6	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	5%	0.049	C	C	.	.	T	Hydrogen-bonded Turn	trans	102.2	-35.6	-170	0	0	0	0	0	113	E264 R431 K588	E264-G641 WeakPolarHBondContact OE1-CA 3.48Å; E264-G641 PolarHBondContact OE1-N 3.11Å; R431-G641 PolarHBondContact NH1-O 3.44Å; R431-G641 VanDerWaalsContact NH1-O 3.14Å; K588-G641 PolarHBondContact NZ-O 2.85Å
642	W	91.3	Very high	93.5	Very high	1 Å²	1	11.3 Å²	11.3	0%	0.004	6%	0.057	C	C	.	.			trans	-101.1	-0	-165.9	-62.9	95	0	0	0	114.6	D543 L584 K588 N615 I617 M644 A645 F646	D543-W642 HydrophobicContact CB-CH2 4.35Å; D543-W642 HydrophobicContact CB-CZ3 3.99Å; D543-W642 VanDerWaalsContact CG-CZ3 3.44Å; D543-W642 WeakPolarHBondContact OD2-CZ3 3.43Å; L584-W642 HydrophobicContact CD1-CZ2 4.27Å; L584-W642 HydrophobicContact CG-CZ2 4.22Å; K588-W642 HydrophobicContact CB-CZ2 4.23Å; K588-W642 HydrophobicContact CD-CH2 4.5Å; K588-W642 HydrophobicContact CD-CZ2 4.36Å; K588-W642 HydrophobicContact CG-CH2 3.91Å; K588-W642 HydrophobicContact CG-CZ2 3.95Å; K588-W642 HydrophobicContact CG-CZ3 4.35Å; N615-W642 HydrophobicContact CB-CH2 4.37Å; I617-W642 HydrophobicContact CD1-CD2 3.52Å; I617-W642 HydrophobicContact CD1-CE3 3.34Å; I617-W642 HydrophobicContact CD1-CG 4.2Å; I617-W642 HydrophobicContact CD1-CH2 3.84Å; I617-W642 HydrophobicContact CD1-CZ2 4.02Å; I617-W642 HydrophobicContact CD1-CZ3 3.52Å; I617-W642 HydrophobicContact CG1-CD2 4.01Å; I617-W642 HydrophobicContact CG1-CE3 4.26Å; I617-W642 HydrophobicContact CG1-CH2 4.17Å; I617-W642 HydrophobicContact CG1-CZ2 3.95Å; I617-W642 HydrophobicContact CG1-CZ3 4.34Å; I617-W642 HydrophobicContact CG2-CG 4.32Å; W642-M644 PolarHBondContact O-N 3.22Å; W642-A645 HydrophobicContact CE3-CB 4.25Å; W642-A645 VanDerWaalsContact O-CB 3.32Å; W642-A645 WeakPolarHBondContact O-CB 3.37Å; W642-A645 PolarHBondContact O-N 3.42Å; W642-F646 HydrophobicContact CB-CD2 3.85Å; W642-F646 HydrophobicContact CB-CE2 3.7Å; W642-F646 WeakPolarHBondContact O-CD2 3.42Å; W642-F646 PolarHBondContact O-N 3.22Å; W642-F646 VanDerWaalsContact O-N 3.1Å
643	G	92.4	Very high	93.8	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-58.9	-47.2	-172.2	0	0	0	0	0	113.7	E264 A645 W647	E264-G643 WeakPolarHBondContact OE2-CA 3.38Å; E264-G643 PolarHBondContact OE2-N 2.9Å; G643-A645 VanDerWaalsContact C-N 3.28Å; G643-A645 PolarHBondContact O-N 2.91Å; G643-W647 WeakPolarHBondContact O-CB 3.47Å; G643-W647 PolarHBondContact O-N 3.26Å
644	M	92.5	Very high	93.8	Very high	61 Å²	61	12.4 Å²	12.4	30%	0.3	7%	0.065	S	C	.	.	H	α-helix	trans	-68	-26.7	177.8	-86.3	-60.9	-54.6	0	0	113.9	E264 T265 W268 W642 T648	E264-M644 VanDerWaalsContact O-CG 3.24Å; E264-M644 WeakPolarHBondContact O-CG 3.22Å; T265-M644 HydrophobicContact CG2-SD 4.26Å; W268-M644 HydrophobicContact CB-CE 4.03Å; W268-M644 HydrophobicContact CB-SD 3.87Å; W268-M644 HydrophobicContact CG-CE 4.45Å; W642-M644 PolarHBondContact O-N 3.22Å; M644-T648 VanDerWaalsContact O-CB 3.29Å; M644-T648 WeakPolarHBondContact O-CB 3.41Å; M644-T648 PolarHBondContact O-N 2.97Å; M644-T648 VanDerWaalsContact O-N 3.09Å; M644-T648 PolarHBondContact O-OG1 3.48Å
645	A	93.1	Very high	93.8	Very high	6 Å²	6	12.5 Å²	12.5	5%	0.05	7%	0.066	C	C	.	.	H	α-helix	trans	-68.9	-57.2	177.4	0	0	0	0	0	109.7	P544 R545 W642 G643 W647 T648 A649	P544-A645 HydrophobicContact CG-CB 4.02Å; R545-A645 HydrophobicContact CG-CB 3.69Å; W642-A645 HydrophobicContact CE3-CB 4.25Å; W642-A645 VanDerWaalsContact O-CB 3.32Å; W642-A645 WeakPolarHBondContact O-CB 3.37Å; W642-A645 PolarHBondContact O-N 3.42Å; G643-A645 VanDerWaalsContact C-N 3.28Å; G643-A645 PolarHBondContact O-N 2.91Å; A645-W647 PolarHBondContact O-N 2.87Å; A645-T648 PolarHBondContact O-N 3.37Å; A645-A649 PolarHBondContact O-N 3.32Å
646	F	95	Very high	93.8	Very high	1 Å²	1	15.8 Å²	15.8	0%	0.004	8%	0.078	C	C	.	.	H	α-helix	trans	-59.8	-46.4	175.5	-73.3	-66.8	0	0	0	111.9	F459 L474 P544 I617 L619 A638 W642 T648 A649 I650	F459-F646 HydrophobicContact CE2-CB 4.19Å; L474-F646 HydrophobicContact CD2-CD1 4.18Å; L474-F646 HydrophobicContact CD2-CE1 3.76Å; P544-F646 HydrophobicContact CB-CD1 4.09Å; P544-F646 HydrophobicContact CB-CE1 4.11Å; P544-F646 HydrophobicContact CG-CD1 3.63Å; P544-F646 HydrophobicContact CG-CE1 3.63Å; P544-F646 HydrophobicContact CG-CG 4.08Å; P544-F646 HydrophobicContact CG-CZ 4.11Å; I617-F646 HydrophobicContact CB-CZ 4.39Å; I617-F646 HydrophobicContact CD1-CE2 4.25Å; I617-F646 HydrophobicContact CD1-CZ 3.99Å; I617-F646 HydrophobicContact CG2-CE2 3.99Å; I617-F646 HydrophobicContact CG2-CZ 4.04Å; L619-F646 HydrophobicContact CD1-CE1 3.94Å; L619-F646 HydrophobicContact CD1-CZ 3.9Å; L619-F646 HydrophobicContact CD2-CE1 4.44Å; L619-F646 HydrophobicContact CD2-CE2 3.94Å; L619-F646 HydrophobicContact CD2-CZ 3.78Å; L619-F646 HydrophobicContact CG-CZ 4.3Å; A638-F646 HydrophobicContact CB-CD2 4.33Å; A638-F646 HydrophobicContact CB-CE2 4.22Å; W642-F646 HydrophobicContact CB-CD2 3.85Å; W642-F646 HydrophobicContact CB-CE2 3.7Å; W642-F646 WeakPolarHBondContact O-CD2 3.42Å; W642-F646 PolarHBondContact O-N 3.22Å; W642-F646 VanDerWaalsContact O-N 3.1Å; F646-T648 VanDerWaalsContact C-N 3.29Å; F646-T648 PolarHBondContact O-N 3.2Å; F646-A649 PolarHBondContact O-N 3.37Å; F646-I650 HydrophobicContact CB-CD1 4.47Å; F646-I650 WeakPolarHBondContact O-CB 3.44Å; F646-I650 VanDerWaalsContact O-CG1 3.27Å; F646-I650 WeakPolarHBondContact O-CG1 3.48Å; F646-I650 PolarHBondContact O-N 3.06Å
647	W	96	Very high	93.8	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-56.4	-45.2	179.5	-169.6	-94.1	0	0	0	111.8	T265 W268 H269 I305 D307 F459 G643 A645 Q651 A657	T265-W647 HydrophobicContact CG2-CB 3.94Å; T265-W647 HydrophobicContact CG2-CD2 3.89Å; T265-W647 HydrophobicContact CG2-CE3 4.06Å; T265-W647 HydrophobicContact CG2-CG 3.83Å; W268-W647 AromaticContact CD2-CD1 3.8Å; W268-W647 AromaticContact CD2-NE1 3.28Å; W268-W647 VanDerWaalsContact CD2-NE1 3.28Å; W268-W647 AromaticContact CE2-CD1 3.94Å; W268-W647 AromaticContact CE2-NE1 3.51Å; W268-W647 HydrophobicContact CE3-CZ2 4.31Å; W268-W647 AromaticContact CE3-NE1 3.22Å; W268-W647 AromaticContact CG-CD1 3.96Å; W268-W647 AromaticContact CG-NE1 3.92Å; W268-W647 HydrophobicContact CH2-CZ2 4.5Å; W268-W647 AromaticContact CH2-NE1 3.74Å; W268-W647 AromaticContact CZ2-NE1 3.76Å; W268-W647 AromaticContact CZ3-CZ2 3.96Å; W268-W647 HydrophobicContact CZ3-CZ2 3.96Å; W268-W647 AromaticContact CZ3-NE1 3.45Å; H269-W647 AromaticContact CE1-CE2 3.51Å; H269-W647 AromaticContact CE1-CH2 3.62Å; H269-W647 AromaticContact CE1-CZ2 3.13Å; H269-W647 WeakPolarHBondContact CE1-CZ2 3.39Å; H269-W647 AromaticContact CE1-NE1 3.97Å; H269-W647 AromaticContact NE2-CH2 3.69Å; H269-W647 AromaticContact NE2-CZ2 3.3Å; H269-W647 VanDerWaalsContact NE2-CZ2 3.3Å; H269-W647 WeakPolarHBondContact NE2-CZ2 3.39Å; I305-W647 HydrophobicContact CD1-CE3 3.84Å; I305-W647 HydrophobicContact CD1-CH2 4.43Å; I305-W647 HydrophobicContact CD1-CZ3 3.71Å; I305-W647 HydrophobicContact CG1-CE3 4.29Å; I305-W647 HydrophobicContact CG1-CH2 4.03Å; I305-W647 HydrophobicContact CG1-CZ3 3.63Å; I305-W647 HydrophobicContact CG2-CH2 4.18Å; I305-W647 HydrophobicContact CG2-CZ2 4.47Å; I305-W647 HydrophobicContact CG2-CZ3 4.49Å; D307-W647 HydrophobicContact CB-CH2 4Å; D307-W647 HydrophobicContact CB-CZ3 3.75Å; F459-W647 AromaticContact CD1-CE3 3.59Å; F459-W647 HydrophobicContact CD1-CE3 3.59Å; F459-W647 AromaticContact CD1-CZ3 3.64Å; F459-W647 HydrophobicContact CD1-CZ3 3.64Å; F459-W647 AromaticContact CE1-CE3 3.49Å; F459-W647 HydrophobicContact CE1-CE3 3.49Å; F459-W647 VanDerWaalsContact CE1-CE3 3.49Å; F459-W647 AromaticContact CE1-CZ3 3.9Å; F459-W647 HydrophobicContact CE1-CZ3 3.9Å; F459-W647 HydrophobicContact CG-CE3 4.36Å; F459-W647 HydrophobicContact CZ-CE3 4.18Å; G643-W647 WeakPolarHBondContact O-CB 3.47Å; G643-W647 PolarHBondContact O-N 3.26Å; A645-W647 PolarHBondContact O-N 2.87Å; W647-Q651 WeakPolarHBondContact O-CB 3.38Å; W647-Q651 WeakPolarHBondContact O-CG 3.5Å; W647-Q651 PolarHBondContact O-N 3.14Å; W647-Q651 VanDerWaalsContact O-N 3.07Å; W647-A657 HydrophobicContact CH2-CB 4.43Å; W647-A657 HydrophobicContact CZ2-CB 3.7Å
648	T	94.5	Very high	93.8	Very high	39 Å²	39	16.6 Å²	16.6	24%	0.239	8%	0.084	C	C	.	.	H	α-helix	trans	-67.1	-43.7	-179.6	-58.1	0	0	0	0	111.4	M644 A645 F646 Q651 Y652	M644-T648 VanDerWaalsContact O-CB 3.29Å; M644-T648 WeakPolarHBondContact O-CB 3.41Å; M644-T648 PolarHBondContact O-N 2.97Å; M644-T648 VanDerWaalsContact O-N 3.09Å; M644-T648 PolarHBondContact O-OG1 3.48Å; A645-T648 PolarHBondContact O-N 3.37Å; F646-T648 VanDerWaalsContact C-N 3.29Å; F646-T648 PolarHBondContact O-N 3.2Å; T648-Q651 PolarHBondContact O-N 3.46Å; T648-Y652 HydrophobicContact CG2-CD2 3.79Å; T648-Y652 HydrophobicContact CG2-CE2 3.61Å; T648-Y652 WeakPolarHBondContact O-CD2 3.4Å; T648-Y652 PolarHBondContact O-N 3.24Å; T648-Y652 VanDerWaalsContact O-N 3.11Å
649	A	94.4	Very high	93.8	Very high	6 Å²	6	16.9 Å²	16.9	5%	0.05	9%	0.086	C	C	.	.	H	α-helix	trans	-61	-47.7	178.3	0	0	0	0	0	111.6	V473 P544 I548 A645 F646 Q651 Y652 A653	V473-A649 HydrophobicContact CG1-CB 3.66Å; V473-A649 HydrophobicContact CG2-CB 4.35Å; P544-A649 HydrophobicContact CB-CB 3.91Å; I548-A649 HydrophobicContact CD1-CB 4.3Å; I548-A649 HydrophobicContact CG1-CB 4.3Å; A645-A649 PolarHBondContact O-N 3.32Å; F646-A649 PolarHBondContact O-N 3.37Å; A649-Q651 VanDerWaalsContact C-N 3.31Å; A649-Q651 PolarHBondContact O-N 3.34Å; A649-Y652 PolarHBondContact O-N 2.72Å; A649-A653 PolarHBondContact O-N 2.94Å
650	I	95.7	Very high	93.8	Very high	2 Å²	2	18.3 Å²	18.3	1%	0.01	9%	0.094	C	C	.	.	H	α-helix	trans	-61.1	-38.5	177.9	-65.1	167.7	0	0	0	111.8	I305 L461 I469 L470 V473 F646 Y652 A653 T654 A655	I305-I650 HydrophobicContact CB-CG2 4.49Å; I305-I650 HydrophobicContact CD1-CB 4.18Å; I305-I650 HydrophobicContact CD1-CD1 3.73Å; I305-I650 HydrophobicContact CD1-CG2 3.61Å; I305-I650 HydrophobicContact CG2-CG2 4.37Å; L461-I650 HydrophobicContact CD2-CG2 4.19Å; I469-I650 HydrophobicContact CG2-CG2 4.36Å; L470-I650 HydrophobicContact CD2-CD1 4.48Å; V473-I650 HydrophobicContact CB-CG1 4.49Å; V473-I650 HydrophobicContact CG1-CG1 4.05Å; V473-I650 HydrophobicContact CG2-CG1 4.11Å; F646-I650 HydrophobicContact CB-CD1 4.47Å; F646-I650 WeakPolarHBondContact O-CB 3.44Å; F646-I650 VanDerWaalsContact O-CG1 3.27Å; F646-I650 WeakPolarHBondContact O-CG1 3.48Å; F646-I650 PolarHBondContact O-N 3.06Å; I650-Y652 VanDerWaalsContact C-N 3.32Å; I650-Y652 PolarHBondContact O-N 2.91Å; I650-A653 CarbonylContact O-C 3.04Å; I650-A653 PolarHBondContact O-N 3.3Å; I650-T654 PolarHBondContact O-N 3.14Å; I650-A655 HydrophobicContact CG2-CB 3.47Å; I650-A655 VanDerWaalsContact CG2-CB 3.47Å; I650-A655 PolarHBondContact O-N 3.17Å
651	Q	94.6	Very high	94	Very high	23 Å²	23	22.5 Å²	22.5	11%	0.107	11%	0.112	C	C	.	.	H	α-helix	trans	-66.4	-31.9	175.2	-70.2	-65.1	-51	0	0	113.3	W268 K552 W647 T648 A649 A655	W268-Q651 HydrophobicContact CH2-CG 4.34Å; W268-Q651 HydrophobicContact CZ2-CG 3.77Å; K552-Q651 PolarHBondContact NZ-O 3.37Å; W647-Q651 WeakPolarHBondContact O-CB 3.38Å; W647-Q651 WeakPolarHBondContact O-CG 3.5Å; W647-Q651 PolarHBondContact O-N 3.14Å; W647-Q651 VanDerWaalsContact O-N 3.07Å; T648-Q651 PolarHBondContact O-N 3.46Å; A649-Q651 VanDerWaalsContact C-N 3.31Å; A649-Q651 PolarHBondContact O-N 3.34Å; Q651-A655 PolarHBondContact NE2-O 3.32Å; Q651-A655 PolarHBondContact OE1-O 2.98Å
652	Y	93.6	Very high	94.3	Very high	81 Å²	81	23 Å²	23	32%	0.318	12%	0.115	S	C	.	.	H	α-helix	trans	-77.2	-31.7	173.7	-81.8	-69.8	0	0	0	112.1	I548 Y550 K552 T648 A649 I650 T654	I548-Y652 HydrophobicContact CG2-CD2 3.94Å; I548-Y652 HydrophobicContact CG2-CG 4.23Å; Y550-Y652 HydrophobicContact CD1-CE1 4Å; Y550-Y652 HydrophobicContact CD1-CE2 4.04Å; Y550-Y652 AromaticContact CD1-CZ 3.74Å; Y550-Y652 HydrophobicContact CE1-CE2 4.14Å; K552-Y652 HydrophobicContact CG-CD1 4.47Å; T648-Y652 HydrophobicContact CG2-CD2 3.79Å; T648-Y652 HydrophobicContact CG2-CE2 3.61Å; T648-Y652 WeakPolarHBondContact O-CD2 3.4Å; T648-Y652 PolarHBondContact O-N 3.24Å; T648-Y652 VanDerWaalsContact O-N 3.11Å; A649-Y652 PolarHBondContact O-N 2.72Å; I650-Y652 VanDerWaalsContact C-N 3.32Å; I650-Y652 PolarHBondContact O-N 2.91Å; Y652-T654 PolarHBondContact O-N 3.49Å; Y652-T654 VanDerWaalsContact O-N 3.1Å
653	A	92.9	Very high	94.4	Very high	8 Å²	8	23.3 Å²	23.3	7%	0.066	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	15.7	168.7	0	0	0	0	0	113.9	I469 V473 A649 I650 A655	I469-A653 WeakPolarHBondContact CG1-O 3.49Å; I469-A653 HydrophobicContact CG2-CB 3.73Å; V473-A653 HydrophobicContact CG2-CB 3.46Å; V473-A653 VanDerWaalsContact CG2-CB 3.46Å; A649-A653 PolarHBondContact O-N 2.94Å; I650-A653 CarbonylContact O-C 3.04Å; I650-A653 PolarHBondContact O-N 3.3Å; A653-A655 PolarHBondContact O-N 3.04Å
654	T	93.5	Very high	94.3	Very high	22 Å²	22	24.1 Å²	24.1	14%	0.135	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.1	1.1	168.2	71.5	0	0	0	0	118.5	H302 K552 R553 I650 Y652	H302-T654 PolarHBondContact CE1-O 3.08Å; H302-T654 PolarHBondContact CE1-OG1 2.64Å; H302-T654 PolarHBondContact NE2-OG1 3.42Å; K552-T654 HydrophobicContact CB-CG2 3.92Å; R553-T654 WeakPolarHBondContact O-CG2 3.46Å; I650-T654 PolarHBondContact O-N 3.14Å; Y652-T654 PolarHBondContact O-N 3.49Å; Y652-T654 VanDerWaalsContact O-N 3.1Å
655	A	94.9	Very high	94.3	Very high	2 Å²	2	22 Å²	22	2%	0.017	12%	0.116	C	C	.	.	P	Polyproline II helix	trans	-65.4	138	172.7	0	0	0	0	0	111.8	I305 I469 I650 Q651 A653	I305-A655 HydrophobicContact CB-CB 4.36Å; I305-A655 HydrophobicContact CG2-CB 4.03Å; I469-A655 HydrophobicContact CD1-CB 4.19Å; I469-A655 HydrophobicContact CG2-CB 4.3Å; I650-A655 HydrophobicContact CG2-CB 3.47Å; I650-A655 VanDerWaalsContact CG2-CB 3.47Å; I650-A655 PolarHBondContact O-N 3.17Å; Q651-A655 PolarHBondContact NE2-O 3.32Å; Q651-A655 PolarHBondContact OE1-O 2.98Å; A653-A655 PolarHBondContact O-N 3.04Å
656	R	94.8	Very high	94.2	Very high	70 Å²	70	22.3 Å²	22.3	26%	0.264	12%	0.116	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	123	-179.8	-179.9	178.9	-56.9	-124.7	1.1	111	S295 D298 C303 T304 I305 V658	S295-R656 WeakPolarHBondContact OG-CD 3.38Å; D298-R656 IonicContact OD1-NH2 2.69Å; D298-R656 IonicContact OD2-CZ 2.76Å; D298-R656 IonicContact OD2-NE 3.33Å; D298-R656 PolarHBondContact OD2-NE 3.49Å; D298-R656 IonicContact OD2-NH2 3.99Å; D298-R656 PolarHBondContact OD2-NH2 2.83Å; C303-R656 PolarHBondContact O-N 2.98Å; C303-R656 VanDerWaalsContact O-N 3.13Å; T304-R656 CarbonylContact C-O 3.53Å; T304-R656 VanDerWaalsContact CA-O 3.26Å; T304-R656 WeakPolarHBondContact CA-O 3.4Å; T304-R656 HydrophobicContact CG2-CB 4.41Å; I305-R656 PolarHBondContact N-O 3.5Å; R656-V658 WeakPolarHBondContact O-CG2 3.03Å
657	A	96.9	Very high	93.9	Very high	8 Å²	8	24.7 Å²	24.7	7%	0.066	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	141.4	171.1	0	0	0	0	0	112.3	W268 F273 I305 W647	W268-A657 HydrophobicContact CH2-CB 3.38Å; W268-A657 HydrophobicContact CZ3-CB 3.57Å; F273-A657 HydrophobicContact CE2-CB 4.1Å; F273-A657 HydrophobicContact CZ-CB 3.88Å; I305-A657 CarbonylContact O-C 3.57Å; I305-A657 WeakPolarHBondContact O-CA 3.31Å; W647-A657 HydrophobicContact CH2-CB 4.43Å; W647-A657 HydrophobicContact CZ2-CB 3.7Å
658	V	96.3	Very high	93.5	Very high	10 Å²	10	25.6 Å²	25.6	6%	0.061	13%	0.131	C	C	.	.			trans	-132.8	164.1	178.5	-157.2	0	0	0	0	111	T304 I305 R656 F662	T304-V658 HydrophobicContact CG2-CG2 3.64Å; I305-V658 PolarHBondContact O-N 3.04Å; R656-V658 WeakPolarHBondContact O-CG2 3.03Å; V658-F662 HydrophobicContact CB-CD1 4.04Å; V658-F662 HydrophobicContact CG1-CB 3.29Å; V658-F662 HydrophobicContact CG1-CD1 3.06Å; V658-F662 HydrophobicContact CG1-CD2 4.14Å; V658-F662 HydrophobicContact CG1-CE1 3.85Å; V658-F662 HydrophobicContact CG1-CG 3.21Å; V658-F662 HydrophobicContact CG2-CD1 4.3Å; V658-F662 HydrophobicContact CG2-CE1 4.32Å
659	G	95.5	Very high	93.2	Very high	5 Å²	5	24.2 Å²	24.2	5%	0.052	12%	0.121	C	C	.	.			trans	-124.6	176.1	-179.2	0	0	0	0	0	112	A284 D285 Q661 F662 A663	A284-G659 WeakPolarHBondContact O-CA 3.47Å; D285-G659 CarbonylContact O-C 3.45Å; D285-G659 VanDerWaalsContact O-C 3.31Å; D285-G659 WeakPolarHBondContact O-CA 3.13Å; G659-Q661 VanDerWaalsContact C-N 3.28Å; G659-Q661 PolarHBondContact O-N 3.33Å; G659-Q661 VanDerWaalsContact O-N 3.16Å; G659-F662 PolarHBondContact O-N 3.18Å; G659-F662 VanDerWaalsContact O-N 3.09Å; G659-A663 PolarHBondContact O-N 2.66Å; G659-A663 VanDerWaalsContact O-N 3.09Å
660	L	94.7	Very high	92.7	Very high	32 Å²	32	24.4 Å²	24.4	17%	0.168	12%	0.122	C	C	.	.	H	α-helix	trans	-52.5	-40.8	-170.7	-69.8	169.5	0	0	0	113.6	I276 W279 L283 A284 D285 Y310 F662 A663 G664	I276-L660 HydrophobicContact CD1-CD1 4.05Å; W279-L660 HydrophobicContact CH2-CD1 4.38Å; W279-L660 HydrophobicContact CH2-CD2 4.28Å; W279-L660 HydrophobicContact CZ3-CD1 4.32Å; W279-L660 HydrophobicContact CZ3-CD2 4.29Å; L283-L660 HydrophobicContact CB-CD1 3.65Å; L283-L660 HydrophobicContact CD1-CD1 3.92Å; L283-L660 HydrophobicContact CG-CD1 4.45Å; A284-L660 WeakPolarHBondContact O-CG 3.36Å; A284-L660 PolarHBondContact O-N 2.75Å; D285-L660 PolarHBondContact O-N 3.44Å; Y310-L660 HydrophobicContact CE1-CD2 4.26Å; L660-F662 VanDerWaalsContact C-N 3.32Å; L660-F662 PolarHBondContact O-N 3.47Å; L660-A663 PolarHBondContact O-N 2.68Å; L660-G664 PolarHBondContact O-N 3.31Å
661	Q	93.6	Very high	92.1	Very high	95 Å²	95	25.4 Å²	25.4	44%	0.444	13%	0.133	S	C	.	.	H	α-helix	trans	-58.8	-44.7	-178.5	-175.5	180	31.5	0	0	112.3	D285 W292 G659 T665	D285-Q661 PolarHBondContact O-N 2.78Å; W292-Q661 HydrophobicContact CH2-CG 4.37Å; W292-Q661 HydrophobicContact CZ3-CG 4.11Å; G659-Q661 VanDerWaalsContact C-N 3.28Å; G659-Q661 PolarHBondContact O-N 3.33Å; G659-Q661 VanDerWaalsContact O-N 3.16Å; Q661-T665 PolarHBondContact O-N 2.99Å; Q661-T665 PolarHBondContact O-OG1 2.9Å
662	F	94.1	Very high	91.7	Very high	12 Å²	12	26.3 Å²	26.3	5%	0.053	14%	0.14	C	C	.	.	H	α-helix	trans	-75.2	-38.3	178.5	167.8	-76.4	0	0	0	110.7	W292 F296 V658 G659 L660 G664 T665 F666	W292-F662 HydrophobicContact CE3-CB 4.36Å; W292-F662 HydrophobicContact CE3-CD2 4.34Å; W292-F662 HydrophobicContact CH2-CB 4.35Å; W292-F662 HydrophobicContact CZ3-CB 3.74Å; W292-F662 HydrophobicContact CZ3-CD2 4.27Å; F296-F662 HydrophobicContact CB-CE2 4.42Å; F296-F662 HydrophobicContact CD1-CE2 4.15Å; F296-F662 HydrophobicContact CD1-CZ 4.49Å; F296-F662 AromaticContact CD2-CD2 3.91Å; F296-F662 HydrophobicContact CD2-CD2 3.91Å; F296-F662 AromaticContact CD2-CE2 3.39Å; F296-F662 HydrophobicContact CD2-CE2 3.39Å; F296-F662 HydrophobicContact CD2-CZ 4.43Å; F296-F662 HydrophobicContact CE1-CE2 4.18Å; F296-F662 AromaticContact CE2-CD2 3.6Å; F296-F662 HydrophobicContact CE2-CD2 3.6Å; F296-F662 AromaticContact CE2-CE2 3.44Å; F296-F662 HydrophobicContact CE2-CE2 3.44Å; F296-F662 VanDerWaalsContact CE2-CE2 3.44Å; F296-F662 HydrophobicContact CE2-CZ 4.46Å; F296-F662 AromaticContact CG-CE2 3.76Å; F296-F662 HydrophobicContact CG-CE2 3.76Å; F296-F662 HydrophobicContact CG-CZ 4.43Å; F296-F662 HydrophobicContact CZ-CD2 4.14Å; F296-F662 AromaticContact CZ-CE2 3.84Å; F296-F662 HydrophobicContact CZ-CE2 3.84Å; F296-F662 HydrophobicContact CZ-CZ 4.49Å; V658-F662 HydrophobicContact CB-CD1 4.04Å; V658-F662 HydrophobicContact CG1-CB 3.29Å; V658-F662 HydrophobicContact CG1-CD1 3.06Å; V658-F662 HydrophobicContact CG1-CD2 4.14Å; V658-F662 HydrophobicContact CG1-CE1 3.85Å; V658-F662 HydrophobicContact CG1-CG 3.21Å; V658-F662 HydrophobicContact CG2-CD1 4.3Å; V658-F662 HydrophobicContact CG2-CE1 4.32Å; G659-F662 PolarHBondContact O-N 3.18Å; G659-F662 VanDerWaalsContact O-N 3.09Å; L660-F662 VanDerWaalsContact C-N 3.32Å; L660-F662 PolarHBondContact O-N 3.47Å; F662-G664 VanDerWaalsContact C-N 3.35Å; F662-G664 PolarHBondContact O-N 2.74Å; F662-T665 PolarHBondContact O-N 3.2Å; F662-F666 HydrophobicContact CD1-CB 4.12Å; F662-F666 HydrophobicContact CE1-CB 3.84Å; F662-F666 HydrophobicContact CE1-CD2 4.43Å; F662-F666 HydrophobicContact CE1-CG 4.08Å; F662-F666 HydrophobicContact CZ-CB 4.28Å; F662-F666 HydrophobicContact CZ-CD2 4.29Å; F662-F666 HydrophobicContact CZ-CG 4.38Å; F662-F666 VanDerWaalsContact O-CB 3.26Å; F662-F666 WeakPolarHBondContact O-CB 3.43Å; F662-F666 PolarHBondContact O-N 3.4Å
663	A	92.7	Very high	91.5	Very high	7 Å²	7	22.7 Å²	22.7	6%	0.058	13%	0.127	C	C	.	.	H	α-helix	trans	-56.6	-48.4	178.3	0	0	0	0	0	111.6	E306 G659 L660 T665 F666 Q667	E306-A663 VanDerWaalsContact CD-CB 3.44Å; E306-A663 WeakPolarHBondContact OE1-CB 3.4Å; E306-A663 WeakPolarHBondContact OE2-CB 3.45Å; G659-A663 PolarHBondContact O-N 2.66Å; G659-A663 VanDerWaalsContact O-N 3.09Å; L660-A663 PolarHBondContact O-N 2.68Å; A663-T665 PolarHBondContact O-N 3.36Å; A663-F666 PolarHBondContact O-N 3.04Å; A663-Q667 WeakPolarHBondContact O-CB 3.28Å; A663-Q667 VanDerWaalsContact O-CG 3.32Å; A663-Q667 WeakPolarHBondContact O-CG 3.1Å; A663-Q667 PolarHBondContact O-N 2.9Å
664	G	91.7	Very high	91.4	Very high	17 Å²	17	22.7 Å²	22.7	18%	0.175	13%	0.127	C	C	.	.	H	α-helix	trans	-62.8	-40.2	176.5	0	0	0	0	0	113.1	L660 F662 Q667 R668	L660-G664 PolarHBondContact O-N 3.31Å; F662-G664 VanDerWaalsContact C-N 3.35Å; F662-G664 PolarHBondContact O-N 2.74Å; G664-Q667 PolarHBondContact O-N 3.29Å; G664-R668 PolarHBondContact O-N 3.15Å
665	T	91.8	Very high	91.4	Very high	15 Å²	15	23.1 Å²	23.1	9%	0.092	13%	0.126	C	C	.	.	H	α-helix	trans	-68.6	-38.1	176.6	-56.5	0	0	0	0	111.9	W292 F296 Q661 F662 A663 R668 E669	W292-T665 HydrophobicContact CH2-CG2 3.85Å; W292-T665 WeakPolarHBondContact CH2-OG1 3.03Å; W292-T665 HydrophobicContact CZ2-CG2 3.52Å; F296-T665 HydrophobicContact CE2-CG2 4.36Å; F296-T665 HydrophobicContact CZ-CG2 3.86Å; Q661-T665 PolarHBondContact O-N 2.99Å; Q661-T665 PolarHBondContact O-OG1 2.9Å; F662-T665 PolarHBondContact O-N 3.2Å; A663-T665 PolarHBondContact O-N 3.36Å; T665-R668 PolarHBondContact O-N 3.26Å; T665-E669 WeakPolarHBondContact O-CG 3.09Å; T665-E669 PolarHBondContact O-N 3.43Å
666	F	91	Very high	91.4	Very high	13 Å²	13	23 Å²	23	6%	0.057	13%	0.126	C	C	.	.	H	α-helix	trans	-67.4	-42.9	177.3	-177.1	-110.4	0	0	0	110.9	F296 S299 A630 F662 A663 R668 E669 C670	F296-F666 HydrophobicContact CD1-CD2 4.44Å; F296-F666 AromaticContact CE1-CD2 3.98Å; F296-F666 HydrophobicContact CE1-CD2 3.98Å; S299-F666 WeakPolarHBondContact OG-CE2 3.37Å; A630-F666 WeakPolarHBondContact O-CZ 3.27Å; F662-F666 HydrophobicContact CD1-CB 4.12Å; F662-F666 HydrophobicContact CE1-CB 3.84Å; F662-F666 HydrophobicContact CE1-CD2 4.43Å; F662-F666 HydrophobicContact CE1-CG 4.08Å; F662-F666 HydrophobicContact CZ-CB 4.28Å; F662-F666 HydrophobicContact CZ-CD2 4.29Å; F662-F666 HydrophobicContact CZ-CG 4.38Å; F662-F666 VanDerWaalsContact O-CB 3.26Å; F662-F666 WeakPolarHBondContact O-CB 3.43Å; F662-F666 PolarHBondContact O-N 3.4Å; A663-F666 PolarHBondContact O-N 3.04Å; F666-R668 PolarHBondContact O-N 3.43Å; F666-E669 PolarHBondContact O-N 2.94Å; F666-E669 VanDerWaalsContact O-N 3.17Å; F666-C670 PolarHBondContact O-N 2.95Å; F666-C670 PolarHBondContact O-SG 2.96Å
667	Q	89.2	Confident	91.1	Very high	51 Å²	51	21.3 Å²	21.3	24%	0.238	12%	0.122	C	C	.	.	H	α-helix	trans	-56.6	-48.4	172.2	-75.7	173.7	-12.5	0	0	111.5	A663 G664 E669 C670 G671 V672	A663-Q667 WeakPolarHBondContact O-CB 3.28Å; A663-Q667 VanDerWaalsContact O-CG 3.32Å; A663-Q667 WeakPolarHBondContact O-CG 3.1Å; A663-Q667 PolarHBondContact O-N 2.9Å; G664-Q667 PolarHBondContact O-N 3.29Å; Q667-E669 VanDerWaalsContact C-N 3.32Å; Q667-E669 PolarHBondContact O-N 3.36Å; Q667-C670 CarbonylContact O-C 3.56Å; Q667-C670 WeakPolarHBondContact O-CA 3.49Å; Q667-C670 WeakPolarHBondContact O-CB 3.45Å; Q667-C670 PolarHBondContact O-N 2.56Å; Q667-G671 PolarHBondContact O-N 2.8Å; Q667-V672 CarbonylContact C-O 3.56Å; Q667-V672 HydrophobicContact CB-CB 4.36Å; Q667-V672 PolarHBondContact O-N 3.23Å
668	R	88	Confident	90.8	Very high	20 Å²	20	21.1 Å²	21.1	8%	0.075	12%	0.12	C	C	.	.	H	α-helix	trans	-57.5	-43.5	174.6	-175.8	-172.1	70	-142.5	4.5	112.3	G664 T665 F666 C670 G671 V672 D902	G664-R668 PolarHBondContact O-N 3.15Å; T665-R668 PolarHBondContact O-N 3.26Å; F666-R668 PolarHBondContact O-N 3.43Å; R668-C670 PolarHBondContact O-N 2.79Å; R668-G671 PolarHBondContact O-N 2.93Å; R668-V672 PolarHBondContact N-O 2.89Å; R668-D902 IonicContact CZ-OD2 3.93Å; R668-D902 IonicContact NE-OD2 2.65Å; R668-D902 IonicContact NH1-OD1 2.84Å; R668-D902 PolarHBondContact NH1-OD1 2.66Å; R668-D902 IonicContact NH1-OD2 3.68Å; R668-D902 PolarHBondContact NH1-OD2 3.26Å
669	E	86.8	Confident	90.6	Very high	9 Å²	9	21.2 Å²	21.2	4%	0.042	12%	0.119	C	C	.	.	H	α-helix	trans	-65.8	-24.9	176.9	-74.8	-166.9	-168.6	0	0	113.1	F296 T665 F666 Q667 G671 S906 L907 L908	F296-E669 HydrophobicContact CE1-CG 4.27Å; F296-E669 WeakPolarHBondContact CE1-OE1 3.29Å; F296-E669 WeakPolarHBondContact CE1-OE2 3.44Å; F296-E669 WeakPolarHBondContact CZ-OE1 3.44Å; T665-E669 WeakPolarHBondContact O-CG 3.09Å; T665-E669 PolarHBondContact O-N 3.43Å; F666-E669 PolarHBondContact O-N 2.94Å; F666-E669 VanDerWaalsContact O-N 3.17Å; Q667-E669 VanDerWaalsContact C-N 3.32Å; Q667-E669 PolarHBondContact O-N 3.36Å; E669-G671 VanDerWaalsContact C-N 3.29Å; E669-S906 WeakPolarHBondContact OE1-CA 3.1Å; E669-L907 PolarHBondContact OE1-N 3.4Å; E669-L908 HydrophobicContact CB-CD1 4.13Å; E669-L908 WeakPolarHBondContact OE2-CD1 3.44Å; E669-L908 WeakPolarHBondContact OE2-CG 3.49Å
670	C	84.4	Confident	90.4	Very high	10 Å²	10	21.4 Å²	21.4	7%	0.068	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	6.9	173.2	-56.7	0	0	0	0	113	S631 F666 Q667 R668 V672	S631-C670 WeakPolarHBondContact CB-SG 3.26Å; F666-C670 PolarHBondContact O-N 2.95Å; F666-C670 PolarHBondContact O-SG 2.96Å; Q667-C670 CarbonylContact O-C 3.56Å; Q667-C670 WeakPolarHBondContact O-CA 3.49Å; Q667-C670 WeakPolarHBondContact O-CB 3.45Å; Q667-C670 PolarHBondContact O-N 2.56Å; R668-C670 PolarHBondContact O-N 2.79Å; C670-V672 PolarHBondContact O-N 2.82Å
671	G	83.6	Confident	90.2	Very high	23 Å²	23	21 Å²	21	24%	0.237	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	0.6	-178	0	0	0	0	0	115.1	Q667 R668 E669 Q958	Q667-G671 PolarHBondContact O-N 2.8Å; R668-G671 PolarHBondContact O-N 2.93Å; E669-G671 VanDerWaalsContact C-N 3.29Å; G671-Q958 PolarHBondContact O-NE2 3.45Å
672	V	86.3	Confident	90.1	Very high	42 Å²	42	16.5 Å²	16.5	26%	0.255	10%	0.097	S	C	.	.			trans	-88.7	133.2	-177.9	-178.4	0	0	0	0	111.1	Q667 R668 C670 P674	Q667-V672 CarbonylContact C-O 3.56Å; Q667-V672 HydrophobicContact CB-CB 4.36Å; Q667-V672 PolarHBondContact O-N 3.23Å; R668-V672 PolarHBondContact N-O 2.89Å; C670-V672 PolarHBondContact O-N 2.82Å; V672-P674 VanDerWaalsContact O-CD 3.26Å; V672-P674 WeakPolarHBondContact O-CD 3.29Å
673	A	89.4	Confident	90.1	Very high	6 Å²	6	20.3 Å²	20.3	5%	0.05	12%	0.115	C	C	.	.			trans	-68	115	174.6	0	0	0	0	0	113.3	F675 D678 R775	A673-F675 PolarHBondContact O-N 2.77Å; A673-D678 HydrophobicContact CB-CB 4.47Å; A673-R775 VanDerWaalsContact CA-NH2 3.34Å; A673-R775 VanDerWaalsContact CB-NH2 3.34Å
674	P	91.3	Very high	90.1	Very high	8 Å²	8	20.5 Å²	20.5	5%	0.052	12%	0.117	C	C	.	.			trans	-66.2	121	171.1	26.9	-34.2	0	0	0	110.9	V672 D677 D678	V672-P674 VanDerWaalsContact O-CD 3.26Å; V672-P674 WeakPolarHBondContact O-CD 3.29Å; P674-D677 PolarHBondContact O-N 2.85Å; P674-D678 VanDerWaalsContact CD-OD2 3.31Å; P674-D678 WeakPolarHBondContact CD-OD2 3.33Å; P674-D678 HydrophobicContact CG-CB 4.04Å; P674-D678 WeakPolarHBondContact O-CB 3.5Å; P674-D678 PolarHBondContact O-N 3.26Å
675	F	93.3	Very high	90.2	Very high	30 Å²	30	19.8 Å²	19.8	13%	0.132	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	135.8	172.7	-174.7	-88.4	0	0	0	110	P368 H392 S394 I395 A673 W679 A684	P368-F675 HydrophobicContact CG-CB 3.94Å; P368-F675 HydrophobicContact CG-CD2 3.79Å; P368-F675 HydrophobicContact CG-CG 3.86Å; H392-F675 HydrophobicContact CB-CD1 3.56Å; H392-F675 HydrophobicContact CB-CE1 3.58Å; H392-F675 AromaticContact CG-CD1 3.52Å; H392-F675 AromaticContact CG-CE1 3.62Å; H392-F675 AromaticContact ND1-CD1 3.8Å; H392-F675 AromaticContact ND1-CE1 3.54Å; S394-F675 VanDerWaalsContact OG-CE1 3.31Å; S394-F675 WeakPolarHBondContact OG-CE1 3.44Å; I395-F675 HydrophobicContact CD1-CD1 4.25Å; I395-F675 HydrophobicContact CD1-CE1 3.36Å; I395-F675 HydrophobicContact CD1-CE2 3.97Å; I395-F675 HydrophobicContact CD1-CZ 3.2Å; I395-F675 HydrophobicContact CG1-CE1 3.41Å; I395-F675 VanDerWaalsContact CG1-CE1 3.41Å; I395-F675 HydrophobicContact CG1-CE2 4.46Å; I395-F675 HydrophobicContact CG1-CZ 3.33Å; A673-F675 PolarHBondContact O-N 2.77Å; F675-W679 HydrophobicContact CD2-CB 3.97Å; F675-W679 AromaticContact CD2-CD1 3.58Å; F675-W679 AromaticContact CD2-CD2 3.76Å; F675-W679 HydrophobicContact CD2-CD2 3.76Å; F675-W679 HydrophobicContact CD2-CE3 4.45Å; F675-W679 AromaticContact CD2-CG 3.49Å; F675-W679 HydrophobicContact CD2-CG 3.49Å; F675-W679 VanDerWaalsContact CD2-CG 3.49Å; F675-W679 AromaticContact CD2-NE1 3.89Å; F675-W679 HydrophobicContact CE2-CB 4.1Å; F675-W679 HydrophobicContact CE2-CD2 4.28Å; F675-W679 HydrophobicContact CE2-CG 4.04Å; F675-A684 HydrophobicContact CZ-CB 3.81Å
676	P	93.8	Very high	90.3	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	cis	-91.4	-11.2	6.3	34.2	-34.6	0	0	0	115.6	W279 D678 W679 A684 G685 A688	W279-P676 HydrophobicContact CZ2-CG 4.23Å; P676-D678 VanDerWaalsContact C-N 3.32Å; P676-D678 PolarHBondContact O-N 2.85Å; P676-W679 PolarHBondContact O-N 3.22Å; P676-A684 HydrophobicContact CB-CB 4.33Å; P676-G685 VanDerWaalsContact O-CA 3.24Å; P676-G685 WeakPolarHBondContact O-CA 3.2Å; P676-A688 HydrophobicContact CB-CB 4.2Å; P676-A688 HydrophobicContact CG-CB 3.86Å
677	D	89.4	Confident	90.4	Very high	35 Å²	35	26.8 Å²	26.8	19%	0.187	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-29.5	-162.9	-65.4	-62.2	0	0	0	115.7	P674 R692	P674-D677 PolarHBondContact O-N 2.85Å; D677-R692 IonicContact OD1-CZ 2.99Å; D677-R692 VanDerWaalsContact OD1-CZ 3.22Å; D677-R692 IonicContact OD1-NE 3.83Å; D677-R692 PolarHBondContact OD1-NE 3.27Å; D677-R692 IonicContact OD1-NH2 4Å; D677-R692 PolarHBondContact OD1-NH2 3.13Å; D677-R692 IonicContact OD2-CZ 2.77Å; D677-R692 IonicContact OD2-NE 3.53Å; D677-R692 IonicContact OD2-NH2 3.47Å; D677-R692 PolarHBondContact OD2-NH2 3.25Å
678	D	89.4	Confident	90.6	Very high	3 Å²	3	25 Å²	25	2%	0.016	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	9.7	-176.5	-82.3	23.9	0	0	0	113.6	A673 P674 P676 R775 L901 S915	A673-D678 HydrophobicContact CB-CB 4.47Å; P674-D678 VanDerWaalsContact CD-OD2 3.31Å; P674-D678 WeakPolarHBondContact CD-OD2 3.33Å; P674-D678 HydrophobicContact CG-CB 4.04Å; P674-D678 WeakPolarHBondContact O-CB 3.5Å; P674-D678 PolarHBondContact O-N 3.26Å; P676-D678 VanDerWaalsContact C-N 3.32Å; P676-D678 PolarHBondContact O-N 2.85Å; D678-R775 PolarHBondContact O-NH1 3.06Å; D678-R775 VanDerWaalsContact O-NH1 3.12Å; D678-R775 IonicContact OD2-CZ 2.86Å; D678-R775 IonicContact OD2-NH2 3.12Å; D678-R775 PolarHBondContact OD2-NH2 3.08Å; D678-L901 HydrophobicContact CB-CD1 4.2Å; D678-S915 PolarHBondContact OD2-OG 3.32Å
679	W	93	Very high	90.8	Very high	12 Å²	12	24.8 Å²	24.8	5%	0.045	14%	0.142	C	C	.	.			trans	-107.8	77.7	-175.4	-77	68	0	0	0	111.6	V354 P368 F675 P676 D681 S682 G685	V354-W679 HydrophobicContact CG1-CH2 3.91Å; V354-W679 HydrophobicContact CG1-CZ3 3.71Å; V354-W679 HydrophobicContact CG2-CH2 3.82Å; V354-W679 HydrophobicContact CG2-CZ3 4.48Å; P368-W679 HydrophobicContact CB-CH2 4Å; P368-W679 HydrophobicContact CB-CZ2 3.91Å; P368-W679 HydrophobicContact CG-CH2 4.05Å; P368-W679 HydrophobicContact CG-CZ2 3.65Å; F675-W679 HydrophobicContact CD2-CB 3.97Å; F675-W679 AromaticContact CD2-CD1 3.58Å; F675-W679 AromaticContact CD2-CD2 3.76Å; F675-W679 HydrophobicContact CD2-CD2 3.76Å; F675-W679 HydrophobicContact CD2-CE3 4.45Å; F675-W679 AromaticContact CD2-CG 3.49Å; F675-W679 HydrophobicContact CD2-CG 3.49Å; F675-W679 VanDerWaalsContact CD2-CG 3.49Å; F675-W679 AromaticContact CD2-NE1 3.89Å; F675-W679 HydrophobicContact CE2-CB 4.1Å; F675-W679 HydrophobicContact CE2-CD2 4.28Å; F675-W679 HydrophobicContact CE2-CG 4.04Å; P676-W679 PolarHBondContact O-N 3.22Å; W679-D681 VanDerWaalsContact C-N 3.32Å; W679-D681 PolarHBondContact O-N 3.46Å; W679-S682 PolarHBondContact O-N 2.76Å; W679-G685 WeakPolarHBondContact O-CA 3.2Å
680	A	90.4	Very high	91.1	Very high	9 Å²	9	31 Å²	31	7%	0.074	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-26.8	-170.9	0	0	0	0	0	115.3	N686 Y747 L917	A680-N686 PolarHBondContact O-ND2 3.36Å; A680-N686 PolarHBondContact O-OD1 2.98Å; A680-Y747 PolarHBondContact O-OH 2.92Å; A680-L917 HydrophobicContact CB-CD1 3.63Å
681	D	90.8	Very high	91.5	Very high	23 Å²	23	33.5 Å²	33.5	12%	0.123	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-13.3	179	60.2	-19.6	0	0	0	113.8	C365 W679 V749 R751	C365-D681 HydrophobicContact CB-CB 4.5Å; C365-D681 WeakPolarHBondContact CB-OD2 3.34Å; W679-D681 VanDerWaalsContact C-N 3.32Å; W679-D681 PolarHBondContact O-N 3.46Å; D681-V749 HydrophobicContact CB-CG2 4.02Å; D681-V749 PolarHBondContact OD2-N 3.22Å; D681-R751 IonicContact OD1-CZ 3.22Å; D681-R751 IonicContact OD1-NH2 2.81Å; D681-R751 PolarHBondContact OD1-NH2 3.17Å; D681-R751 IonicContact OD2-CZ 3.23Å; D681-R751 IonicContact OD2-NH1 2.71Å; D681-R751 PolarHBondContact OD2-NH1 2.89Å; D681-R751 IonicContact OD2-NH2 2.92Å; D681-R751 PolarHBondContact OD2-NH2 2.86Å
682	S	92.9	Very high	91.8	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.007	19%	0.193	C	C	.	.	S	Bend	trans	-82.9	136.9	174.3	176.2	0	0	0	0	110.7	C365 I366 W679 A684 G685 N686	C365-S682 WeakPolarHBondContact O-CA 3.48Å; I366-S682 PolarHBondContact O-OG 3.35Å; W679-S682 PolarHBondContact O-N 2.76Å; S682-A684 PolarHBondContact O-N 3.2Å; S682-A684 PolarHBondContact OG-N 3.33Å; S682-G685 CarbonylContact O-C 3.58Å; S682-G685 WeakPolarHBondContact O-CA 3.32Å; S682-G685 PolarHBondContact O-N 3.29Å; S682-N686 PolarHBondContact O-N 2.98Å
683	E	92.8	Very high	92.1	Very high	93 Å²	93	34.9 Å²	34.9	44%	0.435	18%	0.184	S	C	.	.	H	α-helix	trans	-54	-40.6	172.8	-175	-172.2	162.1	0	0	111.9	K398 G685 N686 I687	K398-E683 HydrophobicContact CD-CB 4.41Å; K398-E683 WeakPolarHBondContact CD-OE2 3.27Å; K398-E683 WeakPolarHBondContact CE-OE2 3.26Å; K398-E683 IonicContact NZ-OE2 3.68Å; K398-E683 PolarHBondContact NZ-OE2 3.05Å; E683-G685 VanDerWaalsContact C-N 3.26Å; E683-G685 PolarHBondContact O-N 2.69Å; E683-N686 PolarHBondContact O-N 3.04Å; E683-I687 HydrophobicContact CG-CD1 4.16Å; E683-I687 WeakPolarHBondContact O-CG1 3.36Å; E683-I687 PolarHBondContact O-N 3.11Å
684	A	94	Very high	92.3	Very high	11 Å²	11	38.1 Å²	38.1	9%	0.091	20%	0.201	C	C	.	.	H	α-helix	trans	-63.4	-36	177.1	0	0	0	0	0	111.9	S394 F675 P676 S682 A688	S394-A684 WeakPolarHBondContact OG-CB 3.3Å; F675-A684 HydrophobicContact CZ-CB 3.81Å; P676-A684 HydrophobicContact CB-CB 4.33Å; S682-A684 PolarHBondContact O-N 3.2Å; S682-A684 PolarHBondContact OG-N 3.33Å; A684-A688 WeakPolarHBondContact O-CB 3.46Å; A684-A688 PolarHBondContact O-N 3.01Å; A684-A688 VanDerWaalsContact O-N 3.08Å
685	G	93.1	Very high	92.4	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-70.6	-40	175.6	0	0	0	0	0	112.2	P676 W679 S682 E683 I687 A688 A689	P676-G685 VanDerWaalsContact O-CA 3.24Å; P676-G685 WeakPolarHBondContact O-CA 3.2Å; W679-G685 WeakPolarHBondContact O-CA 3.2Å; S682-G685 CarbonylContact O-C 3.58Å; S682-G685 WeakPolarHBondContact O-CA 3.32Å; S682-G685 PolarHBondContact O-N 3.29Å; E683-G685 VanDerWaalsContact C-N 3.26Å; E683-G685 PolarHBondContact O-N 2.69Å; G685-I687 PolarHBondContact O-N 3.21Å; G685-A688 PolarHBondContact O-N 3.19Å; G685-A689 VanDerWaalsContact O-CB 3.28Å; G685-A689 WeakPolarHBondContact O-CB 3.26Å; G685-A689 PolarHBondContact O-N 3.21Å
686	N	92.8	Very high	92.3	Very high	69 Å²	69	44.5 Å²	44.5	37%	0.369	24%	0.236	S	C	.	.	H	α-helix	trans	-60.3	-43.9	174.2	-75.8	-31.3	0	0	0	112.6	A680 S682 E683 A689 K690	A680-N686 PolarHBondContact O-ND2 3.36Å; A680-N686 PolarHBondContact O-OD1 2.98Å; S682-N686 PolarHBondContact O-N 2.98Å; E683-N686 PolarHBondContact O-N 3.04Å; N686-A689 PolarHBondContact O-N 3.15Å; N686-K690 VanDerWaalsContact O-CB 3.31Å; N686-K690 WeakPolarHBondContact O-CB 3.23Å; N686-K690 PolarHBondContact O-N 2.98Å
687	I	94.1	Very high	92.2	Very high	107 Å²	107	48.8 Å²	48.8	55%	0.549	25%	0.252	S	S	.	.	H	α-helix	trans	-62.5	-44.3	174.9	-66.3	166.8	0	0	0	110.7	E683 G685 A691	E683-I687 HydrophobicContact CG-CD1 4.16Å; E683-I687 WeakPolarHBondContact O-CG1 3.36Å; E683-I687 PolarHBondContact O-N 3.11Å; G685-I687 PolarHBondContact O-N 3.21Å; I687-A691 WeakPolarHBondContact O-CB 3.28Å; I687-A691 PolarHBondContact O-N 2.98Å
688	A	93.1	Very high	92.5	Very high	14 Å²	14	49.8 Å²	49.8	12%	0.116	27%	0.266	C	S	.	.	H	α-helix	trans	-67.1	-42.3	-180	0	0	0	0	0	112.5	P676 A684 G685 A691 R692	P676-A688 HydrophobicContact CB-CB 4.2Å; P676-A688 HydrophobicContact CG-CB 3.86Å; A684-A688 WeakPolarHBondContact O-CB 3.46Å; A684-A688 PolarHBondContact O-N 3.01Å; A684-A688 VanDerWaalsContact O-N 3.08Å; G685-A688 PolarHBondContact O-N 3.19Å; A688-A691 PolarHBondContact O-N 3.46Å; A688-R692 PolarHBondContact O-N 3.41Å; A688-R692 VanDerWaalsContact O-N 3.11Å
689	A	92.3	Very high	92.7	Very high	15 Å²	15	56 Å²	56	12%	0.124	29%	0.292	C	S	.	.	H	α-helix	trans	-60	-54.3	175.8	0	0	0	0	0	110.1	G685 N686 A691 R692 D693	G685-A689 VanDerWaalsContact O-CB 3.28Å; G685-A689 WeakPolarHBondContact O-CB 3.26Å; G685-A689 PolarHBondContact O-N 3.21Å; N686-A689 PolarHBondContact O-N 3.15Å; A689-A691 VanDerWaalsContact C-N 3.28Å; A689-A691 PolarHBondContact O-N 2.86Å; A689-R692 WeakPolarHBondContact O-CA 3.38Å; A689-R692 WeakPolarHBondContact O-CB 3.46Å; A689-R692 PolarHBondContact O-N 2.96Å; A689-D693 WeakPolarHBondContact O-CB 3.49Å; A689-D693 PolarHBondContact O-N 3.47Å
690	K	92.4	Very high	92.6	Very high	139 Å²	139	57.2 Å²	57.2	60%	0.604	30%	0.297	S	S	*	.	H	α-helix	trans	-54.8	-42.6	178	-172.9	171.9	-175.6	168.9	0	112.7	N686 R692 D693 D694	N686-K690 VanDerWaalsContact O-CB 3.31Å; N686-K690 WeakPolarHBondContact O-CB 3.23Å; N686-K690 PolarHBondContact O-N 2.98Å; K690-R692 VanDerWaalsContact C-N 3.35Å; K690-R692 PolarHBondContact O-N 3.19Å; K690-D693 PolarHBondContact O-N 3.3Å; K690-D694 WeakPolarHBondContact O-CB 3.48Å; K690-D694 PolarHBondContact O-N 2.68Å
691	A	93.1	Very high	92.7	Very high	62 Å²	62	58.2 Å²	58.2	51%	0.512	30%	0.301	S	S	.	.	H	α-helix	trans	-62.4	-39.7	177	0	0	0	0	0	112.8	I687 A688 A689 E695	I687-A691 WeakPolarHBondContact O-CB 3.28Å; I687-A691 PolarHBondContact O-N 2.98Å; A688-A691 PolarHBondContact O-N 3.46Å; A689-A691 VanDerWaalsContact C-N 3.28Å; A689-A691 PolarHBondContact O-N 2.86Å; A691-E695 PolarHBondContact O-N 2.96Å; A691-E695 VanDerWaalsContact O-N 3.11Å
692	R	91.1	Very high	92.8	Very high	79 Å²	79	61.4 Å²	61.4	30%	0.298	33%	0.325	S	S	.	.	H	α-helix	trans	-70.2	-37.8	174.5	-74.5	-169.5	-177	-171.6	-5.8	112.2	D677 A688 A689 K690 D694 E695 A696	D677-R692 IonicContact OD1-CZ 2.99Å; D677-R692 VanDerWaalsContact OD1-CZ 3.22Å; D677-R692 IonicContact OD1-NE 3.83Å; D677-R692 PolarHBondContact OD1-NE 3.27Å; D677-R692 IonicContact OD1-NH2 4Å; D677-R692 PolarHBondContact OD1-NH2 3.13Å; D677-R692 IonicContact OD2-CZ 2.77Å; D677-R692 IonicContact OD2-NE 3.53Å; D677-R692 IonicContact OD2-NH2 3.47Å; D677-R692 PolarHBondContact OD2-NH2 3.25Å; A688-R692 PolarHBondContact O-N 3.41Å; A688-R692 VanDerWaalsContact O-N 3.11Å; A689-R692 WeakPolarHBondContact O-CA 3.38Å; A689-R692 WeakPolarHBondContact O-CB 3.46Å; A689-R692 PolarHBondContact O-N 2.96Å; K690-R692 VanDerWaalsContact C-N 3.35Å; K690-R692 PolarHBondContact O-N 3.19Å; R692-D694 VanDerWaalsContact C-N 3.34Å; R692-E695 WeakPolarHBondContact O-CB 3.49Å; R692-E695 PolarHBondContact O-N 3.22Å; R692-A696 WeakPolarHBondContact O-CB 3.45Å; R692-A696 PolarHBondContact O-N 3.01Å
693	D	91.3	Very high	92.7	Very high	15 Å²	15	67.1 Å²	67.1	8%	0.08	35%	0.347	C	S	.	.	H	α-helix	trans	-66.1	-41.9	-178.7	-61.1	-7.3	0	0	0	109.6	A689 K690 A696 R697 F720 R788 H789	A689-D693 WeakPolarHBondContact O-CB 3.49Å; A689-D693 PolarHBondContact O-N 3.47Å; K690-D693 PolarHBondContact O-N 3.3Å; D693-A696 PolarHBondContact O-N 2.78Å; D693-R697 VanDerWaalsContact O-CB 3.29Å; D693-R697 WeakPolarHBondContact O-CB 3.4Å; D693-R697 PolarHBondContact O-N 3.41Å; D693-F720 WeakPolarHBondContact CB-O 3.39Å; D693-F720 VanDerWaalsContact OD1-O 3.05Å; D693-R788 IonicContact OD1-NH2 3.61Å; D693-H789 IonicContact OD1-CE1 3.12Å; D693-H789 PolarHBondContact OD1-CE1 3.45Å; D693-H789 IonicContact OD1-NE2 2.8Å
694	D	93.8	Very high	92.7	Very high	75 Å²	75	66.9 Å²	66.9	40%	0.401	35%	0.353	S	S	.	.	H	α-helix	trans	-64	-39.5	171.3	-75.2	-27.7	0	0	0	112.5	K690 R692 R697 A698	K690-D694 WeakPolarHBondContact O-CB 3.48Å; K690-D694 PolarHBondContact O-N 2.68Å; R692-D694 VanDerWaalsContact C-N 3.34Å; D694-R697 PolarHBondContact O-N 3.12Å; D694-R697 IonicContact OD1-NH1 3.55Å; D694-R697 PolarHBondContact OD1-NH1 3.08Å; D694-A698 VanDerWaalsContact O-CB 3.23Å; D694-A698 WeakPolarHBondContact O-CB 3.27Å; D694-A698 PolarHBondContact O-N 2.89Å
695	E	93.2	Very high	92.3	Very high	141 Å²	141	73 Å²	73	66%	0.659	38%	0.384	S	S	*	.	H	α-helix	trans	-62.6	-43.9	173.6	-173.2	-176.8	177.2	0	0	111.2	A691 R692 A698 K699	A691-E695 PolarHBondContact O-N 2.96Å; A691-E695 VanDerWaalsContact O-N 3.11Å; R692-E695 WeakPolarHBondContact O-CB 3.49Å; R692-E695 PolarHBondContact O-N 3.22Å; E695-A698 PolarHBondContact O-N 3.25Å; E695-K699 WeakPolarHBondContact O-CB 3.49Å; E695-K699 PolarHBondContact O-N 3.14Å
696	A	91.8	Very high	92.1	Very high	31 Å²	31	82.9 Å²	82.9	26%	0.256	43%	0.426	S	S	.	.	H	α-helix	trans	-64.9	-44.2	178.4	0	0	0	0	0	111.5	R692 D693 K699 Y700 F720	R692-A696 WeakPolarHBondContact O-CB 3.45Å; R692-A696 PolarHBondContact O-N 3.01Å; D693-A696 PolarHBondContact O-N 2.78Å; A696-K699 PolarHBondContact O-N 3.39Å; A696-Y700 PolarHBondContact O-N 3.1Å; A696-F720 HydrophobicContact CB-CD1 3.79Å; A696-F720 HydrophobicContact CB-CE1 4.36Å
697	R	92.3	Very high	91.9	Very high	89 Å²	89	86.2 Å²	86.2	34%	0.336	44%	0.441	S	S	.	.	H	α-helix	trans	-61.8	-47.8	175.2	-173.8	-175.8	-75.1	152.4	-9.7	111.1	D693 D694 K699 Y700 L701 F720	D693-R697 VanDerWaalsContact O-CB 3.29Å; D693-R697 WeakPolarHBondContact O-CB 3.4Å; D693-R697 PolarHBondContact O-N 3.41Å; D694-R697 PolarHBondContact O-N 3.12Å; D694-R697 IonicContact OD1-NH1 3.55Å; D694-R697 PolarHBondContact OD1-NH1 3.08Å; R697-K699 VanDerWaalsContact C-N 3.29Å; R697-K699 PolarHBondContact O-N 3.31Å; R697-Y700 WeakPolarHBondContact O-CB 3.44Å; R697-Y700 PolarHBondContact O-N 3.15Å; R697-Y700 VanDerWaalsContact O-N 3.15Å; R697-L701 HydrophobicContact CG-CD1 3.93Å; R697-L701 WeakPolarHBondContact O-CB 3.38Å; R697-L701 VanDerWaalsContact O-CG 3.26Å; R697-L701 WeakPolarHBondContact O-CG 3.38Å; R697-L701 PolarHBondContact O-N 3.01Å; R697-F720 HydrophobicContact CB-CD2 4.24Å; R697-F720 HydrophobicContact CG-CD2 4.46Å
698	A	94.4	Very high	91.6	Very high	57 Å²	57	83.6 Å²	83.6	47%	0.471	42%	0.424	S	S	.	.	H	α-helix	trans	-60.2	-39.5	176.6	0	0	0	0	0	111.9	D694 E695 L701 S702	D694-A698 VanDerWaalsContact O-CB 3.23Å; D694-A698 WeakPolarHBondContact O-CB 3.27Å; D694-A698 PolarHBondContact O-N 2.89Å; E695-A698 PolarHBondContact O-N 3.25Å; A698-L701 PolarHBondContact O-N 2.96Å; A698-S702 WeakPolarHBondContact O-CB 3.41Å; A698-S702 PolarHBondContact O-N 3.1Å
699	K	93.1	Very high	91.4	Very high	132 Å²	132	84.9 Å²	84.9	57%	0.574	43%	0.432	S	S	*	.	H	α-helix	trans	-67.6	-38.9	175.8	-173.2	179.3	-179.2	-178.4	0	112.3	E695 A696 R697 S702	E695-K699 WeakPolarHBondContact O-CB 3.49Å; E695-K699 PolarHBondContact O-N 3.14Å; A696-K699 PolarHBondContact O-N 3.39Å; R697-K699 VanDerWaalsContact C-N 3.29Å; R697-K699 PolarHBondContact O-N 3.31Å; K699-S702 PolarHBondContact O-N 3.36Å; K699-S702 PolarHBondContact O-OG 3.45Å
700	Y	92.3	Very high	91.3	Very high	38 Å²	38	86.4 Å²	86.4	15%	0.149	44%	0.441	C	S	.	.	H	α-helix	trans	-61.6	-50.1	173	173	-100.8	0	0	0	110.8	A696 R697 S702 R703 R708 P709 F711 F720	A696-Y700 PolarHBondContact O-N 3.1Å; R697-Y700 WeakPolarHBondContact O-CB 3.44Å; R697-Y700 PolarHBondContact O-N 3.15Å; R697-Y700 VanDerWaalsContact O-N 3.15Å; Y700-S702 PolarHBondContact O-N 2.94Å; Y700-R703 WeakPolarHBondContact O-CB 3.31Å; Y700-R703 PolarHBondContact O-N 2.99Å; Y700-R703 VanDerWaalsContact O-N 3.12Å; Y700-R708 HydrophobicContact CD2-CB 4.28Å; Y700-R708 HydrophobicContact CD2-CG 4.15Å; Y700-R708 HydrophobicContact CE2-CB 3.56Å; Y700-R708 HydrophobicContact CE2-CG 3.85Å; Y700-R708 WeakPolarHBondContact O-CD 3.45Å; Y700-R708 PolarHBondContact O-NE 3.05Å; Y700-P709 HydrophobicContact CE2-CG 4.17Å; Y700-P709 PolarHBondContact OH-O 2.97Å; Y700-F711 AromaticContact CD2-CE2 3.87Å; Y700-F711 HydrophobicContact CD2-CE2 3.87Å; Y700-F711 HydrophobicContact CD2-CZ 4.15Å; Y700-F711 HydrophobicContact CE1-CE2 4.26Å; Y700-F711 HydrophobicContact CE2-CD2 4.22Å; Y700-F711 AromaticContact CE2-CE2 3.39Å; Y700-F711 HydrophobicContact CE2-CE2 3.39Å; Y700-F711 AromaticContact CE2-CZ 3.92Å; Y700-F711 HydrophobicContact CE2-CZ 3.92Å; Y700-F711 HydrophobicContact CG-CE2 4.46Å; Y700-F711 AromaticContact CZ-CE2 3.63Å; Y700-F720 HydrophobicContact CD1-CE2 4.12Å; Y700-F720 HydrophobicContact CD1-CZ 4.03Å; Y700-F720 AromaticContact CD2-CZ 3.88Å; Y700-F720 HydrophobicContact CD2-CZ 3.88Å; Y700-F720 HydrophobicContact CG-CE2 4.12Å; Y700-F720 AromaticContact CG-CZ 3.55Å; Y700-F720 HydrophobicContact CG-CZ 3.55Å
701	L	91.7	Very high	91.1	Very high	30 Å²	30	80.9 Å²	80.9	16%	0.157	42%	0.418	C	S	.	.	H	α-helix	trans	-66.2	-21.1	178.4	-66	167.1	0	0	0	113.7	R697 A698 R703 R708 E873 V876	R697-L701 HydrophobicContact CG-CD1 3.93Å; R697-L701 WeakPolarHBondContact O-CB 3.38Å; R697-L701 VanDerWaalsContact O-CG 3.26Å; R697-L701 WeakPolarHBondContact O-CG 3.38Å; R697-L701 PolarHBondContact O-N 3.01Å; A698-L701 PolarHBondContact O-N 2.96Å; L701-R703 VanDerWaalsContact C-N 3.26Å; L701-R703 PolarHBondContact O-N 3.19Å; L701-R708 PolarHBondContact O-NH2 3.1Å; L701-E873 HydrophobicContact CD1-CG 3.87Å; L701-V876 HydrophobicContact CD2-CB 4.29Å; L701-V876 HydrophobicContact CD2-CG1 4.03Å; L701-V876 HydrophobicContact CD2-CG2 4.3Å
702	S	93.1	Very high	90.7	Very high	90 Å²	90	81.6 Å²	81.6	63%	0.629	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-20.3	174.4	75.7	0	0	0	0	113.5	A698 K699 Y700	A698-S702 WeakPolarHBondContact O-CB 3.41Å; A698-S702 PolarHBondContact O-N 3.1Å; K699-S702 PolarHBondContact O-N 3.36Å; K699-S702 PolarHBondContact O-OG 3.45Å; Y700-S702 PolarHBondContact O-N 2.94Å
703	R	90.8	Very high	90.4	Very high	121 Å²	121	84.5 Å²	84.5	46%	0.457	43%	0.434	S	S	.	.	S	Bend	trans	-80.9	151.8	177.3	-62	178.5	179.5	-165.1	-1.9	110	Y700 L701 R708	Y700-R703 WeakPolarHBondContact O-CB 3.31Å; Y700-R703 PolarHBondContact O-N 2.99Å; Y700-R703 VanDerWaalsContact O-N 3.12Å; L701-R703 VanDerWaalsContact C-N 3.26Å; L701-R703 PolarHBondContact O-N 3.19Å; R703-R708 HydrophobicContact CB-CG 3.79Å; R703-R708 PolarHBondContact O-NE 3.48Å; R703-R708 PolarHBondContact O-NH2 3.41Å
704	P	91.9	Very high	90.2	Very high	88 Å²	88	85 Å²	85	57%	0.571	44%	0.436	S	S	*	.			trans	-70.9	156.6	170.6	29.1	-33.4	0	0	0	111.4	K706 M707 R708	P704-K706 PolarHBondContact O-N 2.83Å; P704-M707 HydrophobicContact CG-CB 3.85Å; P704-M707 HydrophobicContact CG-CG 3.62Å; P704-M707 PolarHBondContact O-N 3.01Å; P704-R708 PolarHBondContact O-N 2.93Å
705	L	87.1	Confident	89.8	Confident	140 Å²	140	83.6 Å²	83.6	73%	0.733	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-52.1	-49.1	-171.5	-171.4	67.4	0	0	0	113.3	M707 R708	L705-M707 PolarHBondContact O-N 2.88Å; L705-R708 WeakPolarHBondContact O-CB 3.48Å; L705-R708 PolarHBondContact O-N 3.25Å; L705-R708 VanDerWaalsContact O-N 3.15Å
706	K	87.9	Confident	89.5	Confident	208 Å²	208	77.4 Å²	77.4	90%	0.904	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-66.2	-15.6	179.4	-65.9	-174.2	178.3	-177.9	0	114.5	P704	P704-K706 PolarHBondContact O-N 2.83Å
707	M	89.8	Confident	89.2	Confident	139 Å²	139	77.9 Å²	77.9	69%	0.685	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-100.1	4.1	178.5	-62.3	-65.6	-116.8	0	0	112.9	P704 L705	P704-M707 HydrophobicContact CG-CB 3.85Å; P704-M707 HydrophobicContact CG-CG 3.62Å; P704-M707 PolarHBondContact O-N 3.01Å; L705-M707 PolarHBondContact O-N 2.88Å
708	R	88.1	Confident	89.1	Confident	52 Å²	52	76.7 Å²	76.7	20%	0.196	39%	0.39	C	S	.	.	S	Bend	trans	-99.8	140.9	176.9	-68.3	178.9	-162	171.5	7.2	110	Y700 L701 R703 P704 L705	Y700-R708 HydrophobicContact CD2-CB 4.28Å; Y700-R708 HydrophobicContact CD2-CG 4.15Å; Y700-R708 HydrophobicContact CE2-CB 3.56Å; Y700-R708 HydrophobicContact CE2-CG 3.85Å; Y700-R708 WeakPolarHBondContact O-CD 3.45Å; Y700-R708 PolarHBondContact O-NE 3.05Å; L701-R708 PolarHBondContact O-NH2 3.1Å; R703-R708 HydrophobicContact CB-CG 3.79Å; R703-R708 PolarHBondContact O-NE 3.48Å; R703-R708 PolarHBondContact O-NH2 3.41Å; P704-R708 PolarHBondContact O-N 2.93Å; L705-R708 WeakPolarHBondContact O-CB 3.48Å; L705-R708 PolarHBondContact O-N 3.25Å; L705-R708 VanDerWaalsContact O-N 3.15Å
709	P	87.8	Confident	88.9	Confident	41 Å²	41	74.8 Å²	74.8	27%	0.266	37%	0.373	S	S	.	.			trans	-66.8	134.1	166.5	28.3	-33	0	0	0	109.8	Y700 F711 L714	Y700-P709 HydrophobicContact CE2-CG 4.17Å; Y700-P709 PolarHBondContact OH-O 2.97Å; P709-F711 HydrophobicContact CG-CE1 4.15Å; P709-F711 HydrophobicContact CG-CZ 4.07Å; P709-F711 PolarHBondContact O-N 3.04Å; P709-L714 HydrophobicContact CB-CD1 4.03Å
710	S	89.8	Confident	88.8	Confident	47 Å²	47	70 Å²	70	33%	0.329	35%	0.352	S	S	.	.			trans	-81.2	112.2	171.3	171.2	0	0	0	0	109.1	K713 L714	S710-K713 PolarHBondContact O-N 3.06Å; S710-L714 WeakPolarHBondContact O-CG 3.36Å; S710-L714 PolarHBondContact O-N 3.37Å
711	F	89	Confident	88.7	Confident	24 Å²	24	72.7 Å²	72.7	11%	0.105	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-29.1	-177.5	-64	-62.9	0	0	0	113.4	Y700 P709 L714 K715 I716 P719 F720 T945	Y700-F711 AromaticContact CD2-CE2 3.87Å; Y700-F711 HydrophobicContact CD2-CE2 3.87Å; Y700-F711 HydrophobicContact CD2-CZ 4.15Å; Y700-F711 HydrophobicContact CE1-CE2 4.26Å; Y700-F711 HydrophobicContact CE2-CD2 4.22Å; Y700-F711 AromaticContact CE2-CE2 3.39Å; Y700-F711 HydrophobicContact CE2-CE2 3.39Å; Y700-F711 AromaticContact CE2-CZ 3.92Å; Y700-F711 HydrophobicContact CE2-CZ 3.92Å; Y700-F711 HydrophobicContact CG-CE2 4.46Å; Y700-F711 AromaticContact CZ-CE2 3.63Å; P709-F711 HydrophobicContact CG-CE1 4.15Å; P709-F711 HydrophobicContact CG-CZ 4.07Å; P709-F711 PolarHBondContact O-N 3.04Å; F711-L714 HydrophobicContact CD1-CD1 4.32Å; F711-L714 CarbonylContact O-C 3.6Å; F711-L714 WeakPolarHBondContact O-CA 3.31Å; F711-L714 PolarHBondContact O-N 3.44Å; F711-L714 VanDerWaalsContact O-N 3.1Å; F711-K715 PolarHBondContact O-N 3.15Å; F711-I716 HydrophobicContact CB-CB 4.41Å; F711-I716 HydrophobicContact CD1-CD1 4.12Å; F711-I716 PolarHBondContact O-N 3.05Å; F711-P719 HydrophobicContact CD1-CB 3.64Å; F711-P719 HydrophobicContact CD1-CG 4.31Å; F711-P719 HydrophobicContact CD2-CB 3.81Å; F711-P719 HydrophobicContact CD2-CG 3.62Å; F711-P719 HydrophobicContact CE1-CB 3.56Å; F711-P719 HydrophobicContact CE1-CG 4.44Å; F711-P719 HydrophobicContact CE2-CB 3.72Å; F711-P719 HydrophobicContact CE2-CG 3.76Å; F711-P719 HydrophobicContact CG-CB 3.76Å; F711-P719 HydrophobicContact CG-CG 3.9Å; F711-P719 HydrophobicContact CZ-CB 3.6Å; F711-P719 HydrophobicContact CZ-CG 4.18Å; F711-F720 HydrophobicContact CE2-CE1 4.49Å; F711-F720 AromaticContact CE2-CE2 3.82Å; F711-F720 HydrophobicContact CE2-CE2 3.82Å; F711-F720 AromaticContact CE2-CZ 3.56Å; F711-F720 HydrophobicContact CE2-CZ 3.56Å; F711-F720 HydrophobicContact CZ-CE1 4.21Å; F711-F720 HydrophobicContact CZ-CE2 4.33Å; F711-F720 AromaticContact CZ-CZ 3.68Å; F711-F720 HydrophobicContact CZ-CZ 3.68Å; F711-T945 WeakPolarHBondContact CE1-O 3.36Å
712	S	84.6	Confident	88.6	Confident	76 Å²	76	72.1 Å²	72.1	53%	0.531	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-46.3	172.8	-37.5	0	0	0	0	110.9	L714 K715	S712-L714 PolarHBondContact O-N 3.34Å; S712-K715 PolarHBondContact O-N 3.08Å
713	K	85.4	Confident	88.4	Confident	141 Å²	141	68.6 Å²	68.6	61%	0.613	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-30.1	174.2	-68	-175	-179.1	-173.4	0	113	S710 K715 M948	S710-K713 PolarHBondContact O-N 3.06Å; K713-K715 VanDerWaalsContact C-N 3.27Å; K713-M948 WeakPolarHBondContact O-CE 3.33Å
714	L	85.4	Confident	88.5	Confident	24 Å²	24	63.3 Å²	63.3	13%	0.126	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-2	177.4	-65	175.1	0	0	0	113.4	P709 S710 F711 S712 I716 R943 T945 M948	P709-L714 HydrophobicContact CB-CD1 4.03Å; S710-L714 WeakPolarHBondContact O-CG 3.36Å; S710-L714 PolarHBondContact O-N 3.37Å; F711-L714 HydrophobicContact CD1-CD1 4.32Å; F711-L714 CarbonylContact O-C 3.6Å; F711-L714 WeakPolarHBondContact O-CA 3.31Å; F711-L714 PolarHBondContact O-N 3.44Å; F711-L714 VanDerWaalsContact O-N 3.1Å; S712-L714 PolarHBondContact O-N 3.34Å; L714-I716 HydrophobicContact CB-CD1 3.66Å; L714-I716 HydrophobicContact CB-CG1 4.24Å; L714-I716 HydrophobicContact CD1-CD1 4.25Å; L714-R943 PolarHBondContact O-NH1 3.14Å; L714-T945 WeakPolarHBondContact CD1-O 3.23Å; L714-M948 VanDerWaalsContact CA-SD 3.55Å; L714-M948 HydrophobicContact CB-SD 4.18Å; L714-M948 HydrophobicContact CD2-CG 3.64Å; L714-M948 HydrophobicContact CD2-SD 3.51Å; L714-M948 VanDerWaalsContact CD2-SD 3.51Å; L714-M948 HydrophobicContact CG-SD 4.43Å
715	K	86.2	Confident	88.3	Confident	47 Å²	47	62.2 Å²	62.2	20%	0.204	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	57.2	-172	-63	-178.8	173.1	-174	0	111.8	F711 S712 K713 E813 R814 F891 R943	F711-K715 PolarHBondContact O-N 3.15Å; S712-K715 PolarHBondContact O-N 3.08Å; K713-K715 VanDerWaalsContact C-N 3.27Å; K715-E813 HydrophobicContact CD-CG 4.19Å; K715-E813 VanDerWaalsContact CD-OE1 3.31Å; K715-E813 WeakPolarHBondContact CD-OE1 3.42Å; K715-E813 IonicContact NZ-OE1 3.53Å; K715-R814 PolarHBondContact NZ-O 3.1Å; K715-F891 HydrophobicContact CB-CD1 4.14Å; K715-F891 HydrophobicContact CB-CE1 4.14Å; K715-F891 WeakPolarHBondContact O-CD1 3.49Å; K715-R943 PolarHBondContact O-NH2 3.48Å
716	I	86.6	Confident	88.4	Confident	10 Å²	10	58 Å²	58	5%	0.051	29%	0.289	C	S	.	.			trans	-125.2	116.9	173.4	-62	155.4	0	0	0	109.4	F711 L714 P719 T945	F711-I716 HydrophobicContact CB-CB 4.41Å; F711-I716 HydrophobicContact CD1-CD1 4.12Å; F711-I716 PolarHBondContact O-N 3.05Å; L714-I716 HydrophobicContact CB-CD1 3.66Å; L714-I716 HydrophobicContact CB-CG1 4.24Å; L714-I716 HydrophobicContact CD1-CD1 4.25Å; I716-P719 HydrophobicContact CG2-CB 3.99Å; I716-T945 VanDerWaalsContact CD1-C 3.43Å; I716-T945 HydrophobicContact CD1-CG2 4.38Å; I716-T945 WeakPolarHBondContact CD1-O 3.19Å; I716-T945 HydrophobicContact CG2-CG2 4.39Å
717	K	86.1	Confident	88.5	Confident	41 Å²	41	48 Å²	48	18%	0.178	25%	0.246	C	C	.	.	S	Bend	trans	-73.5	-56.2	178	-166.4	174.5	179.1	178.8	0	111.9	P719 E726 E886 V888 F891	K717-P719 WeakPolarHBondContact O-CD 2.98Å; K717-E726 IonicContact NZ-OE1 3.42Å; K717-E726 PolarHBondContact NZ-OE1 3.48Å; K717-E726 IonicContact NZ-OE2 3.41Å; K717-E886 PolarHBondContact NZ-O 2.81Å; K717-V888 HydrophobicContact CD-CG2 4.01Å; K717-F891 HydrophobicContact CB-CD1 4.25Å; K717-F891 HydrophobicContact CB-CE1 4.35Å; K717-F891 HydrophobicContact CB-CG 4.42Å
718	Y	89.5	Confident	88.4	Confident	65 Å²	65	41.6 Å²	41.6	26%	0.255	21%	0.214	S	C	.	.			trans	-112.7	92.1	179.8	-59.4	-73.6	0	0	0	112.1	A723 E726 V888	Y718-A723 HydrophobicContact CD2-CB 3.57Å; Y718-A723 HydrophobicContact CE2-CB 3.78Å; Y718-A723 HydrophobicContact CG-CB 4.19Å; Y718-E726 VanDerWaalsContact CE2-OE2 3.22Å; Y718-E726 WeakPolarHBondContact CE2-OE2 3.5Å; Y718-E726 PolarHBondContact OH-OE2 2.88Å; Y718-V888 HydrophobicContact CD2-CG2 3.76Å; Y718-V888 HydrophobicContact CE2-CG2 3.63Å
719	P	90	Very high	88.3	Confident	17 Å²	17	42.6 Å²	42.6	11%	0.11	22%	0.224	C	C	.	.	S	Bend	trans	-78.9	-21.6	-176.2	28.3	-35	0	0	0	114.7	F711 I716 K717	F711-P719 HydrophobicContact CD1-CB 3.64Å; F711-P719 HydrophobicContact CD1-CG 4.31Å; F711-P719 HydrophobicContact CD2-CB 3.81Å; F711-P719 HydrophobicContact CD2-CG 3.62Å; F711-P719 HydrophobicContact CE1-CB 3.56Å; F711-P719 HydrophobicContact CE1-CG 4.44Å; F711-P719 HydrophobicContact CE2-CB 3.72Å; F711-P719 HydrophobicContact CE2-CG 3.76Å; F711-P719 HydrophobicContact CG-CB 3.76Å; F711-P719 HydrophobicContact CG-CG 3.9Å; F711-P719 HydrophobicContact CZ-CB 3.6Å; F711-P719 HydrophobicContact CZ-CG 4.18Å; I716-P719 HydrophobicContact CG2-CB 3.99Å; K717-P719 WeakPolarHBondContact O-CD 2.98Å
720	F	91.7	Very high	88.3	Confident	31 Å²	31	41.5 Å²	41.5	14%	0.136	22%	0.217	C	C	.	.	S	Bend	trans	-123	-5	-174.6	-53	-62.8	0	0	0	113.3	D693 A696 R697 Y700 F711 H789	D693-F720 WeakPolarHBondContact CB-O 3.39Å; D693-F720 VanDerWaalsContact OD1-O 3.05Å; A696-F720 HydrophobicContact CB-CD1 3.79Å; A696-F720 HydrophobicContact CB-CE1 4.36Å; R697-F720 HydrophobicContact CB-CD2 4.24Å; R697-F720 HydrophobicContact CG-CD2 4.46Å; Y700-F720 HydrophobicContact CD1-CE2 4.12Å; Y700-F720 HydrophobicContact CD1-CZ 4.03Å; Y700-F720 AromaticContact CD2-CZ 3.88Å; Y700-F720 HydrophobicContact CD2-CZ 3.88Å; Y700-F720 HydrophobicContact CG-CE2 4.12Å; Y700-F720 AromaticContact CG-CZ 3.55Å; Y700-F720 HydrophobicContact CG-CZ 3.55Å; F711-F720 HydrophobicContact CE2-CE1 4.49Å; F711-F720 AromaticContact CE2-CE2 3.82Å; F711-F720 HydrophobicContact CE2-CE2 3.82Å; F711-F720 AromaticContact CE2-CZ 3.56Å; F711-F720 HydrophobicContact CE2-CZ 3.56Å; F711-F720 HydrophobicContact CZ-CE1 4.21Å; F711-F720 HydrophobicContact CZ-CE2 4.33Å; F711-F720 AromaticContact CZ-CZ 3.68Å; F711-F720 HydrophobicContact CZ-CZ 3.68Å; F720-H789 VanDerWaalsContact C-CE1 3.47Å; F720-H789 PolarHBondContact O-CE1 2.81Å
721	E	90.4	Very high	88.2	Confident	95 Å²	95	39.5 Å²	39.5	44%	0.444	20%	0.202	S	C	.	.	S	Bend	trans	-127	152.8	-172.5	-179.8	167.1	-173.2	0	0	109.2
722	F	89.5	Confident	87.9	Confident	18 Å²	18	40.8 Å²	40.8	8%	0.079	21%	0.208	C	C	.	.			trans	-103.3	103	175.2	-54.9	-76.6	0	0	0	109.7	W724 R788 H789 F899 L901	F722-W724 HydrophobicContact CB-CD2 4.09Å; F722-W724 HydrophobicContact CB-CG 4.38Å; F722-W724 HydrophobicContact CB-CH2 4.47Å; F722-W724 HydrophobicContact CB-CZ2 3.57Å; F722-W724 VanDerWaalsContact CB-NE1 3.28Å; F722-W724 HydrophobicContact CD1-CH2 4.22Å; F722-W724 AromaticContact CD1-CZ2 3.74Å; F722-W724 HydrophobicContact CD1-CZ2 3.74Å; F722-W724 HydrophobicContact CD2-CZ2 4.43Å; F722-W724 AromaticContact CG-CE2 3.98Å; F722-W724 AromaticContact CG-CZ2 3.68Å; F722-W724 HydrophobicContact CG-CZ2 3.68Å; F722-W724 PolarHBondContact O-N 2.83Å; F722-R788 HydrophobicContact CZ-CG 4.21Å; F722-H789 AromaticContact CD1-ND1 3.82Å; F722-H789 AromaticContact CE1-CE1 3.96Å; F722-H789 AromaticContact CE1-ND1 3.28Å; F722-H789 VanDerWaalsContact CE1-ND1 3.28Å; F722-H789 WeakPolarHBondContact CE1-ND1 3.49Å; F722-H789 AromaticContact CE2-CE1 3.53Å; F722-H789 AromaticContact CE2-ND1 3.71Å; F722-H789 AromaticContact CZ-CE1 3.41Å; F722-H789 VanDerWaalsContact CZ-CE1 3.41Å; F722-H789 WeakPolarHBondContact CZ-CE1 3.42Å; F722-H789 AromaticContact CZ-ND1 3.22Å; F722-H789 WeakPolarHBondContact CZ-ND1 3.49Å; F722-F899 HydrophobicContact CD1-CB 3.73Å; F722-F899 HydrophobicContact CD1-CD2 4.48Å; F722-F899 HydrophobicContact CD1-CG 4.17Å; F722-F899 HydrophobicContact CE1-CB 4.06Å; F722-L901 HydrophobicContact CE1-CD2 4.29Å; F722-L901 HydrophobicContact CE2-CD2 4.2Å; F722-L901 HydrophobicContact CZ-CD2 4.04Å
723	A	89.9	Confident	87.7	Confident	15 Å²	15	43.4 Å²	43.4	12%	0.124	22%	0.216	C	C	.	.			trans	-80.9	68.3	178.6	0	0	0	0	0	111.1	Y718 E726 L727 V888	Y718-A723 HydrophobicContact CD2-CB 3.57Å; Y718-A723 HydrophobicContact CE2-CB 3.78Å; Y718-A723 HydrophobicContact CG-CB 4.19Å; A723-E726 HydrophobicContact CB-CB 4.3Å; A723-L727 WeakPolarHBondContact O-CB 3.21Å; A723-L727 PolarHBondContact O-N 3.29Å; A723-V888 HydrophobicContact CB-CG2 4.29Å
724	W	91.1	Very high	87.1	Confident	10 Å²	10	41.8 Å²	41.8	4%	0.038	21%	0.209	C	C	.	.	H	α-helix	trans	-63.9	-44	-176.7	-60.2	120.8	0	0	0	113.1	F722 L727 I728 Y747 L773 F899 L901 L917	F722-W724 HydrophobicContact CB-CD2 4.09Å; F722-W724 HydrophobicContact CB-CG 4.38Å; F722-W724 HydrophobicContact CB-CH2 4.47Å; F722-W724 HydrophobicContact CB-CZ2 3.57Å; F722-W724 VanDerWaalsContact CB-NE1 3.28Å; F722-W724 HydrophobicContact CD1-CH2 4.22Å; F722-W724 AromaticContact CD1-CZ2 3.74Å; F722-W724 HydrophobicContact CD1-CZ2 3.74Å; F722-W724 HydrophobicContact CD2-CZ2 4.43Å; F722-W724 AromaticContact CG-CE2 3.98Å; F722-W724 AromaticContact CG-CZ2 3.68Å; F722-W724 HydrophobicContact CG-CZ2 3.68Å; F722-W724 PolarHBondContact O-N 2.83Å; W724-L727 HydrophobicContact CE3-CD2 4.35Å; W724-L727 WeakPolarHBondContact O-CB 3.33Å; W724-L727 PolarHBondContact O-N 2.94Å; W724-I728 WeakPolarHBondContact O-CG1 3.26Å; W724-I728 PolarHBondContact O-N 3.47Å; W724-Y747 HydrophobicContact CB-CD1 4.05Å; W724-Y747 HydrophobicContact CB-CD2 4.32Å; W724-Y747 HydrophobicContact CB-CE1 3.79Å; W724-Y747 HydrophobicContact CB-CE2 4.07Å; W724-Y747 HydrophobicContact CB-CG 4.32Å; W724-Y747 AromaticContact CD1-CZ 3.78Å; W724-Y747 HydrophobicContact CG-CE2 4.21Å; W724-L773 HydrophobicContact CB-CD1 4.16Å; W724-L773 HydrophobicContact CD2-CD1 3.83Å; W724-L773 HydrophobicContact CE3-CD1 3.76Å; W724-L773 HydrophobicContact CE3-CD2 4.04Å; W724-L773 HydrophobicContact CG-CD1 4Å; W724-L773 HydrophobicContact CZ3-CD1 4.47Å; W724-F899 AromaticContact CE3-CD2 3.95Å; W724-F899 HydrophobicContact CE3-CD2 3.95Å; W724-F899 HydrophobicContact CH2-CB 3.71Å; W724-F899 AromaticContact CH2-CD2 3.84Å; W724-F899 HydrophobicContact CH2-CD2 3.84Å; W724-F899 HydrophobicContact CH2-CG 4.27Å; W724-F899 HydrophobicContact CZ3-CB 4.14Å; W724-F899 AromaticContact CZ3-CD2 3.52Å; W724-F899 HydrophobicContact CZ3-CD2 3.52Å; W724-F899 HydrophobicContact CZ3-CE2 4.46Å; W724-F899 HydrophobicContact CZ3-CG 4.31Å; W724-L901 HydrophobicContact CH2-CD2 4.36Å; W724-L901 HydrophobicContact CZ2-CD2 3.75Å; W724-L917 HydrophobicContact CH2-CB 3.62Å; W724-L917 HydrophobicContact CH2-CD1 4.13Å; W724-L917 HydrophobicContact CH2-CG 4.38Å; W724-L917 HydrophobicContact CZ2-CB 4.37Å; W724-L917 HydrophobicContact CZ2-CD1 4.03Å; W724-L917 HydrophobicContact CZ3-CB 3.69Å
725	S	88.6	Confident	86.4	Confident	66 Å²	66	43.2 Å²	43.2	46%	0.462	22%	0.217	S	C	.	.	H	α-helix	trans	-60.9	-53.7	179.6	-48.3	0	0	0	0	110.9	L727 I728 D729	S725-L727 VanDerWaalsContact C-N 3.28Å; S725-L727 PolarHBondContact O-N 3.34Å; S725-I728 PolarHBondContact O-N 3.21Å; S725-D729 PolarHBondContact O-N 3.4Å; S725-D729 VanDerWaalsContact O-OD2 3.11Å
726	E	88.3	Confident	85	Confident	50 Å²	50	51.9 Å²	51.9	23%	0.234	25%	0.248	C	C	.	.	H	α-helix	trans	-60.4	-36.3	178.7	-170	-176.7	164.8	0	0	112.6	K717 Y718 A723 S730 V888	K717-E726 IonicContact NZ-OE1 3.42Å; K717-E726 PolarHBondContact NZ-OE1 3.48Å; K717-E726 IonicContact NZ-OE2 3.41Å; Y718-E726 VanDerWaalsContact CE2-OE2 3.22Å; Y718-E726 WeakPolarHBondContact CE2-OE2 3.5Å; Y718-E726 PolarHBondContact OH-OE2 2.88Å; A723-E726 HydrophobicContact CB-CB 4.3Å; E726-S730 VanDerWaalsContact O-CB 3.3Å; E726-S730 WeakPolarHBondContact O-CB 3.44Å; E726-S730 PolarHBondContact O-N 2.84Å; E726-S730 PolarHBondContact O-OG 3.17Å; E726-V888 HydrophobicContact CB-CG2 4.47Å; E726-V888 HydrophobicContact CG-CB 4.46Å; E726-V888 HydrophobicContact CG-CG2 4.06Å; E726-V888 WeakPolarHBondContact OE1-CG2 3.42Å; E726-V888 PolarHBondContact OE1-N 2.95Å; E726-V888 WeakPolarHBondContact OE2-CG2 3.49Å
727	L	89.9	Confident	83.4	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.9	-47.6	174	-175.7	88	0	0	0	110.9	A723 W724 S725 S730 W731 V888 V889 V896 F899	A723-L727 WeakPolarHBondContact O-CB 3.21Å; A723-L727 PolarHBondContact O-N 3.29Å; W724-L727 HydrophobicContact CE3-CD2 4.35Å; W724-L727 WeakPolarHBondContact O-CB 3.33Å; W724-L727 PolarHBondContact O-N 2.94Å; S725-L727 VanDerWaalsContact C-N 3.28Å; S725-L727 PolarHBondContact O-N 3.34Å; L727-S730 PolarHBondContact O-OG 3.29Å; L727-W731 PolarHBondContact O-N 3.12Å; L727-V888 HydrophobicContact CD1-CG1 4.22Å; L727-V889 HydrophobicContact CD1-CG2 4.16Å; L727-V896 HydrophobicContact CD1-CG1 4.22Å; L727-F899 HydrophobicContact CB-CE2 4.44Å; L727-F899 HydrophobicContact CD1-CE2 4.17Å; L727-F899 HydrophobicContact CD1-CZ 4.46Å; L727-F899 HydrophobicContact CD2-CE2 4.38Å
728	I	89	Confident	81.7	Confident	3 Å²	3	63 Å²	63	2%	0.015	29%	0.293	C	S	.	.	H	α-helix	trans	-67.2	-46.8	-178.5	-69.7	163.8	0	0	0	110.4	W724 S725 S730 W731 K732 Y747 L773	W724-I728 WeakPolarHBondContact O-CG1 3.26Å; W724-I728 PolarHBondContact O-N 3.47Å; S725-I728 PolarHBondContact O-N 3.21Å; I728-S730 VanDerWaalsContact C-N 3.32Å; I728-S730 PolarHBondContact O-N 3.45Å; I728-W731 PolarHBondContact O-N 3.05Å; I728-W731 VanDerWaalsContact O-N 3.11Å; I728-K732 HydrophobicContact CG2-CD 4.41Å; I728-K732 HydrophobicContact CG2-CG 4.44Å; I728-K732 WeakPolarHBondContact O-CG 3.23Å; I728-K732 PolarHBondContact O-N 2.92Å; I728-Y747 HydrophobicContact CD1-CG 4.06Å; I728-L773 HydrophobicContact CD1-CD2 3.93Å; I728-L773 HydrophobicContact CD1-CG 4.06Å; I728-L773 HydrophobicContact CG1-CD2 4.14Å
729	D	86.1	Confident	79.5	Confident	74 Å²	74	65.4 Å²	65.4	40%	0.396	32%	0.319	S	S	.	.	H	α-helix	trans	-62.7	-40.4	-177.6	-60.5	-27.4	0	0	0	111.6	S725 W731 K732 N733	S725-D729 PolarHBondContact O-N 3.4Å; S725-D729 VanDerWaalsContact O-OD2 3.11Å; D729-W731 VanDerWaalsContact C-N 3.35Å; D729-W731 PolarHBondContact O-N 3.17Å; D729-K732 PolarHBondContact O-N 3.12Å; D729-K732 IonicContact OD1-NZ 2.74Å; D729-N733 PolarHBondContact O-N 2.98Å; D729-N733 PolarHBondContact O-ND2 2.73Å
730	S	87.2	Confident	77.5	Confident	17 Å²	17	68.6 Å²	68.6	12%	0.119	34%	0.342	C	S	.	.	H	α-helix	trans	-65.9	-35	175.3	53.8	0	0	0	0	113.4	E726 L727 I728 F734 V889	E726-S730 VanDerWaalsContact O-CB 3.3Å; E726-S730 WeakPolarHBondContact O-CB 3.44Å; E726-S730 PolarHBondContact O-N 2.84Å; E726-S730 PolarHBondContact O-OG 3.17Å; L727-S730 PolarHBondContact O-OG 3.29Å; I728-S730 VanDerWaalsContact C-N 3.32Å; I728-S730 PolarHBondContact O-N 3.45Å; S730-F734 PolarHBondContact O-N 3.38Å; S730-V889 WeakPolarHBondContact OG-CG2 3.45Å
731	W	87.1	Confident	75.2	Confident	6 Å²	6	72.4 Å²	72.4	2%	0.023	37%	0.37	C	S	.	.	H	α-helix	trans	-72.6	-35.7	174	-84.8	106.2	0	0	0	112.8	L727 I728 D729 F734 D735 L794 V889 P895 V896 I897 L921 A922 R925	L727-W731 PolarHBondContact O-N 3.12Å; I728-W731 PolarHBondContact O-N 3.05Å; I728-W731 VanDerWaalsContact O-N 3.11Å; D729-W731 VanDerWaalsContact C-N 3.35Å; D729-W731 PolarHBondContact O-N 3.17Å; W731-F734 WeakPolarHBondContact O-CB 3.49Å; W731-F734 PolarHBondContact O-N 3.35Å; W731-D735 PolarHBondContact O-N 3Å; W731-L794 HydrophobicContact CH2-CD1 3.78Å; W731-L794 HydrophobicContact CZ2-CD1 4.36Å; W731-V889 HydrophobicContact CG-CG2 4.41Å; W731-V889 HydrophobicContact CZ2-CG1 3.9Å; W731-P895 HydrophobicContact CZ2-CB 4.37Å; W731-V896 PolarHBondContact NE1-O 3.45Å; W731-I897 HydrophobicContact CZ2-CG2 4.05Å; W731-L921 HydrophobicContact CB-CB 4.44Å; W731-A922 HydrophobicContact CD2-CB 3.7Å; W731-A922 VanDerWaalsContact CE2-CB 3.44Å; W731-A922 HydrophobicContact CE3-CB 4.19Å; W731-A922 HydrophobicContact CG-CB 4.14Å; W731-A922 HydrophobicContact CH2-CB 4.25Å; W731-A922 HydrophobicContact CZ2-CB 3.76Å; W731-A922 HydrophobicContact CZ3-CB 4.44Å; W731-R925 HydrophobicContact CZ3-CB 4.4Å; W731-R925 VanDerWaalsContact CZ3-CD 3.44Å
732	K	83.2	Confident	73.3	Confident	51 Å²	51	71.5 Å²	71.5	22%	0.222	37%	0.371	C	S	.	.	H	α-helix	trans	-60.7	-47.2	171.4	-73.1	176.6	179.1	169.6	0	111.9	I728 D729 F734 D735 N771 L921	I728-K732 HydrophobicContact CG2-CD 4.41Å; I728-K732 HydrophobicContact CG2-CG 4.44Å; I728-K732 WeakPolarHBondContact O-CG 3.23Å; I728-K732 PolarHBondContact O-N 2.92Å; D729-K732 PolarHBondContact O-N 3.12Å; D729-K732 IonicContact OD1-NZ 2.74Å; K732-F734 PolarHBondContact O-N 3.15Å; K732-F734 VanDerWaalsContact O-N 3.15Å; K732-D735 CarbonylContact O-C 3.53Å; K732-D735 PolarHBondContact O-N 3.39Å; K732-N771 WeakPolarHBondContact CE-OD1 3.46Å; K732-N771 PolarHBondContact NZ-OD1 3.45Å; K732-L921 HydrophobicContact CG-CD1 4.03Å
733	N	80.8	Confident	71.6	Confident	131 Å²	131	77.8 Å²	77.8	70%	0.701	41%	0.405	S	S	*	.	H	α-helix	trans	-60.9	-26.8	179.8	-70.5	-19.1	0	0	0	112.4	D729	D729-N733 PolarHBondContact O-N 2.98Å; D729-N733 PolarHBondContact O-ND2 2.73Å
734	F	73.5	Confident	70.3	Confident	106 Å²	106	84.6 Å²	84.6	47%	0.465	44%	0.44	S	S	.	.	H	α-helix	trans	-77.1	-39.2	175.7	-161.4	-85.5	0	0	0	112.2	S730 W731 K732 R736	S730-F734 PolarHBondContact O-N 3.38Å; W731-F734 WeakPolarHBondContact O-CB 3.49Å; W731-F734 PolarHBondContact O-N 3.35Å; K732-F734 PolarHBondContact O-N 3.15Å; K732-F734 VanDerWaalsContact O-N 3.15Å; F734-R736 PolarHBondContact O-N 3.3Å; F734-R736 VanDerWaalsContact O-N 3.13Å
735	D	69	Low	69.3	Low	55 Å²	55	88.3 Å²	88.3	29%	0.294	46%	0.457	S	S	.	.	S	Bend	trans	-87.1	78.8	-179.1	-147.5	-6.5	0	0	0	110.1	W731 K732 R737 N738	W731-D735 PolarHBondContact O-N 3Å; K732-D735 CarbonylContact O-C 3.53Å; K732-D735 PolarHBondContact O-N 3.39Å; D735-R737 PolarHBondContact O-N 3.05Å; D735-N738 PolarHBondContact O-N 3.49Å
736	R	57	Low	69	Low	229 Å²	229	89 Å²	89	86%	0.864	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	1.9	-174.8	-67.2	-175.6	177.4	-179.9	-1.3	116.2	F734	F734-R736 PolarHBondContact O-N 3.3Å; F734-R736 VanDerWaalsContact O-N 3.13Å
737	R	52.9	Low	69.1	Low	218 Å²	218	88.8 Å²	88.8	82%	0.823	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-26.7	179.6	-62.2	-176.6	-162.1	-178.7	5.8	113.1	D735	D735-R737 PolarHBondContact O-N 3.05Å
738	N	50.7	Low	69.2	Low	67 Å²	67	89 Å²	89	36%	0.358	46%	0.459	S	S	.	.			trans	-120.1	61.9	-173.5	-68.7	-0.9	0	0	0	111.4	D735 S740 D767	D735-N738 PolarHBondContact O-N 3.49Å; N738-S740 VanDerWaalsContact C-N 3.26Å; N738-S740 PolarHBondContact O-N 3.31Å; N738-D767 PolarHBondContact ND2-OD1 3.33Å
739	S	44	Very low	69.4	Low	114 Å²	114	89.4 Å²	89.4	80%	0.797	46%	0.461	S	S	*	.			trans	-85.7	68	164.4	62.7	0	0	0	0	109.8
740	S	47.5	Very low	69.7	Low	85 Å²	85	86 Å²	86	59%	0.594	44%	0.444	S	S	*	.			trans	-100	126.6	161	57.4	0	0	0	0	108.8	N738 T742	N738-S740 VanDerWaalsContact C-N 3.26Å; N738-S740 PolarHBondContact O-N 3.31Å; S740-T742 PolarHBondContact O-N 3.14Å
741	P	44.8	Very low	69.8	Low	111 Å²	111	85.9 Å²	85.9	72%	0.721	44%	0.44	S	S	*	.			trans	-80.3	86.6	-176.1	33.4	-32.4	0	0	0	109.7
742	T	50.3	Low	70	Confident	76 Å²	76	86.2 Å²	86.2	47%	0.466	44%	0.443	S	S	.	.			trans	-126.5	73	159.6	50.2	0	0	0	0	108.2	S740 D744	S740-T742 PolarHBondContact O-N 3.14Å; T742-D744 PolarHBondContact O-N 3.19Å
743	D	53.1	Low	70.2	Confident	149 Å²	149	87.1 Å²	87.1	80%	0.797	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	4.6	-170.5	-70.5	-32.8	0	0	0	115.2
744	D	63.3	Low	70.6	Confident	159 Å²	159	86 Å²	86	85%	0.85	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124	5.2	-173.6	-71.8	-40.8	0	0	0	115.1	T742	T742-D744 PolarHBondContact O-N 3.19Å
745	E	68.5	Low	71.2	Confident	87 Å²	87	81 Å²	81	41%	0.407	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-73.6	126.6	-179.5	-74.3	-167.7	-172	0	0	112.5	Y363 N771	Y363-E745 PolarHBondContact OH-OE2 2.91Å; E745-N771 PolarHBondContact OE2-ND2 2.92Å
746	P	83.2	Confident	72.2	Confident	82 Å²	82	78.7 Å²	78.7	53%	0.532	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-68.8	144.3	-179.1	28.4	-34	0	0	0	111	Y363	Y363-P746 HydrophobicContact CD1-CG 4.05Å; Y363-P746 WeakPolarHBondContact CD1-O 3.37Å; Y363-P746 WeakPolarHBondContact CE1-O 3.27Å
747	Y	89.8	Confident	73.6	Confident	45 Å²	45	73.2 Å²	73.2	18%	0.176	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-65.9	152.5	173.6	65.4	-93.2	0	0	0	112	A680 W724 I728 N771 L773	A680-Y747 PolarHBondContact O-OH 2.92Å; W724-Y747 HydrophobicContact CB-CD1 4.05Å; W724-Y747 HydrophobicContact CB-CD2 4.32Å; W724-Y747 HydrophobicContact CB-CE1 3.79Å; W724-Y747 HydrophobicContact CB-CE2 4.07Å; W724-Y747 HydrophobicContact CB-CG 4.32Å; W724-Y747 AromaticContact CD1-CZ 3.78Å; W724-Y747 HydrophobicContact CG-CE2 4.21Å; I728-Y747 HydrophobicContact CD1-CG 4.06Å; Y747-N771 WeakPolarHBondContact CA-O 3.24Å; Y747-L773 HydrophobicContact CD2-CD1 3.69Å; Y747-L773 HydrophobicContact CD2-CG 4.49Å; Y747-L773 HydrophobicContact CE2-CD1 4.1Å; Y747-L773 HydrophobicContact CG-CD1 4.47Å
748	F	92.1	Very high	75.1	Confident	4 Å²	4	68.4 Å²	68.4	2%	0.018	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	157.6	175.2	66.4	-85.8	0	0	0	111.5	P362 Y363 L750 W768 N771 S772 L773	P362-F748 HydrophobicContact CB-CD2 3.79Å; P362-F748 HydrophobicContact CB-CE2 3.86Å; P362-F748 HydrophobicContact CB-CG 4.27Å; P362-F748 HydrophobicContact CB-CZ 4.37Å; P362-F748 HydrophobicContact CG-CD1 4.38Å; P362-F748 HydrophobicContact CG-CD2 4.16Å; P362-F748 HydrophobicContact CG-CE1 4.17Å; P362-F748 HydrophobicContact CG-CE2 3.97Å; P362-F748 HydrophobicContact CG-CG 4.36Å; P362-F748 HydrophobicContact CG-CZ 3.95Å; Y363-F748 HydrophobicContact CD1-CB 4.13Å; Y363-F748 AromaticContact CD1-CD1 3.87Å; Y363-F748 HydrophobicContact CD1-CD1 3.87Å; Y363-F748 HydrophobicContact CD1-CG 4.34Å; Y363-F748 HydrophobicContact CE1-CB 4.44Å; Y363-F748 AromaticContact CE1-CD1 3.35Å; Y363-F748 HydrophobicContact CE1-CD1 3.35Å; Y363-F748 AromaticContact CE1-CE1 3.91Å; Y363-F748 HydrophobicContact CE1-CE1 3.91Å; Y363-F748 HydrophobicContact CE1-CG 4.25Å; Y363-F748 AromaticContact CZ-CD1 3.99Å; F748-L750 HydrophobicContact CE2-CD1 4.28Å; F748-W768 HydrophobicContact CE2-CE3 4.31Å; F748-W768 AromaticContact CE2-CZ3 3.84Å; F748-W768 HydrophobicContact CE2-CZ3 3.84Å; F748-W768 AromaticContact CZ-CE3 3.8Å; F748-W768 HydrophobicContact CZ-CE3 3.8Å; F748-W768 AromaticContact CZ-CZ3 3.81Å; F748-W768 HydrophobicContact CZ-CZ3 3.81Å; F748-N771 HydrophobicContact CD1-CB 4.3Å; F748-N771 HydrophobicContact CE1-CB 4.04Å; F748-N771 PolarHBondContact N-O 2.85Å; F748-S772 CarbonylContact O-C 3.28Å; F748-S772 WeakPolarHBondContact O-CA 3.43Å; F748-L773 PolarHBondContact O-N 3.12Å
749	V	93.1	Very high	76.7	Confident	11 Å²	11	65.4 Å²	65.4	7%	0.067	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	122.9	172.8	178.2	0	0	0	0	109.4	D681 R751 L773 L917	D681-V749 HydrophobicContact CB-CG2 4.02Å; D681-V749 PolarHBondContact OD2-N 3.22Å; V749-R751 PolarHBondContact O-N 3.5Å; V749-R751 PolarHBondContact O-NH1 2.84Å; V749-L773 CarbonylContact C-O 3.59Å; V749-L773 WeakPolarHBondContact CA-O 3.49Å; V749-L773 HydrophobicContact CG2-CB 4.26Å; V749-L917 HydrophobicContact CG1-CD2 4.06Å; V749-L917 HydrophobicContact CG2-CD1 4.26Å; V749-L917 HydrophobicContact CG2-CD2 4.14Å
750	L	92.3	Very high	78.4	Confident	4 Å²	4	62.3 Å²	62.3	2%	0.021	33%	0.333	C	S	.	.			trans	-66.9	118.8	178.8	-173.9	67.6	0	0	0	110.3	F748 N752 A755 L756 L759 W768 M769 L773 V774	F748-L750 HydrophobicContact CE2-CD1 4.28Å; L750-N752 HydrophobicContact CD1-CB 4.4Å; L750-A755 HydrophobicContact CD1-CB 4.25Å; L750-A755 HydrophobicContact CD2-CB 4.17Å; L750-L756 HydrophobicContact CD2-CD2 4.1Å; L750-L756 HydrophobicContact CG-CD2 4.31Å; L750-L759 HydrophobicContact CD2-CD1 3.42Å; L750-L759 VanDerWaalsContact CD2-CD1 3.42Å; L750-W768 HydrophobicContact CD1-CH2 3.51Å; L750-W768 HydrophobicContact CD1-CZ2 4.42Å; L750-W768 HydrophobicContact CD1-CZ3 3.84Å; L750-M769 HydrophobicContact CD2-SD 4.35Å; L750-L773 PolarHBondContact N-O 3.12Å; L750-V774 HydrophobicContact CB-CG2 4.34Å; L750-V774 HydrophobicContact CD2-CG2 4.11Å
751	R	90.2	Very high	79.8	Confident	14 Å²	14	61.8 Å²	61.8	5%	0.053	33%	0.329	C	S	.	.			trans	-123.8	-1.6	178.6	-63.1	-178.6	-171.4	79.5	-5.8	114.3	V335 C365 D681 V749 K753	V335-R751 HydrophobicContact CG1-CB 3.91Å; V335-R751 HydrophobicContact CG2-CB 4.19Å; C365-R751 PolarHBondContact SG-NH2 2.79Å; D681-R751 IonicContact OD1-CZ 3.22Å; D681-R751 IonicContact OD1-NH2 2.81Å; D681-R751 PolarHBondContact OD1-NH2 3.17Å; D681-R751 IonicContact OD2-CZ 3.23Å; D681-R751 IonicContact OD2-NH1 2.71Å; D681-R751 PolarHBondContact OD2-NH1 2.89Å; D681-R751 IonicContact OD2-NH2 2.92Å; D681-R751 PolarHBondContact OD2-NH2 2.86Å; V749-R751 PolarHBondContact O-N 3.5Å; V749-R751 PolarHBondContact O-NH1 2.84Å; R751-K753 PolarHBondContact O-N 3.33Å
752	N	90.1	Very high	80.8	Confident	13 Å²	13	60.1 Å²	60.1	7%	0.07	31%	0.312	C	S	.	.			trans	-62.6	120.4	177.7	176.4	-36.5	0	0	0	109.2	E334 L750 L754 A755 L756 W768	E334-N752 HydrophobicContact CB-CB 4.43Å; E334-N752 PolarHBondContact OE2-ND2 3.43Å; L750-N752 HydrophobicContact CD1-CB 4.4Å; N752-L754 VanDerWaalsContact C-N 3.34Å; N752-L754 PolarHBondContact O-N 3.38Å; N752-L754 WeakPolarHBondContact OD1-CB 3.45Å; N752-L754 PolarHBondContact OD1-N 3.27Å; N752-A755 HydrophobicContact CB-CB 3.89Å; N752-A755 PolarHBondContact O-N 2.83Å; N752-A755 PolarHBondContact OD1-N 3.49Å; N752-L756 WeakPolarHBondContact O-CB 3.48Å; N752-L756 VanDerWaalsContact O-CG 3.31Å; N752-L756 WeakPolarHBondContact O-CG 3.47Å; N752-L756 PolarHBondContact O-N 2.79Å; N752-W768 HydrophobicContact CB-CH2 4.46Å
753	K	87.9	Confident	81.3	Confident	70 Å²	70	60 Å²	60	30%	0.304	31%	0.312	S	S	.	.	H	α-helix	trans	-66.8	-34.8	-173.7	-68.3	-168.7	177.2	-153.7	0	112.4	E334 V335 R751 K757 D960 D961	E334-K753 PolarHBondContact O-N 3.48Å; V335-K753 WeakPolarHBondContact O-CE 3.22Å; V335-K753 WeakPolarHBondContact O-CG 3.47Å; R751-K753 PolarHBondContact O-N 3.33Å; K753-K757 WeakPolarHBondContact O-CB 3.16Å; K753-K757 VanDerWaalsContact O-CG 3.25Å; K753-K757 WeakPolarHBondContact O-CG 3.45Å; K753-K757 PolarHBondContact O-N 2.84Å; K753-D960 WeakPolarHBondContact CE-O 3.39Å; K753-D960 PolarHBondContact NZ-O 3.02Å; K753-D961 PolarHBondContact NZ-OXT 3.24Å
754	L	88.5	Confident	81.8	Confident	106 Å²	106	58.2 Å²	58.2	56%	0.555	31%	0.306	S	S	*	.	H	α-helix	trans	-70	-44.5	177.9	-64.2	176.5	0	0	0	110.6	N752 K757 R758	N752-L754 VanDerWaalsContact C-N 3.34Å; N752-L754 PolarHBondContact O-N 3.38Å; N752-L754 WeakPolarHBondContact OD1-CB 3.45Å; N752-L754 PolarHBondContact OD1-N 3.27Å; L754-K757 WeakPolarHBondContact O-CB 3.46Å; L754-K757 PolarHBondContact O-N 3.12Å; L754-R758 WeakPolarHBondContact O-CG 3.48Å; L754-R758 PolarHBondContact O-N 2.73Å
755	A	87.8	Confident	82.1	Confident	2 Å²	2	52.1 Å²	52.1	2%	0.017	28%	0.275	C	S	.	.	H	α-helix	trans	-61	-46.5	175.2	0	0	0	0	0	111.7	L750 N752 K757 R758 L759 M769	L750-A755 HydrophobicContact CD1-CB 4.25Å; L750-A755 HydrophobicContact CD2-CB 4.17Å; N752-A755 HydrophobicContact CB-CB 3.89Å; N752-A755 PolarHBondContact O-N 2.83Å; N752-A755 PolarHBondContact OD1-N 3.49Å; A755-K757 VanDerWaalsContact C-N 3.31Å; A755-K757 PolarHBondContact O-N 3.15Å; A755-R758 PolarHBondContact O-N 3.04Å; A755-L759 WeakPolarHBondContact O-CB 3.39Å; A755-L759 WeakPolarHBondContact O-CG 3.47Å; A755-L759 PolarHBondContact O-N 3.14Å; A755-M769 HydrophobicContact CB-CE 3.49Å; A755-M769 VanDerWaalsContact CB-CE 3.49Å
756	L	88.5	Confident	82.5	Confident	7 Å²	7	51.5 Å²	51.5	4%	0.037	27%	0.272	C	S	.	.	H	α-helix	trans	-63.3	-36.2	176.5	-70.9	173.5	0	0	0	112.4	L750 N752 S760 V774 V957	L750-L756 HydrophobicContact CD2-CD2 4.1Å; L750-L756 HydrophobicContact CG-CD2 4.31Å; N752-L756 WeakPolarHBondContact O-CB 3.48Å; N752-L756 VanDerWaalsContact O-CG 3.31Å; N752-L756 WeakPolarHBondContact O-CG 3.47Å; N752-L756 PolarHBondContact O-N 2.79Å; L756-S760 WeakPolarHBondContact O-CB 3.47Å; L756-S760 PolarHBondContact O-N 3.34Å; L756-S760 PolarHBondContact O-OG 2.79Å; L756-V774 HydrophobicContact CD2-CG1 3.94Å; L756-V957 HydrophobicContact CD2-CG1 4.07Å
757	K	86.6	Confident	82.1	Confident	114 Å²	114	53.2 Å²	53.2	50%	0.496	28%	0.277	S	S	.	.	H	α-helix	trans	-64	-47	172.1	-80	177.2	-179.9	-174.4	0	111.5	K753 L754 A755 L759 S760 S761	K753-K757 WeakPolarHBondContact O-CB 3.16Å; K753-K757 VanDerWaalsContact O-CG 3.25Å; K753-K757 WeakPolarHBondContact O-CG 3.45Å; K753-K757 PolarHBondContact O-N 2.84Å; L754-K757 WeakPolarHBondContact O-CB 3.46Å; L754-K757 PolarHBondContact O-N 3.12Å; A755-K757 VanDerWaalsContact C-N 3.31Å; A755-K757 PolarHBondContact O-N 3.15Å; K757-L759 PolarHBondContact O-N 3.42Å; K757-S760 WeakPolarHBondContact CA-OG 3.42Å; K757-S760 CarbonylContact O-C 3.5Å; K757-S760 PolarHBondContact O-N 2.85Å; K757-S760 VanDerWaalsContact O-N 3.15Å; K757-S760 PolarHBondContact O-OG 2.8Å; K757-S761 PolarHBondContact O-N 2.93Å; K757-S761 PolarHBondContact O-OG 3.45Å
758	R	85.2	Confident	81.8	Confident	116 Å²	116	55.6 Å²	55.6	44%	0.438	29%	0.285	S	S	.	.	H	α-helix	trans	-59.6	-44	176.5	-73.2	177.4	-173.7	156.8	3.8	112.3	L754 A755 S760 S761 M762 V763 E766	L754-R758 WeakPolarHBondContact O-CG 3.48Å; L754-R758 PolarHBondContact O-N 2.73Å; A755-R758 PolarHBondContact O-N 3.04Å; R758-S760 VanDerWaalsContact C-N 3.34Å; R758-S760 PolarHBondContact O-N 3.35Å; R758-S761 WeakPolarHBondContact CA-OG 3.33Å; R758-S761 CarbonylContact O-C 3.59Å; R758-S761 PolarHBondContact O-N 2.67Å; R758-S761 PolarHBondContact O-OG 3.43Å; R758-M762 PolarHBondContact O-N 2.86Å; R758-V763 HydrophobicContact CB-CB 4.44Å; R758-V763 PolarHBondContact O-N 2.86Å; R758-E766 IonicContact NH1-OE1 3.25Å; R758-E766 PolarHBondContact NH1-OE1 3.07Å
759	L	83.2	Confident	81.4	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-62.4	-41.5	174.5	-74.6	172	0	0	0	111.5	L750 A755 K757 S761 M762 T765 V774	L750-L759 HydrophobicContact CD2-CD1 3.42Å; L750-L759 VanDerWaalsContact CD2-CD1 3.42Å; A755-L759 WeakPolarHBondContact O-CB 3.39Å; A755-L759 WeakPolarHBondContact O-CG 3.47Å; A755-L759 PolarHBondContact O-N 3.14Å; K757-L759 PolarHBondContact O-N 3.42Å; L759-S761 VanDerWaalsContact C-N 3.3Å; L759-S761 PolarHBondContact O-N 3.44Å; L759-M762 PolarHBondContact O-N 3.05Å; L759-M762 VanDerWaalsContact O-N 3.14Å; L759-T765 HydrophobicContact CD2-CG2 3.96Å; L759-V774 HydrophobicContact CD1-CG2 4Å
760	S	80	Confident	80.8	Confident	50 Å²	50	55.7 Å²	55.7	35%	0.35	29%	0.287	S	S	.	.	H	α-helix	trans	-67.2	-31.1	175.3	73.3	0	0	0	0	113	L756 K757 R758 M762 Q959	L756-S760 WeakPolarHBondContact O-CB 3.47Å; L756-S760 PolarHBondContact O-N 3.34Å; L756-S760 PolarHBondContact O-OG 2.79Å; K757-S760 WeakPolarHBondContact CA-OG 3.42Å; K757-S760 CarbonylContact O-C 3.5Å; K757-S760 PolarHBondContact O-N 2.85Å; K757-S760 VanDerWaalsContact O-N 3.15Å; K757-S760 PolarHBondContact O-OG 2.8Å; R758-S760 VanDerWaalsContact C-N 3.34Å; R758-S760 PolarHBondContact O-N 3.35Å; S760-M762 VanDerWaalsContact C-N 3.29Å; S760-Q959 PolarHBondContact OG-NE2 3.23Å; S760-Q959 VanDerWaalsContact OG-NE2 3.08Å
761	S	77.7	Confident	80.6	Confident	74 Å²	74	56.2 Å²	56.2	52%	0.517	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	8.1	173	64.5	0	0	0	0	113.6	K757 R758 L759 V763	K757-S761 PolarHBondContact O-N 2.93Å; K757-S761 PolarHBondContact O-OG 3.45Å; R758-S761 WeakPolarHBondContact CA-OG 3.33Å; R758-S761 CarbonylContact O-C 3.59Å; R758-S761 PolarHBondContact O-N 2.67Å; R758-S761 PolarHBondContact O-OG 3.43Å; L759-S761 VanDerWaalsContact C-N 3.3Å; L759-S761 PolarHBondContact O-N 3.44Å; S761-V763 PolarHBondContact O-N 3.2Å
762	M	65.9	Low	80.6	Confident	75 Å²	75	55.5 Å²	55.5	37%	0.369	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	33.1	171.7	-44.4	176.3	-166.9	0	0	115	R758 L759 S760 R933 H938	R758-M762 PolarHBondContact O-N 2.86Å; L759-M762 PolarHBondContact O-N 3.05Å; L759-M762 VanDerWaalsContact O-N 3.14Å; S760-M762 VanDerWaalsContact C-N 3.29Å; M762-R933 PolarHBondContact SD-NH2 2.91Å; M762-R933 VanDerWaalsContact SD-NH2 3.35Å; M762-H938 VanDerWaalsContact CE-NE2 3.3Å; M762-H938 WeakPolarHBondContact CE-NE2 3.46Å
763	V	60.9	Low	80.8	Confident	74 Å²	74	54.9 Å²	54.9	45%	0.448	28%	0.284	S	S	.	.			trans	-95.1	148.2	175.1	-177.8	0	0	0	0	110.1	R758 S761	R758-V763 HydrophobicContact CB-CB 4.44Å; R758-V763 PolarHBondContact O-N 2.86Å; S761-V763 PolarHBondContact O-N 3.2Å
764	T	63.4	Low	81	Confident	111 Å²	111	51.6 Å²	51.6	68%	0.681	27%	0.27	S	S	*	.			trans	-41.5	139.6	-174.3	44.9	0	0	0	0	114.9
765	T	68.7	Low	81.3	Confident	31 Å²	31	47.2 Å²	47.2	19%	0.19	25%	0.246	C	C	.	.			trans	-69.4	138.9	170	49.5	0	0	0	0	111.3	L759 N924	L759-T765 HydrophobicContact CD2-CG2 3.96Å; T765-N924 HydrophobicContact CG2-CB 3.7Å; T765-N924 PolarHBondContact OG1-ND2 3.33Å
766	E	76.6	Confident	81.5	Confident	75 Å²	75	47.1 Å²	47.1	35%	0.35	25%	0.245	S	C	.	.			trans	-88.2	151.8	172.7	-60.8	169.5	-162.6	0	0	109.7	R758 W768 M769	R758-E766 IonicContact NH1-OE1 3.25Å; R758-E766 PolarHBondContact NH1-OE1 3.07Å; E766-W768 VanDerWaalsContact C-N 3.31Å; E766-W768 PolarHBondContact O-N 2.97Å; E766-W768 PolarHBondContact OE2-NE1 3.34Å; E766-M769 HydrophobicContact CB-CE 4.02Å; E766-M769 HydrophobicContact CB-CG 4.31Å; E766-M769 HydrophobicContact CB-SD 4.4Å; E766-M769 HydrophobicContact CG-CE 4.07Å; E766-M769 VanDerWaalsContact O-CB 3.25Å; E766-M769 WeakPolarHBondContact O-CB 3.34Å; E766-M769 PolarHBondContact O-N 3.35Å
767	D	76	Confident	81.7	Confident	118 Å²	118	47.8 Å²	47.8	63%	0.631	25%	0.25	S	C	*	.	G	3₁₀ helix	trans	-61.1	-35.6	-171.1	-67	-41.1	0	0	0	113.9	N738 M769 A770	N738-D767 PolarHBondContact ND2-OD1 3.33Å; D767-M769 PolarHBondContact O-N 3.42Å; D767-M769 VanDerWaalsContact O-N 3.1Å; D767-A770 VanDerWaalsContact O-CB 3.26Å; D767-A770 WeakPolarHBondContact O-CB 3.2Å; D767-A770 PolarHBondContact O-N 3.39Å
768	W	83.2	Confident	82	Confident	94 Å²	94	42.3 Å²	42.3	36%	0.356	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-64.3	-15.7	176.8	72.3	-89.8	0	0	0	113.2	P362 F748 L750 N752 E766 A770	P362-W768 HydrophobicContact CG-CZ3 4.39Å; F748-W768 HydrophobicContact CE2-CE3 4.31Å; F748-W768 AromaticContact CE2-CZ3 3.84Å; F748-W768 HydrophobicContact CE2-CZ3 3.84Å; F748-W768 AromaticContact CZ-CE3 3.8Å; F748-W768 HydrophobicContact CZ-CE3 3.8Å; F748-W768 AromaticContact CZ-CZ3 3.81Å; F748-W768 HydrophobicContact CZ-CZ3 3.81Å; L750-W768 HydrophobicContact CD1-CH2 3.51Å; L750-W768 HydrophobicContact CD1-CZ2 4.42Å; L750-W768 HydrophobicContact CD1-CZ3 3.84Å; N752-W768 HydrophobicContact CB-CH2 4.46Å; E766-W768 VanDerWaalsContact C-N 3.31Å; E766-W768 PolarHBondContact O-N 2.97Å; E766-W768 PolarHBondContact OE2-NE1 3.34Å; W768-A770 VanDerWaalsContact C-N 3.29Å
769	M	83.7	Confident	82.3	Confident	6 Å²	6	38.3 Å²	38.3	3%	0.03	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-82.2	-3.6	176.4	-54.4	-177	-175.3	0	0	113	L750 A755 E766 D767 N771 S772	L750-M769 HydrophobicContact CD2-SD 4.35Å; A755-M769 HydrophobicContact CB-CE 3.49Å; A755-M769 VanDerWaalsContact CB-CE 3.49Å; E766-M769 HydrophobicContact CB-CE 4.02Å; E766-M769 HydrophobicContact CB-CG 4.31Å; E766-M769 HydrophobicContact CB-SD 4.4Å; E766-M769 HydrophobicContact CG-CE 4.07Å; E766-M769 VanDerWaalsContact O-CB 3.25Å; E766-M769 WeakPolarHBondContact O-CB 3.34Å; E766-M769 PolarHBondContact O-N 3.35Å; D767-M769 PolarHBondContact O-N 3.42Å; D767-M769 VanDerWaalsContact O-N 3.1Å; M769-N771 VanDerWaalsContact C-N 3.27Å; M769-N771 PolarHBondContact O-N 2.98Å; M769-S772 VanDerWaalsContact O-CB 3.25Å; M769-S772 WeakPolarHBondContact O-CB 3.32Å; M769-S772 PolarHBondContact O-N 3.01Å; M769-S772 PolarHBondContact O-OG 3.33Å
770	A	81.1	Confident	82.7	Confident	12 Å²	12	38.3 Å²	38.3	10%	0.099	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-35.7	-176.4	0	0	0	0	0	113.2	D767 W768 S772 L921	D767-A770 VanDerWaalsContact O-CB 3.26Å; D767-A770 WeakPolarHBondContact O-CB 3.2Å; D767-A770 PolarHBondContact O-N 3.39Å; W768-A770 VanDerWaalsContact C-N 3.29Å; A770-S772 VanDerWaalsContact C-N 3.27Å; A770-S772 PolarHBondContact O-N 2.95Å; A770-L921 HydrophobicContact CB-CD1 4.33Å; A770-L921 HydrophobicContact CB-CD2 4.38Å
771	N	86.8	Confident	83.1	Confident	14 Å²	14	38.7 Å²	38.7	8%	0.075	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	8.2	177.3	-70	-18.3	0	0	0	114.1	K732 E745 Y747 F748 M769	K732-N771 WeakPolarHBondContact CE-OD1 3.46Å; K732-N771 PolarHBondContact NZ-OD1 3.45Å; E745-N771 PolarHBondContact OE2-ND2 2.92Å; Y747-N771 WeakPolarHBondContact CA-O 3.24Å; F748-N771 HydrophobicContact CD1-CB 4.3Å; F748-N771 HydrophobicContact CE1-CB 4.04Å; F748-N771 PolarHBondContact N-O 2.85Å; M769-N771 VanDerWaalsContact C-N 3.27Å; M769-N771 PolarHBondContact O-N 2.98Å
772	S	90.7	Very high	83.3	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	141.1	-167.9	79.1	0	0	0	0	113.7	F748 M769 A770 C920	F748-S772 CarbonylContact O-C 3.28Å; F748-S772 WeakPolarHBondContact O-CA 3.43Å; M769-S772 VanDerWaalsContact O-CB 3.25Å; M769-S772 WeakPolarHBondContact O-CB 3.32Å; M769-S772 PolarHBondContact O-N 3.01Å; M769-S772 PolarHBondContact O-OG 3.33Å; A770-S772 VanDerWaalsContact C-N 3.27Å; A770-S772 PolarHBondContact O-N 2.95Å; S772-C920 WeakPolarHBondContact O-CB 3.25Å; S772-C920 PolarHBondContact O-N 2.97Å; S772-C920 WeakPolarHBondContact OG-CB 3.19Å
773	L	93.9	Very high	84.1	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	134.4	168.1	-65	175.7	0	0	0	109.8	W724 I728 Y747 F748 V749 L750 L917 C918	W724-L773 HydrophobicContact CB-CD1 4.16Å; W724-L773 HydrophobicContact CD2-CD1 3.83Å; W724-L773 HydrophobicContact CE3-CD1 3.76Å; W724-L773 HydrophobicContact CE3-CD2 4.04Å; W724-L773 HydrophobicContact CG-CD1 4Å; W724-L773 HydrophobicContact CZ3-CD1 4.47Å; I728-L773 HydrophobicContact CD1-CD2 3.93Å; I728-L773 HydrophobicContact CD1-CG 4.06Å; I728-L773 HydrophobicContact CG1-CD2 4.14Å; Y747-L773 HydrophobicContact CD2-CD1 3.69Å; Y747-L773 HydrophobicContact CD2-CG 4.49Å; Y747-L773 HydrophobicContact CE2-CD1 4.1Å; Y747-L773 HydrophobicContact CG-CD1 4.47Å; F748-L773 PolarHBondContact O-N 3.12Å; V749-L773 CarbonylContact C-O 3.59Å; V749-L773 WeakPolarHBondContact CA-O 3.49Å; V749-L773 HydrophobicContact CG2-CB 4.26Å; L750-L773 PolarHBondContact N-O 3.12Å; L773-L917 HydrophobicContact CB-CB 4.37Å; L773-L917 HydrophobicContact CB-CD2 4.36Å; L773-L917 HydrophobicContact CD1-CD1 4.24Å; L773-C918 CarbonylContact C-O 3.58Å; L773-C918 WeakPolarHBondContact CA-O 3.41Å
774	V	93.1	Very high	85.3	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	132.8	179.2	-179.7	0	0	0	0	109.5	L750 L756 L759 V776 L917 C918 C920 L923 V957	L750-V774 HydrophobicContact CB-CG2 4.34Å; L750-V774 HydrophobicContact CD2-CG2 4.11Å; L756-V774 HydrophobicContact CD2-CG1 3.94Å; L759-V774 HydrophobicContact CD1-CG2 4Å; V774-V776 HydrophobicContact CG1-CG1 4.46Å; V774-L917 WeakPolarHBondContact O-CA 3.5Å; V774-C918 PolarHBondContact N-O 2.85Å; V774-C918 PolarHBondContact O-N 2.9Å; V774-C920 HydrophobicContact CG2-CB 3.97Å; V774-L923 HydrophobicContact CB-CD1 3.62Å; V774-L923 HydrophobicContact CG1-CD1 3.84Å; V774-L923 HydrophobicContact CG2-CD1 4.04Å; V774-V957 HydrophobicContact CG1-CG1 3.8Å
775	R	93.3	Very high	86.8	Confident	15 Å²	15	38 Å²	38	6%	0.057	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	126.3	176.8	-163.1	176.7	-178.2	100.5	8.3	110.9	A673 D678 L917 Q958	A673-R775 VanDerWaalsContact CA-NH2 3.34Å; A673-R775 VanDerWaalsContact CB-NH2 3.34Å; D678-R775 PolarHBondContact O-NH1 3.06Å; D678-R775 VanDerWaalsContact O-NH1 3.12Å; D678-R775 IonicContact OD2-CZ 2.86Å; D678-R775 IonicContact OD2-NH2 3.12Å; D678-R775 PolarHBondContact OD2-NH2 3.08Å; R775-L917 HydrophobicContact CB-CD2 4.1Å; R775-L917 HydrophobicContact CG-CD2 4.37Å; R775-Q958 HydrophobicContact CG-CB 4.45Å; R775-Q958 PolarHBondContact O-N 3.21Å
776	V	92.9	Very high	88	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	147	-177.2	-61.7	0	0	0	0	111.2	V774 I792 S915 G916 C918 L923 L955 K956	V774-V776 HydrophobicContact CG1-CG1 4.46Å; V776-I792 HydrophobicContact CG2-CD1 4.31Å; V776-S915 WeakPolarHBondContact O-CA 3.29Å; V776-G916 PolarHBondContact N-O 3.18Å; V776-G916 PolarHBondContact O-N 2.73Å; V776-C918 HydrophobicContact CG1-CB 4.44Å; V776-C918 HydrophobicContact CG2-CB 4.5Å; V776-L923 HydrophobicContact CG1-CD1 4.22Å; V776-L955 HydrophobicContact CB-CD1 4.16Å; V776-L955 HydrophobicContact CB-CD2 4.24Å; V776-L955 HydrophobicContact CB-CG 4.03Å; V776-L955 HydrophobicContact CG1-CD1 4.21Å; V776-L955 HydrophobicContact CG1-CD2 3.9Å; V776-L955 HydrophobicContact CG1-CG 4.19Å; V776-L955 HydrophobicContact CG2-CD1 4.14Å; V776-L955 HydrophobicContact CG2-CG 4.48Å; V776-K956 WeakPolarHBondContact CA-O 2.87Å
777	S	92.5	Very high	88.9	Confident	20 Å²	20	40.1 Å²	40.1	14%	0.14	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	136.4	169.4	63.3	0	0	0	0	109.5	A914 L955 K956	S777-A914 CarbonylContact C-O 3.55Å; S777-A914 WeakPolarHBondContact CA-O 3.48Å; S777-L955 WeakPolarHBondContact O-CA 3.33Å; S777-K956 PolarHBondContact N-O 3.02Å; S777-K956 PolarHBondContact O-N 2.92Å; S777-K956 WeakPolarHBondContact OG-CB 3.3Å; S777-K956 PolarHBondContact OG-O 3.28Å
778	I	92.7	Very high	89.7	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	125.9	-175.6	-63	177.9	0	0	0	108.7	I792 V900 I913 A914 A953 V954	I778-I792 HydrophobicContact CD1-CB 4.26Å; I778-I792 HydrophobicContact CD1-CD1 3.34Å; I778-I792 HydrophobicContact CD1-CG1 3.44Å; I778-I792 VanDerWaalsContact CD1-CG1 3.44Å; I778-I792 HydrophobicContact CD1-CG2 3.77Å; I778-V900 HydrophobicContact CD1-CG2 4.48Å; I778-I913 CarbonylContact O-C 3.58Å; I778-I913 WeakPolarHBondContact O-CA 3.46Å; I778-A914 HydrophobicContact CB-CB 4.45Å; I778-A914 PolarHBondContact N-O 2.91Å; I778-A914 PolarHBondContact O-N 3.12Å; I778-A953 HydrophobicContact CG2-CB 3.27Å; I778-V954 WeakPolarHBondContact CA-O 3.19Å
779	E	92.3	Very high	90.1	Very high	31 Å²	31	32.6 Å²	32.6	15%	0.145	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	120.3	179	-61.1	-175.8	150.5	0	0	109.8	V781 K909 I913 A953 V954 K956	E779-V781 PolarHBondContact O-N 2.89Å; E779-K909 WeakPolarHBondContact OE1-CD 3.02Å; E779-K909 IonicContact OE1-NZ 2.97Å; E779-K909 PolarHBondContact OE1-NZ 2.91Å; E779-I913 HydrophobicContact CG-CG1 4.44Å; E779-A953 CarbonylContact O-C 3.6Å; E779-A953 WeakPolarHBondContact O-CA 3.03Å; E779-A953 VanDerWaalsContact O-CB 3.3Å; E779-A953 WeakPolarHBondContact O-CB 3.45Å; E779-V954 PolarHBondContact N-O 3.41Å; E779-V954 PolarHBondContact O-N 3.21Å; E779-K956 IonicContact OE1-NZ 3.89Å; E779-K956 IonicContact OE2-NZ 2.76Å; E779-K956 PolarHBondContact OE2-NZ 3.32Å
780	S	91.8	Very high	90.7	Very high	4 Å²	4	32.3 Å²	32.3	3%	0.028	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	132.2	178.9	62.4	0	0	0	0	111.3	G784 K911 G912	S780-G784 WeakPolarHBondContact CB-O 3.34Å; S780-G784 PolarHBondContact OG-O 3.31Å; S780-K911 WeakPolarHBondContact O-CD 3.11Å; S780-G912 PolarHBondContact N-O 3.43Å; S780-G912 VanDerWaalsContact OG-CA 3.32Å; S780-G912 WeakPolarHBondContact OG-CA 3.38Å; S780-G912 PolarHBondContact OG-N 2.8Å; S780-G912 PolarHBondContact OG-O 3.21Å
781	V	87	Confident	91.3	Very high	58 Å²	58	32.3 Å²	32.3	35%	0.352	16%	0.158	S	C	.	.	S	Bend	trans	-74.5	-45.4	179.2	175.1	0	0	0	0	110.3	E779 M939 A952 V954	E779-V781 PolarHBondContact O-N 2.89Å; V781-M939 HydrophobicContact CG2-CE 4.15Å; V781-A952 PolarHBondContact N-O 2.9Å; V781-A952 VanDerWaalsContact N-O 3.16Å; V781-V954 HydrophobicContact CG2-CG2 3.66Å
782	G	82.7	Confident	91.7	Very high	35 Å²	35	31.7 Å²	31.7	36%	0.361	16%	0.155	S	C	.	.	S	Bend	trans	-120.6	-143.9	-177.5	0	0	0	0	0	113.4	G784	G782-G784 PolarHBondContact O-N 3.1Å
783	R	82.4	Confident	91.8	Very high	217 Å²	217	31.7 Å²	31.7	82%	0.819	16%	0.155	S	C	*	.	S	Bend	trans	-72.2	112.6	-179	-172.9	178	-179.8	-176	0	110.6	R951	R783-R951 VanDerWaalsContact O-CD 3.31Å; R783-R951 WeakPolarHBondContact O-CD 3.28Å
784	G	87.4	Confident	91.6	Very high	19 Å²	19	32 Å²	32	20%	0.196	16%	0.156	C	C	.	.			trans	166	145	173.4	0	0	0	0	0	111.4	S780 G782	S780-G784 WeakPolarHBondContact CB-O 3.34Å; S780-G784 PolarHBondContact OG-O 3.31Å; G782-G784 PolarHBondContact O-N 3.1Å
785	V	94.1	Very high	91.4	Very high	50 Å²	50	32.7 Å²	32.7	30%	0.303	16%	0.161	S	C	.	.			trans	-123.5	114.6	174.3	-178.8	0	0	0	0	107.8	G904 Y905 N944	V785-G904 VanDerWaalsContact CG1-C 3.43Å; V785-Y905 HydrophobicContact CG2-CD2 4.1Å; V785-N944 PolarHBondContact O-ND2 2.91Å
786	P	94.6	Very high	91	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.177	C	C	.	.			trans	-66.1	140.1	173.4	28.4	-33.5	0	0	0	109.4	V900 G903 G904 A914 F942	P786-V900 HydrophobicContact CB-CG2 4.5Å; P786-G903 CarbonylContact O-C 3.6Å; P786-G903 WeakPolarHBondContact O-CA 3.37Å; P786-G904 PolarHBondContact O-N 3.07Å; P786-A914 HydrophobicContact CB-CB 3.66Å; P786-A914 HydrophobicContact CG-CB 3.41Å; P786-A914 VanDerWaalsContact CG-CB 3.41Å; P786-F942 HydrophobicContact CB-CD2 3.89Å; P786-F942 HydrophobicContact CB-CE2 3.9Å; P786-F942 HydrophobicContact CB-CG 4.44Å; P786-F942 HydrophobicContact CB-CZ 4.44Å
787	R	94.2	Very high	90.4	Very high	149 Å²	149	41.2 Å²	41.2	56%	0.562	21%	0.207	S	C	*	.			trans	-117.1	165	176.9	-65.6	-173.6	175.8	177.6	1.4	110	A790 V900 N944	R787-A790 WeakPolarHBondContact O-CB 3.36Å; R787-A790 PolarHBondContact O-N 3.24Å; R787-V900 VanDerWaalsContact O-CG1 3.29Å; R787-V900 WeakPolarHBondContact O-CG1 3.36Å; R787-N944 PolarHBondContact N-OD1 3.47Å
788	R	92.7	Very high	89.9	Confident	41 Å²	41	46 Å²	46	16%	0.155	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	139.9	169.8	179.1	171.6	-179.6	109.9	-7.3	111.2	D693 F722 A790 L901	D693-R788 IonicContact OD1-NH2 3.61Å; F722-R788 HydrophobicContact CZ-CG 4.21Å; R788-A790 PolarHBondContact O-N 2.85Å; R788-L901 WeakPolarHBondContact CG-O 3.48Å; R788-L901 PolarHBondContact NH1-O 2.89Å
789	H	93.3	Very high	89.3	Confident	13 Å²	13	46.2 Å²	46.2	6%	0.06	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	6.9	-171.3	-47.6	-72.5	0	0	0	115.3	D693 F720 F722 L791 V900 T945	D693-H789 IonicContact OD1-CE1 3.12Å; D693-H789 PolarHBondContact OD1-CE1 3.45Å; D693-H789 IonicContact OD1-NE2 2.8Å; F720-H789 VanDerWaalsContact C-CE1 3.47Å; F720-H789 PolarHBondContact O-CE1 2.81Å; F722-H789 AromaticContact CD1-ND1 3.82Å; F722-H789 AromaticContact CE1-CE1 3.96Å; F722-H789 AromaticContact CE1-ND1 3.28Å; F722-H789 VanDerWaalsContact CE1-ND1 3.28Å; F722-H789 WeakPolarHBondContact CE1-ND1 3.49Å; F722-H789 AromaticContact CE2-CE1 3.53Å; F722-H789 AromaticContact CE2-ND1 3.71Å; F722-H789 AromaticContact CZ-CE1 3.41Å; F722-H789 VanDerWaalsContact CZ-CE1 3.41Å; F722-H789 WeakPolarHBondContact CZ-CE1 3.42Å; F722-H789 AromaticContact CZ-ND1 3.22Å; F722-H789 WeakPolarHBondContact CZ-ND1 3.49Å; H789-L791 PolarHBondContact O-N 3.15Å; H789-V900 PolarHBondContact N-O 3.03Å; H789-T945 HydrophobicContact CB-CG2 3.87Å; H789-T945 WeakPolarHBondContact O-CG2 3.31Å
790	A	94.4	Very high	88.7	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-61.1	141.2	172.8	0	0	0	0	0	110.7	R787 R788 F899 V900 R943 N944	R787-A790 WeakPolarHBondContact O-CB 3.36Å; R787-A790 PolarHBondContact O-N 3.24Å; R788-A790 PolarHBondContact O-N 2.85Å; A790-F899 WeakPolarHBondContact O-CA 3.43Å; A790-V900 HydrophobicContact CB-CB 3.99Å; A790-V900 HydrophobicContact CB-CG2 3.93Å; A790-V900 PolarHBondContact O-N 3.47Å; A790-R943 CarbonylContact C-O 3.43Å; A790-R943 WeakPolarHBondContact CA-O 3.38Å; A790-R943 WeakPolarHBondContact CB-O 3.47Å; A790-N944 WeakPolarHBondContact CB-OD1 3.46Å
791	L	94.8	Very high	88	Confident	13 Å²	13	49.6 Å²	49.6	7%	0.068	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	137.7	177.5	-50.1	-176.7	0	0	0	109	H789 V896 F899 F942 R943	H789-L791 PolarHBondContact O-N 3.15Å; L791-V896 HydrophobicContact CB-CG1 4.41Å; L791-V896 HydrophobicContact CB-CG2 4.42Å; L791-V896 HydrophobicContact CD1-CG2 4.11Å; L791-V896 HydrophobicContact CD2-CG1 4.49Å; L791-F899 HydrophobicContact CD2-CD1 3.55Å; L791-F899 HydrophobicContact CD2-CE1 3.38Å; L791-F942 CarbonylContact O-C 3.56Å; L791-F942 VanDerWaalsContact O-CA 3.22Å; L791-F942 WeakPolarHBondContact O-CA 3.31Å; L791-R943 PolarHBondContact N-O 2.68Å; L791-R943 PolarHBondContact O-N 2.88Å
792	I	94.7	Very high	87.6	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	127	169.2	-48.3	163.7	0	0	0	105.8	V776 I778 V896 I897 G898 V900 V940 L955	V776-I792 HydrophobicContact CG2-CD1 4.31Å; I778-I792 HydrophobicContact CD1-CB 4.26Å; I778-I792 HydrophobicContact CD1-CD1 3.34Å; I778-I792 HydrophobicContact CD1-CG1 3.44Å; I778-I792 VanDerWaalsContact CD1-CG1 3.44Å; I778-I792 HydrophobicContact CD1-CG2 3.77Å; I792-V896 CarbonylContact O-C 3.52Å; I792-V896 WeakPolarHBondContact O-CA 3.45Å; I792-I897 HydrophobicContact CB-CD1 4.38Å; I792-I897 HydrophobicContact CB-CG1 3.8Å; I792-I897 HydrophobicContact CG2-CD1 3.57Å; I792-I897 HydrophobicContact CG2-CG1 3.54Å; I792-I897 WeakPolarHBondContact O-CG1 3.32Å; I792-I897 PolarHBondContact O-N 2.88Å; I792-G898 PolarHBondContact N-O 3.45Å; I792-V900 HydrophobicContact CD1-CG2 4.29Å; I792-V900 HydrophobicContact CG1-CG2 4Å; I792-V940 HydrophobicContact CG2-CB 4.39Å; I792-V940 HydrophobicContact CG2-CG2 4.3Å; I792-L955 HydrophobicContact CG2-CD1 4.47Å
793	C	92.8	Very high	87.3	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	148.6	-170.4	-59	0	0	0	0	111.8	R894 P895 L941 Y950	C793-R894 HydrophobicContact CB-CB 3.91Å; C793-P895 CarbonylContact C-O 3.36Å; C793-P895 WeakPolarHBondContact CA-O 3.42Å; C793-P895 WeakPolarHBondContact CB-O 3.42Å; C793-L941 HydrophobicContact CB-CB 4.31Å; C793-L941 PolarHBondContact N-O 3.45Å; C793-L941 PolarHBondContact O-N 3Å; C793-L941 VanDerWaalsContact O-N 3.1Å; C793-Y950 HydrophobicContact CB-CD1 4.5Å; C793-Y950 HydrophobicContact CB-CE1 4.23Å
794	L	89.9	Confident	86.9	Confident	6 Å²	6	45 Å²	45	3%	0.031	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-67.6	135.9	169.4	-72.4	176.3	0	0	0	110.2	W731 P895 I897 L926	W731-L794 HydrophobicContact CH2-CD1 3.78Å; W731-L794 HydrophobicContact CZ2-CD1 4.36Å; L794-P895 HydrophobicContact CB-CB 4.42Å; L794-P895 HydrophobicContact CB-CG 4.15Å; L794-P895 HydrophobicContact CD1-CB 4.22Å; L794-P895 HydrophobicContact CD1-CG 4.23Å; L794-P895 PolarHBondContact N-O 3.02Å; L794-I897 HydrophobicContact CD1-CG2 4.16Å; L794-I897 HydrophobicContact CD2-CG2 3.69Å; L794-I897 HydrophobicContact CG-CG2 3.45Å; L794-I897 VanDerWaalsContact CG-CG2 3.45Å; L794-L926 HydrophobicContact CD2-CB 3.74Å; L794-L926 HydrophobicContact CD2-CD1 3.49Å; L794-L926 VanDerWaalsContact CD2-CD1 3.49Å; L794-L926 HydrophobicContact CD2-CG 4.18Å
795	P	87.9	Confident	86.2	Confident	15 Å²	15	51.4 Å²	51.4	10%	0.097	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-77.1	146.6	168	32.1	-31.6	0	0	0	110.8	D799 L800 T930 L941	P795-D799 HydrophobicContact CB-CB 4.46Å; P795-L800 HydrophobicContact CB-CD2 3.9Å; P795-L800 HydrophobicContact CB-CG 4.15Å; P795-L800 HydrophobicContact CG-CD2 3.81Å; P795-L800 HydrophobicContact CG-CG 4.31Å; P795-T930 HydrophobicContact CG-CG2 4.24Å; P795-L941 HydrophobicContact CB-CD1 4.28Å; P795-L941 HydrophobicContact CB-CG 4.17Å
796	N	85.2	Confident	84.7	Confident	73 Å²	73	51.9 Å²	51.9	39%	0.39	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-87.8	163.7	165.2	-64.4	-1.1	0	0	0	109.8	E798 D799 L800	N796-E798 VanDerWaalsContact C-N 3.3Å; N796-E798 PolarHBondContact O-N 3.26Å; N796-D799 WeakPolarHBondContact O-CA 3.48Å; N796-D799 WeakPolarHBondContact O-CB 3.37Å; N796-D799 PolarHBondContact O-N 3.15Å; N796-L800 PolarHBondContact O-N 2.89Å; N796-L800 VanDerWaalsContact O-N 3.08Å
797	D	81.5	Confident	83.2	Confident	121 Å²	121	60.1 Å²	60.1	65%	0.647	29%	0.288	S	S	*	.	H	α-helix	trans	-54.9	-43.5	178.8	-63.3	-31	0	0	0	112.4	D799 L800 D801	D797-D799 VanDerWaalsContact C-N 3.26Å; D797-D799 PolarHBondContact O-N 3.12Å; D797-L800 WeakPolarHBondContact O-CB 3.29Å; D797-L800 PolarHBondContact O-N 3.2Å; D797-L800 VanDerWaalsContact O-N 3.08Å; D797-D801 PolarHBondContact O-N 2.81Å
798	E	82	Confident	81.4	Confident	122 Å²	122	57 Å²	57	57%	0.57	29%	0.289	S	S	*	.	H	α-helix	trans	-58.2	-36.3	174	-65.9	-175.6	-160.8	0	0	113.7	N796 L800 R802	N796-E798 VanDerWaalsContact C-N 3.3Å; N796-E798 PolarHBondContact O-N 3.26Å; E798-L800 VanDerWaalsContact C-N 3.35Å; E798-R802 WeakPolarHBondContact O-CG 3.4Å; E798-R802 PolarHBondContact O-N 3.41Å; E798-R802 IonicContact OE2-CZ 3.92Å; E798-R802 IonicContact OE2-NH1 3Å; E798-R802 IonicContact OE2-NH2 3.93Å; E798-R802 PolarHBondContact OE2-NH2 3.44Å
799	D	80.4	Confident	79.6	Confident	4 Å²	4	57.6 Å²	57.6	2%	0.021	30%	0.3	C	S	.	.	H	α-helix	trans	-73.1	-33.9	-179.4	-70.9	-40.7	0	0	0	109.9	P795 N796 D797 R802 I803 C811 R894 L941	P795-D799 HydrophobicContact CB-CB 4.46Å; N796-D799 WeakPolarHBondContact O-CA 3.48Å; N796-D799 WeakPolarHBondContact O-CB 3.37Å; N796-D799 PolarHBondContact O-N 3.15Å; D797-D799 VanDerWaalsContact C-N 3.26Å; D797-D799 PolarHBondContact O-N 3.12Å; D799-R802 IonicContact OD1-NH1 3.2Å; D799-R802 PolarHBondContact OD1-NH1 3.13Å; D799-I803 VanDerWaalsContact O-CD1 3.23Å; D799-I803 WeakPolarHBondContact O-CD1 3.34Å; D799-I803 WeakPolarHBondContact O-CG1 3.5Å; D799-I803 PolarHBondContact O-N 3.45Å; D799-I803 VanDerWaalsContact O-N 3.16Å; D799-C811 PolarHBondContact OD1-SG 3.46Å; D799-R894 IonicContact OD1-NH2 3.82Å; D799-R894 PolarHBondContact OD1-NH2 2.8Å; D799-R894 VanDerWaalsContact OD1-NH2 3.15Å; D799-R894 IonicContact OD2-CZ 3.2Å; D799-R894 IonicContact OD2-NE 2.65Å; D799-R894 PolarHBondContact OD2-NE 2.67Å; D799-R894 VanDerWaalsContact OD2-NE 3.08Å; D799-R894 IonicContact OD2-NH2 3.19Å; D799-R894 PolarHBondContact OD2-NH2 3.4Å; D799-L941 HydrophobicContact CB-CD1 4.18Å
800	L	78.2	Confident	78	Confident	9 Å²	9	58 Å²	58	5%	0.047	31%	0.307	C	S	.	.	H	α-helix	trans	-64.8	-46.6	174.1	-65.6	175.1	0	0	0	111.3	P795 N796 D797 E798 R802 I803 V804 V932 M939	P795-L800 HydrophobicContact CB-CD2 3.9Å; P795-L800 HydrophobicContact CB-CG 4.15Å; P795-L800 HydrophobicContact CG-CD2 3.81Å; P795-L800 HydrophobicContact CG-CG 4.31Å; N796-L800 PolarHBondContact O-N 2.89Å; N796-L800 VanDerWaalsContact O-N 3.08Å; D797-L800 WeakPolarHBondContact O-CB 3.29Å; D797-L800 PolarHBondContact O-N 3.2Å; D797-L800 VanDerWaalsContact O-N 3.08Å; E798-L800 VanDerWaalsContact C-N 3.35Å; L800-R802 PolarHBondContact O-N 2.99Å; L800-I803 WeakPolarHBondContact O-CB 3.33Å; L800-I803 PolarHBondContact O-N 2.94Å; L800-V804 WeakPolarHBondContact O-CG2 3.43Å; L800-V804 PolarHBondContact O-N 2.84Å; L800-V804 VanDerWaalsContact O-N 3.11Å; L800-V932 HydrophobicContact CD1-CG2 4.33Å; L800-M939 HydrophobicContact CD2-CB 4.12Å
801	D	78.9	Confident	76.8	Confident	97 Å²	97	58.9 Å²	58.9	52%	0.519	31%	0.313	S	S	.	.	H	α-helix	trans	-59.7	-47.7	179.1	-66.2	-24.7	0	0	0	111.2	D797 I803 V804 E805	D797-D801 PolarHBondContact O-N 2.81Å; D801-I803 VanDerWaalsContact C-N 3.27Å; D801-I803 PolarHBondContact O-N 3.1Å; D801-V804 PolarHBondContact O-N 3.13Å; D801-V804 VanDerWaalsContact O-N 3.14Å; D801-E805 WeakPolarHBondContact O-CG 3.25Å; D801-E805 PolarHBondContact O-N 3.15Å
802	R	77.5	Confident	75.7	Confident	101 Å²	101	61.7 Å²	61.7	38%	0.381	33%	0.33	S	S	.	.	H	α-helix	trans	-59.1	-37.2	177	-74.2	179.3	-169.4	132.3	11.8	113.1	E798 D799 L800 T806	E798-R802 WeakPolarHBondContact O-CG 3.4Å; E798-R802 PolarHBondContact O-N 3.41Å; E798-R802 IonicContact OE2-CZ 3.92Å; E798-R802 IonicContact OE2-NH1 3Å; E798-R802 IonicContact OE2-NH2 3.93Å; E798-R802 PolarHBondContact OE2-NH2 3.44Å; D799-R802 IonicContact OD1-NH1 3.2Å; D799-R802 PolarHBondContact OD1-NH1 3.13Å; L800-R802 PolarHBondContact O-N 2.99Å; R802-T806 PolarHBondContact O-N 3.4Å; R802-T806 PolarHBondContact O-OG1 2.99Å
803	I	75.9	Confident	74.5	Confident	19 Å²	19	61.9 Å²	61.9	10%	0.097	33%	0.331	C	S	.	.	H	α-helix	trans	-66.8	-42.5	179.5	-72.1	162.9	0	0	0	110.4	D799 L800 D801 K807 M939 L941 A952	D799-I803 VanDerWaalsContact O-CD1 3.23Å; D799-I803 WeakPolarHBondContact O-CD1 3.34Å; D799-I803 WeakPolarHBondContact O-CG1 3.5Å; D799-I803 PolarHBondContact O-N 3.45Å; D799-I803 VanDerWaalsContact O-N 3.16Å; L800-I803 WeakPolarHBondContact O-CB 3.33Å; L800-I803 PolarHBondContact O-N 2.94Å; D801-I803 VanDerWaalsContact C-N 3.27Å; D801-I803 PolarHBondContact O-N 3.1Å; I803-K807 WeakPolarHBondContact O-CA 3.42Å; I803-K807 PolarHBondContact O-N 2.85Å; I803-K807 VanDerWaalsContact O-N 3.13Å; I803-M939 HydrophobicContact CD1-CE 4.11Å; I803-M939 HydrophobicContact CG2-CE 3.56Å; I803-M939 HydrophobicContact CG2-SD 3.72Å; I803-L941 HydrophobicContact CD1-CD2 4.14Å; I803-A952 HydrophobicContact CD1-CB 3.72Å; I803-A952 HydrophobicContact CG1-CB 3.95Å; I803-A952 HydrophobicContact CG2-CB 4.41Å
804	V	74.8	Confident	73.1	Confident	93 Å²	93	71.5 Å²	71.5	56%	0.564	37%	0.368	S	S	*	.	H	α-helix	trans	-63.2	-45.1	177.7	175	0	0	0	0	110.3	L800 D801	L800-V804 WeakPolarHBondContact O-CG2 3.43Å; L800-V804 PolarHBondContact O-N 2.84Å; L800-V804 VanDerWaalsContact O-N 3.11Å; D801-V804 PolarHBondContact O-N 3.13Å; D801-V804 VanDerWaalsContact O-N 3.14Å
805	E	72.9	Confident	71.4	Confident	153 Å²	153	76 Å²	76	72%	0.715	40%	0.399	S	S	*	.	H	α-helix	trans	-67.9	-51.1	-177.8	-71.1	176.1	174.5	0	0	113.2	D801	D801-E805 WeakPolarHBondContact O-CG 3.25Å; D801-E805 PolarHBondContact O-N 3.15Å
806	T	63	Low	69.5	Low	61 Å²	61	77.5 Å²	77.5	37%	0.374	42%	0.418	S	S	.	.	H	α-helix	trans	-97.7	-8.5	-166.9	59.3	0	0	0	0	114.4	R802 S808 S809	R802-T806 PolarHBondContact O-N 3.4Å; R802-T806 PolarHBondContact O-OG1 2.99Å; T806-S808 WeakPolarHBondContact O-CB 3.37Å; T806-S808 PolarHBondContact O-N 3.28Å; T806-S808 PolarHBondContact O-OG 3.32Å; T806-S809 WeakPolarHBondContact OG1-CB 3.49Å; T806-S809 PolarHBondContact OG1-N 3.29Å; T806-S809 PolarHBondContact OG1-OG 3.21Å
807	K	61.5	Low	67.1	Low	173 Å²	173	78.7 Å²	78.7	75%	0.752	43%	0.432	S	S	*	.	S	Bend	trans	49.8	3.8	-174.3	-67.1	-177.4	178.8	174.2	0	115.7	I803	I803-K807 WeakPolarHBondContact O-CA 3.42Å; I803-K807 PolarHBondContact O-N 2.85Å; I803-K807 VanDerWaalsContact O-N 3.13Å
808	S	56.4	Low	65.1	Low	84 Å²	84	79 Å²	79	59%	0.587	43%	0.433	S	S	*	.	S	Bend	trans	-161.2	-10.1	-163.3	64.1	0	0	0	0	116.7	T806	T806-S808 WeakPolarHBondContact O-CB 3.37Å; T806-S808 PolarHBondContact O-N 3.28Å; T806-S808 PolarHBondContact O-OG 3.32Å
809	S	55.9	Low	62.7	Low	53 Å²	53	80.3 Å²	80.3	37%	0.371	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-90.1	131	-176.6	74.3	0	0	0	0	111.9	T806	T806-S809 WeakPolarHBondContact OG1-CB 3.49Å; T806-S809 PolarHBondContact OG1-N 3.29Å; T806-S809 PolarHBondContact OG1-OG 3.21Å
810	G	59.6	Low	60.5	Low	21 Å²	21	82 Å²	82	22%	0.216	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-99.4	145.3	172.6	0	0	0	0	0	109.3	Y950	G810-Y950 CarbonylContact C-O 3.56Å; G810-Y950 WeakPolarHBondContact CA-O 3.45Å
811	C	69.2	Low	58.3	Low	18 Å²	18	86.3 Å²	86.3	12%	0.122	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-85.4	158.3	178	56.4	0	0	0	0	111.6	D799 Y949 Y950	D799-C811 PolarHBondContact OD1-SG 3.46Å; C811-Y949 WeakPolarHBondContact O-CA 3.44Å; C811-Y950 PolarHBondContact N-O 2.89Å; C811-Y950 PolarHBondContact O-N 3.08Å; C811-Y950 VanDerWaalsContact SG-CB 3.54Å
812	V	71.9	Confident	56.3	Low	72 Å²	72	86.9 Å²	86.9	44%	0.436	49%	0.492	S	S	.	.	B	Isolated β-bridge	trans	-106.2	136.5	-177.6	-170.1	0	0	0	0	109.3	R814 M948 Y949	V812-R814 PolarHBondContact O-N 3.28Å; V812-M948 HydrophobicContact CG1-CB 4.07Å; V812-Y949 HydrophobicContact CG2-CD1 3.61Å; V812-Y949 HydrophobicContact CG2-CE1 3.46Å; V812-Y949 VanDerWaalsContact CG2-CE1 3.46Å
813	E	70.2	Confident	54.2	Low	4 Å²	4	90.2 Å²	90.2	2%	0.019	51%	0.511	C	S	.	.			trans	-65.6	121.3	166.5	-174	67.2	-172.7	0	0	109.3	K715 S815 L893 R894 M948 Y950	K715-E813 HydrophobicContact CD-CG 4.19Å; K715-E813 VanDerWaalsContact CD-OE1 3.31Å; K715-E813 WeakPolarHBondContact CD-OE1 3.42Å; K715-E813 IonicContact NZ-OE1 3.53Å; E813-S815 PolarHBondContact O-N 3.4Å; E813-L893 VanDerWaalsContact OE1-CG 3.31Å; E813-L893 WeakPolarHBondContact OE1-CG 3.16Å; E813-L893 PolarHBondContact OE1-N 2.88Å; E813-L893 WeakPolarHBondContact OE2-CB 3.43Å; E813-R894 IonicContact OE2-NH1 2.86Å; E813-M948 HydrophobicContact CB-CB 4.2Å; E813-M948 HydrophobicContact CB-CE 3.79Å; E813-M948 WeakPolarHBondContact CB-O 3.31Å; E813-M948 HydrophobicContact CB-SD 3.99Å; E813-M948 HydrophobicContact CG-CE 3.73Å; E813-M948 HydrophobicContact CG-SD 4.24Å; E813-M948 PolarHBondContact N-O 2.94Å; E813-M948 WeakPolarHBondContact O-CE 3.47Å; E813-Y950 HydrophobicContact CB-CE2 3.82Å; E813-Y950 WeakPolarHBondContact OE2-CE2 3.3Å; E813-Y950 PolarHBondContact OE2-OH 3.27Å
814	R	62.3	Low	52.3	Low	203 Å²	203	91.4 Å²	91.4	77%	0.766	52%	0.521	S	S	*	.			trans	-71.8	126.3	174.9	-63.3	-178.2	179	169.8	0.7	108.8	K715 V812 G816 L893	K715-R814 PolarHBondContact NZ-O 3.1Å; V812-R814 PolarHBondContact O-N 3.28Å; R814-G816 PolarHBondContact O-N 2.94Å; R814-G816 VanDerWaalsContact O-N 3.1Å; R814-L893 HydrophobicContact CB-CD1 4.05Å; R814-L893 HydrophobicContact CG-CD1 4.31Å
815	S	53.4	Low	50.6	Low	99 Å²	99	92 Å²	92	69%	0.692	52%	0.521	S	S	*	.			trans	-66.7	106.6	165.7	50.7	0	0	0	0	107.7	E813	E813-S815 PolarHBondContact O-N 3.4Å
816	G	48	Very low	48.8	Very low	47 Å²	47	90.9 Å²	90.9	49%	0.485	52%	0.52	S	S	.	.			trans	-62.5	141.4	163.8	0	0	0	0	0	108.3	R814 L818	R814-G816 PolarHBondContact O-N 2.94Å; R814-G816 VanDerWaalsContact O-N 3.1Å; G816-L818 VanDerWaalsContact C-N 3.3Å; G816-L818 PolarHBondContact O-N 3.01Å
817	S	36.3	Very low	47.5	Very low	98 Å²	98	91.8 Å²	91.8	69%	0.685	53%	0.529	S	S	*	.			trans	-64.6	97.5	166.8	-153.7	0	0	0	0	106.9	N819	S817-N819 PolarHBondContact O-N 2.82Å; S817-N819 PolarHBondContact OG-OD1 3.45Å
818	L	39.1	Very low	46.5	Very low	128 Å²	128	86.8 Å²	86.8	67%	0.67	52%	0.515	S	S	*	.			trans	-70.2	78.7	162	-85.3	159.5	0	0	0	106.1	G816 G820	G816-L818 VanDerWaalsContact C-N 3.3Å; G816-L818 PolarHBondContact O-N 3.01Å; L818-G820 PolarHBondContact O-N 3.27Å
819	N	31.5	Very low	45.6	Very low	150 Å²	150	90.2 Å²	90.2	80%	0.802	52%	0.522	S	S	*	.			trans	-72.8	77.2	160.8	-71.1	-0.7	0	0	0	105.9	S817	S817-N819 PolarHBondContact O-N 2.82Å; S817-N819 PolarHBondContact OG-OD1 3.45Å
820	G	33.6	Very low	44.6	Very low	40 Å²	40	94.8 Å²	94.8	41%	0.412	54%	0.542	S	S	.	.	S	Bend	trans	170.4	116.4	-176.9	0	0	0	0	0	110.1	L818	L818-G820 PolarHBondContact O-N 3.27Å
821	T	32.7	Very low	43.3	Very low	98 Å²	98	96.9 Å²	96.9	60%	0.601	56%	0.564	S	S	*	*	S	Bend	trans	62.7	53.7	162.8	38.3	0	0	0	0	117.8	S824	T821-S824 WeakPolarHBondContact CG2-OG 3.39Å
822	L	36.2	Very low	41.6	Very low	110 Å²	110	102.6 Å²	102.6	58%	0.576	59%	0.593	S	S	*	*	S	Bend	trans	-120.7	-7.9	149.7	-115.5	150.4	0	0	0	113.1
823	E	33.1	Very low	39.9	Very low	170 Å²	170	105.7 Å²	105.7	79%	0.794	61%	0.612	S	S	*	*	S	Bend	trans	-81.1	-18.2	167.5	-70.5	-175.1	158.7	0	0	112.5	D825 L826 S827	E823-D825 VanDerWaalsContact C-N 3.33Å; E823-D825 PolarHBondContact O-N 3.3Å; E823-L826 PolarHBondContact O-N 3.25Å; E823-S827 PolarHBondContact O-N 2.72Å; E823-S827 PolarHBondContact O-OG 3.44Å
824	S	37.3	Very low	38.1	Very low	44 Å²	44	111.4 Å²	111.4	31%	0.308	65%	0.65	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.8	-16.6	177.9	57.5	0	0	0	0	114.9	T821 S827 S828	T821-S824 WeakPolarHBondContact CG2-OG 3.39Å; S824-S827 WeakPolarHBondContact CA-OG 3.42Å; S824-S828 PolarHBondContact O-OG 2.86Å; S824-S828 VanDerWaalsContact O-OG 3.12Å
825	D	38.2	Very low	36.6	Very low	105 Å²	105	106.2 Å²	106.2	56%	0.561	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-14.3	176.4	-81.3	-6.2	0	0	0	112.4	E823	E823-D825 VanDerWaalsContact C-N 3.33Å; E823-D825 PolarHBondContact O-N 3.3Å
826	L	35.1	Very low	35.9	Very low	131 Å²	131	110.9 Å²	110.9	69%	0.686	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	-30.8	168.6	-70.3	170.3	0	0	0	111.3	E823 S828	E823-L826 PolarHBondContact O-N 3.25Å; L826-S828 VanDerWaalsContact C-N 3.27Å; L826-S828 PolarHBondContact O-N 2.85Å
827	S	36.7	Very low	35.4	Very low	80 Å²	80	115.7 Å²	115.7	56%	0.559	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	11.8	178.5	73.4	0	0	0	0	114.8	E823 S824	E823-S827 PolarHBondContact O-N 2.72Å; E823-S827 PolarHBondContact O-OG 3.44Å; S824-S827 WeakPolarHBondContact CA-OG 3.42Å
828	S	39.6	Very low	35.2	Very low	67 Å²	67	114.9 Å²	114.9	47%	0.469	68%	0.682	S	S	.	*	T	Hydrogen-bonded Turn	trans	-116.1	13.2	170.4	57.5	0	0	0	0	113.4	S824 L826	S824-S828 PolarHBondContact O-OG 2.86Å; S824-S828 VanDerWaalsContact O-OG 3.12Å; L826-S828 VanDerWaalsContact C-N 3.27Å; L826-S828 PolarHBondContact O-N 2.85Å
829	E	38.6	Very low	35	Very low	157 Å²	157	114.1 Å²	114.1	73%	0.734	68%	0.682	S	S	*	*	S	Bend	trans	-93.6	-7.4	164.3	-63.3	-155.6	150.6	0	0	113.1	G831	E829-G831 VanDerWaalsContact C-N 3.28Å; E829-G831 PolarHBondContact O-N 2.94Å
830	D	33.7	Very low	35.2	Very low	148 Å²	148	116.3 Å²	116.3	79%	0.791	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	22	-177.4	-63.6	-35.9	0	0	0	114.8
831	G	32.8	Very low	35.5	Very low	65 Å²	65	123.1 Å²	123.1	67%	0.67	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.6	0.5	-175.2	0	0	0	0	0	116.7	E829	E829-G831 VanDerWaalsContact C-N 3.28Å; E829-G831 PolarHBondContact O-N 2.94Å
832	D	33.7	Very low	36.1	Very low	139 Å²	139	127.2 Å²	127.2	74%	0.743	72%	0.718	S	S	*	*	S	Bend	trans	-138.2	93.3	179	-84.9	-35.2	0	0	0	111.3
833	T	35.8	Very low	36.8	Very low	136 Å²	136	128.2 Å²	128.2	83%	0.834	72%	0.722	S	S	*	*			trans	70.7	131.1	160.1	55.4	0	0	0	0	120.1
834	P	33.2	Very low	37.7	Very low	125 Å²	125	125.6 Å²	125.6	81%	0.812	71%	0.714	S	S	*	*			trans	-78.8	139.8	173.9	32.6	-31.5	0	0	0	112
835	A	29.9	Very low	38.3	Very low	93 Å²	93	131.4 Å²	131.4	77%	0.769	73%	0.734	S	S	*	*			trans	26	102.2	148.3	0	0	0	0	0	119.2
836	E	38.6	Very low	39.2	Very low	197 Å²	197	134.4 Å²	134.4	92%	0.921	75%	0.745	S	S	*	*			trans	-119.1	96.8	139.5	-83.7	-172	175.5	0	0	109.2
837	I	37.8	Very low	40.3	Very low	148 Å²	148	132 Å²	132	76%	0.759	74%	0.736	S	S	*	*			trans	11.4	122.4	144.4	-59.5	166	0	0	0	115.5	V839	I837-V839 HydrophobicContact CG2-CG2 4.48Å; I837-V839 PolarHBondContact O-N 3.42Å
838	G	31.9	Very low	41.2	Very low	82 Å²	82	133.7 Å²	133.7	85%	0.845	74%	0.738	S	S	*	*			trans	-56.9	106.8	166	0	0	0	0	0	111.4
839	V	35.1	Very low	41.9	Very low	111 Å²	111	138.4 Å²	138.4	67%	0.673	75%	0.75	S	S	*	*			trans	-110.9	110.7	155.5	-179.4	0	0	0	0	106.2	I837 K841	I837-V839 HydrophobicContact CG2-CG2 4.48Å; I837-V839 PolarHBondContact O-N 3.42Å; V839-K841 VanDerWaalsContact C-N 3.31Å; V839-K841 PolarHBondContact O-N 2.65Å
840	E	36.3	Very low	42.5	Very low	196 Å²	196	133.6 Å²	133.6	92%	0.916	73%	0.733	S	S	*	*			trans	-56.8	99.7	160.6	-75.7	-172.8	151.1	0	0	107.4	Q842	E840-Q842 PolarHBondContact O-N 3.37Å
841	K	40.4	Very low	43.6	Very low	183 Å²	183	132.8 Å²	132.8	80%	0.796	73%	0.728	S	S	*	*			trans	-65.2	111.7	171.2	-74.2	-173.7	177.2	-176	0	107.8	V839 I843	V839-K841 VanDerWaalsContact C-N 3.31Å; V839-K841 PolarHBondContact O-N 2.65Å; K841-I843 PolarHBondContact O-N 3.15Å; K841-I843 VanDerWaalsContact O-N 3.14Å
842	Q	44.5	Very low	44.8	Very low	185 Å²	185	135 Å²	135	86%	0.864	73%	0.73	S	S	*	*			trans	-49.1	119.3	157.3	-93.7	179	-23.8	0	0	107.6	E840 D844	E840-Q842 PolarHBondContact O-N 3.37Å; Q842-D844 PolarHBondContact O-N 3.17Å
843	I	49.9	Very low	46	Very low	130 Å²	130	136.2 Å²	136.2	67%	0.667	73%	0.732	S	S	*	*			trans	-77	104.4	174.8	-61	173	0	0	0	105.8	K841 F845 T847	K841-I843 PolarHBondContact O-N 3.15Å; K841-I843 VanDerWaalsContact O-N 3.14Å; I843-F845 PolarHBondContact O-N 2.86Å; I843-T847 WeakPolarHBondContact CG2-OG1 3.33Å
844	D	52.7	Low	47.1	Very low	115 Å²	115	134.4 Å²	134.4	62%	0.615	72%	0.717	S	S	*	*			trans	-55	133.9	172.7	-88.8	-31.3	0	0	0	110.5	Q842 E846 T847	Q842-D844 PolarHBondContact O-N 3.17Å; D844-E846 PolarHBondContact O-N 3.44Å; D844-T847 HydrophobicContact CB-CG2 4.38Å; D844-T847 WeakPolarHBondContact O-CB 3.34Å; D844-T847 PolarHBondContact O-N 3.41Å; D844-T847 PolarHBondContact O-OG1 3.06Å
845	F	50.2	Low	48.4	Very low	167 Å²	167	132 Å²	132	73%	0.732	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-57	-23	-176.3	-125.4	-92.6	0	0	0	112.8	I843 L848	I843-F845 PolarHBondContact O-N 2.86Å; F845-L848 PolarHBondContact O-N 2.77Å
846	E	57.2	Low	50	Low	167 Å²	167	133.4 Å²	133.4	78%	0.78	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-72.8	-22.6	176.4	-64.7	-171.4	161.6	0	0	113.7	D844 L848 F849	D844-E846 PolarHBondContact O-N 3.44Å; E846-L848 PolarHBondContact O-N 3.47Å; E846-F849 CarbonylContact O-C 3.56Å; E846-F849 PolarHBondContact O-N 3.19Å; E846-F849 VanDerWaalsContact O-N 3.14Å
847	T	57.6	Low	51.3	Low	82 Å²	82	126.9 Å²	126.9	50%	0.503	67%	0.674	S	S	.	*	G	3₁₀ helix	trans	-71.9	-13.4	176.9	63.5	0	0	0	0	113.5	I843 D844 F849	I843-T847 WeakPolarHBondContact CG2-OG1 3.33Å; D844-T847 HydrophobicContact CB-CG2 4.38Å; D844-T847 WeakPolarHBondContact O-CB 3.34Å; D844-T847 PolarHBondContact O-N 3.41Å; D844-T847 PolarHBondContact O-OG1 3.06Å; T847-F849 VanDerWaalsContact C-N 3.32Å
848	L	56.7	Low	52.6	Low	114 Å²	114	128 Å²	128	60%	0.597	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-79.8	-13.8	173.2	-67	171.5	0	0	0	112.7	F845 E846	F845-L848 PolarHBondContact O-N 2.77Å; E846-L848 PolarHBondContact O-N 3.47Å
849	F	53.1	Low	54.3	Low	166 Å²	166	130.6 Å²	130.6	73%	0.728	66%	0.656	S	S	*	*	S	Bend	trans	-134.8	66.7	-179.1	-55.7	-78.1	0	0	0	113.2	E846 T847	E846-F849 CarbonylContact O-C 3.56Å; E846-F849 PolarHBondContact O-N 3.19Å; E846-F849 VanDerWaalsContact O-N 3.14Å; T847-F849 VanDerWaalsContact C-N 3.32Å
850	P	52.4	Low	56.1	Low	57 Å²	57	132.4 Å²	132.4	37%	0.37	66%	0.655	S	S	.	*			trans	-88.4	143.8	-169.5	34.2	-32.8	0	0	0	113.8	N854	P850-N854 HydrophobicContact CB-CB 3.95Å
851	N	55.5	Low	57.9	Low	130 Å²	130	125.5 Å²	125.5	70%	0.695	63%	0.632	S	S	*	*			trans	-54.5	154.2	167.6	-81.8	-24.4	0	0	0	113	E853 N854	N851-E853 PolarHBondContact O-N 3.4Å; N851-N854 PolarHBondContact O-N 3.03Å
852	P	59.3	Low	59.5	Low	111 Å²	111	122.9 Å²	122.9	72%	0.721	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58	-19.8	-168	18.5	-31.4	0	0	0	116.3	V855	P852-V855 WeakPolarHBondContact O-CG2 3.18Å
853	E	58.4	Low	61	Low	165 Å²	165	121.1 Å²	121.1	77%	0.771	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-29.3	-179.6	-62.7	-174.9	161.8	0	0	113.4	N851 V855 L856	N851-E853 PolarHBondContact O-N 3.4Å; E853-V855 PolarHBondContact O-N 3.19Å; E853-V855 VanDerWaalsContact O-N 3.17Å; E853-L856 PolarHBondContact O-N 2.89Å
854	N	58.6	Low	62.1	Low	98 Å²	98	122.2 Å²	122.2	52%	0.524	61%	0.612	S	S	.	*	H	α-helix	trans	-73.9	-7.2	-178.7	-74.9	-23.5	0	0	0	114.1	P850 N851 L856 A857 R858	P850-N854 HydrophobicContact CB-CB 3.95Å; N851-N854 PolarHBondContact O-N 3.03Å; N854-L856 VanDerWaalsContact C-N 3.31Å; N854-L856 PolarHBondContact O-N 3.44Å; N854-A857 PolarHBondContact O-N 2.9Å; N854-R858 PolarHBondContact O-N 3.05Å
855	V	61.4	Low	63.1	Low	75 Å²	75	124.7 Å²	124.7	46%	0.455	62%	0.617	S	S	.	*	H	α-helix	trans	-66.9	-33	176.4	179	0	0	0	0	111.5	P852 E853 K859	P852-V855 WeakPolarHBondContact O-CG2 3.18Å; E853-V855 PolarHBondContact O-N 3.19Å; E853-V855 VanDerWaalsContact O-N 3.17Å; V855-K859 HydrophobicContact CG1-CD 4.49Å; V855-K859 WeakPolarHBondContact O-CB 3.03Å; V855-K859 WeakPolarHBondContact O-CG 3.32Å; V855-K859 PolarHBondContact O-N 2.93Å
856	L	62	Low	64	Low	122 Å²	122	121.4 Å²	121.4	64%	0.639	61%	0.607	S	S	*	*	H	α-helix	trans	-70.4	-41.4	178.6	-83.4	157	0	0	0	112	E853 N854 R858 K859 K860	E853-L856 PolarHBondContact O-N 2.89Å; N854-L856 VanDerWaalsContact C-N 3.31Å; N854-L856 PolarHBondContact O-N 3.44Å; L856-R858 VanDerWaalsContact C-N 3.34Å; L856-K859 PolarHBondContact O-N 3.46Å; L856-K860 WeakPolarHBondContact O-CB 3.47Å; L856-K860 WeakPolarHBondContact O-CG 3.42Å; L856-K860 PolarHBondContact O-N 3.39Å
857	A	66.4	Low	64.6	Low	61 Å²	61	119.2 Å²	119.2	50%	0.504	60%	0.597	S	S	.	*	H	α-helix	trans	-63.1	-41.9	174.8	0	0	0	0	0	111.3	N854 K860 A861	N854-A857 PolarHBondContact O-N 2.9Å; A857-K860 PolarHBondContact O-N 3.25Å; A857-A861 WeakPolarHBondContact O-CB 3.32Å; A857-A861 PolarHBondContact O-N 3.24Å
858	R	64.7	Low	65	Low	172 Å²	172	123 Å²	123	65%	0.649	61%	0.606	S	S	*	*	H	α-helix	trans	-63.9	-44.1	176.3	-145.3	175.6	-174.6	172.9	4.7	112.1	N854 L856 K860 A861 E862	N854-R858 PolarHBondContact O-N 3.05Å; L856-R858 VanDerWaalsContact C-N 3.34Å; R858-K860 PolarHBondContact O-N 2.85Å; R858-A861 PolarHBondContact O-N 2.87Å; R858-E862 PolarHBondContact O-N 2.76Å
859	K	69	Low	65.4	Low	135 Å²	135	122.8 Å²	122.8	59%	0.587	60%	0.6	S	S	*	*	H	α-helix	trans	-62	-40.4	173.1	-78.6	-177.9	178.1	177.6	0	112.3	V855 L856 E862 K863	V855-K859 HydrophobicContact CG1-CD 4.49Å; V855-K859 WeakPolarHBondContact O-CB 3.03Å; V855-K859 WeakPolarHBondContact O-CG 3.32Å; V855-K859 PolarHBondContact O-N 2.93Å; L856-K859 PolarHBondContact O-N 3.46Å; K859-E862 PolarHBondContact O-N 2.81Å; K859-K863 WeakPolarHBondContact O-CB 3.43Å; K859-K863 PolarHBondContact O-N 3.2Å
860	K	72.6	Confident	65.9	Low	150 Å²	150	120.9 Å²	120.9	65%	0.652	59%	0.592	S	S	*	*	H	α-helix	trans	-64.3	-42.7	175.4	-78.3	-178.3	179.5	179.5	0	111.6	L856 A857 R858 K863 K864	L856-K860 WeakPolarHBondContact O-CB 3.47Å; L856-K860 WeakPolarHBondContact O-CG 3.42Å; L856-K860 PolarHBondContact O-N 3.39Å; A857-K860 PolarHBondContact O-N 3.25Å; R858-K860 PolarHBondContact O-N 2.85Å; K860-K863 PolarHBondContact O-N 2.65Å; K860-K864 PolarHBondContact O-N 2.84Å
861	A	73	Confident	66.3	Low	51 Å²	51	125.3 Å²	125.3	42%	0.421	61%	0.605	S	S	.	*	H	α-helix	trans	-65.3	-41.5	176.4	0	0	0	0	0	112.5	A857 R858 K863 K864 K865	A857-A861 WeakPolarHBondContact O-CB 3.32Å; A857-A861 PolarHBondContact O-N 3.24Å; R858-A861 PolarHBondContact O-N 2.87Å; A861-K863 VanDerWaalsContact C-N 3.34Å; A861-K864 PolarHBondContact O-N 3.27Å; A861-K865 PolarHBondContact O-N 3.15Å
862	E	74.5	Confident	66.4	Low	128 Å²	128	125.3 Å²	125.3	60%	0.598	60%	0.601	S	S	*	*	H	α-helix	trans	-62.3	-40.5	172.2	-77.2	-174.3	163.3	0	0	111.9	R858 K859 K865 L866	R858-E862 PolarHBondContact O-N 2.76Å; K859-E862 PolarHBondContact O-N 2.81Å; E862-K865 PolarHBondContact O-N 3.4Å; E862-L866 WeakPolarHBondContact O-CB 3.27Å; E862-L866 PolarHBondContact O-N 3.44Å
863	K	75	Confident	66.3	Low	147 Å²	147	123.4 Å²	123.4	64%	0.639	58%	0.582	S	S	*	*	H	α-helix	trans	-63.6	-41.8	176.2	-147.3	177.4	-173.3	-175.4	0	111.4	K859 K860 A861 L866 Q867	K859-K863 WeakPolarHBondContact O-CB 3.43Å; K859-K863 PolarHBondContact O-N 3.2Å; K860-K863 PolarHBondContact O-N 2.65Å; A861-K863 VanDerWaalsContact C-N 3.34Å; K863-L866 PolarHBondContact O-N 3.18Å; K863-Q867 WeakPolarHBondContact O-CG 3.32Å; K863-Q867 PolarHBondContact O-N 2.95Å
864	K	74.5	Confident	66.1	Low	154 Å²	154	123.3 Å²	123.3	67%	0.67	58%	0.579	S	S	*	*	H	α-helix	trans	-63.9	-43.5	173.2	-78.4	-171.4	175.7	-174	0	112.1	K860 A861 L866 Q867 K868	K860-K864 PolarHBondContact O-N 2.84Å; A861-K864 PolarHBondContact O-N 3.27Å; K864-L866 VanDerWaalsContact C-N 3.34Å; K864-L866 PolarHBondContact O-N 3.08Å; K864-Q867 PolarHBondContact O-N 2.71Å; K864-K868 PolarHBondContact O-N 3Å
865	K	72.7	Confident	65.8	Low	166 Å²	166	124.8 Å²	124.8	72%	0.722	58%	0.581	S	S	*	*	H	α-helix	trans	-61.2	-41.4	173.9	-78.2	-175.3	177.9	-178.7	0	111.9	A861 E862 K868 K869	A861-K865 PolarHBondContact O-N 3.15Å; E862-K865 PolarHBondContact O-N 3.4Å; K865-K868 PolarHBondContact O-N 2.7Å; K865-K869 WeakPolarHBondContact O-CB 3.44Å; K865-K869 PolarHBondContact O-N 3.29Å
866	L	69.9	Low	65.4	Low	98 Å²	98	124 Å²	124	51%	0.513	58%	0.576	S	S	.	*	H	α-helix	trans	-66	-39.1	176.6	-168	69.5	0	0	0	111.8	E862 K863 K864 K869 K870	E862-L866 WeakPolarHBondContact O-CB 3.27Å; E862-L866 PolarHBondContact O-N 3.44Å; K863-L866 PolarHBondContact O-N 3.18Å; K864-L866 VanDerWaalsContact C-N 3.34Å; K864-L866 PolarHBondContact O-N 3.08Å; L866-K869 PolarHBondContact O-N 2.7Å; L866-K870 WeakPolarHBondContact O-CB 3.49Å; L866-K870 WeakPolarHBondContact O-CG 3.24Å; L866-K870 PolarHBondContact O-N 3.4Å
867	Q	68.9	Low	64.5	Low	122 Å²	122	120.2 Å²	120.2	57%	0.57	56%	0.563	S	S	*	*	H	α-helix	trans	-64.7	-44.9	173.2	-79.4	177.8	-15.6	0	0	112.1	K863 K864 K869 K870 K871	K863-Q867 WeakPolarHBondContact O-CG 3.32Å; K863-Q867 PolarHBondContact O-N 2.95Å; K864-Q867 PolarHBondContact O-N 2.71Å; Q867-K869 VanDerWaalsContact C-N 3.31Å; Q867-K869 PolarHBondContact O-N 3.44Å; Q867-K870 PolarHBondContact O-N 2.98Å; Q867-K871 WeakPolarHBondContact O-CB 3.46Å; Q867-K871 PolarHBondContact O-N 3.43Å
868	K	66.8	Low	63.4	Low	160 Å²	160	119.6 Å²	119.6	70%	0.696	56%	0.555	S	S	*	*	H	α-helix	trans	-61.7	-40.6	176.3	-159.8	171.7	-175.2	174.7	0	111.1	K864 K865 K871 Q872	K864-K868 PolarHBondContact O-N 3Å; K865-K868 PolarHBondContact O-N 2.7Å; K868-K871 PolarHBondContact O-N 3.46Å; K868-Q872 PolarHBondContact O-N 2.92Å
869	K	64.8	Low	62.4	Low	110 Å²	110	114.9 Å²	114.9	48%	0.478	55%	0.548	S	S	.	.	H	α-helix	trans	-62	-46.7	172.8	-168.3	-178.7	177.9	-170.9	0	112	K865 L866 Q867 K871 Q872 E873	K865-K869 WeakPolarHBondContact O-CB 3.44Å; K865-K869 PolarHBondContact O-N 3.29Å; L866-K869 PolarHBondContact O-N 2.7Å; Q867-K869 VanDerWaalsContact C-N 3.31Å; Q867-K869 PolarHBondContact O-N 3.44Å; K869-K871 VanDerWaalsContact C-N 3.3Å; K869-K871 PolarHBondContact O-N 2.72Å; K869-Q872 PolarHBondContact O-N 3.23Å; K869-E873 WeakPolarHBondContact CE-OE1 3.46Å; K869-E873 VanDerWaalsContact O-CG 3.29Å; K869-E873 WeakPolarHBondContact O-CG 3.48Å; K869-E873 PolarHBondContact O-N 2.88Å
870	K	63.4	Low	61.2	Low	127 Å²	127	111.4 Å²	111.4	55%	0.552	54%	0.541	S	S	*	.	H	α-helix	trans	-61.3	-36	174.6	-78.2	-173.7	175.7	-169.4	0	112.8	L866 Q867 E873 K874	L866-K870 WeakPolarHBondContact O-CB 3.49Å; L866-K870 WeakPolarHBondContact O-CG 3.24Å; L866-K870 PolarHBondContact O-N 3.4Å; Q867-K870 PolarHBondContact O-N 2.98Å; K870-E873 PolarHBondContact O-N 3.27Å; K870-K874 PolarHBondContact O-N 2.9Å
871	K	60.1	Low	59.7	Low	150 Å²	150	107.9 Å²	107.9	65%	0.652	54%	0.535	S	S	*	.	H	α-helix	trans	-67.6	-40.5	176.3	-155	178.1	-176.8	-173.7	0	110.9	Q867 K868 K869 K874 K875	Q867-K871 WeakPolarHBondContact O-CB 3.46Å; Q867-K871 PolarHBondContact O-N 3.43Å; K868-K871 PolarHBondContact O-N 3.46Å; K869-K871 VanDerWaalsContact C-N 3.3Å; K869-K871 PolarHBondContact O-N 2.72Å; K871-K874 PolarHBondContact O-N 3.46Å; K871-K875 PolarHBondContact O-N 2.85Å
872	Q	57.9	Low	57.9	Low	129 Å²	129	111 Å²	111	60%	0.603	54%	0.544	S	S	*	.	H	α-helix	trans	-65.1	-41.7	170.5	-93.9	-179.9	-14.8	0	0	112.7	K868 K869 K874 K875 V876	K868-Q872 PolarHBondContact O-N 2.92Å; K869-Q872 PolarHBondContact O-N 3.23Å; Q872-K874 VanDerWaalsContact C-N 3.31Å; Q872-K874 PolarHBondContact O-N 3.36Å; Q872-K875 PolarHBondContact O-N 3.4Å; Q872-V876 WeakPolarHBondContact O-CG2 3.39Å; Q872-V876 PolarHBondContact O-N 2.92Å
873	E	56.8	Low	56.4	Low	71 Å²	71	109.8 Å²	109.8	33%	0.332	55%	0.546	S	S	.	.	H	α-helix	trans	-60.6	-40.4	175.6	-72.9	174.2	174.6	0	0	111.6	L701 K869 K870 A877	L701-E873 HydrophobicContact CD1-CG 3.87Å; K869-E873 WeakPolarHBondContact CE-OE1 3.46Å; K869-E873 VanDerWaalsContact O-CG 3.29Å; K869-E873 WeakPolarHBondContact O-CG 3.48Å; K869-E873 PolarHBondContact O-N 2.88Å; K870-E873 PolarHBondContact O-N 3.27Å; E873-A877 PolarHBondContact O-N 2.92Å; E873-A877 VanDerWaalsContact O-N 3.15Å
874	K	55	Low	55.2	Low	163 Å²	163	106 Å²	106	71%	0.709	54%	0.535	S	S	*	.	H	α-helix	trans	-66	-44.5	172.7	-80.1	-170.9	173.2	-167.2	0	113	K870 K871 Q872 V876 A877 S878	K870-K874 PolarHBondContact O-N 2.9Å; K871-K874 PolarHBondContact O-N 3.46Å; Q872-K874 VanDerWaalsContact C-N 3.31Å; Q872-K874 PolarHBondContact O-N 3.36Å; K874-V876 VanDerWaalsContact C-N 3.33Å; K874-V876 PolarHBondContact O-N 3.31Å; K874-A877 PolarHBondContact O-N 3.39Å; K874-A877 VanDerWaalsContact O-N 3.13Å; K874-S878 PolarHBondContact O-N 2.98Å; K874-S878 PolarHBondContact O-OG 3.32Å
875	K	51.6	Low	54.4	Low	129 Å²	129	105 Å²	105	56%	0.561	55%	0.548	S	S	*	.	H	α-helix	trans	-60.9	-37.5	176.4	-89.6	-166.9	172.1	-166.3	0	112.9	K871 Q872 A877 S878 S879	K871-K875 PolarHBondContact O-N 2.85Å; Q872-K875 PolarHBondContact O-N 3.4Å; K875-A877 VanDerWaalsContact C-N 3.33Å; K875-S878 PolarHBondContact O-OG 3.28Å; K875-S878 VanDerWaalsContact O-OG 3.13Å; K875-S879 WeakPolarHBondContact O-CB 3.38Å; K875-S879 PolarHBondContact O-N 3.05Å; K875-S879 VanDerWaalsContact O-N 3.1Å; K875-S879 PolarHBondContact O-OG 2.98Å
876	V	53.3	Low	53.9	Low	58 Å²	58	101.9 Å²	101.9	35%	0.352	54%	0.535	S	S	.	.	H	α-helix	trans	-72.8	-27.3	176.4	177.1	0	0	0	0	111.9	L701 Q872 K874 S879	L701-V876 HydrophobicContact CD2-CB 4.29Å; L701-V876 HydrophobicContact CD2-CG1 4.03Å; L701-V876 HydrophobicContact CD2-CG2 4.3Å; Q872-V876 WeakPolarHBondContact O-CG2 3.39Å; Q872-V876 PolarHBondContact O-N 2.92Å; K874-V876 VanDerWaalsContact C-N 3.33Å; K874-V876 PolarHBondContact O-N 3.31Å; V876-S879 WeakPolarHBondContact CA-OG 3.44Å; V876-S879 PolarHBondContact O-OG 2.91Å
877	A	44.1	Very low	54.1	Low	43 Å²	43	99 Å²	99	36%	0.355	52%	0.524	S	S	.	.	H	α-helix	trans	-77.7	-38.2	174.5	0	0	0	0	0	112.5	E873 K874 K875 S880	E873-A877 PolarHBondContact O-N 2.92Å; E873-A877 VanDerWaalsContact O-N 3.15Å; K874-A877 PolarHBondContact O-N 3.39Å; K874-A877 VanDerWaalsContact O-N 3.13Å; K875-A877 VanDerWaalsContact C-N 3.33Å; A877-S880 PolarHBondContact O-N 3.36Å; A877-S880 PolarHBondContact O-OG 3.44Å
878	S	42.3	Very low	54.5	Low	49 Å²	49	93.7 Å²	93.7	34%	0.343	50%	0.5	S	S	.	.	H	α-helix	trans	-72.3	-35.8	178	61.6	0	0	0	0	112.8	K874 K875 S880 S881 D882	K874-S878 PolarHBondContact O-N 2.98Å; K874-S878 PolarHBondContact O-OG 3.32Å; K875-S878 PolarHBondContact O-OG 3.28Å; K875-S878 VanDerWaalsContact O-OG 3.13Å; S878-S880 PolarHBondContact O-N 3.46Å; S878-S880 VanDerWaalsContact O-N 3.17Å; S878-S881 WeakPolarHBondContact CA-OG 3.35Å; S878-S881 PolarHBondContact O-N 2.72Å; S878-S881 PolarHBondContact O-OG 3.37Å; S878-S881 VanDerWaalsContact O-OG 3.12Å; S878-D882 WeakPolarHBondContact O-CB 3.5Å; S878-D882 PolarHBondContact O-N 2.82Å; S878-D882 VanDerWaalsContact O-N 3.17Å
879	S	43.7	Very low	55	Low	73 Å²	73	86.2 Å²	86.2	51%	0.51	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-16.1	173.4	47.3	0	0	0	0	114	K875 V876	K875-S879 WeakPolarHBondContact O-CB 3.38Å; K875-S879 PolarHBondContact O-N 3.05Å; K875-S879 VanDerWaalsContact O-N 3.1Å; K875-S879 PolarHBondContact O-OG 2.98Å; V876-S879 WeakPolarHBondContact CA-OG 3.44Å; V876-S879 PolarHBondContact O-OG 2.91Å
880	S	43.8	Very low	55.6	Low	61 Å²	61	85.3 Å²	85.3	43%	0.427	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-15.3	171.2	51	0	0	0	0	114.7	A877 S878	A877-S880 PolarHBondContact O-N 3.36Å; A877-S880 PolarHBondContact O-OG 3.44Å; S878-S880 PolarHBondContact O-N 3.46Å; S878-S880 VanDerWaalsContact O-N 3.17Å
881	S	41.5	Very low	56.2	Low	76 Å²	76	81 Å²	81	53%	0.531	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-24.8	-177.7	54.6	0	0	0	0	114.3	S878	S878-S881 WeakPolarHBondContact CA-OG 3.35Å; S878-S881 PolarHBondContact O-N 2.72Å; S878-S881 PolarHBondContact O-OG 3.37Å; S878-S881 VanDerWaalsContact O-OG 3.12Å
882	D	35.5	Very low	57.1	Low	116 Å²	116	74.5 Å²	74.5	62%	0.62	42%	0.422	S	S	*	.	S	Bend	trans	-108	13.9	-154.5	-65.7	-6.5	0	0	0	117.4	S878	S878-D882 WeakPolarHBondContact O-CB 3.5Å; S878-D882 PolarHBondContact O-N 2.82Å; S878-D882 VanDerWaalsContact O-N 3.17Å
883	V	42.8	Very low	58.2	Low	103 Å²	103	72.4 Å²	72.4	62%	0.624	41%	0.414	S	S	*	.	S	Bend	trans	-134.5	-2.6	-169.7	-168.7	0	0	0	0	118.7
884	T	50.2	Low	59.6	Low	68 Å²	68	70.1 Å²	70.1	42%	0.417	40%	0.402	S	S	.	.			trans	-144.2	121.5	176.2	56	0	0	0	0	113.2	E886	T884-E886 PolarHBondContact O-N 3.19Å
885	S	57.2	Low	61.3	Low	134 Å²	134	63.2 Å²	63.2	94%	0.937	37%	0.374	S	S	*	.			trans	-64.1	3.1	169.8	44	0	0	0	0	114.2
886	E	62.9	Low	63.2	Low	99 Å²	99	57.4 Å²	57.4	46%	0.463	35%	0.349	S	S	.	.			trans	-74.3	131.4	179.6	-65.9	-178.3	172.9	0	0	111.7	K717 T884 F891	K717-E886 PolarHBondContact NZ-O 2.81Å; T884-E886 PolarHBondContact O-N 3.19Å; E886-F891 HydrophobicContact CB-CD2 4.06Å; E886-F891 WeakPolarHBondContact OE2-CD2 3.47Å
887	S	72.9	Confident	65.1	Low	38 Å²	38	54.6 Å²	54.6	27%	0.266	33%	0.333	S	S	.	.			trans	-70.3	148.7	178	65.4	0	0	0	0	111.4	V889 H890 F891	S887-V889 PolarHBondContact O-N 3.49Å; S887-H890 PolarHBondContact O-N 2.94Å; S887-F891 PolarHBondContact O-N 2.86Å; S887-F891 VanDerWaalsContact O-N 3.14Å
888	V	77.9	Confident	67.5	Low	11 Å²	11	52.6 Å²	52.6	7%	0.067	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	-32.8	176.7	163.1	0	0	0	0	113.3	K717 Y718 A723 E726 L727 F899	K717-V888 HydrophobicContact CD-CG2 4.01Å; Y718-V888 HydrophobicContact CD2-CG2 3.76Å; Y718-V888 HydrophobicContact CE2-CG2 3.63Å; A723-V888 HydrophobicContact CB-CG2 4.29Å; E726-V888 HydrophobicContact CB-CG2 4.47Å; E726-V888 HydrophobicContact CG-CB 4.46Å; E726-V888 HydrophobicContact CG-CG2 4.06Å; E726-V888 WeakPolarHBondContact OE1-CG2 3.42Å; E726-V888 PolarHBondContact OE1-N 2.95Å; E726-V888 WeakPolarHBondContact OE2-CG2 3.49Å; L727-V888 HydrophobicContact CD1-CG1 4.22Å; V888-F899 HydrophobicContact CG1-CZ 3.7Å
889	V	78.1	Confident	70	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.018	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-41.2	-178.9	175.9	0	0	0	0	111.9	L727 S730 W731 S887 P895 V896	L727-V889 HydrophobicContact CD1-CG2 4.16Å; S730-V889 WeakPolarHBondContact OG-CG2 3.45Å; W731-V889 HydrophobicContact CG-CG2 4.41Å; W731-V889 HydrophobicContact CZ2-CG1 3.9Å; S887-V889 PolarHBondContact O-N 3.49Å; V889-P895 HydrophobicContact CG1-CB 4.02Å; V889-P895 VanDerWaalsContact O-CA 3.31Å; V889-P895 WeakPolarHBondContact O-CA 3.32Å; V889-V896 PolarHBondContact O-N 3.34Å
890	H	77.6	Confident	72.5	Confident	91 Å²	91	47.1 Å²	47.1	42%	0.421	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	11.4	-171.6	-66.6	-62.7	0	0	0	114.7	S887 G892	S887-H890 PolarHBondContact O-N 2.94Å; H890-G892 PolarHBondContact O-N 3Å
891	F	75.5	Confident	74.8	Confident	37 Å²	37	44.4 Å²	44.4	16%	0.162	26%	0.257	C	S	.	.	S	Bend	trans	-64.3	-24.7	177.2	-163.9	-110.4	0	0	0	113.7	K715 K717 E886 S887	K715-F891 HydrophobicContact CB-CD1 4.14Å; K715-F891 HydrophobicContact CB-CE1 4.14Å; K715-F891 WeakPolarHBondContact O-CD1 3.49Å; K717-F891 HydrophobicContact CB-CD1 4.25Å; K717-F891 HydrophobicContact CB-CE1 4.35Å; K717-F891 HydrophobicContact CB-CG 4.42Å; E886-F891 HydrophobicContact CB-CD2 4.06Å; E886-F891 WeakPolarHBondContact OE2-CD2 3.47Å; S887-F891 PolarHBondContact O-N 2.86Å; S887-F891 VanDerWaalsContact O-N 3.14Å
892	G	77.7	Confident	77.2	Confident	13 Å²	13	42.1 Å²	42.1	13%	0.134	24%	0.239	C	C	.	.	S	Bend	trans	-110.3	171.8	173.7	0	0	0	0	0	111.9	H890 R894	H890-G892 PolarHBondContact O-N 3Å; G892-R894 PolarHBondContact O-N 2.79Å
893	L	81.2	Confident	79.9	Confident	85 Å²	85	37.2 Å²	37.2	45%	0.445	22%	0.216	S	C	.	.	S	Bend	trans	-60.3	-29	176.6	-69.8	168.9	0	0	0	113.3	E813 R814	E813-L893 VanDerWaalsContact OE1-CG 3.31Å; E813-L893 WeakPolarHBondContact OE1-CG 3.16Å; E813-L893 PolarHBondContact OE1-N 2.88Å; E813-L893 WeakPolarHBondContact OE2-CB 3.43Å; R814-L893 HydrophobicContact CB-CD1 4.05Å; R814-L893 HydrophobicContact CG-CD1 4.31Å
894	R	86.6	Confident	82.3	Confident	22 Å²	22	33 Å²	33	8%	0.083	19%	0.193	C	C	.	.	S	Bend	trans	-108.9	137.4	-179.3	-78.3	68.5	172.5	-171.3	6.4	110.3	C793 D799 E813 G892 V896 L941 Y950	C793-R894 HydrophobicContact CB-CB 3.91Å; D799-R894 IonicContact OD1-NH2 3.82Å; D799-R894 PolarHBondContact OD1-NH2 2.8Å; D799-R894 VanDerWaalsContact OD1-NH2 3.15Å; D799-R894 IonicContact OD2-CZ 3.2Å; D799-R894 IonicContact OD2-NE 2.65Å; D799-R894 PolarHBondContact OD2-NE 2.67Å; D799-R894 VanDerWaalsContact OD2-NE 3.08Å; D799-R894 IonicContact OD2-NH2 3.19Å; D799-R894 PolarHBondContact OD2-NH2 3.4Å; E813-R894 IonicContact OE2-NH1 2.86Å; G892-R894 PolarHBondContact O-N 2.79Å; R894-V896 PolarHBondContact O-N 2.87Å; R894-L941 HydrophobicContact CG-CD1 4.35Å; R894-Y950 HydrophobicContact CB-CE1 4.09Å; R894-Y950 HydrophobicContact CG-CE1 4.42Å
895	P	90.2	Very high	84.4	Confident	19 Å²	19	35.5 Å²	35.5	12%	0.123	20%	0.196	C	C	.	.			trans	-63	132.2	179.2	-10.8	21.4	0	0	0	111.4	W731 C793 L794 V889	W731-P895 HydrophobicContact CZ2-CB 4.37Å; C793-P895 CarbonylContact C-O 3.36Å; C793-P895 WeakPolarHBondContact CA-O 3.42Å; C793-P895 WeakPolarHBondContact CB-O 3.42Å; L794-P895 HydrophobicContact CB-CB 4.42Å; L794-P895 HydrophobicContact CB-CG 4.15Å; L794-P895 HydrophobicContact CD1-CB 4.22Å; L794-P895 HydrophobicContact CD1-CG 4.23Å; L794-P895 PolarHBondContact N-O 3.02Å; V889-P895 HydrophobicContact CG1-CB 4.02Å; V889-P895 VanDerWaalsContact O-CA 3.31Å; V889-P895 WeakPolarHBondContact O-CA 3.32Å
896	V	92.9	Very high	86	Confident	6 Å²	6	29.2 Å²	29.2	4%	0.036	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	124.8	175.3	-177.8	0	0	0	0	110.6	L727 W731 L791 I792 V889 R894 F899	L727-V896 HydrophobicContact CD1-CG1 4.22Å; W731-V896 PolarHBondContact NE1-O 3.45Å; L791-V896 HydrophobicContact CB-CG1 4.41Å; L791-V896 HydrophobicContact CB-CG2 4.42Å; L791-V896 HydrophobicContact CD1-CG2 4.11Å; L791-V896 HydrophobicContact CD2-CG1 4.49Å; I792-V896 CarbonylContact O-C 3.52Å; I792-V896 WeakPolarHBondContact O-CA 3.45Å; V889-V896 PolarHBondContact O-N 3.34Å; R894-V896 PolarHBondContact O-N 2.87Å; V896-F899 HydrophobicContact CG1-CE1 4.24Å; V896-F899 HydrophobicContact CG1-CZ 4.46Å
897	I	92.6	Very high	87.2	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-20.1	177.6	63.7	173.5	0	0	0	113.5	W731 I792 L794 C918 S919 A922 V940 L955	W731-I897 HydrophobicContact CZ2-CG2 4.05Å; I792-I897 HydrophobicContact CB-CD1 4.38Å; I792-I897 HydrophobicContact CB-CG1 3.8Å; I792-I897 HydrophobicContact CG2-CD1 3.57Å; I792-I897 HydrophobicContact CG2-CG1 3.54Å; I792-I897 WeakPolarHBondContact O-CG1 3.32Å; I792-I897 PolarHBondContact O-N 2.88Å; L794-I897 HydrophobicContact CD1-CG2 4.16Å; L794-I897 HydrophobicContact CD2-CG2 3.69Å; L794-I897 HydrophobicContact CG-CG2 3.45Å; L794-I897 VanDerWaalsContact CG-CG2 3.45Å; I897-C918 WeakPolarHBondContact O-CA 3.37Å; I897-S919 PolarHBondContact O-N 3.4Å; I897-S919 VanDerWaalsContact O-N 3.1Å; I897-A922 HydrophobicContact CB-CB 3.87Å; I897-A922 HydrophobicContact CG2-CB 3.96Å; I897-V940 HydrophobicContact CD1-CG1 4.26Å; I897-L955 HydrophobicContact CD1-CD1 4.25Å
898	G	94.5	Very high	87.7	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.2	-176.3	-175.4	0	0	0	0	0	113.6	I792 L917	I792-G898 PolarHBondContact N-O 3.45Å; G898-L917 VanDerWaalsContact CA-O 3.23Å; G898-L917 WeakPolarHBondContact CA-O 3.37Å
899	F	95.5	Very high	88	Confident	8 Å²	8	31.8 Å²	31.8	4%	0.035	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	146.5	-176.2	-54.3	-78.8	0	0	0	112.2	F722 W724 L727 A790 L791 V888 V896 G916 L917	F722-F899 HydrophobicContact CD1-CB 3.73Å; F722-F899 HydrophobicContact CD1-CD2 4.48Å; F722-F899 HydrophobicContact CD1-CG 4.17Å; F722-F899 HydrophobicContact CE1-CB 4.06Å; W724-F899 AromaticContact CE3-CD2 3.95Å; W724-F899 HydrophobicContact CE3-CD2 3.95Å; W724-F899 HydrophobicContact CH2-CB 3.71Å; W724-F899 AromaticContact CH2-CD2 3.84Å; W724-F899 HydrophobicContact CH2-CD2 3.84Å; W724-F899 HydrophobicContact CH2-CG 4.27Å; W724-F899 HydrophobicContact CZ3-CB 4.14Å; W724-F899 AromaticContact CZ3-CD2 3.52Å; W724-F899 HydrophobicContact CZ3-CD2 3.52Å; W724-F899 HydrophobicContact CZ3-CE2 4.46Å; W724-F899 HydrophobicContact CZ3-CG 4.31Å; L727-F899 HydrophobicContact CB-CE2 4.44Å; L727-F899 HydrophobicContact CD1-CE2 4.17Å; L727-F899 HydrophobicContact CD1-CZ 4.46Å; L727-F899 HydrophobicContact CD2-CE2 4.38Å; A790-F899 WeakPolarHBondContact O-CA 3.43Å; L791-F899 HydrophobicContact CD2-CD1 3.55Å; L791-F899 HydrophobicContact CD2-CE1 3.38Å; V888-F899 HydrophobicContact CG1-CZ 3.7Å; V896-F899 HydrophobicContact CG1-CE1 4.24Å; V896-F899 HydrophobicContact CG1-CZ 4.46Å; F899-G916 WeakPolarHBondContact O-CA 3.33Å; F899-L917 PolarHBondContact N-O 3.26Å; F899-L917 PolarHBondContact O-N 2.89Å; F899-L917 VanDerWaalsContact O-N 3.07Å
900	V	95.2	Very high	88.4	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	118.2	171.9	172.8	0	0	0	0	110	I778 P786 R787 H789 A790 I792 A914	I778-V900 HydrophobicContact CD1-CG2 4.48Å; P786-V900 HydrophobicContact CB-CG2 4.5Å; R787-V900 VanDerWaalsContact O-CG1 3.29Å; R787-V900 WeakPolarHBondContact O-CG1 3.36Å; H789-V900 PolarHBondContact N-O 3.03Å; A790-V900 HydrophobicContact CB-CB 3.99Å; A790-V900 HydrophobicContact CB-CG2 3.93Å; A790-V900 PolarHBondContact O-N 3.47Å; I792-V900 HydrophobicContact CD1-CG2 4.29Å; I792-V900 HydrophobicContact CG1-CG2 4Å; V900-A914 HydrophobicContact CB-CB 4.44Å; V900-A914 HydrophobicContact CG1-CB 3.52Å; V900-A914 HydrophobicContact CG2-CB 4.05Å
901	L	93	Very high	89.1	Confident	4 Å²	4	34.3 Å²	34.3	2%	0.021	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	-47.5	176.2	-70.7	174.7	0	0	0	111.5	D678 F722 W724 R788 S915 L917	D678-L901 HydrophobicContact CB-CD1 4.2Å; F722-L901 HydrophobicContact CE1-CD2 4.29Å; F722-L901 HydrophobicContact CE2-CD2 4.2Å; F722-L901 HydrophobicContact CZ-CD2 4.04Å; W724-L901 HydrophobicContact CH2-CD2 4.36Å; W724-L901 HydrophobicContact CZ2-CD2 3.75Å; R788-L901 WeakPolarHBondContact CG-O 3.48Å; R788-L901 PolarHBondContact NH1-O 2.89Å; L901-S915 PolarHBondContact N-O 2.91Å; L901-L917 HydrophobicContact CD1-CD1 3.83Å; L901-L917 HydrophobicContact CD1-CG 3.82Å; L901-L917 HydrophobicContact CD2-CD1 4.44Å; L901-L917 HydrophobicContact CG-CD1 4.43Å; L901-L917 HydrophobicContact CG-CG 4.43Å
902	D	91.1	Very high	89.9	Confident	28 Å²	28	32.6 Å²	32.6	15%	0.15	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	134.6	178.8	-167.5	17.7	0	0	0	110.7	R668 A914 S915	R668-D902 IonicContact CZ-OD2 3.93Å; R668-D902 IonicContact NE-OD2 2.65Å; R668-D902 IonicContact NH1-OD1 2.84Å; R668-D902 PolarHBondContact NH1-OD1 2.66Å; R668-D902 IonicContact NH1-OD2 3.68Å; R668-D902 PolarHBondContact NH1-OD2 3.26Å; D902-A914 CarbonylContact O-C 3.51Å; D902-A914 VanDerWaalsContact O-CA 3.29Å; D902-A914 WeakPolarHBondContact O-CA 3.38Å; D902-S915 PolarHBondContact N-O 3.49Å; D902-S915 PolarHBondContact O-N 3.35Å; D902-S915 PolarHBondContact O-OG 3.49Å
903	G	92.2	Very high	90.6	Very high	13 Å²	13	32.6 Å²	32.6	13%	0.134	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	140.6	-170.4	0	0	0	0	0	111.8	P786	P786-G903 CarbonylContact O-C 3.6Å; P786-G903 WeakPolarHBondContact O-CA 3.37Å
904	G	93.2	Very high	91.2	Very high	13 Å²	13	28.6 Å²	28.6	13%	0.134	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.2	176.7	-179.9	0	0	0	0	0	113.3	V785 P786 S906 I913	V785-G904 VanDerWaalsContact CG1-C 3.43Å; P786-G904 PolarHBondContact O-N 3.07Å; G904-S906 PolarHBondContact O-N 2.91Å; G904-I913 PolarHBondContact N-O 3.44Å; G904-I913 PolarHBondContact O-N 3.4Å
905	Y	93.5	Very high	91.5	Very high	122 Å²	122	27.7 Å²	27.7	48%	0.478	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	119.9	173.1	-175.4	-90.3	0	0	0	109.3	V785 L907 G910	V785-Y905 HydrophobicContact CG2-CD2 4.1Å; Y905-L907 HydrophobicContact CD1-CD2 4.17Å; Y905-L907 HydrophobicContact CE1-CD2 4.1Å; Y905-G910 PolarHBondContact OH-O 3.44Å; Y905-G910 VanDerWaalsContact OH-O 3.12Å
906	S	90.7	Very high	91.7	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.007	14%	0.14	C	C	.	.			trans	-79.5	125	176.9	174.1	0	0	0	0	110.5	E669 G904 L908 K909 G910 K911	E669-S906 WeakPolarHBondContact OE1-CA 3.1Å; G904-S906 PolarHBondContact O-N 2.91Å; S906-L908 VanDerWaalsContact C-N 3.34Å; S906-L908 PolarHBondContact OG-N 3.41Å; S906-K909 PolarHBondContact OG-N 3.32Å; S906-G910 WeakPolarHBondContact O-CA 3.29Å; S906-G910 PolarHBondContact O-N 2.84Å; S906-K911 PolarHBondContact N-O 3.33Å
907	L	88.4	Confident	91.8	Very high	60 Å²	60	26.6 Å²	26.6	31%	0.314	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-19.7	174.7	-70.1	172.6	0	0	0	112.4	R293 F296 E669 Y905	R293-L907 HydrophobicContact CB-CD1 4.45Å; R293-L907 HydrophobicContact CG-CD1 3.96Å; R293-L907 HydrophobicContact CG-CD2 4.41Å; F296-L907 HydrophobicContact CB-CB 4.33Å; F296-L907 HydrophobicContact CB-CD1 3.98Å; F296-L907 HydrophobicContact CD2-CD1 3.59Å; F296-L907 HydrophobicContact CE2-CD1 4.37Å; F296-L907 HydrophobicContact CG-CB 4.23Å; F296-L907 HydrophobicContact CG-CD1 3.88Å; E669-L907 PolarHBondContact OE1-N 3.4Å; Y905-L907 HydrophobicContact CD1-CD2 4.17Å; Y905-L907 HydrophobicContact CE1-CD2 4.1Å
908	L	83.5	Confident	91.9	Very high	43 Å²	43	26.6 Å²	26.6	23%	0.225	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-45.5	177.2	-69.1	176.3	0	0	0	112.6	K300 A630 E669 S906	K300-L908 HydrophobicContact CB-CD2 4.31Å; K300-L908 HydrophobicContact CD-CD2 3.87Å; K300-L908 HydrophobicContact CG-CD2 4.48Å; A630-L908 HydrophobicContact CB-CD1 3.78Å; E669-L908 HydrophobicContact CB-CD1 4.13Å; E669-L908 WeakPolarHBondContact OE2-CD1 3.44Å; E669-L908 WeakPolarHBondContact OE2-CG 3.49Å; S906-L908 VanDerWaalsContact C-N 3.34Å; S906-L908 PolarHBondContact OG-N 3.41Å
909	K	83.9	Confident	91.8	Very high	100 Å²	100	26.6 Å²	26.6	44%	0.435	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-16.9	-179.5	-50.3	-162.7	-165.5	-176.8	0	114	E779 S906 I913	E779-K909 WeakPolarHBondContact OE1-CD 3.02Å; E779-K909 IonicContact OE1-NZ 2.97Å; E779-K909 PolarHBondContact OE1-NZ 2.91Å; S906-K909 PolarHBondContact OG-N 3.32Å; K909-I913 HydrophobicContact CB-CD1 3.99Å; K909-I913 HydrophobicContact CD-CD1 3.49Å; K909-I913 VanDerWaalsContact CD-CD1 3.49Å; K909-I913 HydrophobicContact CG-CD1 3.71Å
910	G	88.4	Confident	91.5	Very high	37 Å²	37	26.2 Å²	26.2	38%	0.381	14%	0.137	S	C	.	.	S	Bend	trans	74.2	21.4	179.9	0	0	0	0	0	114.8	Y905 S906	Y905-G910 PolarHBondContact OH-O 3.44Å; Y905-G910 VanDerWaalsContact OH-O 3.12Å; S906-G910 WeakPolarHBondContact O-CA 3.29Å; S906-G910 PolarHBondContact O-N 2.84Å
911	K	90.2	Very high	91.2	Very high	109 Å²	109	26.8 Å²	26.8	47%	0.474	14%	0.14	S	C	.	.	S	Bend	trans	-135.1	172	179.3	-60.3	-172.1	-177.8	-172.5	0	110.8	S780 S906	S780-K911 WeakPolarHBondContact O-CD 3.11Å; S906-K911 PolarHBondContact N-O 3.33Å
912	G	92.5	Very high	90.9	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.01	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	124.4	171.4	0	0	0	0	0	110.1	S780	S780-G912 PolarHBondContact N-O 3.43Å; S780-G912 VanDerWaalsContact OG-CA 3.32Å; S780-G912 WeakPolarHBondContact OG-CA 3.38Å; S780-G912 PolarHBondContact OG-N 2.8Å; S780-G912 PolarHBondContact OG-O 3.21Å
913	I	92.5	Very high	90.8	Very high	14 Å²	14	25.3 Å²	25.3	7%	0.072	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	138.7	176.6	-57.2	-176.5	0	0	0	108.9	I778 E779 G904 K909	I778-I913 CarbonylContact O-C 3.58Å; I778-I913 WeakPolarHBondContact O-CA 3.46Å; E779-I913 HydrophobicContact CG-CG1 4.44Å; G904-I913 PolarHBondContact N-O 3.44Å; G904-I913 PolarHBondContact O-N 3.4Å; K909-I913 HydrophobicContact CB-CD1 3.99Å; K909-I913 HydrophobicContact CD-CD1 3.49Å; K909-I913 VanDerWaalsContact CD-CD1 3.49Å; K909-I913 HydrophobicContact CG-CD1 3.71Å
914	A	94.2	Very high	90.4	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.008	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	150.9	173.2	0	0	0	0	0	111.8	S777 I778 P786 V900 D902	S777-A914 CarbonylContact C-O 3.55Å; S777-A914 WeakPolarHBondContact CA-O 3.48Å; I778-A914 HydrophobicContact CB-CB 4.45Å; I778-A914 PolarHBondContact N-O 2.91Å; I778-A914 PolarHBondContact O-N 3.12Å; P786-A914 HydrophobicContact CB-CB 3.66Å; P786-A914 HydrophobicContact CG-CB 3.41Å; P786-A914 VanDerWaalsContact CG-CB 3.41Å; V900-A914 HydrophobicContact CB-CB 4.44Å; V900-A914 HydrophobicContact CG1-CB 3.52Å; V900-A914 HydrophobicContact CG2-CB 4.05Å; D902-A914 CarbonylContact O-C 3.51Å; D902-A914 VanDerWaalsContact O-CA 3.29Å; D902-A914 WeakPolarHBondContact O-CA 3.38Å
915	S	93.3	Very high	90	Very high	3 Å²	3	29 Å²	29	2%	0.021	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	138.2	162	47.8	0	0	0	0	109	D678 V776 L901 D902	D678-S915 PolarHBondContact OD2-OG 3.32Å; V776-S915 WeakPolarHBondContact O-CA 3.29Å; L901-S915 PolarHBondContact N-O 2.91Å; D902-S915 PolarHBondContact N-O 3.49Å; D902-S915 PolarHBondContact O-N 3.35Å; D902-S915 PolarHBondContact O-OG 3.49Å
916	G	94.3	Very high	89.6	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	175.3	-179.5	0	0	0	0	0	112.4	V776 F899	V776-G916 PolarHBondContact N-O 3.18Å; V776-G916 PolarHBondContact O-N 2.73Å; F899-G916 WeakPolarHBondContact O-CA 3.33Å
917	L	95.4	Very high	89.2	Confident	1 Å²	1	24.7 Å²	24.7	1%	0.005	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	136.1	172.5	-66.5	167.4	0	0	0	108.6	A680 W724 V749 L773 V774 R775 G898 F899 L901	A680-L917 HydrophobicContact CB-CD1 3.63Å; W724-L917 HydrophobicContact CH2-CB 3.62Å; W724-L917 HydrophobicContact CH2-CD1 4.13Å; W724-L917 HydrophobicContact CH2-CG 4.38Å; W724-L917 HydrophobicContact CZ2-CB 4.37Å; W724-L917 HydrophobicContact CZ2-CD1 4.03Å; W724-L917 HydrophobicContact CZ3-CB 3.69Å; V749-L917 HydrophobicContact CG1-CD2 4.06Å; V749-L917 HydrophobicContact CG2-CD1 4.26Å; V749-L917 HydrophobicContact CG2-CD2 4.14Å; L773-L917 HydrophobicContact CB-CB 4.37Å; L773-L917 HydrophobicContact CB-CD2 4.36Å; L773-L917 HydrophobicContact CD1-CD1 4.24Å; V774-L917 WeakPolarHBondContact O-CA 3.5Å; R775-L917 HydrophobicContact CB-CD2 4.1Å; R775-L917 HydrophobicContact CG-CD2 4.37Å; G898-L917 VanDerWaalsContact CA-O 3.23Å; G898-L917 WeakPolarHBondContact CA-O 3.37Å; F899-L917 PolarHBondContact N-O 3.26Å; F899-L917 PolarHBondContact O-N 2.89Å; F899-L917 VanDerWaalsContact O-N 3.07Å; L901-L917 HydrophobicContact CD1-CD1 3.83Å; L901-L917 HydrophobicContact CD1-CG 3.82Å; L901-L917 HydrophobicContact CD2-CD1 4.44Å; L901-L917 HydrophobicContact CG-CD1 4.43Å; L901-L917 HydrophobicContact CG-CG 4.43Å
918	C	94.1	Very high	88.8	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	150.7	175.4	-69.7	0	0	0	0	110.1	L773 V774 V776 I897 L923	L773-C918 CarbonylContact C-O 3.58Å; L773-C918 WeakPolarHBondContact CA-O 3.41Å; V774-C918 PolarHBondContact N-O 2.85Å; V774-C918 PolarHBondContact O-N 2.9Å; V776-C918 HydrophobicContact CG1-CB 4.44Å; V776-C918 HydrophobicContact CG2-CB 4.5Å; I897-C918 WeakPolarHBondContact O-CA 3.37Å; C918-L923 HydrophobicContact CB-CD1 4.11Å; C918-L923 HydrophobicContact CB-CD2 4.03Å; C918-L923 HydrophobicContact CB-CG 3.92Å
919	S	92.5	Very high	88.3	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	137.1	170	169.9	0	0	0	0	110.2	I897 L921 A922 L923	I897-S919 PolarHBondContact O-N 3.4Å; I897-S919 VanDerWaalsContact O-N 3.1Å; S919-L921 VanDerWaalsContact C-N 3.33Å; S919-L921 PolarHBondContact O-N 3.46Å; S919-L921 PolarHBondContact OG-N 3.44Å; S919-A922 WeakPolarHBondContact O-CB 3.43Å; S919-A922 PolarHBondContact O-N 3.38Å; S919-L923 PolarHBondContact O-N 2.92Å
920	C	89.8	Confident	87.4	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61.9	-41.5	177.8	-165.7	0	0	0	0	111.8	S772 V774 A922 L923 N924	S772-C920 WeakPolarHBondContact O-CB 3.25Å; S772-C920 PolarHBondContact O-N 2.97Å; S772-C920 WeakPolarHBondContact OG-CB 3.19Å; V774-C920 HydrophobicContact CG2-CB 3.97Å; C920-A922 VanDerWaalsContact C-N 3.32Å; C920-A922 PolarHBondContact O-N 3.17Å; C920-L923 PolarHBondContact O-N 3.5Å; C920-N924 PolarHBondContact O-N 2.83Å
921	L	87.6	Confident	85.9	Confident	13 Å²	13	32.3 Å²	32.3	7%	0.068	16%	0.157	C	C	.	.	H	α-helix	trans	-60.2	-42.9	175.6	-63.3	177.1	0	0	0	111.5	W731 K732 A770 S919 L923 N924 R925	W731-L921 HydrophobicContact CB-CB 4.44Å; K732-L921 HydrophobicContact CG-CD1 4.03Å; A770-L921 HydrophobicContact CB-CD1 4.33Å; A770-L921 HydrophobicContact CB-CD2 4.38Å; S919-L921 VanDerWaalsContact C-N 3.33Å; S919-L921 PolarHBondContact O-N 3.46Å; S919-L921 PolarHBondContact OG-N 3.44Å; L921-L923 VanDerWaalsContact C-N 3.33Å; L921-L923 PolarHBondContact O-N 3.31Å; L921-N924 WeakPolarHBondContact O-CB 3.36Å; L921-N924 PolarHBondContact O-N 2.83Å; L921-R925 PolarHBondContact O-N 2.8Å; L921-R925 VanDerWaalsContact O-N 3.08Å
922	A	88	Confident	84.2	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.9	-36.4	177.5	0	0	0	0	0	112.5	W731 I897 S919 C920 L926	W731-A922 HydrophobicContact CD2-CB 3.7Å; W731-A922 VanDerWaalsContact CE2-CB 3.44Å; W731-A922 HydrophobicContact CE3-CB 4.19Å; W731-A922 HydrophobicContact CG-CB 4.14Å; W731-A922 HydrophobicContact CH2-CB 4.25Å; W731-A922 HydrophobicContact CZ2-CB 3.76Å; W731-A922 HydrophobicContact CZ3-CB 4.44Å; I897-A922 HydrophobicContact CB-CB 3.87Å; I897-A922 HydrophobicContact CG2-CB 3.96Å; S919-A922 WeakPolarHBondContact O-CB 3.43Å; S919-A922 PolarHBondContact O-N 3.38Å; C920-A922 VanDerWaalsContact C-N 3.32Å; C920-A922 PolarHBondContact O-N 3.17Å; A922-L926 PolarHBondContact O-N 2.86Å
923	L	88.4	Confident	82.4	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-68.8	-39	174.5	-72.5	177.9	0	0	0	112	V774 V776 C918 S919 C920 L921 R925 L926 F927 L955	V774-L923 HydrophobicContact CB-CD1 3.62Å; V774-L923 HydrophobicContact CG1-CD1 3.84Å; V774-L923 HydrophobicContact CG2-CD1 4.04Å; V776-L923 HydrophobicContact CG1-CD1 4.22Å; C918-L923 HydrophobicContact CB-CD1 4.11Å; C918-L923 HydrophobicContact CB-CD2 4.03Å; C918-L923 HydrophobicContact CB-CG 3.92Å; S919-L923 PolarHBondContact O-N 2.92Å; C920-L923 PolarHBondContact O-N 3.5Å; L921-L923 VanDerWaalsContact C-N 3.33Å; L921-L923 PolarHBondContact O-N 3.31Å; L923-R925 VanDerWaalsContact C-N 3.29Å; L923-R925 PolarHBondContact O-N 2.83Å; L923-L926 HydrophobicContact CD2-CD2 4.19Å; L923-L926 WeakPolarHBondContact O-CB 3.47Å; L923-L926 PolarHBondContact O-N 3.36Å; L923-F927 HydrophobicContact CB-CE2 4.05Å; L923-F927 HydrophobicContact CB-CZ 4.2Å; L923-F927 HydrophobicContact CD2-CZ 4.43Å; L923-F927 VanDerWaalsContact O-CD2 3.22Å; L923-F927 WeakPolarHBondContact O-CD2 2.86Å; L923-F927 WeakPolarHBondContact O-CG 3.48Å; L923-F927 PolarHBondContact O-N 3.5Å; L923-L955 HydrophobicContact CD2-CD1 4.22Å; L923-L955 HydrophobicContact CD2-CD2 4.14Å
924	N	85.1	Confident	80.6	Confident	47 Å²	47	38.8 Å²	38.8	25%	0.251	19%	0.189	S	C	.	.	H	α-helix	trans	-59.3	-45.2	175.4	-167.2	23.1	0	0	0	110.9	T765 C920 L921 L926 F927 S928	T765-N924 HydrophobicContact CG2-CB 3.7Å; T765-N924 PolarHBondContact OG1-ND2 3.33Å; C920-N924 PolarHBondContact O-N 2.83Å; L921-N924 WeakPolarHBondContact O-CB 3.36Å; L921-N924 PolarHBondContact O-N 2.83Å; N924-L926 PolarHBondContact O-N 2.84Å; N924-F927 PolarHBondContact O-N 2.85Å; N924-S928 PolarHBondContact O-N 2.8Å; N924-S928 PolarHBondContact O-OG 3.01Å
925	R	84.3	Confident	78.7	Confident	57 Å²	57	45.8 Å²	45.8	22%	0.215	23%	0.234	C	C	.	.	H	α-helix	trans	-58.4	-48.6	173.6	-173.2	176.4	-179.7	168.1	11.1	112	W731 L921 L923 F927 S928 E929	W731-R925 HydrophobicContact CZ3-CB 4.4Å; W731-R925 VanDerWaalsContact CZ3-CD 3.44Å; L921-R925 PolarHBondContact O-N 2.8Å; L921-R925 VanDerWaalsContact O-N 3.08Å; L923-R925 VanDerWaalsContact C-N 3.29Å; L923-R925 PolarHBondContact O-N 2.83Å; R925-F927 VanDerWaalsContact C-N 3.29Å; R925-F927 PolarHBondContact O-N 2.87Å; R925-S928 WeakPolarHBondContact CA-OG 3.5Å; R925-S928 PolarHBondContact O-N 3.42Å; R925-S928 VanDerWaalsContact O-N 3.13Å; R925-S928 PolarHBondContact O-OG 3.33Å; R925-E929 VanDerWaalsContact CG-CD 3.45Å; R925-E929 HydrophobicContact CG-CG 4.13Å; R925-E929 WeakPolarHBondContact CG-OE2 3.46Å; R925-E929 IonicContact CZ-OE1 3.21Å; R925-E929 VanDerWaalsContact NE-CD 3.27Å; R925-E929 IonicContact NE-OE1 3.43Å; R925-E929 PolarHBondContact NE-OE1 3.17Å; R925-E929 IonicContact NE-OE2 3.22Å; R925-E929 PolarHBondContact NE-OE2 2.99Å; R925-E929 VanDerWaalsContact NE-OE2 3.15Å; R925-E929 IonicContact NH2-OE1 2.96Å; R925-E929 PolarHBondContact NH2-OE1 3.2Å; R925-E929 VanDerWaalsContact NH2-OE1 3.1Å; R925-E929 WeakPolarHBondContact O-CB 3.43Å; R925-E929 PolarHBondContact O-N 3.23Å
926	L	85	Confident	77.3	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-53.1	-47.2	175.2	177.8	71.1	0	0	0	111.4	L794 A922 L923 N924 S928 T930 H938 V940	L794-L926 HydrophobicContact CD2-CB 3.74Å; L794-L926 HydrophobicContact CD2-CD1 3.49Å; L794-L926 VanDerWaalsContact CD2-CD1 3.49Å; L794-L926 HydrophobicContact CD2-CG 4.18Å; A922-L926 PolarHBondContact O-N 2.86Å; L923-L926 HydrophobicContact CD2-CD2 4.19Å; L923-L926 WeakPolarHBondContact O-CB 3.47Å; L923-L926 PolarHBondContact O-N 3.36Å; N924-L926 PolarHBondContact O-N 2.84Å; L926-S928 VanDerWaalsContact C-N 3.33Å; L926-S928 PolarHBondContact O-N 2.74Å; L926-T930 HydrophobicContact CD1-CG2 3.69Å; L926-T930 WeakPolarHBondContact O-CB 3.46Å; L926-T930 PolarHBondContact O-N 2.95Å; L926-T930 PolarHBondContact O-OG1 2.67Å; L926-H938 HydrophobicContact CD2-CB 4.12Å; L926-V940 HydrophobicContact CD1-CG1 4.13Å; L926-V940 HydrophobicContact CD2-CG1 3.77Å
927	F	82.1	Confident	76.4	Confident	32 Å²	32	49.5 Å²	49.5	14%	0.14	26%	0.264	C	S	.	.	H	α-helix	trans	-68.7	-31.5	-178.5	-58.8	-28.4	0	0	0	113	L923 N924 R925 H938 V957	L923-F927 HydrophobicContact CB-CE2 4.05Å; L923-F927 HydrophobicContact CB-CZ 4.2Å; L923-F927 HydrophobicContact CD2-CZ 4.43Å; L923-F927 VanDerWaalsContact O-CD2 3.22Å; L923-F927 WeakPolarHBondContact O-CD2 2.86Å; L923-F927 WeakPolarHBondContact O-CG 3.48Å; L923-F927 PolarHBondContact O-N 3.5Å; N924-F927 PolarHBondContact O-N 2.85Å; R925-F927 VanDerWaalsContact C-N 3.29Å; R925-F927 PolarHBondContact O-N 2.87Å; F927-H938 AromaticContact CD1-CD2 3.73Å; F927-H938 AromaticContact CD1-CE1 3.42Å; F927-H938 VanDerWaalsContact CD1-CE1 3.42Å; F927-H938 WeakPolarHBondContact CD1-CE1 3.41Å; F927-H938 AromaticContact CD1-CG 3.91Å; F927-H938 AromaticContact CD1-ND1 3.73Å; F927-H938 AromaticContact CD1-NE2 3.43Å; F927-H938 WeakPolarHBondContact CD1-NE2 3.37Å; F927-H938 AromaticContact CE1-CD2 3.37Å; F927-H938 WeakPolarHBondContact CE1-CD2 3.43Å; F927-H938 AromaticContact CE1-CE1 3.89Å; F927-H938 AromaticContact CE1-CG 3.83Å; F927-H938 AromaticContact CE1-NE2 3.43Å; F927-H938 WeakPolarHBondContact CE1-NE2 3.29Å; F927-V957 HydrophobicContact CZ-CG2 4.27Å
928	S	79	Confident	75.8	Confident	90 Å²	90	50.2 Å²	50.2	63%	0.629	27%	0.267	S	S	*	.	H	α-helix	trans	-76.9	-39	176.8	69.8	0	0	0	0	113.5	N924 R925 L926	N924-S928 PolarHBondContact O-N 2.8Å; N924-S928 PolarHBondContact O-OG 3.01Å; R925-S928 WeakPolarHBondContact CA-OG 3.5Å; R925-S928 PolarHBondContact O-N 3.42Å; R925-S928 VanDerWaalsContact O-N 3.13Å; R925-S928 PolarHBondContact O-OG 3.33Å; L926-S928 VanDerWaalsContact C-N 3.33Å; L926-S928 PolarHBondContact O-N 2.74Å
929	E	73.2	Confident	75.5	Confident	96 Å²	96	51 Å²	51	45%	0.449	27%	0.271	S	S	.	.	H	α-helix	trans	-87.9	-34	-172.8	-69.6	178.6	166.9	0	0	112.4	R925 K931	R925-E929 VanDerWaalsContact CG-CD 3.45Å; R925-E929 HydrophobicContact CG-CG 4.13Å; R925-E929 WeakPolarHBondContact CG-OE2 3.46Å; R925-E929 IonicContact CZ-OE1 3.21Å; R925-E929 VanDerWaalsContact NE-CD 3.27Å; R925-E929 IonicContact NE-OE1 3.43Å; R925-E929 PolarHBondContact NE-OE1 3.17Å; R925-E929 IonicContact NE-OE2 3.22Å; R925-E929 PolarHBondContact NE-OE2 2.99Å; R925-E929 VanDerWaalsContact NE-OE2 3.15Å; R925-E929 IonicContact NH2-OE1 2.96Å; R925-E929 PolarHBondContact NH2-OE1 3.2Å; R925-E929 VanDerWaalsContact NH2-OE1 3.1Å; R925-E929 WeakPolarHBondContact O-CB 3.43Å; R925-E929 PolarHBondContact O-N 3.23Å; E929-K931 PolarHBondContact O-N 2.8Å
930	T	65	Low	75.4	Confident	14 Å²	14	51 Å²	51	9%	0.086	27%	0.271	C	S	.	.			trans	-85.3	100.3	-174.9	57.5	0	0	0	0	113.1	P795 L926	P795-T930 HydrophobicContact CG-CG2 4.24Å; L926-T930 HydrophobicContact CD1-CG2 3.69Å; L926-T930 WeakPolarHBondContact O-CB 3.46Å; L926-T930 PolarHBondContact O-N 2.95Å; L926-T930 PolarHBondContact O-OG1 2.67Å
931	K	57.2	Low	75.5	Confident	201 Å²	201	51.1 Å²	51.1	87%	0.874	27%	0.271	S	S	*	.			trans	-72.7	-24.7	172.5	-69.6	-178.5	-179.6	175.6	0	113.6	E929 R933	E929-K931 PolarHBondContact O-N 2.8Å; K931-R933 PolarHBondContact O-N 2.81Å
932	V	54.9	Low	75.8	Confident	56 Å²	56	50.6 Å²	50.6	34%	0.339	27%	0.268	S	S	.	.			trans	-82.2	100.6	-175.4	-175.8	0	0	0	0	110.6	L800	L800-V932 HydrophobicContact CD1-CG2 4.33Å
933	R	54.5	Low	76	Confident	178 Å²	178	50.7 Å²	50.7	67%	0.672	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	121.4	175.1	-68.2	-179.3	178.1	174.8	-0.7	110.5	M762 K931	M762-R933 PolarHBondContact SD-NH2 2.91Å; M762-R933 VanDerWaalsContact SD-NH2 3.35Å; K931-R933 PolarHBondContact O-N 2.81Å
934	A	55.6	Low	76.3	Confident	25 Å²	25	51.9 Å²	51.9	21%	0.207	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	147	158.9	0	0	0	0	0	108.3	S936 G937 M939	A934-S936 PolarHBondContact O-N 2.97Å; A934-G937 PolarHBondContact N-O 3.1Å; A934-G937 PolarHBondContact O-N 2.9Å; A934-M939 HydrophobicContact CB-CG 4.46Å
935	P	54	Low	76.6	Confident	148 Å²	148	50.5 Å²	50.5	96%	0.961	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-6	-177.7	21.9	-32.4	0	0	0	114.4
936	S	64.2	Low	76.8	Confident	62 Å²	62	51.3 Å²	51.3	43%	0.434	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126	5.1	-177.1	61.5	0	0	0	0	115.3	A934 K956	A934-S936 PolarHBondContact O-N 2.97Å; S936-K956 WeakPolarHBondContact O-CE 3.44Å; S936-K956 WeakPolarHBondContact O-CG 3.46Å
937	G	74.9	Confident	77	Confident	20 Å²	20	53 Å²	53	21%	0.206	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	153.7	-170.6	177.5	0	0	0	0	0	114.2	A934	A934-G937 PolarHBondContact N-O 3.1Å; A934-G937 PolarHBondContact O-N 2.9Å
938	H	83.3	Confident	77.3	Confident	16 Å²	16	53 Å²	53	7%	0.074	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	141.9	-179	-65.6	-89.2	0	0	0	111.7	M762 L926 F927 V954 L955	M762-H938 VanDerWaalsContact CE-NE2 3.3Å; M762-H938 WeakPolarHBondContact CE-NE2 3.46Å; L926-H938 HydrophobicContact CD2-CB 4.12Å; F927-H938 AromaticContact CD1-CD2 3.73Å; F927-H938 AromaticContact CD1-CE1 3.42Å; F927-H938 VanDerWaalsContact CD1-CE1 3.42Å; F927-H938 WeakPolarHBondContact CD1-CE1 3.41Å; F927-H938 AromaticContact CD1-CG 3.91Å; F927-H938 AromaticContact CD1-ND1 3.73Å; F927-H938 AromaticContact CD1-NE2 3.43Å; F927-H938 WeakPolarHBondContact CD1-NE2 3.37Å; F927-H938 AromaticContact CE1-CD2 3.37Å; F927-H938 WeakPolarHBondContact CE1-CD2 3.43Å; F927-H938 AromaticContact CE1-CE1 3.89Å; F927-H938 AromaticContact CE1-CG 3.83Å; F927-H938 AromaticContact CE1-NE2 3.43Å; F927-H938 WeakPolarHBondContact CE1-NE2 3.29Å; H938-V954 CarbonylContact O-C 3.59Å; H938-V954 WeakPolarHBondContact O-CA 3.27Å; H938-L955 PolarHBondContact N-O 3.15Å; H938-L955 VanDerWaalsContact N-O 3.14Å; H938-L955 PolarHBondContact O-N 3.39Å
939	M	86.9	Confident	77.8	Confident	16 Å²	16	54.1 Å²	54.1	8%	0.079	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	127.8	175.7	-67.7	-132.1	61.8	0	0	110.4	V781 L800 I803 A934 A952	V781-M939 HydrophobicContact CG2-CE 4.15Å; L800-M939 HydrophobicContact CD2-CB 4.12Å; I803-M939 HydrophobicContact CD1-CE 4.11Å; I803-M939 HydrophobicContact CG2-CE 3.56Å; I803-M939 HydrophobicContact CG2-SD 3.72Å; A934-M939 HydrophobicContact CB-CG 4.46Å; M939-A952 HydrophobicContact CE-CB 4.02Å
940	V	90.6	Very high	78.6	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	162	174.3	-64.1	0	0	0	0	110.4	I792 I897 L926 A953 L955	I792-V940 HydrophobicContact CG2-CB 4.39Å; I792-V940 HydrophobicContact CG2-CG2 4.3Å; I897-V940 HydrophobicContact CD1-CG1 4.26Å; L926-V940 HydrophobicContact CD1-CG1 4.13Å; L926-V940 HydrophobicContact CD2-CG1 3.77Å; V940-A953 HydrophobicContact CG2-CB 4.33Å; V940-A953 PolarHBondContact N-O 3.14Å; V940-A953 PolarHBondContact O-N 3.02Å; V940-A953 VanDerWaalsContact O-O 3.09Å; V940-L955 HydrophobicContact CG1-CB 3.86Å; V940-L955 HydrophobicContact CG1-CD1 3.94Å; V940-L955 HydrophobicContact CG2-CB 3.81Å; V940-L955 HydrophobicContact CG2-CD1 4.37Å
941	L	91.9	Very high	79.9	Confident	3 Å²	3	52.3 Å²	52.3	2%	0.016	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	144.5	170	-63.4	177.1	0	0	0	109.7	C793 P795 D799 I803 R894 Y950 R951 A952	C793-L941 HydrophobicContact CB-CB 4.31Å; C793-L941 PolarHBondContact N-O 3.45Å; C793-L941 PolarHBondContact O-N 3Å; C793-L941 VanDerWaalsContact O-N 3.1Å; P795-L941 HydrophobicContact CB-CD1 4.28Å; P795-L941 HydrophobicContact CB-CG 4.17Å; D799-L941 HydrophobicContact CB-CD1 4.18Å; I803-L941 HydrophobicContact CD1-CD2 4.14Å; R894-L941 HydrophobicContact CG-CD1 4.35Å; L941-Y950 HydrophobicContact CB-CD1 4.17Å; L941-Y950 HydrophobicContact CD1-CD1 4.48Å; L941-Y950 HydrophobicContact CD1-CG 4.47Å; L941-R951 CarbonylContact C-O 3.59Å; L941-R951 WeakPolarHBondContact CA-O 3.24Å; L941-A952 HydrophobicContact CD2-CB 4.46Å
942	F	93.7	Very high	81.4	Confident	1 Å²	1	43.4 Å²	43.4	0%	0.004	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	145.9	166.3	76.5	-88.1	0	0	0	111.4	P786 L791 Y950 R951 A953	P786-F942 HydrophobicContact CB-CD2 3.89Å; P786-F942 HydrophobicContact CB-CE2 3.9Å; P786-F942 HydrophobicContact CB-CG 4.44Å; P786-F942 HydrophobicContact CB-CZ 4.44Å; L791-F942 CarbonylContact O-C 3.56Å; L791-F942 VanDerWaalsContact O-CA 3.22Å; L791-F942 WeakPolarHBondContact O-CA 3.31Å; F942-Y950 WeakPolarHBondContact O-CA 3.22Å; F942-R951 HydrophobicContact CD1-CB 3.91Å; F942-R951 WeakPolarHBondContact CD1-O 3.14Å; F942-R951 HydrophobicContact CE1-CB 3.4Å; F942-R951 HydrophobicContact CE1-CG 4.45Å; F942-R951 HydrophobicContact CE2-CB 4.04Å; F942-R951 HydrophobicContact CE2-CG 4.35Å; F942-R951 HydrophobicContact CG-CB 4.45Å; F942-R951 HydrophobicContact CZ-CB 3.48Å; F942-R951 VanDerWaalsContact CZ-CB 3.48Å; F942-R951 HydrophobicContact CZ-CG 4.06Å; F942-R951 PolarHBondContact N-O 3.48Å; F942-R951 PolarHBondContact O-N 3.18Å; F942-A953 HydrophobicContact CD1-CB 3.64Å; F942-A953 HydrophobicContact CE1-CB 4Å
943	R	92.7	Very high	83.2	Confident	3 Å²	3	40.8 Å²	40.8	1%	0.011	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	125.3	177.8	-171.3	-179.6	68.5	152.6	5.3	110.4	L714 K715 A790 L791 S947 Y950	L714-R943 PolarHBondContact O-NH1 3.14Å; K715-R943 PolarHBondContact O-NH2 3.48Å; A790-R943 CarbonylContact C-O 3.43Å; A790-R943 WeakPolarHBondContact CA-O 3.38Å; A790-R943 WeakPolarHBondContact CB-O 3.47Å; L791-R943 PolarHBondContact N-O 2.68Å; L791-R943 PolarHBondContact O-N 2.88Å; R943-S947 WeakPolarHBondContact CG-O 3.48Å; R943-Y950 HydrophobicContact CB-CD1 3.84Å; R943-Y950 HydrophobicContact CB-CE1 3.88Å; R943-Y950 HydrophobicContact CG-CD1 4.46Å; R943-Y950 HydrophobicContact CG-CE1 4.36Å
944	N	93.9	Very high	84.9	Confident	25 Å²	25	32.9 Å²	32.9	13%	0.134	19%	0.191	C	C	.	.			trans	-75.7	145.9	175.3	-76	-36.1	0	0	0	110.8	V785 R787 A790 T946 S947	V785-N944 PolarHBondContact O-ND2 2.91Å; R787-N944 PolarHBondContact N-OD1 3.47Å; A790-N944 WeakPolarHBondContact CB-OD1 3.46Å; N944-T946 PolarHBondContact O-N 3.25Å; N944-S947 PolarHBondContact O-N 2.83Å
945	T	91.2	Very high	86.6	Confident	18 Å²	18	31.7 Å²	31.7	11%	0.11	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-6.5	178.7	54.9	0	0	0	0	115.5	F711 L714 I716 H789	F711-T945 WeakPolarHBondContact CE1-O 3.36Å; L714-T945 WeakPolarHBondContact CD1-O 3.23Å; I716-T945 VanDerWaalsContact CD1-C 3.43Å; I716-T945 HydrophobicContact CD1-CG2 4.38Å; I716-T945 WeakPolarHBondContact CD1-O 3.19Å; I716-T945 HydrophobicContact CG2-CG2 4.39Å; H789-T945 HydrophobicContact CB-CG2 3.87Å; H789-T945 WeakPolarHBondContact O-CG2 3.31Å
946	T	89.9	Confident	88.3	Confident	73 Å²	73	27.9 Å²	27.9	45%	0.448	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.2	4.1	-178.8	47.2	0	0	0	0	112.3	N944	N944-T946 PolarHBondContact O-N 3.25Å
947	S	89.5	Confident	89.4	Confident	35 Å²	35	26.1 Å²	26.1	25%	0.245	14%	0.136	C	C	.	.			trans	-143.3	144.3	-168.9	-166.9	0	0	0	0	111.8	R943 N944 Y949	R943-S947 WeakPolarHBondContact CG-O 3.48Å; N944-S947 PolarHBondContact O-N 2.83Å; S947-Y949 WeakPolarHBondContact OG-CD2 3.49Å; S947-Y949 PolarHBondContact OG-N 3.35Å
948	M	87.9	Confident	89.8	Confident	32 Å²	32	26.4 Å²	26.4	16%	0.158	13%	0.132	C	C	.	.	S	Bend	trans	-84.4	-9.4	173.3	-65.6	-60.9	-99.2	0	0	113.5	K713 L714 V812 E813	K713-M948 WeakPolarHBondContact O-CE 3.33Å; L714-M948 VanDerWaalsContact CA-SD 3.55Å; L714-M948 HydrophobicContact CB-SD 4.18Å; L714-M948 HydrophobicContact CD2-CG 3.64Å; L714-M948 HydrophobicContact CD2-SD 3.51Å; L714-M948 VanDerWaalsContact CD2-SD 3.51Å; L714-M948 HydrophobicContact CG-SD 4.43Å; V812-M948 HydrophobicContact CG1-CB 4.07Å; E813-M948 HydrophobicContact CB-CB 4.2Å; E813-M948 HydrophobicContact CB-CE 3.79Å; E813-M948 WeakPolarHBondContact CB-O 3.31Å; E813-M948 HydrophobicContact CB-SD 3.99Å; E813-M948 HydrophobicContact CG-CE 3.73Å; E813-M948 HydrophobicContact CG-SD 4.24Å; E813-M948 PolarHBondContact N-O 2.94Å; E813-M948 WeakPolarHBondContact O-CE 3.47Å
949	Y	89.4	Confident	89.2	Confident	115 Å²	115	30 Å²	30	45%	0.451	15%	0.148	S	C	.	.	B	Isolated β-bridge	trans	-84.7	123.7	-174.7	-63.6	-88.1	0	0	0	110.9	C811 V812 S947	C811-Y949 WeakPolarHBondContact O-CA 3.44Å; V812-Y949 HydrophobicContact CG2-CD1 3.61Å; V812-Y949 HydrophobicContact CG2-CE1 3.46Å; V812-Y949 VanDerWaalsContact CG2-CE1 3.46Å; S947-Y949 WeakPolarHBondContact OG-CD2 3.49Å; S947-Y949 PolarHBondContact OG-N 3.35Å
950	Y	90.2	Very high	87.7	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.008	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	142.5	161.9	-63.8	-86.1	0	0	0	109.5	C793 G810 C811 E813 R894 L941 F942 R943	C793-Y950 HydrophobicContact CB-CD1 4.5Å; C793-Y950 HydrophobicContact CB-CE1 4.23Å; G810-Y950 CarbonylContact C-O 3.56Å; G810-Y950 WeakPolarHBondContact CA-O 3.45Å; C811-Y950 PolarHBondContact N-O 2.89Å; C811-Y950 PolarHBondContact O-N 3.08Å; C811-Y950 VanDerWaalsContact SG-CB 3.54Å; E813-Y950 HydrophobicContact CB-CE2 3.82Å; E813-Y950 WeakPolarHBondContact OE2-CE2 3.3Å; E813-Y950 PolarHBondContact OE2-OH 3.27Å; R894-Y950 HydrophobicContact CB-CE1 4.09Å; R894-Y950 HydrophobicContact CG-CE1 4.42Å; L941-Y950 HydrophobicContact CB-CD1 4.17Å; L941-Y950 HydrophobicContact CD1-CD1 4.48Å; L941-Y950 HydrophobicContact CD1-CG 4.47Å; F942-Y950 WeakPolarHBondContact O-CA 3.22Å; R943-Y950 HydrophobicContact CB-CD1 3.84Å; R943-Y950 HydrophobicContact CB-CE1 3.88Å; R943-Y950 HydrophobicContact CG-CD1 4.46Å; R943-Y950 HydrophobicContact CG-CE1 4.36Å
951	R	91.1	Very high	85.6	Confident	69 Å²	69	37.7 Å²	37.7	26%	0.26	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	137.4	178.6	-61.8	-63.5	-178.3	175.3	-8.3	108.7	R783 L941 F942	R783-R951 VanDerWaalsContact O-CD 3.31Å; R783-R951 WeakPolarHBondContact O-CD 3.28Å; L941-R951 CarbonylContact C-O 3.59Å; L941-R951 WeakPolarHBondContact CA-O 3.24Å; F942-R951 HydrophobicContact CD1-CB 3.91Å; F942-R951 WeakPolarHBondContact CD1-O 3.14Å; F942-R951 HydrophobicContact CE1-CB 3.4Å; F942-R951 HydrophobicContact CE1-CG 4.45Å; F942-R951 HydrophobicContact CE2-CB 4.04Å; F942-R951 HydrophobicContact CE2-CG 4.35Å; F942-R951 HydrophobicContact CG-CB 4.45Å; F942-R951 HydrophobicContact CZ-CB 3.48Å; F942-R951 VanDerWaalsContact CZ-CB 3.48Å; F942-R951 HydrophobicContact CZ-CG 4.06Å; F942-R951 PolarHBondContact N-O 3.48Å; F942-R951 PolarHBondContact O-N 3.18Å
952	A	89.9	Confident	85.3	Confident	15 Å²	15	39.5 Å²	39.5	12%	0.124	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	137.9	176.2	0	0	0	0	0	111.7	V781 I803 M939 L941	V781-A952 PolarHBondContact N-O 2.9Å; V781-A952 VanDerWaalsContact N-O 3.16Å; I803-A952 HydrophobicContact CD1-CB 3.72Å; I803-A952 HydrophobicContact CG1-CB 3.95Å; I803-A952 HydrophobicContact CG2-CB 4.41Å; M939-A952 HydrophobicContact CE-CB 4.02Å; L941-A952 HydrophobicContact CD2-CB 4.46Å
953	A	91.3	Very high	84.8	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	160.1	173.4	0	0	0	0	0	111.5	I778 E779 V940 F942	I778-A953 HydrophobicContact CG2-CB 3.27Å; E779-A953 CarbonylContact O-C 3.6Å; E779-A953 WeakPolarHBondContact O-CA 3.03Å; E779-A953 VanDerWaalsContact O-CB 3.3Å; E779-A953 WeakPolarHBondContact O-CB 3.45Å; V940-A953 HydrophobicContact CG2-CB 4.33Å; V940-A953 PolarHBondContact N-O 3.14Å; V940-A953 PolarHBondContact O-N 3.02Å; V940-A953 VanDerWaalsContact O-O 3.09Å; F942-A953 HydrophobicContact CD1-CB 3.64Å; F942-A953 HydrophobicContact CE1-CB 4Å
954	V	90.3	Very high	84.4	Confident	12 Å²	12	43.6 Å²	43.6	7%	0.073	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	126.1	173.2	-176.8	0	0	0	0	108.3	I778 E779 V781 H938	I778-V954 WeakPolarHBondContact CA-O 3.19Å; E779-V954 PolarHBondContact N-O 3.41Å; E779-V954 PolarHBondContact O-N 3.21Å; V781-V954 HydrophobicContact CG2-CG2 3.66Å; H938-V954 CarbonylContact O-C 3.59Å; H938-V954 WeakPolarHBondContact O-CA 3.27Å
955	L	91.6	Very high	83.8	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	131.9	175.1	-174.2	148.8	0	0	0	110	V776 S777 I792 I897 L923 H938 V940	V776-L955 HydrophobicContact CB-CD1 4.16Å; V776-L955 HydrophobicContact CB-CD2 4.24Å; V776-L955 HydrophobicContact CB-CG 4.03Å; V776-L955 HydrophobicContact CG1-CD1 4.21Å; V776-L955 HydrophobicContact CG1-CD2 3.9Å; V776-L955 HydrophobicContact CG1-CG 4.19Å; V776-L955 HydrophobicContact CG2-CD1 4.14Å; V776-L955 HydrophobicContact CG2-CG 4.48Å; S777-L955 WeakPolarHBondContact O-CA 3.33Å; I792-L955 HydrophobicContact CG2-CD1 4.47Å; I897-L955 HydrophobicContact CD1-CD1 4.25Å; L923-L955 HydrophobicContact CD2-CD1 4.22Å; L923-L955 HydrophobicContact CD2-CD2 4.14Å; H938-L955 PolarHBondContact N-O 3.15Å; H938-L955 VanDerWaalsContact N-O 3.14Å; H938-L955 PolarHBondContact O-N 3.39Å; V940-L955 HydrophobicContact CG1-CB 3.86Å; V940-L955 HydrophobicContact CG1-CD1 3.94Å; V940-L955 HydrophobicContact CG2-CB 3.81Å; V940-L955 HydrophobicContact CG2-CD1 4.37Å
956	K	89.5	Confident	83.4	Confident	67 Å²	67	46.4 Å²	46.4	29%	0.291	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	129.1	172.6	-67.6	168.8	178.4	163.7	0	109.3	V776 S777 E779 S936 Q958	V776-K956 WeakPolarHBondContact CA-O 2.87Å; S777-K956 PolarHBondContact N-O 3.02Å; S777-K956 PolarHBondContact O-N 2.92Å; S777-K956 WeakPolarHBondContact OG-CB 3.3Å; S777-K956 PolarHBondContact OG-O 3.28Å; E779-K956 IonicContact OE1-NZ 3.89Å; E779-K956 IonicContact OE2-NZ 2.76Å; E779-K956 PolarHBondContact OE2-NZ 3.32Å; S936-K956 WeakPolarHBondContact O-CE 3.44Å; S936-K956 WeakPolarHBondContact O-CG 3.46Å; K956-Q958 PolarHBondContact O-N 3.31Å
957	V	88.3	Confident	83	Confident	26 Å²	26	44.6 Å²	44.6	16%	0.158	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	126.5	171.8	179.6	0	0	0	0	108.6	L756 V774 F927	L756-V957 HydrophobicContact CD2-CG1 4.07Å; V774-V957 HydrophobicContact CG1-CG1 3.8Å; F927-V957 HydrophobicContact CZ-CG2 4.27Å
958	Q	82	Confident	82.5	Confident	26 Å²	26	45.3 Å²	45.3	12%	0.121	22%	0.216	C	C	.	.			trans	-80.9	126.9	176.5	-65.9	-162.6	-67.7	0	0	109.4	G671 R775 K956	G671-Q958 PolarHBondContact O-NE2 3.45Å; R775-Q958 HydrophobicContact CG-CB 4.45Å; R775-Q958 PolarHBondContact O-N 3.21Å; K956-Q958 PolarHBondContact O-N 3.31Å
959	Q	71	Confident	82.1	Confident	90 Å²	90	46.3 Å²	46.3	42%	0.421	22%	0.221	S	C	.	.			trans	-94.9	113.7	165.6	-63.6	-179.2	7.1	0	0	106.5	S760 D961	S760-Q959 PolarHBondContact OG-NE2 3.23Å; S760-Q959 VanDerWaalsContact OG-NE2 3.08Å; Q959-D961 PolarHBondContact O-N 3.06Å
960	D	56.9	Low	81.5	Confident	54 Å²	54	40.6 Å²	40.6	29%	0.289	20%	0.202	S	C	.	.			trans	-69.2	122.5	177.1	-78.1	-26.7	0	0	0	109.6	K753	K753-D960 WeakPolarHBondContact CE-O 3.39Å; K753-D960 PolarHBondContact NZ-O 3.02Å
961	D	45.6	Very low	80.7	Confident	125 Å²	125	44.1 Å²	44.1	67%	0.668	22%	0.219	S	C	*	.			trans	-70.8	0	178.2	-83	-16.3	0	0	0	113.5	K753 Q959	K753-D961 PolarHBondContact NZ-OXT 3.24Å; Q959-D961 PolarHBondContact O-N 3.06Å

Retrieved 961 of 961 residues in 253.9 ms (Link to these results)

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