A0A087X819_POEFO Loading...

DNA repair protein RAD51 homolog 4

Involved in the homologous recombination repair (HRR) pathway of double-stranded DNA breaks arising during DNA replication or induced by DNA-damaging agents. Bind to single-stranded DNA (ssDNA) and has DNA-dependent ATPase activity. Part of the RAD51 paralog protein complex BCDX2 which acts in the BRCA1-BRCA2-dependent HR pathway. Upon DNA damage, BCDX2 acts downstream of BRCA2 recruitment and upstream of RAD51 recruitment. BCDX2 binds predominantly to the intersection of the four duplex arms of the Holliday junction and to junction of replication forks. The BCDX2 complex was originally reported to bind single-stranded DNA, single-stranded gaps in duplex DNA and specifically to nicks in duplex DNA. Involved in telomere maintenance. The BCDX2 subcomplex XRCC2:RAD51D can stimulate Holliday junction resolution by BLM.

AlphaFold DB , UniProt , Accession A0A087X819, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 333 aa.

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(Predicted Aligned Error values between residue pairs)

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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	61	Low	81.9	Confident	189 Å²	189	73.2 Å²	73.2	93%	0.931	46%	0.463	S	S	*	.				0	130.5	0	-74.9	173.4	-173.5	0	0	108.8	T27	M1-T27 HydrophobicContact CB-CG2 4.31Å
2	V	80.4	Confident	82.3	Confident	72 Å²	72	67.4 Å²	67.4	44%	0.436	43%	0.426	S	S	.	.			trans	-85	115.1	179.6	-176.5	0	0	0	0	108.8	M8 T27 V28	V2-M8 HydrophobicContact CG1-CE 3.68Å; V2-T27 WeakPolarHBondContact O-CA 3.15Å; V2-T27 WeakPolarHBondContact O-CB 3.45Å; V2-V28 HydrophobicContact CB-CB 4.38Å; V2-V28 HydrophobicContact CB-CG2 3.97Å; V2-V28 HydrophobicContact CG1-CG2 3.79Å; V2-V28 PolarHBondContact O-N 3.18Å
3	V	87.6	Confident	82.8	Confident	77 Å²	77	68.1 Å²	68.1	47%	0.467	42%	0.424	S	S	.	.	B	Isolated β-bridge	trans	-73.9	139.2	177.1	179.6	0	0	0	0	109.3	L5	V3-L5 PolarHBondContact O-N 3.36Å
4	L	86.9	Confident	83.4	Confident	1 Å²	1	71.4 Å²	71.4	1%	0.005	43%	0.432	C	S	.	.			trans	-68.9	123.5	173.4	-75.6	162.1	0	0	0	110.4	L12 L17 I25 R26 T27 V28 L31 L57	L4-L12 HydrophobicContact CD2-CD2 3.92Å; L4-L17 HydrophobicContact CB-CD1 3.56Å; L4-I25 HydrophobicContact CD1-CG2 3.81Å; L4-R26 PolarHBondContact N-O 3.27Å; L4-T27 VanDerWaalsContact CD1-O 3.28Å; L4-T27 WeakPolarHBondContact CD1-O 3.24Å; L4-V28 HydrophobicContact CD2-CG2 4.06Å; L4-V28 HydrophobicContact CG-CG2 4.45Å; L4-L31 HydrophobicContact CD1-CB 4.11Å; L4-L31 HydrophobicContact CD1-CD1 4.14Å; L4-L57 HydrophobicContact CD2-CD1 3.69Å
5	L	87.4	Confident	83.8	Confident	99 Å²	99	72.9 Å²	72.9	52%	0.518	44%	0.437	S	S	.	.			trans	-124.4	151.6	178.6	-64.1	174.1	0	0	0	110.2	V3 G7 M8 L12	V3-L5 PolarHBondContact O-N 3.36Å; L5-G7 PolarHBondContact O-N 3.05Å; L5-M8 HydrophobicContact CB-CG 4.07Å; L5-M8 HydrophobicContact CB-SD 4.09Å; L5-M8 PolarHBondContact N-SD 3.31Å; L5-M8 VanDerWaalsContact O-CG 3.3Å; L5-M8 WeakPolarHBondContact O-CG 3.43Å; L5-M8 PolarHBondContact O-N 3.49Å; L5-L12 VanDerWaalsContact O-CD2 3.29Å; L5-L12 WeakPolarHBondContact O-CD2 3.28Å
6	V	87.1	Confident	84.1	Confident	78 Å²	78	69 Å²	69	47%	0.473	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	137.7	175.5	-178.4	0	0	0	0	109.2	M8 E14 L17	V6-M8 VanDerWaalsContact C-N 3.35Å; V6-M8 PolarHBondContact O-N 3.29Å; V6-E14 HydrophobicContact CG2-CB 4.13Å; V6-E14 HydrophobicContact CG2-CG 4.13Å; V6-L17 HydrophobicContact CG2-CB 4.42Å; V6-L17 HydrophobicContact CG2-CD2 3.56Å
7	G	83	Confident	84.6	Confident	63 Å²	63	65.4 Å²	65.4	65%	0.649	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.6	4.2	174.8	0	0	0	0	0	115.9	L5 C9 L12	L5-G7 PolarHBondContact O-N 3.05Å; G7-C9 PolarHBondContact O-N 3.02Å; G7-L12 PolarHBondContact N-O 3.1Å
8	M	84	Confident	85	Confident	44 Å²	44	68.9 Å²	68.9	22%	0.217	40%	0.396	C	S	.	.	S	Bend	trans	-60.3	-31.5	172.2	-71.6	180	74.6	0	0	112.8	V2 L5 V6 L12 V28 L57 Q60	V2-M8 HydrophobicContact CG1-CE 3.68Å; L5-M8 HydrophobicContact CB-CG 4.07Å; L5-M8 HydrophobicContact CB-SD 4.09Å; L5-M8 PolarHBondContact N-SD 3.31Å; L5-M8 VanDerWaalsContact O-CG 3.3Å; L5-M8 WeakPolarHBondContact O-CG 3.43Å; L5-M8 PolarHBondContact O-N 3.49Å; V6-M8 VanDerWaalsContact C-N 3.35Å; V6-M8 PolarHBondContact O-N 3.29Å; M8-L12 HydrophobicContact CB-CD2 4.33Å; M8-V28 HydrophobicContact CE-CG2 3.83Å; M8-L57 HydrophobicContact CB-CD2 4.33Å; M8-L57 HydrophobicContact CE-CD2 4.12Å; M8-Q60 PolarHBondContact O-NE2 3.47Å; M8-Q60 PolarHBondContact O-OE1 3.49Å
9	C	82	Confident	85.3	Confident	7 Å²	7	67.7 Å²	67.7	5%	0.047	39%	0.392	C	S	.	.	S	Bend	trans	-148.5	158.3	173.4	61.6	0	0	0	0	111.3	G7 G11 L12 V56	G7-C9 PolarHBondContact O-N 3.02Å; C9-G11 PolarHBondContact O-N 3.28Å; C9-L12 PolarHBondContact O-N 3.08Å; C9-V56 HydrophobicContact CB-CB 4.04Å; C9-V56 HydrophobicContact CB-CG1 3.51Å
10	P	80.6	Confident	85.6	Confident	120 Å²	120	64.3 Å²	64.3	78%	0.779	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	123.9	172.7	-22.6	33.7	0	0	0	110.9
11	G	80.9	Confident	86	Confident	55 Å²	55	66.9 Å²	66.9	57%	0.567	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.4	-9.9	179.9	0	0	0	0	0	115.4	C9 D13 L16 I53	C9-G11 PolarHBondContact O-N 3.28Å; G11-D13 PolarHBondContact O-N 3.48Å; G11-L16 WeakPolarHBondContact O-CD2 3.14Å; G11-I53 WeakPolarHBondContact O-CD1 3.49Å
12	L	86.6	Confident	87.4	Confident	4 Å²	4	62.2 Å²	62.2	2%	0.021	37%	0.368	C	S	.	.			trans	-89.4	80.9	170.5	-169	66.2	0	0	0	110.5	L4 L5 G7 M8 C9 L16 L17 L20	L4-L12 HydrophobicContact CD2-CD2 3.92Å; L5-L12 VanDerWaalsContact O-CD2 3.29Å; L5-L12 WeakPolarHBondContact O-CD2 3.28Å; G7-L12 PolarHBondContact N-O 3.1Å; M8-L12 HydrophobicContact CB-CD2 4.33Å; C9-L12 PolarHBondContact O-N 3.08Å; L12-L16 HydrophobicContact CD1-CD2 3.98Å; L12-L16 HydrophobicContact CD1-CG 4.15Å; L12-L17 HydrophobicContact CD1-CD1 4.42Å; L12-L20 HydrophobicContact CD1-CD1 3.75Å
13	D	89.5	Confident	87.9	Confident	76 Å²	76	60.3 Å²	60.3	41%	0.406	36%	0.36	S	S	.	.			trans	-88.1	172.8	178.1	74.6	-9.8	0	0	0	112.4	G11 N15 L16 L17	G11-D13 PolarHBondContact O-N 3.48Å; D13-N15 VanDerWaalsContact C-N 3.25Å; D13-N15 PolarHBondContact O-N 2.91Å; D13-N15 PolarHBondContact OD1-N 2.76Å; D13-L16 PolarHBondContact O-N 2.69Å; D13-L16 WeakPolarHBondContact OD1-CB 3.38Å; D13-L16 PolarHBondContact OD1-N 2.78Å; D13-L17 WeakPolarHBondContact O-CB 3.46Å; D13-L17 PolarHBondContact O-N 2.94Å
14	E	90.8	Very high	88.1	Confident	114 Å²	114	61.5 Å²	61.5	53%	0.533	36%	0.363	S	S	.	.	H	α-helix	trans	-64.6	-31.7	-177.1	-156.3	-171.2	143.9	0	0	112.5	V6 R18	V6-E14 HydrophobicContact CG2-CB 4.13Å; V6-E14 HydrophobicContact CG2-CG 4.13Å; E14-R18 WeakPolarHBondContact O-CG 3.35Å; E14-R18 PolarHBondContact O-N 3.28Å; E14-R18 IonicContact OE1-CZ 3.61Å; E14-R18 IonicContact OE1-NE 3.57Å; E14-R18 IonicContact OE1-NH2 2.8Å; E14-R18 PolarHBondContact OE1-NH2 2.89Å; E14-R18 IonicContact OE2-NH2 3.77Å
15	N	89.6	Confident	88.3	Confident	95 Å²	95	62.3 Å²	62.3	51%	0.508	37%	0.368	S	S	.	.	H	α-helix	trans	-70.9	-48.1	179	-67.2	-35.1	0	0	0	111.3	D13 L17 R18 S19	D13-N15 VanDerWaalsContact C-N 3.25Å; D13-N15 PolarHBondContact O-N 2.91Å; D13-N15 PolarHBondContact OD1-N 2.76Å; N15-L17 VanDerWaalsContact C-N 3.3Å; N15-L17 PolarHBondContact O-N 3.07Å; N15-R18 PolarHBondContact O-N 3.45Å; N15-R18 PolarHBondContact OD1-NH1 3.02Å; N15-S19 PolarHBondContact O-N 2.87Å; N15-S19 PolarHBondContact O-OG 3.24Å
16	L	88.9	Confident	88.4	Confident	10 Å²	10	63.8 Å²	63.8	5%	0.052	37%	0.366	C	S	.	.	H	α-helix	trans	-60.5	-42.3	174.3	179.4	58.6	0	0	0	110.9	G11 L12 D13 R18 S19 L20 V45 L50 I53	G11-L16 WeakPolarHBondContact O-CD2 3.14Å; L12-L16 HydrophobicContact CD1-CD2 3.98Å; L12-L16 HydrophobicContact CD1-CG 4.15Å; D13-L16 PolarHBondContact O-N 2.69Å; D13-L16 WeakPolarHBondContact OD1-CB 3.38Å; D13-L16 PolarHBondContact OD1-N 2.78Å; L16-R18 VanDerWaalsContact C-N 3.32Å; L16-R18 PolarHBondContact O-N 3.48Å; L16-S19 PolarHBondContact O-N 3.25Å; L16-L20 HydrophobicContact CD1-CD1 4.29Å; L16-L20 HydrophobicContact CD1-CG 4.13Å; L16-L20 HydrophobicContact CG-CD1 3.95Å; L16-L20 HydrophobicContact CG-CG 4.27Å; L16-L20 WeakPolarHBondContact O-CB 3.27Å; L16-L20 VanDerWaalsContact O-CG 3.26Å; L16-L20 WeakPolarHBondContact O-CG 3.35Å; L16-L20 PolarHBondContact O-N 3.39Å; L16-V45 HydrophobicContact CD1-CB 4.23Å; L16-V45 HydrophobicContact CD1-CG1 4.14Å; L16-V45 HydrophobicContact CD1-CG2 3.53Å; L16-L50 HydrophobicContact CD1-CD1 4.08Å; L16-I53 HydrophobicContact CD2-CD1 3.36Å
17	L	91.3	Very high	88.6	Confident	7 Å²	7	60.8 Å²	60.8	4%	0.037	35%	0.348	C	S	.	.	H	α-helix	trans	-62.6	-38.9	178.8	-168.5	71.2	0	0	0	112.3	L4 V6 L12 D13 N15 R21	L4-L17 HydrophobicContact CB-CD1 3.56Å; V6-L17 HydrophobicContact CG2-CB 4.42Å; V6-L17 HydrophobicContact CG2-CD2 3.56Å; L12-L17 HydrophobicContact CD1-CD1 4.42Å; D13-L17 WeakPolarHBondContact O-CB 3.46Å; D13-L17 PolarHBondContact O-N 2.94Å; N15-L17 VanDerWaalsContact C-N 3.3Å; N15-L17 PolarHBondContact O-N 3.07Å; L17-R21 VanDerWaalsContact O-CG 3.3Å; L17-R21 WeakPolarHBondContact O-CG 3.3Å; L17-R21 PolarHBondContact O-N 3.2Å
18	R	92.3	Very high	88.9	Confident	129 Å²	129	58.2 Å²	58.2	49%	0.487	32%	0.32	S	S	.	.	H	α-helix	trans	-63.9	-44.3	172.9	-74.8	-173.8	-129.9	122.5	0.1	111.7	E14 N15 L16 L20 R21 A22	E14-R18 WeakPolarHBondContact O-CG 3.35Å; E14-R18 PolarHBondContact O-N 3.28Å; E14-R18 IonicContact OE1-CZ 3.61Å; E14-R18 IonicContact OE1-NE 3.57Å; E14-R18 IonicContact OE1-NH2 2.8Å; E14-R18 PolarHBondContact OE1-NH2 2.89Å; E14-R18 IonicContact OE2-NH2 3.77Å; N15-R18 PolarHBondContact O-N 3.45Å; N15-R18 PolarHBondContact OD1-NH1 3.02Å; L16-R18 VanDerWaalsContact C-N 3.32Å; L16-R18 PolarHBondContact O-N 3.48Å; R18-L20 VanDerWaalsContact C-N 3.35Å; R18-L20 PolarHBondContact O-N 3.16Å; R18-R21 PolarHBondContact O-N 2.81Å; R18-A22 PolarHBondContact O-N 2.78Å
19	S	91.5	Very high	89	Confident	46 Å²	46	61.5 Å²	61.5	32%	0.322	34%	0.335	S	S	.	.	H	α-helix	trans	-62.6	-40.1	177.2	-62.7	0	0	0	0	112.6	N15 L16 A22 A23	N15-S19 PolarHBondContact O-N 2.87Å; N15-S19 PolarHBondContact O-OG 3.24Å; L16-S19 PolarHBondContact O-N 3.25Å; S19-A22 PolarHBondContact O-N 3.1Å; S19-A23 PolarHBondContact O-N 3.46Å; S19-A23 VanDerWaalsContact O-N 3.1Å
20	L	91.5	Very high	89.4	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-63.6	-45.6	175.2	-72	171.6	0	0	0	111.4	L12 L16 R18 A22 A23 D24 I25 L31 L39	L12-L20 HydrophobicContact CD1-CD1 3.75Å; L16-L20 HydrophobicContact CD1-CD1 4.29Å; L16-L20 HydrophobicContact CD1-CG 4.13Å; L16-L20 HydrophobicContact CG-CD1 3.95Å; L16-L20 HydrophobicContact CG-CG 4.27Å; L16-L20 WeakPolarHBondContact O-CB 3.27Å; L16-L20 VanDerWaalsContact O-CG 3.26Å; L16-L20 WeakPolarHBondContact O-CG 3.35Å; L16-L20 PolarHBondContact O-N 3.39Å; R18-L20 VanDerWaalsContact C-N 3.35Å; R18-L20 PolarHBondContact O-N 3.16Å; L20-A22 VanDerWaalsContact C-N 3.29Å; L20-A22 PolarHBondContact O-N 2.67Å; L20-A23 CarbonylContact O-C 3.57Å; L20-A23 WeakPolarHBondContact O-CA 3.25Å; L20-A23 WeakPolarHBondContact O-CB 3.45Å; L20-A23 PolarHBondContact O-N 2.91Å; L20-D24 PolarHBondContact O-N 3.29Å; L20-I25 CarbonylContact C-O 3.59Å; L20-I25 HydrophobicContact CB-CB 4.16Å; L20-I25 HydrophobicContact CB-CG2 4.41Å; L20-I25 HydrophobicContact CD2-CB 4.38Å; L20-I25 HydrophobicContact CD2-CG2 4.3Å; L20-I25 WeakPolarHBondContact O-CB 3.42Å; L20-I25 PolarHBondContact O-N 2.95Å; L20-L31 HydrophobicContact CD1-CD1 3.78Å; L20-L31 HydrophobicContact CD2-CD1 4.07Å; L20-L39 HydrophobicContact CD2-CD1 4.03Å; L20-L39 HydrophobicContact CD2-CD2 3.71Å; L20-L39 HydrophobicContact CD2-CG 3.99Å
21	R	92.8	Very high	89.8	Confident	118 Å²	118	58.2 Å²	58.2	45%	0.445	31%	0.31	S	S	.	.	H	α-helix	trans	-62.7	-35.3	176.1	-72.9	174.5	-178	-178.7	1.4	112.8	L17 R18 A23 D24 I25	L17-R21 VanDerWaalsContact O-CG 3.3Å; L17-R21 WeakPolarHBondContact O-CG 3.3Å; L17-R21 PolarHBondContact O-N 3.2Å; R18-R21 PolarHBondContact O-N 2.81Å; R21-A23 VanDerWaalsContact C-N 3.26Å; R21-D24 PolarHBondContact O-N 2.96Å; R21-D24 VanDerWaalsContact O-N 3.15Å; R21-I25 PolarHBondContact N-O 3.46Å
22	A	91.6	Very high	90.2	Very high	92 Å²	92	56.9 Å²	56.9	76%	0.76	29%	0.291	S	S	*	.	H	α-helix	trans	-67.6	-28.1	174.1	0	0	0	0	0	112.4	R18 S19 L20 D24	R18-A22 PolarHBondContact O-N 2.78Å; S19-A22 PolarHBondContact O-N 3.1Å; L20-A22 VanDerWaalsContact C-N 3.29Å; L20-A22 PolarHBondContact O-N 2.67Å; A22-D24 PolarHBondContact O-N 3.11Å
23	A	90.8	Very high	90.2	Very high	32 Å²	32	61 Å²	61	26%	0.264	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	16	171.5	0	0	0	0	0	113.5	S19 L20 R21 I25 L39	S19-A23 PolarHBondContact O-N 3.46Å; S19-A23 VanDerWaalsContact O-N 3.1Å; L20-A23 CarbonylContact O-C 3.57Å; L20-A23 WeakPolarHBondContact O-CA 3.25Å; L20-A23 WeakPolarHBondContact O-CB 3.45Å; L20-A23 PolarHBondContact O-N 2.91Å; R21-A23 VanDerWaalsContact C-N 3.26Å; A23-I25 HydrophobicContact CB-CG1 4.4Å; A23-I25 PolarHBondContact O-N 3.08Å; A23-L39 HydrophobicContact CB-CD1 3.8Å
24	D	90.4	Very high	90.3	Very high	101 Å²	101	58.5 Å²	58.5	54%	0.54	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.5	15.9	-178.5	-148.7	42.6	0	0	0	115.4	L20 R21 A22 R26	L20-D24 PolarHBondContact O-N 3.29Å; R21-D24 PolarHBondContact O-N 2.96Å; R21-D24 VanDerWaalsContact O-N 3.15Å; A22-D24 PolarHBondContact O-N 3.11Å; D24-R26 IonicContact OD1-CZ 3.09Å; D24-R26 IonicContact OD1-NH1 2.65Å; D24-R26 PolarHBondContact OD1-NH1 2.97Å; D24-R26 IonicContact OD1-NH2 2.8Å; D24-R26 PolarHBondContact OD1-NH2 3.35Å
25	I	91.8	Very high	90.3	Very high	18 Å²	18	57.8 Å²	57.8	9%	0.092	31%	0.308	C	S	.	.			trans	-90.6	106.6	176	-54.4	-58.1	0	0	0	109.1	L4 L20 R21 A23 D30 L31 L39	L4-I25 HydrophobicContact CD1-CG2 3.81Å; L20-I25 CarbonylContact C-O 3.59Å; L20-I25 HydrophobicContact CB-CB 4.16Å; L20-I25 HydrophobicContact CB-CG2 4.41Å; L20-I25 HydrophobicContact CD2-CB 4.38Å; L20-I25 HydrophobicContact CD2-CG2 4.3Å; L20-I25 WeakPolarHBondContact O-CB 3.42Å; L20-I25 PolarHBondContact O-N 2.95Å; R21-I25 PolarHBondContact N-O 3.46Å; A23-I25 HydrophobicContact CB-CG1 4.4Å; A23-I25 PolarHBondContact O-N 3.08Å; I25-D30 HydrophobicContact CB-CB 4.42Å; I25-D30 HydrophobicContact CD1-CB 3.99Å; I25-D30 HydrophobicContact CG2-CB 3.9Å; I25-L31 HydrophobicContact CG2-CB 3.68Å; I25-L31 HydrophobicContact CG2-CD1 4.44Å; I25-L31 HydrophobicContact CG2-CG 4.46Å; I25-L39 HydrophobicContact CG1-CD1 3.83Å; I25-L39 HydrophobicContact CG1-CD2 4.11Å
26	R	90.6	Very high	90.5	Very high	131 Å²	131	53.9 Å²	53.9	49%	0.494	29%	0.287	S	S	.	.			trans	-114.3	-26.5	-176.7	-62.3	-168.3	-177.2	80.5	12	113.6	L4 D24 D30	L4-R26 PolarHBondContact N-O 3.27Å; D24-R26 IonicContact OD1-CZ 3.09Å; D24-R26 IonicContact OD1-NH1 2.65Å; D24-R26 PolarHBondContact OD1-NH1 2.97Å; D24-R26 IonicContact OD1-NH2 2.8Å; D24-R26 PolarHBondContact OD1-NH2 3.35Å; R26-D30 PolarHBondContact N-OD2 3.31Å
27	T	90.6	Very high	90.6	Very high	14 Å²	14	59 Å²	59	9%	0.086	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-117.4	162.1	-175.2	73.9	0	0	0	0	111.9	M1 V2 L4 E29 D30 L31	M1-T27 HydrophobicContact CB-CG2 4.31Å; V2-T27 WeakPolarHBondContact O-CA 3.15Å; V2-T27 WeakPolarHBondContact O-CB 3.45Å; L4-T27 VanDerWaalsContact CD1-O 3.28Å; L4-T27 WeakPolarHBondContact CD1-O 3.24Å; T27-E29 PolarHBondContact O-N 2.94Å; T27-E29 PolarHBondContact OG1-N 3.16Å; T27-D30 PolarHBondContact N-OD2 3.04Å; T27-D30 PolarHBondContact O-N 3.34Å; T27-D30 PolarHBondContact OG1-N 2.61Å; T27-D30 VanDerWaalsContact OG1-N 3.09Å; T27-D30 PolarHBondContact OG1-OD1 3.34Å; T27-D30 VanDerWaalsContact OG1-OD1 3.05Å; T27-D30 PolarHBondContact OG1-OD2 2.81Å; T27-L31 PolarHBondContact O-N 2.85Å
28	V	88.6	Confident	90.7	Very high	10 Å²	10	61.9 Å²	61.9	6%	0.061	33%	0.326	C	S	.	.	H	α-helix	trans	-57.9	-38.8	172.2	174.6	0	0	0	0	110.5	V2 L4 M8 L31 V32 L57 N61	V2-V28 HydrophobicContact CB-CB 4.38Å; V2-V28 HydrophobicContact CB-CG2 3.97Å; V2-V28 HydrophobicContact CG1-CG2 3.79Å; V2-V28 PolarHBondContact O-N 3.18Å; L4-V28 HydrophobicContact CD2-CG2 4.06Å; L4-V28 HydrophobicContact CG-CG2 4.45Å; M8-V28 HydrophobicContact CE-CG2 3.83Å; V28-L31 PolarHBondContact O-N 2.78Å; V28-V32 HydrophobicContact CG1-CG2 4.06Å; V28-V32 VanDerWaalsContact O-CB 3.32Å; V28-V32 WeakPolarHBondContact O-CB 3.3Å; V28-V32 WeakPolarHBondContact O-CG2 3.48Å; V28-V32 PolarHBondContact O-N 3.46Å; V28-L57 HydrophobicContact CG1-CB 4.04Å; V28-L57 HydrophobicContact CG2-CD2 4.23Å; V28-N61 HydrophobicContact CG1-CB 4.12Å
29	E	87.6	Confident	90.7	Very high	113 Å²	113	56 Å²	56	53%	0.528	31%	0.305	S	S	.	.	H	α-helix	trans	-62.9	-42.8	178.3	-174.9	176.4	178.8	0	0	112	T27 L31 V32 S33	T27-E29 PolarHBondContact O-N 2.94Å; T27-E29 PolarHBondContact OG1-N 3.16Å; E29-L31 PolarHBondContact O-N 3.39Å; E29-V32 PolarHBondContact O-N 3.25Å; E29-S33 VanDerWaalsContact O-CB 3.22Å; E29-S33 WeakPolarHBondContact O-CB 3.41Å; E29-S33 PolarHBondContact O-N 3.49Å; E29-S33 PolarHBondContact O-OG 3.25Å
30	D	89.1	Confident	90.8	Very high	56 Å²	56	54.3 Å²	54.3	30%	0.299	29%	0.293	S	S	.	.	H	α-helix	trans	-58.8	-49	177	-56.1	-24.1	0	0	0	110.6	I25 R26 T27 S33 S34	I25-D30 HydrophobicContact CB-CB 4.42Å; I25-D30 HydrophobicContact CD1-CB 3.99Å; I25-D30 HydrophobicContact CG2-CB 3.9Å; R26-D30 PolarHBondContact N-OD2 3.31Å; T27-D30 PolarHBondContact N-OD2 3.04Å; T27-D30 PolarHBondContact O-N 3.34Å; T27-D30 PolarHBondContact OG1-N 2.61Å; T27-D30 VanDerWaalsContact OG1-N 3.09Å; T27-D30 PolarHBondContact OG1-OD1 3.34Å; T27-D30 VanDerWaalsContact OG1-OD1 3.05Å; T27-D30 PolarHBondContact OG1-OD2 2.81Å; D30-S33 PolarHBondContact O-N 3.45Å; D30-S34 VanDerWaalsContact O-CB 3.3Å; D30-S34 WeakPolarHBondContact O-CB 3.3Å; D30-S34 PolarHBondContact O-N 2.92Å
31	L	89.6	Confident	90.8	Very high	2 Å²	2	61.2 Å²	61.2	1%	0.01	33%	0.326	C	S	.	.	H	α-helix	trans	-66.2	-42.4	-179	-174.5	145.4	0	0	0	111.4	L4 L20 I25 T27 V28 E29 S33 S34 I53 R54 L57	L4-L31 HydrophobicContact CD1-CB 4.11Å; L4-L31 HydrophobicContact CD1-CD1 4.14Å; L20-L31 HydrophobicContact CD1-CD1 3.78Å; L20-L31 HydrophobicContact CD2-CD1 4.07Å; I25-L31 HydrophobicContact CG2-CB 3.68Å; I25-L31 HydrophobicContact CG2-CD1 4.44Å; I25-L31 HydrophobicContact CG2-CG 4.46Å; T27-L31 PolarHBondContact O-N 2.85Å; V28-L31 PolarHBondContact O-N 2.78Å; E29-L31 PolarHBondContact O-N 3.39Å; L31-S33 VanDerWaalsContact C-N 3.3Å; L31-S33 PolarHBondContact O-N 3.17Å; L31-S34 PolarHBondContact O-N 3.35Å; L31-S34 PolarHBondContact O-OG 2.95Å; L31-I53 HydrophobicContact CD1-CG2 4.46Å; L31-R54 HydrophobicContact CD2-CB 3.85Å; L31-R54 HydrophobicContact CD2-CG 4.11Å; L31-L57 HydrophobicContact CD1-CD1 4.4Å; L31-L57 HydrophobicContact CD2-CD1 3.92Å
32	V	88.3	Confident	90.7	Very high	26 Å²	26	62 Å²	62	16%	0.158	33%	0.332	C	S	.	.	H	α-helix	trans	-69.4	-28.4	179.4	169.3	0	0	0	0	112.2	V28 E29 R54 L58	V28-V32 HydrophobicContact CG1-CG2 4.06Å; V28-V32 VanDerWaalsContact O-CB 3.32Å; V28-V32 WeakPolarHBondContact O-CB 3.3Å; V28-V32 WeakPolarHBondContact O-CG2 3.48Å; V28-V32 PolarHBondContact O-N 3.46Å; E29-V32 PolarHBondContact O-N 3.25Å; V32-R54 HydrophobicContact CG2-CG 4.23Å; V32-R54 PolarHBondContact O-NE 2.93Å; V32-R54 VanDerWaalsContact O-NE 3.17Å; V32-R54 PolarHBondContact O-NH2 3.43Å; V32-L58 HydrophobicContact CB-CD2 4.43Å; V32-L58 HydrophobicContact CG1-CD1 4.41Å; V32-L58 HydrophobicContact CG1-CD2 3.38Å; V32-L58 HydrophobicContact CG1-CG 3.92Å; V32-L58 HydrophobicContact CG2-CD2 4.1Å; V32-L58 HydrophobicContact CG2-CG 3.95Å
33	S	87.5	Confident	90.6	Very high	90 Å²	90	58 Å²	58	63%	0.629	30%	0.299	S	S	*	.	H	α-helix	trans	-91.4	-16.2	-179.6	-53.8	0	0	0	0	113	E29 D30 L31	E29-S33 VanDerWaalsContact O-CB 3.22Å; E29-S33 WeakPolarHBondContact O-CB 3.41Å; E29-S33 PolarHBondContact O-N 3.49Å; E29-S33 PolarHBondContact O-OG 3.25Å; D30-S33 PolarHBondContact O-N 3.45Å; L31-S33 VanDerWaalsContact C-N 3.3Å; L31-S33 PolarHBondContact O-N 3.17Å
34	S	90.4	Very high	90.5	Very high	24 Å²	24	61.9 Å²	61.9	17%	0.168	32%	0.324	C	S	.	.	S	Bend	trans	-70.6	158.4	178.3	69.9	0	0	0	0	114.1	D30 L31 I36 L39 R54	D30-S34 VanDerWaalsContact O-CB 3.3Å; D30-S34 WeakPolarHBondContact O-CB 3.3Å; D30-S34 PolarHBondContact O-N 2.92Å; L31-S34 PolarHBondContact O-N 3.35Å; L31-S34 PolarHBondContact O-OG 2.95Å; S34-I36 PolarHBondContact O-N 2.99Å; S34-L39 WeakPolarHBondContact OG-CD2 3.47Å; S34-R54 PolarHBondContact O-NH1 2.94Å
35	D	92.5	Very high	90.5	Very high	100 Å²	100	59 Å²	59	54%	0.535	31%	0.31	S	S	.	.			trans	-75.2	118.6	166.1	-169.5	-35.4	0	0	0	109.6	E37 D38 L39	D35-E37 VanDerWaalsContact C-N 3.32Å; D35-E37 PolarHBondContact O-N 2.61Å; D35-E37 WeakPolarHBondContact OD1-CB 3.47Å; D35-E37 PolarHBondContact OD1-N 2.7Å; D35-D38 HydrophobicContact CB-CB 4.13Å; D35-L39 VanDerWaalsContact O-CB 3.24Å; D35-L39 WeakPolarHBondContact O-CB 3.48Å; D35-L39 PolarHBondContact O-N 2.57Å
36	I	92.4	Very high	90.5	Very high	12 Å²	12	61.7 Å²	61.7	6%	0.062	33%	0.33	C	S	.	.	H	α-helix	trans	-69.5	-32.6	-175.4	-53.8	173.2	0	0	0	110.9	S34 A40 Y47 L50 F51 R54	S34-I36 PolarHBondContact O-N 2.99Å; I36-A40 WeakPolarHBondContact O-CB 3.4Å; I36-A40 PolarHBondContact O-N 2.75Å; I36-Y47 HydrophobicContact CB-CD2 4.32Å; I36-Y47 HydrophobicContact CB-CE2 3.93Å; I36-Y47 HydrophobicContact CG2-CD2 3.7Å; I36-Y47 HydrophobicContact CG2-CE2 3.66Å; I36-L50 HydrophobicContact CG2-CB 4.02Å; I36-L50 HydrophobicContact CG2-CD2 3.91Å; I36-F51 HydrophobicContact CD1-CD2 3.56Å; I36-F51 HydrophobicContact CD1-CE2 4.19Å; I36-F51 HydrophobicContact CD1-CG 4.5Å; I36-R54 VanDerWaalsContact CD1-NH1 3.34Å
37	E	92.2	Very high	90.6	Very high	119 Å²	119	60 Å²	60	56%	0.556	33%	0.325	S	S	*	.	H	α-helix	trans	-70.1	-47.2	-178.5	-65.9	-175.3	-176.6	0	0	110.4	D35 A40 Q41 Y47	D35-E37 VanDerWaalsContact C-N 3.32Å; D35-E37 PolarHBondContact O-N 2.61Å; D35-E37 WeakPolarHBondContact OD1-CB 3.47Å; D35-E37 PolarHBondContact OD1-N 2.7Å; E37-A40 PolarHBondContact O-N 3.24Å; E37-Q41 WeakPolarHBondContact O-CG 3.43Å; E37-Q41 PolarHBondContact O-N 2.92Å; E37-Q41 VanDerWaalsContact O-N 3.11Å; E37-Y47 HydrophobicContact CG-CD2 3.87Å; E37-Y47 HydrophobicContact CG-CE2 3.6Å
38	D	92.5	Very high	90.7	Very high	67 Å²	67	67.4 Å²	67.4	36%	0.358	36%	0.356	S	S	.	.	H	α-helix	trans	-62.4	-44	174.9	-179.2	40	0	0	0	111.4	D35 A40 Q41 K42	D35-D38 HydrophobicContact CB-CB 4.13Å; D38-A40 PolarHBondContact O-N 3.28Å; D38-Q41 PolarHBondContact O-N 3.25Å; D38-K42 WeakPolarHBondContact O-CB 3.49Å; D38-K42 WeakPolarHBondContact O-CG 3.44Å; D38-K42 PolarHBondContact O-N 3.22Å; D38-K42 WeakPolarHBondContact OD1-CE 3.39Å; D38-K42 IonicContact OD1-NZ 3.45Å; D38-K42 PolarHBondContact OD1-NZ 3.03Å; D38-K42 VanDerWaalsContact OD2-CE 3.31Å; D38-K42 WeakPolarHBondContact OD2-CE 3.41Å; D38-K42 IonicContact OD2-NZ 2.66Å; D38-K42 PolarHBondContact OD2-NZ 2.75Å
39	L	92.6	Very high	90.7	Very high	6 Å²	6	69 Å²	69	3%	0.031	37%	0.37	C	S	.	.	H	α-helix	trans	-67.6	-37	179.6	-169	58.9	0	0	0	112.4	L20 A23 I25 S34 D35 Q41 K42 C43 L50	L20-L39 HydrophobicContact CD2-CD1 4.03Å; L20-L39 HydrophobicContact CD2-CD2 3.71Å; L20-L39 HydrophobicContact CD2-CG 3.99Å; A23-L39 HydrophobicContact CB-CD1 3.8Å; I25-L39 HydrophobicContact CG1-CD1 3.83Å; I25-L39 HydrophobicContact CG1-CD2 4.11Å; S34-L39 WeakPolarHBondContact OG-CD2 3.47Å; D35-L39 VanDerWaalsContact O-CB 3.24Å; D35-L39 WeakPolarHBondContact O-CB 3.48Å; D35-L39 PolarHBondContact O-N 2.57Å; L39-Q41 VanDerWaalsContact C-N 3.32Å; L39-Q41 PolarHBondContact O-N 3.22Å; L39-K42 PolarHBondContact O-N 3.47Å; L39-C43 VanDerWaalsContact O-CB 3.31Å; L39-C43 WeakPolarHBondContact O-CB 3.42Å; L39-C43 PolarHBondContact O-N 3.21Å; L39-C43 PolarHBondContact O-SG 2.64Å; L39-L50 HydrophobicContact CB-CD2 3.9Å; L39-L50 HydrophobicContact CD2-CD2 3.65Å; L39-L50 HydrophobicContact CG-CD2 3.75Å
40	A	93.3	Very high	90.9	Very high	10 Å²	10	63.7 Å²	63.7	8%	0.083	35%	0.345	C	S	.	.	H	α-helix	trans	-62	-40.5	173.8	0	0	0	0	0	111.6	I36 E37 D38 S44 V45	I36-A40 WeakPolarHBondContact O-CB 3.4Å; I36-A40 PolarHBondContact O-N 2.75Å; E37-A40 PolarHBondContact O-N 3.24Å; D38-A40 PolarHBondContact O-N 3.28Å; A40-S44 WeakPolarHBondContact O-CA 3.22Å; A40-S44 PolarHBondContact O-N 3.39Å; A40-S44 VanDerWaalsContact O-N 3.07Å; A40-V45 WeakPolarHBondContact CB-O 3.39Å; A40-V45 PolarHBondContact O-N 2.89Å
41	Q	91.7	Very high	91	Very high	145 Å²	145	64.8 Å²	64.8	68%	0.678	35%	0.347	S	S	*	.	H	α-helix	trans	-65.8	-51.2	174.8	-69.9	179	8.9	0	0	111.5	E37 D38 L39 C43 S44	E37-Q41 WeakPolarHBondContact O-CG 3.43Å; E37-Q41 PolarHBondContact O-N 2.92Å; E37-Q41 VanDerWaalsContact O-N 3.11Å; D38-Q41 PolarHBondContact O-N 3.25Å; L39-Q41 VanDerWaalsContact C-N 3.32Å; L39-Q41 PolarHBondContact O-N 3.22Å; Q41-C43 PolarHBondContact O-N 3.11Å; Q41-S44 PolarHBondContact O-N 2.79Å; Q41-S44 VanDerWaalsContact O-N 3.17Å
42	K	90.8	Very high	91	Very high	133 Å²	133	67.2 Å²	67.2	58%	0.578	37%	0.367	S	S	*	.	H	α-helix	trans	-60.6	-43.1	-179.1	-75.8	172.6	175.4	166.5	0	113	D38 L39 S44	D38-K42 WeakPolarHBondContact O-CB 3.49Å; D38-K42 WeakPolarHBondContact O-CG 3.44Å; D38-K42 PolarHBondContact O-N 3.22Å; D38-K42 WeakPolarHBondContact OD1-CE 3.39Å; D38-K42 IonicContact OD1-NZ 3.45Å; D38-K42 PolarHBondContact OD1-NZ 3.03Å; D38-K42 VanDerWaalsContact OD2-CE 3.31Å; D38-K42 WeakPolarHBondContact OD2-CE 3.41Å; D38-K42 IonicContact OD2-NZ 2.66Å; D38-K42 PolarHBondContact OD2-NZ 2.75Å; L39-K42 PolarHBondContact O-N 3.47Å; K42-S44 VanDerWaalsContact C-N 3.31Å
43	C	89	Confident	91.1	Very high	10 Å²	10	66.1 Å²	66.1	7%	0.068	36%	0.361	C	S	.	.	H	α-helix	trans	-85.2	-3.5	-179.8	-62.2	0	0	0	0	113.3	L39 Q41 V45	L39-C43 VanDerWaalsContact O-CB 3.31Å; L39-C43 WeakPolarHBondContact O-CB 3.42Å; L39-C43 PolarHBondContact O-N 3.21Å; L39-C43 PolarHBondContact O-SG 2.64Å; Q41-C43 PolarHBondContact O-N 3.11Å; C43-V45 VanDerWaalsContact C-N 3.27Å; C43-V45 HydrophobicContact CB-CB 4.47Å; C43-V45 HydrophobicContact CB-CG2 4Å; C43-V45 VanDerWaalsContact O-CG2 3.26Å; C43-V45 WeakPolarHBondContact O-CG2 3.34Å; C43-V45 PolarHBondContact O-N 2.91Å
44	S	89.9	Confident	91.3	Very high	113 Å²	113	65 Å²	65	79%	0.79	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	43.3	-175	-62.2	0	0	0	0	112.9	A40 Q41 K42	A40-S44 WeakPolarHBondContact O-CA 3.22Å; A40-S44 PolarHBondContact O-N 3.39Å; A40-S44 VanDerWaalsContact O-N 3.07Å; Q41-S44 PolarHBondContact O-N 2.79Å; Q41-S44 VanDerWaalsContact O-N 3.17Å; K42-S44 VanDerWaalsContact C-N 3.31Å
45	V	89.7	Confident	91.2	Very high	41 Å²	41	71.9 Å²	71.9	25%	0.248	37%	0.365	C	S	.	.			trans	-121.3	149.9	-175.5	175.3	0	0	0	0	109.5	L16 A40 C43 Y47 A49 L50	L16-V45 HydrophobicContact CD1-CB 4.23Å; L16-V45 HydrophobicContact CD1-CG1 4.14Å; L16-V45 HydrophobicContact CD1-CG2 3.53Å; A40-V45 WeakPolarHBondContact CB-O 3.39Å; A40-V45 PolarHBondContact O-N 2.89Å; C43-V45 VanDerWaalsContact C-N 3.27Å; C43-V45 HydrophobicContact CB-CB 4.47Å; C43-V45 HydrophobicContact CB-CG2 4Å; C43-V45 VanDerWaalsContact O-CG2 3.26Å; C43-V45 WeakPolarHBondContact O-CG2 3.34Å; C43-V45 PolarHBondContact O-N 2.91Å; V45-Y47 PolarHBondContact O-N 3.37Å; V45-A49 HydrophobicContact CG1-CB 4.32Å; V45-L50 HydrophobicContact CB-CD1 4.02Å; V45-L50 HydrophobicContact CG1-CD1 3.85Å
46	S	92.3	Very high	91.1	Very high	73 Å²	73	69.8 Å²	69.8	51%	0.51	36%	0.355	S	S	.	.			trans	-59.3	128	177.5	-177.5	0	0	0	0	111.4	K48 A49 L50	S46-K48 PolarHBondContact O-N 3.16Å; S46-K48 VanDerWaalsContact O-N 3.17Å; S46-K48 PolarHBondContact OG-N 3.07Å; S46-A49 WeakPolarHBondContact O-CB 3.38Å; S46-A49 PolarHBondContact O-N 2.9Å; S46-L50 PolarHBondContact O-N 3Å
47	Y	92	Very high	90.9	Very high	97 Å²	97	69.2 Å²	69.2	38%	0.38	35%	0.352	S	S	.	.	H	α-helix	trans	-48.1	-43.3	171.6	173.5	-90.5	0	0	0	112.1	I36 E37 V45 A49 L50 F51	I36-Y47 HydrophobicContact CB-CD2 4.32Å; I36-Y47 HydrophobicContact CB-CE2 3.93Å; I36-Y47 HydrophobicContact CG2-CD2 3.7Å; I36-Y47 HydrophobicContact CG2-CE2 3.66Å; E37-Y47 HydrophobicContact CG-CD2 3.87Å; E37-Y47 HydrophobicContact CG-CE2 3.6Å; V45-Y47 PolarHBondContact O-N 3.37Å; Y47-A49 VanDerWaalsContact C-N 3.33Å; Y47-A49 PolarHBondContact O-N 3.15Å; Y47-L50 PolarHBondContact O-N 3.15Å; Y47-F51 HydrophobicContact CE1-CB 4.3Å; Y47-F51 HydrophobicContact CE1-CD2 4.34Å; Y47-F51 HydrophobicContact CE1-CG 4.45Å; Y47-F51 VanDerWaalsContact O-CB 3.24Å; Y47-F51 WeakPolarHBondContact O-CB 3.43Å; Y47-F51 PolarHBondContact O-N 2.83Å
48	K	91.8	Very high	90.6	Very high	169 Å²	169	66.3 Å²	66.3	74%	0.735	34%	0.341	S	S	*	.	H	α-helix	trans	-63.3	-38.7	-179.6	-70.2	-174.3	178.3	-179.8	0	112.5	S46 A52	S46-K48 PolarHBondContact O-N 3.16Å; S46-K48 VanDerWaalsContact O-N 3.17Å; S46-K48 PolarHBondContact OG-N 3.07Å; K48-A52 WeakPolarHBondContact O-CB 3.47Å; K48-A52 PolarHBondContact O-N 3.26Å
49	A	90	Very high	90.2	Very high	43 Å²	43	65.7 Å²	65.7	36%	0.355	34%	0.344	S	S	.	.	H	α-helix	trans	-67.9	-46.7	177.7	0	0	0	0	0	110.7	V45 S46 Y47 F51 A52 I53	V45-A49 HydrophobicContact CG1-CB 4.32Å; S46-A49 WeakPolarHBondContact O-CB 3.38Å; S46-A49 PolarHBondContact O-N 2.9Å; Y47-A49 VanDerWaalsContact C-N 3.33Å; Y47-A49 PolarHBondContact O-N 3.15Å; A49-F51 VanDerWaalsContact C-N 3.34Å; A49-F51 PolarHBondContact O-N 3.08Å; A49-A52 PolarHBondContact O-N 3.49Å; A49-I53 WeakPolarHBondContact O-CG1 3.3Å; A49-I53 PolarHBondContact O-N 3.41Å
50	L	90.8	Very high	89.8	Confident	2 Å²	2	70.5 Å²	70.5	1%	0.01	37%	0.367	C	S	.	.	H	α-helix	trans	-64	-39.6	179	-135.2	104.3	0	0	0	112.1	L16 I36 L39 V45 S46 Y47 I53 R54	L16-L50 HydrophobicContact CD1-CD1 4.08Å; I36-L50 HydrophobicContact CG2-CB 4.02Å; I36-L50 HydrophobicContact CG2-CD2 3.91Å; L39-L50 HydrophobicContact CB-CD2 3.9Å; L39-L50 HydrophobicContact CD2-CD2 3.65Å; L39-L50 HydrophobicContact CG-CD2 3.75Å; V45-L50 HydrophobicContact CB-CD1 4.02Å; V45-L50 HydrophobicContact CG1-CD1 3.85Å; S46-L50 PolarHBondContact O-N 3Å; Y47-L50 PolarHBondContact O-N 3.15Å; L50-I53 PolarHBondContact O-N 2.93Å; L50-R54 PolarHBondContact O-N 2.91Å
51	F	91.4	Very high	89	Confident	79 Å²	79	73.2 Å²	73.2	35%	0.346	38%	0.38	S	S	.	.	H	α-helix	trans	-64.4	-41.6	175.4	-171.8	-93	0	0	0	112.3	I36 Y47 A49 R54 R55	I36-F51 HydrophobicContact CD1-CD2 3.56Å; I36-F51 HydrophobicContact CD1-CE2 4.19Å; I36-F51 HydrophobicContact CD1-CG 4.5Å; Y47-F51 HydrophobicContact CE1-CB 4.3Å; Y47-F51 HydrophobicContact CE1-CD2 4.34Å; Y47-F51 HydrophobicContact CE1-CG 4.45Å; Y47-F51 VanDerWaalsContact O-CB 3.24Å; Y47-F51 WeakPolarHBondContact O-CB 3.43Å; Y47-F51 PolarHBondContact O-N 2.83Å; A49-F51 VanDerWaalsContact C-N 3.34Å; A49-F51 PolarHBondContact O-N 3.08Å; F51-R54 PolarHBondContact O-N 2.73Å; F51-R55 HydrophobicContact CD1-CG 4.32Å; F51-R55 VanDerWaalsContact CE1-CD 3.44Å; F51-R55 HydrophobicContact CE1-CG 4.01Å; F51-R55 HydrophobicContact CZ-CG 4.46Å; F51-R55 PolarHBondContact O-N 3.06Å
52	A	90.7	Very high	88.4	Confident	52 Å²	52	69.2 Å²	69.2	43%	0.43	37%	0.366	S	S	.	.	H	α-helix	trans	-63.1	-44.7	175.2	0	0	0	0	0	111.5	K48 A49 R55 V56	K48-A52 WeakPolarHBondContact O-CB 3.47Å; K48-A52 PolarHBondContact O-N 3.26Å; A49-A52 PolarHBondContact O-N 3.49Å; A52-R55 PolarHBondContact O-N 2.81Å; A52-V56 WeakPolarHBondContact O-CG2 3.3Å; A52-V56 PolarHBondContact O-N 3.25Å
53	I	90.5	Very high	87.8	Confident	4 Å²	4	67.7 Å²	67.7	2%	0.021	38%	0.378	C	S	.	.	H	α-helix	trans	-58.5	-49.5	174.7	-70.6	167.1	0	0	0	110.5	G11 L16 L31 A49 L50 R55 V56 L57	G11-I53 WeakPolarHBondContact O-CD1 3.49Å; L16-I53 HydrophobicContact CD2-CD1 3.36Å; L31-I53 HydrophobicContact CD1-CG2 4.46Å; A49-I53 WeakPolarHBondContact O-CG1 3.3Å; A49-I53 PolarHBondContact O-N 3.41Å; L50-I53 PolarHBondContact O-N 2.93Å; I53-R55 VanDerWaalsContact C-N 3.3Å; I53-R55 PolarHBondContact O-N 3.03Å; I53-V56 PolarHBondContact O-N 3.41Å; I53-L57 HydrophobicContact CG2-CD1 3.71Å; I53-L57 HydrophobicContact CG2-CG 4.28Å; I53-L57 WeakPolarHBondContact O-CB 3.43Å; I53-L57 WeakPolarHBondContact O-CG 3.39Å; I53-L57 PolarHBondContact O-N 3.26Å
54	R	90.6	Very high	87.3	Confident	66 Å²	66	74 Å²	74	25%	0.249	40%	0.404	C	S	.	.	H	α-helix	trans	-57.9	-41.4	177.2	-174.5	-178.5	172.5	167	-7.2	111.9	L31 V32 S34 I36 L50 F51 L58	L31-R54 HydrophobicContact CD2-CB 3.85Å; L31-R54 HydrophobicContact CD2-CG 4.11Å; V32-R54 HydrophobicContact CG2-CG 4.23Å; V32-R54 PolarHBondContact O-NE 2.93Å; V32-R54 VanDerWaalsContact O-NE 3.17Å; V32-R54 PolarHBondContact O-NH2 3.43Å; S34-R54 PolarHBondContact O-NH1 2.94Å; I36-R54 VanDerWaalsContact CD1-NH1 3.34Å; L50-R54 PolarHBondContact O-N 2.91Å; F51-R54 PolarHBondContact O-N 2.73Å; R54-L58 HydrophobicContact CG-CD1 4.1Å; R54-L58 VanDerWaalsContact O-CB 3.29Å; R54-L58 WeakPolarHBondContact O-CB 3.4Å; R54-L58 WeakPolarHBondContact O-CG 3.47Å; R54-L58 PolarHBondContact O-N 2.85Å
55	R	89.1	Confident	87	Confident	169 Å²	169	74.8 Å²	74.8	64%	0.638	41%	0.407	S	S	*	.	H	α-helix	trans	-64.1	-43.5	177.2	-82.7	-172.5	63.6	156.4	1.7	113	F51 A52 I53 A59	F51-R55 HydrophobicContact CD1-CG 4.32Å; F51-R55 VanDerWaalsContact CE1-CD 3.44Å; F51-R55 HydrophobicContact CE1-CG 4.01Å; F51-R55 HydrophobicContact CZ-CG 4.46Å; F51-R55 PolarHBondContact O-N 3.06Å; A52-R55 PolarHBondContact O-N 2.81Å; I53-R55 VanDerWaalsContact C-N 3.3Å; I53-R55 PolarHBondContact O-N 3.03Å; R55-A59 WeakPolarHBondContact O-CB 3.15Å; R55-A59 PolarHBondContact O-N 2.99Å
56	V	89.3	Confident	86.9	Confident	55 Å²	55	77 Å²	77	33%	0.333	42%	0.42	S	S	.	.	H	α-helix	trans	-66	-45.8	177.7	176.1	0	0	0	0	110.1	C9 A52 I53 L58 A59 Q60	C9-V56 HydrophobicContact CB-CB 4.04Å; C9-V56 HydrophobicContact CB-CG1 3.51Å; A52-V56 WeakPolarHBondContact O-CG2 3.3Å; A52-V56 PolarHBondContact O-N 3.25Å; I53-V56 PolarHBondContact O-N 3.41Å; V56-L58 VanDerWaalsContact C-N 3.35Å; V56-L58 PolarHBondContact O-N 2.84Å; V56-A59 PolarHBondContact O-N 3.41Å; V56-Q60 HydrophobicContact CG1-CG 4.26Å; V56-Q60 WeakPolarHBondContact O-CB 3.44Å; V56-Q60 VanDerWaalsContact O-CG 3.32Å; V56-Q60 WeakPolarHBondContact O-CG 3.4Å; V56-Q60 PolarHBondContact O-N 3.4Å
57	L	88.2	Confident	87	Confident	0 Å²	0	76.1 Å²	76.1	0%	0	41%	0.414	C	S	.	.	H	α-helix	trans	-62.7	-40.8	177.8	-70.7	175.9	0	0	0	112.1	L4 M8 V28 L31 I53 Q60 N61	L4-L57 HydrophobicContact CD2-CD1 3.69Å; M8-L57 HydrophobicContact CB-CD2 4.33Å; M8-L57 HydrophobicContact CE-CD2 4.12Å; V28-L57 HydrophobicContact CG1-CB 4.04Å; V28-L57 HydrophobicContact CG2-CD2 4.23Å; L31-L57 HydrophobicContact CD1-CD1 4.4Å; L31-L57 HydrophobicContact CD2-CD1 3.92Å; I53-L57 HydrophobicContact CG2-CD1 3.71Å; I53-L57 HydrophobicContact CG2-CG 4.28Å; I53-L57 WeakPolarHBondContact O-CB 3.43Å; I53-L57 WeakPolarHBondContact O-CG 3.39Å; I53-L57 PolarHBondContact O-N 3.26Å; L57-Q60 PolarHBondContact O-N 3.12Å; L57-N61 VanDerWaalsContact O-CB 3.26Å; L57-N61 WeakPolarHBondContact O-CB 3.33Å; L57-N61 PolarHBondContact O-N 2.93Å; L57-N61 PolarHBondContact O-ND2 3.16Å
58	L	86.8	Confident	87.1	Confident	59 Å²	59	74.5 Å²	74.5	31%	0.309	43%	0.427	S	S	.	.	H	α-helix	trans	-57.5	-57.2	170.6	-84.9	168.5	0	0	0	110.3	V32 R54 V56 Q60 N61 T62	V32-L58 HydrophobicContact CB-CD2 4.43Å; V32-L58 HydrophobicContact CG1-CD1 4.41Å; V32-L58 HydrophobicContact CG1-CD2 3.38Å; V32-L58 HydrophobicContact CG1-CG 3.92Å; V32-L58 HydrophobicContact CG2-CD2 4.1Å; V32-L58 HydrophobicContact CG2-CG 3.95Å; R54-L58 HydrophobicContact CG-CD1 4.1Å; R54-L58 VanDerWaalsContact O-CB 3.29Å; R54-L58 WeakPolarHBondContact O-CB 3.4Å; R54-L58 WeakPolarHBondContact O-CG 3.47Å; R54-L58 PolarHBondContact O-N 2.85Å; V56-L58 VanDerWaalsContact C-N 3.35Å; V56-L58 PolarHBondContact O-N 2.84Å; L58-Q60 PolarHBondContact O-N 2.72Å; L58-Q60 VanDerWaalsContact O-N 3.13Å; L58-N61 CarbonylContact O-C 3.56Å; L58-N61 PolarHBondContact O-N 3.41Å; L58-T62 HydrophobicContact CB-CG2 4.28Å; L58-T62 HydrophobicContact CD2-CG2 3.74Å; L58-T62 VanDerWaalsContact O-CB 3.29Å; L58-T62 WeakPolarHBondContact O-CB 3.26Å; L58-T62 WeakPolarHBondContact O-CG2 3.44Å; L58-T62 PolarHBondContact O-N 3.28Å; L58-T62 PolarHBondContact O-OG1 3.11Å
59	A	84.6	Confident	87.3	Confident	53 Å²	53	69.3 Å²	69.3	44%	0.438	42%	0.416	S	S	.	.	H	α-helix	trans	-57.8	-32.8	-178.2	0	0	0	0	0	113.6	R55 V56 F64	R55-A59 WeakPolarHBondContact O-CB 3.15Å; R55-A59 PolarHBondContact O-N 2.99Å; V56-A59 PolarHBondContact O-N 3.41Å; A59-F64 WeakPolarHBondContact O-CE2 3.44Å; A59-F64 WeakPolarHBondContact O-CZ 3.4Å
60	Q	82.6	Confident	87.4	Confident	108 Å²	108	71.4 Å²	71.4	51%	0.505	42%	0.421	S	S	.	.	H	α-helix	trans	-79.8	-26.2	177.7	-73.1	175.4	-20.3	0	0	113.9	M8 V56 L57 L58	M8-Q60 PolarHBondContact O-NE2 3.47Å; M8-Q60 PolarHBondContact O-OE1 3.49Å; V56-Q60 HydrophobicContact CG1-CG 4.26Å; V56-Q60 WeakPolarHBondContact O-CB 3.44Å; V56-Q60 VanDerWaalsContact O-CG 3.32Å; V56-Q60 WeakPolarHBondContact O-CG 3.4Å; V56-Q60 PolarHBondContact O-N 3.4Å; L57-Q60 PolarHBondContact O-N 3.12Å; L58-Q60 PolarHBondContact O-N 2.72Å; L58-Q60 VanDerWaalsContact O-N 3.13Å
61	N	78.3	Confident	87.4	Confident	67 Å²	67	76.3 Å²	76.3	36%	0.358	45%	0.446	S	S	.	.	H	α-helix	trans	-118.3	-2.6	-170.6	-62.3	-93	0	0	0	113.4	V28 L57 L58	V28-N61 HydrophobicContact CG1-CB 4.12Å; L57-N61 VanDerWaalsContact O-CB 3.26Å; L57-N61 WeakPolarHBondContact O-CB 3.33Å; L57-N61 PolarHBondContact O-N 2.93Å; L57-N61 PolarHBondContact O-ND2 3.16Å; L58-N61 CarbonylContact O-C 3.56Å; L58-N61 PolarHBondContact O-N 3.41Å
62	T	78	Confident	87.4	Confident	61 Å²	61	79.1 Å²	79.1	37%	0.374	46%	0.456	S	S	.	.	S	Bend	trans	-83.8	135.4	171.6	53.5	0	0	0	0	110.4	L58 F64	L58-T62 HydrophobicContact CB-CG2 4.28Å; L58-T62 HydrophobicContact CD2-CG2 3.74Å; L58-T62 VanDerWaalsContact O-CB 3.29Å; L58-T62 WeakPolarHBondContact O-CB 3.26Å; L58-T62 WeakPolarHBondContact O-CG2 3.44Å; L58-T62 PolarHBondContact O-N 3.28Å; L58-T62 PolarHBondContact O-OG1 3.11Å; T62-F64 PolarHBondContact O-N 3.17Å
63	A	77.6	Confident	87.5	Confident	101 Å²	101	82.7 Å²	82.7	84%	0.835	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-64.5	128.4	167.1	0	0	0	0	0	109.6
64	F	79.8	Confident	87.4	Confident	141 Å²	141	87.9 Å²	87.9	62%	0.618	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-88.8	142.4	169.9	-69.6	-82	0	0	0	109.6	A59 T62 V66	A59-F64 WeakPolarHBondContact O-CE2 3.44Å; A59-F64 WeakPolarHBondContact O-CZ 3.4Å; T62-F64 PolarHBondContact O-N 3.17Å; F64-V66 PolarHBondContact O-N 3.22Å
65	P	83.5	Confident	87.3	Confident	130 Å²	130	88.6 Å²	88.6	84%	0.844	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-62.6	125	173.9	27	-32.9	0	0	0	109.2
66	V	87.2	Confident	87.3	Confident	89 Å²	89	85.7 Å²	85.7	54%	0.539	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-98.3	141	174.3	-178.8	0	0	0	0	107.9	F64 D70 L71	F64-V66 PolarHBondContact O-N 3.22Å; V66-D70 HydrophobicContact CG1-CB 3.58Å; V66-L71 HydrophobicContact CG1-CB 4.4Å
67	S	94.2	Very high	87.3	Confident	54 Å²	54	87.9 Å²	87.9	38%	0.378	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-68.3	155.8	177.6	83.2	0	0	0	0	110.6	A69 D70 L71	S67-A69 PolarHBondContact O-N 3.39Å; S67-A69 PolarHBondContact OG-N 2.84Å; S67-D70 WeakPolarHBondContact CB-OD2 3.46Å; S67-D70 PolarHBondContact O-N 3.45Å; S67-D70 PolarHBondContact OG-N 3Å; S67-D70 VanDerWaalsContact OG-N 3.16Å; S67-D70 PolarHBondContact OG-OD2 3.49Å; S67-L71 WeakPolarHBondContact O-CB 3.19Å; S67-L71 PolarHBondContact O-N 3.41Å
68	G	94.3	Very high	87.2	Confident	63 Å²	63	90.2 Å²	90.2	65%	0.649	53%	0.527	S	S	*	.	H	α-helix	trans	-61.3	-27.6	176.3	0	0	0	0	0	113.3	Y72	G68-Y72 WeakPolarHBondContact O-CB 3.32Å; G68-Y72 PolarHBondContact O-N 3.32Å
69	A	95.5	Very high	87.5	Confident	60 Å²	60	89.2 Å²	89.2	50%	0.496	52%	0.523	S	S	.	.	H	α-helix	trans	-72.1	-50.1	177	0	0	0	0	0	111.2	S67 L71 Y72 E73	S67-A69 PolarHBondContact O-N 3.39Å; S67-A69 PolarHBondContact OG-N 2.84Å; A69-L71 VanDerWaalsContact C-N 3.28Å; A69-L71 PolarHBondContact O-N 2.85Å; A69-Y72 WeakPolarHBondContact O-CB 3.4Å; A69-Y72 PolarHBondContact O-N 2.87Å; A69-E73 PolarHBondContact O-N 3.23Å
70	D	92.8	Very high	88	Confident	87 Å²	87	88.3 Å²	88.3	47%	0.465	52%	0.516	S	S	.	.	H	α-helix	trans	-61.1	-40.6	178.7	-54.1	-42.7	0	0	0	111	V66 S67 Y72 E73 E74	V66-D70 HydrophobicContact CG1-CB 3.58Å; S67-D70 WeakPolarHBondContact CB-OD2 3.46Å; S67-D70 PolarHBondContact O-N 3.45Å; S67-D70 PolarHBondContact OG-N 3Å; S67-D70 VanDerWaalsContact OG-N 3.16Å; S67-D70 PolarHBondContact OG-OD2 3.49Å; D70-Y72 VanDerWaalsContact C-N 3.28Å; D70-Y72 PolarHBondContact O-N 2.97Å; D70-E73 PolarHBondContact O-N 3.05Å; D70-E74 WeakPolarHBondContact O-CB 3.42Å; D70-E74 PolarHBondContact O-N 2.65Å
71	L	90.4	Very high	88.6	Confident	104 Å²	104	86.8 Å²	86.8	55%	0.545	51%	0.51	S	S	.	.	H	α-helix	trans	-62.4	-36.3	175.7	-177.1	65.5	0	0	0	112.1	V66 S67 A69 L75	V66-L71 HydrophobicContact CG1-CB 4.4Å; S67-L71 WeakPolarHBondContact O-CB 3.19Å; S67-L71 PolarHBondContact O-N 3.41Å; A69-L71 VanDerWaalsContact C-N 3.28Å; A69-L71 PolarHBondContact O-N 2.85Å; L71-L75 WeakPolarHBondContact O-CB 3.47Å; L71-L75 PolarHBondContact O-N 3.35Å
72	Y	90.9	Very high	89.5	Confident	139 Å²	139	84.1 Å²	84.1	55%	0.545	50%	0.496	S	S	.	.	H	α-helix	trans	-72	-41.2	177	-179.8	-111.8	0	0	0	111.8	G68 A69 D70 L75 L76	G68-Y72 WeakPolarHBondContact O-CB 3.32Å; G68-Y72 PolarHBondContact O-N 3.32Å; A69-Y72 WeakPolarHBondContact O-CB 3.4Å; A69-Y72 PolarHBondContact O-N 2.87Å; D70-Y72 VanDerWaalsContact C-N 3.28Å; D70-Y72 PolarHBondContact O-N 2.97Å; Y72-L75 WeakPolarHBondContact O-CB 3.45Å; Y72-L75 PolarHBondContact O-N 3.14Å; Y72-L76 HydrophobicContact CD1-CD1 4Å; Y72-L76 HydrophobicContact CD1-CG 4.47Å; Y72-L76 HydrophobicContact CE1-CD1 3.46Å; Y72-L76 VanDerWaalsContact CE1-CD1 3.46Å; Y72-L76 HydrophobicContact CE1-CG 4.1Å; Y72-L76 HydrophobicContact CE2-CD1 4.46Å; Y72-L76 HydrophobicContact CE2-CD2 4.28Å; Y72-L76 HydrophobicContact CE2-CG 4.25Å; Y72-L76 WeakPolarHBondContact O-CG 3.03Å; Y72-L76 PolarHBondContact O-N 2.72Å
73	E	93.3	Very high	90.4	Very high	127 Å²	127	82.7 Å²	82.7	59%	0.593	49%	0.488	S	S	*	.	H	α-helix	trans	-64.4	-40.2	174.5	-69.9	-174.6	178.5	0	0	112.1	A69 D70 L75 L76 S77	A69-E73 PolarHBondContact O-N 3.23Å; D70-E73 PolarHBondContact O-N 3.05Å; E73-L75 VanDerWaalsContact C-N 3.34Å; E73-L76 PolarHBondContact O-N 2.86Å; E73-S77 WeakPolarHBondContact O-CB 3.17Å; E73-S77 PolarHBondContact O-N 3.3Å; E73-S77 PolarHBondContact O-OG 3.02Å
74	E	88.8	Confident	91.3	Very high	112 Å²	112	78 Å²	78	52%	0.523	45%	0.45	S	S	.	.	H	α-helix	trans	-60.2	-45	172	-174.3	-177.7	175.1	0	0	110.8	D70 L76 S77 S78	D70-E74 WeakPolarHBondContact O-CB 3.42Å; D70-E74 PolarHBondContact O-N 2.65Å; E74-L76 PolarHBondContact O-N 3.02Å; E74-S77 WeakPolarHBondContact CA-OG 3.45Å; E74-S77 PolarHBondContact O-N 2.91Å; E74-S77 PolarHBondContact O-OG 2.88Å; E74-S77 VanDerWaalsContact O-OG 3.12Å; E74-S78 VanDerWaalsContact O-CB 3.26Å; E74-S78 WeakPolarHBondContact O-CB 3.28Å; E74-S78 PolarHBondContact O-N 2.79Å; E74-S78 PolarHBondContact O-OG 2.89Å
75	L	88.4	Confident	92	Very high	81 Å²	81	71.9 Å²	71.9	42%	0.424	43%	0.426	S	S	.	.	H	α-helix	trans	-59.1	-47.3	176.4	-176.3	76.1	0	0	0	111.5	L71 Y72 E73 S77 T79	L71-L75 WeakPolarHBondContact O-CB 3.47Å; L71-L75 PolarHBondContact O-N 3.35Å; Y72-L75 WeakPolarHBondContact O-CB 3.45Å; Y72-L75 PolarHBondContact O-N 3.14Å; E73-L75 VanDerWaalsContact C-N 3.34Å; L75-S77 VanDerWaalsContact C-N 3.33Å; L75-S77 PolarHBondContact O-N 2.7Å; L75-T79 WeakPolarHBondContact CD1-OG1 3.26Å; L75-T79 WeakPolarHBondContact O-CB 3.48Å; L75-T79 PolarHBondContact O-N 3.46Å; L75-T79 PolarHBondContact O-OG1 3.19Å
76	L	89.2	Confident	92.5	Very high	108 Å²	108	65.8 Å²	65.8	57%	0.565	39%	0.386	S	S	*	.	H	α-helix	trans	-64.9	-35.5	-179.6	-71.7	-178.9	0	0	0	113	Y72 E73 E74	Y72-L76 HydrophobicContact CD1-CD1 4Å; Y72-L76 HydrophobicContact CD1-CG 4.47Å; Y72-L76 HydrophobicContact CE1-CD1 3.46Å; Y72-L76 VanDerWaalsContact CE1-CD1 3.46Å; Y72-L76 HydrophobicContact CE1-CG 4.1Å; Y72-L76 HydrophobicContact CE2-CD1 4.46Å; Y72-L76 HydrophobicContact CE2-CD2 4.28Å; Y72-L76 HydrophobicContact CE2-CG 4.25Å; Y72-L76 WeakPolarHBondContact O-CG 3.03Å; Y72-L76 PolarHBondContact O-N 2.72Å; E73-L76 PolarHBondContact O-N 2.86Å; E74-L76 PolarHBondContact O-N 3.02Å
77	S	89.8	Confident	92.9	Very high	101 Å²	101	65 Å²	65	71%	0.706	38%	0.383	S	S	*	.	H	α-helix	trans	-84.2	-28.2	-177.4	56.8	0	0	0	0	113.6	E73 E74 L75	E73-S77 WeakPolarHBondContact O-CB 3.17Å; E73-S77 PolarHBondContact O-N 3.3Å; E73-S77 PolarHBondContact O-OG 3.02Å; E74-S77 WeakPolarHBondContact CA-OG 3.45Å; E74-S77 PolarHBondContact O-N 2.91Å; E74-S77 PolarHBondContact O-OG 2.88Å; E74-S77 VanDerWaalsContact O-OG 3.12Å; L75-S77 VanDerWaalsContact C-N 3.33Å; L75-S77 PolarHBondContact O-N 2.7Å
78	S	86.6	Confident	93	Very high	50 Å²	50	64 Å²	64	35%	0.35	38%	0.376	S	S	.	.	H	α-helix	trans	-95.8	-29.5	-177	63.5	0	0	0	0	113.7	E74 A80 N242	E74-S78 VanDerWaalsContact O-CB 3.26Å; E74-S78 WeakPolarHBondContact O-CB 3.28Å; E74-S78 PolarHBondContact O-N 2.79Å; E74-S78 PolarHBondContact O-OG 2.89Å; S78-A80 PolarHBondContact O-N 3.47Å; S78-N242 PolarHBondContact O-ND2 2.96Å; S78-N242 PolarHBondContact O-OD1 3.32Å
79	T	92.1	Very high	93.1	Very high	38 Å²	38	61.1 Å²	61.1	23%	0.233	35%	0.345	C	S	.	.			trans	-80.6	124.8	-173.3	-51.9	0	0	0	0	111.4	L75 Y98	L75-T79 WeakPolarHBondContact CD1-OG1 3.26Å; L75-T79 WeakPolarHBondContact O-CB 3.48Å; L75-T79 PolarHBondContact O-N 3.46Å; L75-T79 PolarHBondContact O-OG1 3.19Å; T79-Y98 HydrophobicContact CG2-CD1 3.79Å
80	A	94.1	Very high	93.1	Very high	34 Å²	34	59.2 Å²	59.2	28%	0.281	33%	0.327	S	S	.	.			trans	-106	147.3	168.5	0	0	0	0	0	110.1	S78 T99	S78-A80 PolarHBondContact O-N 3.47Å; A80-T99 HydrophobicContact CB-CG2 3.95Å; A80-T99 PolarHBondContact N-OG1 3.27Å; A80-T99 PolarHBondContact O-N 2.77Å; A80-T99 PolarHBondContact O-OG1 3.41Å
81	I	96	Very high	93.2	Very high	76 Å²	76	61.4 Å²	61.4	39%	0.39	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	121	174.6	-51.6	169.6	0	0	0	107.7	S95 Y98	I81-S95 WeakPolarHBondContact CG2-O 3.31Å; I81-Y98 HydrophobicContact CD1-CD1 4.37Å; I81-Y98 HydrophobicContact CD1-CE1 3.6Å; I81-Y98 HydrophobicContact CD1-CE2 4.15Å; I81-Y98 VanDerWaalsContact CD1-CZ 3.46Å; I81-Y98 WeakPolarHBondContact CD1-OH 3.47Å; I81-Y98 HydrophobicContact CG1-CD1 3.9Å; I81-Y98 HydrophobicContact CG1-CD2 4.35Å; I81-Y98 HydrophobicContact CG1-CE1 3.64Å; I81-Y98 HydrophobicContact CG1-CE2 4.11Å; I81-Y98 HydrophobicContact CG1-CG 4.24Å; I81-Y98 HydrophobicContact CG2-CD2 4.21Å; I81-Y98 HydrophobicContact CG2-CE2 3.99Å
82	L	97.3	Very high	93.5	Very high	10 Å²	10	56.5 Å²	56.5	5%	0.052	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	115.9	178.6	-50	-178	0	0	0	108.8	G96 L97 T99 I124 L128 K201 A202 A244	L82-G96 CarbonylContact O-C 3.56Å; L82-G96 WeakPolarHBondContact O-CA 3.47Å; L82-L97 HydrophobicContact CB-CB 4.47Å; L82-L97 PolarHBondContact N-O 2.98Å; L82-L97 PolarHBondContact O-N 3Å; L82-T99 HydrophobicContact CD1-CG2 4.49Å; L82-T99 HydrophobicContact CG-CG2 4.44Å; L82-I124 HydrophobicContact CB-CD1 4.33Å; L82-I124 HydrophobicContact CB-CG1 4.49Å; L82-I124 HydrophobicContact CD1-CD1 3.95Å; L82-L128 HydrophobicContact CB-CD1 4.27Å; L82-L128 HydrophobicContact CD2-CD1 4.02Å; L82-K201 HydrophobicContact CD1-CB 4.01Å; L82-K201 WeakPolarHBondContact CD1-O 3.36Å; L82-K201 HydrophobicContact CD2-CB 4.44Å; L82-A202 HydrophobicContact CD1-CB 4.2Å; L82-A244 HydrophobicContact CD1-CB 3.75Å; L82-A244 HydrophobicContact CG-CB 4.41Å
83	S	97.1	Very high	93.7	Very high	32 Å²	32	50.3 Å²	50.3	22%	0.224	28%	0.283	C	S	.	.			trans	-56.1	143.1	171.5	169.7	0	0	0	0	110.4	G85 D90 H123	S83-G85 PolarHBondContact O-N 3.39Å; S83-G85 PolarHBondContact OG-N 3.2Å; S83-D90 WeakPolarHBondContact CB-OD2 3.27Å; S83-D90 PolarHBondContact OG-OD2 3.18Å; S83-H123 PolarHBondContact O-CD2 3.27Å; S83-H123 VanDerWaalsContact O-CD2 3.25Å; S83-H123 PolarHBondContact OG-NE2 3.24Å
84	T	96.6	Very high	93.8	Very high	3 Å²	3	47.3 Å²	47.3	2%	0.018	27%	0.271	C	S	.	.			trans	-77	-8.6	172.1	63.9	0	0	0	0	112.6	N86 L89 D90 L93 L97 V120 W311	T84-N86 PolarHBondContact O-N 3.4Å; T84-N86 PolarHBondContact OG1-N 2.59Å; T84-N86 PolarHBondContact OG1-O 3.36Å; T84-L89 HydrophobicContact CG2-CB 4.37Å; T84-L89 WeakPolarHBondContact OG1-CB 3.29Å; T84-D90 VanDerWaalsContact CB-OD1 3.3Å; T84-D90 WeakPolarHBondContact CB-OD1 3.42Å; T84-D90 WeakPolarHBondContact CG2-OD1 3.4Å; T84-D90 PolarHBondContact N-OD1 2.88Å; T84-D90 PolarHBondContact OG1-OD1 2.77Å; T84-L93 HydrophobicContact CG2-CD1 3.76Å; T84-L97 HydrophobicContact CG2-CD1 4.45Å; T84-L97 HydrophobicContact CG2-CD2 4.45Å; T84-L97 HydrophobicContact CG2-CG 4.04Å; T84-V120 HydrophobicContact CG2-CG2 4.17Å; T84-W311 PolarHBondContact O-NE1 2.86Å
85	G	93.9	Very high	94	Very high	12 Å²	12	45.6 Å²	45.6	12%	0.124	27%	0.271	C	S	.	.	S	Bend	trans	76.2	-0.9	-169.9	0	0	0	0	0	113.9	S83 H123 W310	S83-G85 PolarHBondContact O-N 3.39Å; S83-G85 PolarHBondContact OG-N 3.2Å; G85-H123 VanDerWaalsContact CA-CG 3.49Å; G85-H123 WeakPolarHBondContact CA-ND1 3.48Å; G85-W310 VanDerWaalsContact O-CD1 3.24Å; G85-W310 PolarHBondContact O-NE1 2.87Å
86	N	95.2	Very high	94.4	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.011	25%	0.252	C	S	.	.			trans	-118.1	115.8	175.3	-179	-78.9	0	0	0	110.5	T84 S88 L89 D90 W310 W311	T84-N86 PolarHBondContact O-N 3.4Å; T84-N86 PolarHBondContact OG1-N 2.59Å; T84-N86 PolarHBondContact OG1-O 3.36Å; N86-S88 VanDerWaalsContact C-N 3.31Å; N86-S88 PolarHBondContact O-N 2.9Å; N86-S88 WeakPolarHBondContact OD1-CB 3.46Å; N86-S88 PolarHBondContact OD1-N 3.25Å; N86-S88 VanDerWaalsContact OD1-N 3.1Å; N86-L89 HydrophobicContact CB-CB 4.18Å; N86-L89 HydrophobicContact CB-CD1 4.16Å; N86-L89 HydrophobicContact CB-CG 4.25Å; N86-L89 PolarHBondContact O-N 3.43Å; N86-L89 VanDerWaalsContact O-N 3.16Å; N86-L89 PolarHBondContact OD1-N 3.01Å; N86-D90 PolarHBondContact O-N 3.14Å; N86-W310 WeakPolarHBondContact ND2-CB 3.34Å; N86-W310 VanDerWaalsContact ND2-CG 3.25Å; N86-W311 HydrophobicContact CB-CH2 3.98Å; N86-W311 HydrophobicContact CB-CZ2 3.53Å
87	P	94.9	Very high	94.8	Very high	73 Å²	73	36.9 Å²	36.9	47%	0.474	23%	0.226	S	C	.	.	H	α-helix	trans	-59.2	-35.7	-175.6	-27.1	34.9	0	0	0	114.7	D90 K91 W310	P87-D90 PolarHBondContact O-N 2.77Å; P87-K91 VanDerWaalsContact O-CB 3.28Å; P87-K91 WeakPolarHBondContact O-CB 3.17Å; P87-K91 PolarHBondContact O-N 3.25Å; P87-W310 VanDerWaalsContact CD-CE2 3.44Å; P87-W310 HydrophobicContact CG-CH2 4.14Å; P87-W310 HydrophobicContact CG-CZ2 3.59Å
88	S	95.4	Very high	95.2	Very high	32 Å²	32	33.3 Å²	33.3	22%	0.224	20%	0.197	C	C	.	.	H	α-helix	trans	-67.5	-42.3	178.3	-57.7	0	0	0	0	111.5	N86 L92 D305	N86-S88 VanDerWaalsContact C-N 3.31Å; N86-S88 PolarHBondContact O-N 2.9Å; N86-S88 WeakPolarHBondContact OD1-CB 3.46Å; N86-S88 PolarHBondContact OD1-N 3.25Å; N86-S88 VanDerWaalsContact OD1-N 3.1Å; S88-L92 WeakPolarHBondContact O-CB 3.38Å; S88-L92 PolarHBondContact O-N 2.86Å; S88-D305 PolarHBondContact OG-O 2.98Å
89	L	96.1	Very high	95.7	Very high	2 Å²	2	31 Å²	31	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-68.3	-39.8	174.9	-69.7	-178.8	0	0	0	111.7	T84 N86 K91 L92 L93 V116 A290 F306 W311	T84-L89 HydrophobicContact CG2-CB 4.37Å; T84-L89 WeakPolarHBondContact OG1-CB 3.29Å; N86-L89 HydrophobicContact CB-CB 4.18Å; N86-L89 HydrophobicContact CB-CD1 4.16Å; N86-L89 HydrophobicContact CB-CG 4.25Å; N86-L89 PolarHBondContact O-N 3.43Å; N86-L89 VanDerWaalsContact O-N 3.16Å; N86-L89 PolarHBondContact OD1-N 3.01Å; L89-K91 VanDerWaalsContact C-N 3.35Å; L89-L92 PolarHBondContact O-N 2.91Å; L89-L93 VanDerWaalsContact O-CB 3.26Å; L89-L93 WeakPolarHBondContact O-CB 3.14Å; L89-L93 WeakPolarHBondContact O-CG 3.39Å; L89-L93 PolarHBondContact O-N 2.78Å; L89-V116 HydrophobicContact CD1-CG1 3.79Å; L89-V116 HydrophobicContact CD1-CG2 4.34Å; L89-A290 HydrophobicContact CD2-CB 3.82Å; L89-F306 HydrophobicContact CD1-CD2 4.34Å; L89-F306 HydrophobicContact CD1-CE2 4.06Å; L89-F306 HydrophobicContact CD1-CZ 4.31Å; L89-F306 HydrophobicContact CD2-CD1 4.05Å; L89-F306 HydrophobicContact CD2-CE1 3.91Å; L89-F306 HydrophobicContact CD2-CG 4.48Å; L89-F306 HydrophobicContact CD2-CZ 4.15Å; L89-F306 HydrophobicContact CG-CD1 4.43Å; L89-F306 HydrophobicContact CG-CD2 4.37Å; L89-F306 HydrophobicContact CG-CE2 4.42Å; L89-F306 HydrophobicContact CG-CG 4.37Å; L89-W311 HydrophobicContact CD1-CH2 3.7Å; L89-W311 HydrophobicContact CD1-CZ2 4.01Å
90	D	96.6	Very high	95.8	Very high	21 Å²	21	30.2 Å²	30.2	11%	0.112	18%	0.18	C	C	.	.	H	α-helix	trans	-63.4	-42.6	176	-69.5	-15.3	0	0	0	111.1	S83 T84 N86 P87 L92 L93 D94 S95	S83-D90 WeakPolarHBondContact CB-OD2 3.27Å; S83-D90 PolarHBondContact OG-OD2 3.18Å; T84-D90 VanDerWaalsContact CB-OD1 3.3Å; T84-D90 WeakPolarHBondContact CB-OD1 3.42Å; T84-D90 WeakPolarHBondContact CG2-OD1 3.4Å; T84-D90 PolarHBondContact N-OD1 2.88Å; T84-D90 PolarHBondContact OG1-OD1 2.77Å; N86-D90 PolarHBondContact O-N 3.14Å; P87-D90 PolarHBondContact O-N 2.77Å; D90-L92 VanDerWaalsContact C-N 3.34Å; D90-L92 PolarHBondContact O-N 3.36Å; D90-L93 CarbonylContact O-C 3.57Å; D90-L93 PolarHBondContact O-N 2.79Å; D90-D94 PolarHBondContact O-N 3.29Å; D90-S95 WeakPolarHBondContact O-CA 3.29Å; D90-S95 PolarHBondContact O-N 3.33Å
91	K	95.4	Very high	95.9	Very high	132 Å²	132	29.3 Å²	29.3	57%	0.574	17%	0.17	S	C	*	.	H	α-helix	trans	-58.5	-46.1	172.8	-176.4	-174.5	174.7	-154.6	0	111.5	P87 L89 L93 D94 Q298 E304	P87-K91 VanDerWaalsContact O-CB 3.28Å; P87-K91 WeakPolarHBondContact O-CB 3.17Å; P87-K91 PolarHBondContact O-N 3.25Å; L89-K91 VanDerWaalsContact C-N 3.35Å; K91-L93 VanDerWaalsContact C-N 3.28Å; K91-L93 PolarHBondContact O-N 2.97Å; K91-D94 PolarHBondContact O-N 3.4Å; K91-Q298 PolarHBondContact O-NE2 3.01Å; K91-E304 WeakPolarHBondContact CD-OE1 3.49Å; K91-E304 VanDerWaalsContact CE-OE1 3.24Å; K91-E304 WeakPolarHBondContact CE-OE1 3.36Å; K91-E304 IonicContact NZ-OE1 3.55Å; K91-E304 PolarHBondContact NZ-OE1 2.85Å; K91-E304 IonicContact NZ-OE2 3.73Å
92	L	95.7	Very high	96	Very high	1 Å²	1	26 Å²	26	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-64.2	-32.4	178	-170.2	69.5	0	0	0	112.8	S88 L89 D90 I275 A290 L292 Q298 I302 E304	S88-L92 WeakPolarHBondContact O-CB 3.38Å; S88-L92 PolarHBondContact O-N 2.86Å; L89-L92 PolarHBondContact O-N 2.91Å; D90-L92 VanDerWaalsContact C-N 3.34Å; D90-L92 PolarHBondContact O-N 3.36Å; L92-I275 HydrophobicContact CD2-CD1 4.14Å; L92-I275 HydrophobicContact CD2-CG1 4.19Å; L92-I275 HydrophobicContact CD2-CG2 4.24Å; L92-A290 HydrophobicContact CD2-CB 3.52Å; L92-L292 HydrophobicContact CD1-CB 3.87Å; L92-L292 HydrophobicContact CG-CB 4.19Å; L92-Q298 PolarHBondContact O-NE2 3.17Å; L92-I302 HydrophobicContact CD1-CB 4.18Å; L92-I302 HydrophobicContact CD1-CG2 3.94Å; L92-E304 HydrophobicContact CB-CB 4.32Å; L92-E304 HydrophobicContact CB-CG 4.06Å; L92-E304 HydrophobicContact CD1-CB 4.39Å; L92-E304 HydrophobicContact CD1-CG 4.03Å
93	L	95.6	Very high	96	Very high	10 Å²	10	25.6 Å²	25.6	5%	0.052	15%	0.151	C	C	.	.	H	α-helix	trans	-95.2	4.3	-175.1	-74.8	171.5	0	0	0	114.6	T84 L89 D90 K91 G96 L97 T103 T273 I275	T84-L93 HydrophobicContact CG2-CD1 3.76Å; L89-L93 VanDerWaalsContact O-CB 3.26Å; L89-L93 WeakPolarHBondContact O-CB 3.14Å; L89-L93 WeakPolarHBondContact O-CG 3.39Å; L89-L93 PolarHBondContact O-N 2.78Å; D90-L93 CarbonylContact O-C 3.57Å; D90-L93 PolarHBondContact O-N 2.79Å; K91-L93 VanDerWaalsContact C-N 3.28Å; K91-L93 PolarHBondContact O-N 2.97Å; L93-G96 WeakPolarHBondContact CB-O 3.36Å; L93-L97 HydrophobicContact CD1-CD2 3.85Å; L93-T103 HydrophobicContact CD2-CG2 4.12Å; L93-T273 HydrophobicContact CD2-CG2 3.67Å; L93-I275 HydrophobicContact CD1-CD1 4.05Å; L93-I275 HydrophobicContact CD2-CD1 3.52Å; L93-I275 HydrophobicContact CD2-CG1 4.29Å; L93-I275 HydrophobicContact CG-CD1 3.8Å
94	D	94.5	Very high	96.1	Very high	63 Å²	63	24 Å²	24	34%	0.337	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.7	56.9	-175.6	-160.2	23	0	0	0	111.9	D90 K91 Y98 Q298	D90-D94 PolarHBondContact O-N 3.29Å; K91-D94 PolarHBondContact O-N 3.4Å; D94-Y98 HydrophobicContact CB-CE2 4.48Å; D94-Y98 WeakPolarHBondContact O-CE2 3.45Å; D94-Y98 PolarHBondContact O-OH 3.16Å; D94-Y98 PolarHBondContact OD2-OH 2.82Å; D94-Q298 HydrophobicContact CB-CG 4.04Å; D94-Q298 VanDerWaalsContact CB-NE2 3.32Å
95	S	94.6	Very high	96.2	Very high	76 Å²	76	24.1 Å²	24.1	53%	0.531	14%	0.141	S	C	.	.	S	Bend	trans	84.9	-1.3	-179.3	-44.1	0	0	0	0	116.7	I81 D90	I81-S95 WeakPolarHBondContact CG2-O 3.31Å; D90-S95 WeakPolarHBondContact O-CA 3.29Å; D90-S95 PolarHBondContact O-N 3.33Å
96	G	96.6	Very high	96.4	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.01	14%	0.135	C	C	.	.	S	Bend	trans	133.7	-152.3	170.7	0	0	0	0	0	114.9	L82 L93 Y98	L82-G96 CarbonylContact O-C 3.56Å; L82-G96 WeakPolarHBondContact O-CA 3.47Å; L93-G96 WeakPolarHBondContact CB-O 3.36Å; G96-Y98 WeakPolarHBondContact O-CD2 3.22Å
97	L	97.8	Very high	96.4	Very high	5 Å²	5	23.5 Å²	23.5	3%	0.026	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	120.6	-177.4	-57.7	175.4	0	0	0	111	L82 T84 L93 T103 V120 A244 L246	L82-L97 HydrophobicContact CB-CB 4.47Å; L82-L97 PolarHBondContact N-O 2.98Å; L82-L97 PolarHBondContact O-N 3Å; T84-L97 HydrophobicContact CG2-CD1 4.45Å; T84-L97 HydrophobicContact CG2-CD2 4.45Å; T84-L97 HydrophobicContact CG2-CG 4.04Å; L93-L97 HydrophobicContact CD1-CD2 3.85Å; L97-T103 HydrophobicContact CD2-CG2 3.83Å; L97-V120 HydrophobicContact CD1-CG1 3.7Å; L97-A244 HydrophobicContact CB-CB 4.04Å; L97-L246 HydrophobicContact CD1-CB 4.47Å; L97-L246 HydrophobicContact CD1-CD2 4.31Å; L97-L246 HydrophobicContact CD2-CD1 4.19Å
98	Y	96.8	Very high	96.4	Very high	27 Å²	27	21 Å²	21	11%	0.106	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	132.8	-179.3	-72.9	-116.5	0	0	0	110.1	T79 I81 D94 G96 R297	T79-Y98 HydrophobicContact CG2-CD1 3.79Å; I81-Y98 HydrophobicContact CD1-CD1 4.37Å; I81-Y98 HydrophobicContact CD1-CE1 3.6Å; I81-Y98 HydrophobicContact CD1-CE2 4.15Å; I81-Y98 VanDerWaalsContact CD1-CZ 3.46Å; I81-Y98 WeakPolarHBondContact CD1-OH 3.47Å; I81-Y98 HydrophobicContact CG1-CD1 3.9Å; I81-Y98 HydrophobicContact CG1-CD2 4.35Å; I81-Y98 HydrophobicContact CG1-CE1 3.64Å; I81-Y98 HydrophobicContact CG1-CE2 4.11Å; I81-Y98 HydrophobicContact CG1-CG 4.24Å; I81-Y98 HydrophobicContact CG2-CD2 4.21Å; I81-Y98 HydrophobicContact CG2-CE2 3.99Å; D94-Y98 HydrophobicContact CB-CE2 4.48Å; D94-Y98 WeakPolarHBondContact O-CE2 3.45Å; D94-Y98 PolarHBondContact O-OH 3.16Å; D94-Y98 PolarHBondContact OD2-OH 2.82Å; G96-Y98 WeakPolarHBondContact O-CD2 3.22Å; Y98-R297 VanDerWaalsContact CD2-NH2 3.34Å
99	T	96.4	Very high	96.2	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.012	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	156.3	168	62.4	0	0	0	0	110.6	A80 L82 E101 N242 A244	A80-T99 HydrophobicContact CB-CG2 3.95Å; A80-T99 PolarHBondContact N-OG1 3.27Å; A80-T99 PolarHBondContact O-N 2.77Å; A80-T99 PolarHBondContact O-OG1 3.41Å; L82-T99 HydrophobicContact CD1-CG2 4.49Å; L82-T99 HydrophobicContact CG-CG2 4.44Å; T99-E101 PolarHBondContact O-N 3.24Å; T99-N242 WeakPolarHBondContact CB-O 3.31Å; T99-N242 WeakPolarHBondContact CB-OD1 3.32Å; T99-N242 WeakPolarHBondContact CG2-O 3.47Å; T99-N242 PolarHBondContact OG1-OD1 3.28Å; T99-A244 HydrophobicContact CG2-CB 4.26Å
100	G	95.2	Very high	95.9	Very high	20 Å²	20	26.6 Å²	26.6	21%	0.206	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.5	-4.8	-175.5	0	0	0	0	0	114.1	A238 K239 V243	G100-A238 WeakPolarHBondContact CA-O 3.44Å; G100-A238 PolarHBondContact N-O 3.05Å; G100-K239 WeakPolarHBondContact O-CG 3.37Å; G100-V243 PolarHBondContact N-O 2.9Å; G100-V243 VanDerWaalsContact N-O 3.13Å
101	E	95.6	Very high	95.8	Very high	16 Å²	16	25.8 Å²	25.8	8%	0.075	16%	0.161	C	C	.	.	S	Bend	trans	-136.3	161.2	-170.4	-57.3	-177.9	176.5	0	0	113.9	T99 V245 R272 R297	T99-E101 PolarHBondContact O-N 3.24Å; E101-V245 PolarHBondContact O-N 3.34Å; E101-R272 HydrophobicContact CB-CB 4.35Å; E101-R272 VanDerWaalsContact CD-CD 3.4Å; E101-R272 WeakPolarHBondContact OE1-CD 3.43Å; E101-R272 IonicContact OE1-CZ 2.79Å; E101-R272 IonicContact OE1-NE 3.24Å; E101-R272 PolarHBondContact OE1-NE 3.45Å; E101-R272 IonicContact OE1-NH1 3.98Å; E101-R272 PolarHBondContact OE1-NH1 3.34Å; E101-R272 WeakPolarHBondContact OE2-CD 3.32Å; E101-R272 IonicContact OE2-NE 3.78Å; E101-R297 IonicContact OE1-CZ 2.77Å; E101-R297 IonicContact OE1-NH1 3.91Å; E101-R297 PolarHBondContact OE1-NH1 2.89Å; E101-R297 IonicContact OE2-CZ 3.62Å; E101-R297 VanDerWaalsContact OE2-CZ 3.24Å; E101-R297 IonicContact OE2-NH1 2.67Å; E101-R297 PolarHBondContact OE2-NH1 2.92Å; E101-R297 IonicContact OE2-NH2 2.61Å; E101-R297 PolarHBondContact OE2-NH2 3.05Å
102	I	98.3	Very high	95.7	Very high	5 Å²	5	20 Å²	20	3%	0.026	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	124.7	173.8	-56.1	169.3	0	0	0	109	L234 K235 A238 V245 V247 V270 P271 R272 T273	I102-L234 HydrophobicContact CD1-CB 3.79Å; I102-K235 HydrophobicContact CD1-CB 4.45Å; I102-K235 HydrophobicContact CD1-CG 3.64Å; I102-A238 HydrophobicContact CG1-CB 4.31Å; I102-V245 CarbonylContact C-O 3.52Å; I102-V245 WeakPolarHBondContact CA-O 3.12Å; I102-V245 HydrophobicContact CB-CB 4.39Å; I102-V245 HydrophobicContact CG1-CB 3.93Å; I102-V245 HydrophobicContact CG1-CG1 4.04Å; I102-V245 HydrophobicContact CG2-CG1 4.2Å; I102-V247 HydrophobicContact CG2-CG1 4.24Å; I102-V247 HydrophobicContact CG2-CG2 3.89Å; I102-V270 HydrophobicContact CD1-CG1 3.94Å; I102-P271 HydrophobicContact CG2-CB 4.07Å; I102-P271 HydrophobicContact CG2-CG 4.29Å; I102-P271 CarbonylContact O-C 3.53Å; I102-P271 WeakPolarHBondContact O-CA 3.07Å; I102-R272 PolarHBondContact O-N 2.92Å; I102-T273 PolarHBondContact O-N 3.29Å
103	T	98.5	Very high	95.8	Very high	2 Å²	2	20.4 Å²	20.4	1%	0.012	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	131.8	169.2	-59.6	0	0	0	0	109.5	L93 L97 V245 L246 V247 T273	L93-T103 HydrophobicContact CD2-CG2 4.12Å; L97-T103 HydrophobicContact CD2-CG2 3.83Å; T103-V245 PolarHBondContact N-O 2.93Å; T103-L246 HydrophobicContact CG2-CD1 4.08Å; T103-L246 WeakPolarHBondContact O-CA 3.47Å; T103-V247 PolarHBondContact O-N 3.19Å; T103-T273 WeakPolarHBondContact CA-O 3.4Å; T103-T273 HydrophobicContact CG2-CG2 4.36Å
104	E	98.6	Very high	95.8	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	127.8	-180	173.3	-179.5	-130.3	0	0	111.8	T106 V247 N249 W267 P271 T273 R274 I275	E104-T106 WeakPolarHBondContact CG-OG1 3.34Å; E104-V247 CarbonylContact C-O 3.54Å; E104-V247 WeakPolarHBondContact CA-O 3.45Å; E104-V247 HydrophobicContact CB-CG2 3.76Å; E104-V247 HydrophobicContact CG-CG2 4.11Å; E104-N249 HydrophobicContact CG-CB 4.12Å; E104-N249 VanDerWaalsContact OE1-CB 3.27Å; E104-N249 WeakPolarHBondContact OE1-CB 3.27Å; E104-N249 PolarHBondContact OE1-ND2 2.95Å; E104-W267 VanDerWaalsContact OE1-CD1 3.24Å; E104-W267 PolarHBondContact OE1-NE1 3.39Å; E104-P271 HydrophobicContact CB-CB 3.7Å; E104-P271 HydrophobicContact CB-CG 3.56Å; E104-P271 HydrophobicContact CG-CG 4.28Å; E104-P271 WeakPolarHBondContact OE2-CG 3.45Å; E104-T273 PolarHBondContact N-O 3.2Å; E104-R274 HydrophobicContact CB-CG 4.22Å; E104-R274 CarbonylContact O-C 3.51Å; E104-R274 WeakPolarHBondContact O-CA 3.42Å; E104-R274 IonicContact OE1-NH2 3.96Å; E104-R274 WeakPolarHBondContact OE2-CD 3.34Å; E104-R274 WeakPolarHBondContact OE2-CG 3.4Å; E104-R274 IonicContact OE2-CZ 3.04Å; E104-R274 IonicContact OE2-NE 3.18Å; E104-R274 PolarHBondContact OE2-NE 2.99Å; E104-R274 IonicContact OE2-NH1 3.81Å; E104-R274 IonicContact OE2-NH2 2.75Å; E104-R274 PolarHBondContact OE2-NH2 3.36Å; E104-I275 PolarHBondContact O-N 2.79Å
105	L	98.3	Very high	95.9	Very high	5 Å²	5	21.3 Å²	21.3	3%	0.026	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	111.1	167.6	-56.8	-179.5	0	0	0	109.4	V116 L246 V247 T248 N249 I275 L277	L105-V116 HydrophobicContact CD1-CB 3.9Å; L105-V116 HydrophobicContact CD1-CG1 3.59Å; L105-L246 HydrophobicContact CD1-CD1 4.02Å; L105-L246 HydrophobicContact CD1-CD2 4.26Å; L105-L246 HydrophobicContact CD1-CG 4.42Å; L105-L246 HydrophobicContact CD2-CD1 4.38Å; L105-L246 HydrophobicContact CG-CD1 3.79Å; L105-V247 PolarHBondContact N-O 3.17Å; L105-T248 HydrophobicContact CB-CG2 4.4Å; L105-T248 CarbonylContact O-C 3.6Å; L105-T248 VanDerWaalsContact O-CA 3.3Å; L105-T248 WeakPolarHBondContact O-CA 3.48Å; L105-N249 PolarHBondContact O-N 2.99Å; L105-I275 HydrophobicContact CD2-CB 3.93Å; L105-I275 HydrophobicContact CD2-CD1 3.9Å; L105-I275 HydrophobicContact CD2-CG1 4.42Å; L105-I275 HydrophobicContact CD2-CG2 4.44Å; L105-L277 HydrophobicContact CB-CD1 4.41Å
106	T	97.6	Very high	96	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	144	177.4	-48.7	0	0	0	0	109.8	E104 N249 V251 P261 I275 L276 L277	E104-T106 WeakPolarHBondContact CG-OG1 3.34Å; T106-N249 WeakPolarHBondContact CA-O 3.32Å; T106-N249 HydrophobicContact CG2-CB 4.35Å; T106-V251 HydrophobicContact CG2-CG1 3.5Å; T106-V251 VanDerWaalsContact CG2-CG1 3.5Å; T106-P261 HydrophobicContact CG2-CB 3.71Å; T106-P261 HydrophobicContact CG2-CG 3.93Å; T106-I275 PolarHBondContact N-O 3.34Å; T106-L276 CarbonylContact O-C 3.48Å; T106-L276 WeakPolarHBondContact O-CA 3.06Å; T106-L277 PolarHBondContact O-N 2.96Å
107	G	96.7	Very high	96.1	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.4	165	172.5	0	0	0	0	0	113.3	K113 N249	G107-K113 PolarHBondContact O-NZ 2.86Å; G107-N249 PolarHBondContact N-O 3.35Å; G107-N249 VanDerWaalsContact N-O 3.16Å
108	G	94.3	Very high	96.1	Very high	20 Å²	20	17.9 Å²	17.9	21%	0.206	12%	0.121	C	C	.	.			trans	-62.9	168.6	176.3	0	0	0	0	0	113.6	G110 S111 K113	G108-G110 PolarHBondContact O-N 3.23Å; G108-S111 WeakPolarHBondContact O-CB 3.37Å; G108-S111 PolarHBondContact O-N 3.29Å; G108-S111 PolarHBondContact O-OG 3.36Å; G108-K113 PolarHBondContact O-NZ 3.13Å
109	P	91.2	Very high	96.1	Very high	112 Å²	112	16.6 Å²	16.6	73%	0.727	12%	0.116	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52	135.1	169	-25.7	35.4	0	0	0	111.3	S111	P109-S111 PolarHBondContact O-N 3.13Å
110	G	90.1	Very high	96.1	Very high	41 Å²	41	16.6 Å²	16.6	42%	0.423	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	10.8	178.8	0	0	0	0	0	115.9	G108 G112 R279 R288	G108-G110 PolarHBondContact O-N 3.23Å; G110-G112 PolarHBondContact O-N 2.94Å; G110-R279 PolarHBondContact O-NE 3.46Å; G110-R279 PolarHBondContact O-NH2 2.86Å; G110-R288 PolarHBondContact O-NH2 3.17Å
111	S	93.6	Very high	96.3	Very high	4 Å²	4	15.6 Å²	15.6	3%	0.028	11%	0.106	C	C	.	.	S	Bend	trans	-70	-13.8	173.3	68.6	0	0	0	0	113.7	G108 P109 L277 R288	G108-S111 WeakPolarHBondContact O-CB 3.37Å; G108-S111 PolarHBondContact O-N 3.29Å; G108-S111 PolarHBondContact O-OG 3.36Å; P109-S111 PolarHBondContact O-N 3.13Å; S111-L277 VanDerWaalsContact CB-O 3.27Å; S111-L277 WeakPolarHBondContact CB-O 3.36Å; S111-R288 WeakPolarHBondContact O-CD 3.34Å; S111-R288 WeakPolarHBondContact O-CG 3.45Å; S111-R288 PolarHBondContact O-NE 3.12Å
112	G	94.3	Very high	96.3	Very high	9 Å²	9	15 Å²	15	9%	0.093	10%	0.104	C	C	.	.	S	Bend	trans	105.4	5.8	174.7	0	0	0	0	0	115.8	G110 S114 Q115 V116	G110-G112 PolarHBondContact O-N 2.94Å; G112-S114 PolarHBondContact O-N 3.29Å; G112-Q115 WeakPolarHBondContact O-CA 3.32Å; G112-Q115 WeakPolarHBondContact O-CB 3.39Å; G112-Q115 PolarHBondContact O-N 2.96Å; G112-V116 PolarHBondContact O-N 3.42Å
113	K	96.6	Very high	96.3	Very high	11 Å²	11	16.2 Å²	16.2	5%	0.048	11%	0.109	C	C	.	.	H	α-helix	trans	-45.7	-54.3	179	-57.2	-176.8	-61.4	-75.8	0	113.5	G107 G108 Q115 V116 C117 T248 N249 L277	G107-K113 PolarHBondContact O-NZ 2.86Å; G108-K113 PolarHBondContact O-NZ 3.13Å; K113-Q115 VanDerWaalsContact C-N 3.32Å; K113-Q115 PolarHBondContact O-N 3.46Å; K113-V116 PolarHBondContact O-N 2.93Å; K113-C117 PolarHBondContact O-N 2.89Å; K113-C117 PolarHBondContact O-SG 3.38Å; K113-T248 HydrophobicContact CB-CG2 3.96Å; K113-N249 WeakPolarHBondContact CD-O 3.45Å; K113-N249 WeakPolarHBondContact CE-O 3.4Å; K113-L277 HydrophobicContact CG-CD1 4.14Å
114	S	96.6	Very high	96.2	Very high	37 Å²	37	16.1 Å²	16.1	26%	0.259	11%	0.109	S	C	.	.	H	α-helix	trans	-64.6	-35	179.4	-49.7	0	0	0	0	112.6	G112 C117 F118 D206	G112-S114 PolarHBondContact O-N 3.29Å; S114-C117 WeakPolarHBondContact O-CB 3.47Å; S114-C117 PolarHBondContact O-N 3.26Å; S114-F118 WeakPolarHBondContact O-CD1 3.42Å; S114-F118 WeakPolarHBondContact O-CD2 3.21Å; S114-F118 WeakPolarHBondContact O-CG 3.48Å; S114-F118 PolarHBondContact O-N 3.39Å; S114-D206 WeakPolarHBondContact CA-OD2 3.38Å; S114-D206 WeakPolarHBondContact CB-OD2 3.42Å; S114-D206 PolarHBondContact OG-OD1 3.01Å; S114-D206 PolarHBondContact OG-OD2 3.3Å
115	Q	95.5	Very high	96	Very high	55 Å²	55	16.1 Å²	16.1	26%	0.257	11%	0.109	S	C	.	.	H	α-helix	trans	-66.9	-39.5	176.3	-67.7	-60.5	-52.5	0	0	111.8	G112 K113 C117 F118 G119 R145 L308	G112-Q115 WeakPolarHBondContact O-CA 3.32Å; G112-Q115 WeakPolarHBondContact O-CB 3.39Å; G112-Q115 PolarHBondContact O-N 2.96Å; K113-Q115 VanDerWaalsContact C-N 3.32Å; K113-Q115 PolarHBondContact O-N 3.46Å; Q115-C117 VanDerWaalsContact C-N 3.34Å; Q115-F118 PolarHBondContact O-N 3.13Å; Q115-G119 PolarHBondContact O-N 3.42Å; Q115-R145 VanDerWaalsContact OE1-CZ 3.31Å; Q115-L308 HydrophobicContact CB-CD2 4.1Å
116	V	97.3	Very high	95.9	Very high	3 Å²	3	17.1 Å²	17.1	2%	0.018	11%	0.112	C	C	.	.	H	α-helix	trans	-61.6	-45.5	171.4	178.8	0	0	0	0	110	L89 L105 G112 K113 F118 G119 V120 L277 F306 L308 W311	L89-V116 HydrophobicContact CD1-CG1 3.79Å; L89-V116 HydrophobicContact CD1-CG2 4.34Å; L105-V116 HydrophobicContact CD1-CB 3.9Å; L105-V116 HydrophobicContact CD1-CG1 3.59Å; G112-V116 PolarHBondContact O-N 3.42Å; K113-V116 PolarHBondContact O-N 2.93Å; V116-F118 PolarHBondContact O-N 3.41Å; V116-G119 PolarHBondContact O-N 3Å; V116-V120 HydrophobicContact CG1-CG2 4.16Å; V116-V120 WeakPolarHBondContact O-CB 3.16Å; V116-V120 VanDerWaalsContact O-CG2 3.22Å; V116-V120 WeakPolarHBondContact O-CG2 3.26Å; V116-V120 PolarHBondContact O-N 2.86Å; V116-L277 HydrophobicContact CG2-CD1 4.11Å; V116-F306 HydrophobicContact CG2-CE2 3.87Å; V116-F306 HydrophobicContact CG2-CZ 3.94Å; V116-L308 HydrophobicContact CG2-CD2 4.11Å; V116-W311 HydrophobicContact CB-CH2 4.2Å; V116-W311 HydrophobicContact CG1-CH2 4.1Å; V116-W311 HydrophobicContact CG1-CZ2 4.41Å; V116-W311 HydrophobicContact CG2-CH2 3.91Å; V116-W311 HydrophobicContact CG2-CZ3 4.23Å
117	C	98.1	Very high	95.8	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60.1	-43.5	178.2	-67.9	0	0	0	0	112.8	K113 S114 Q115 A121 Y134 I204 T248	K113-C117 PolarHBondContact O-N 2.89Å; K113-C117 PolarHBondContact O-SG 3.38Å; S114-C117 WeakPolarHBondContact O-CB 3.47Å; S114-C117 PolarHBondContact O-N 3.26Å; Q115-C117 VanDerWaalsContact C-N 3.34Å; C117-A121 WeakPolarHBondContact O-CB 3.34Å; C117-A121 PolarHBondContact O-N 2.87Å; C117-Y134 HydrophobicContact CB-CE2 3.88Å; C117-Y134 WeakPolarHBondContact CB-OH 3.49Å; C117-I204 HydrophobicContact CB-CG2 3.87Å; C117-T248 WeakPolarHBondContact SG-CG2 3.25Å
118	F	97.7	Very high	95.6	Very high	6 Å²	6	23.9 Å²	23.9	3%	0.026	15%	0.145	C	C	.	.	H	α-helix	trans	-62.6	-46.3	175.1	-59	-28.1	0	0	0	111.7	S114 Q115 V116 A121 V122 Y134 L141 R145 L146 M149	S114-F118 WeakPolarHBondContact O-CD1 3.42Å; S114-F118 WeakPolarHBondContact O-CD2 3.21Å; S114-F118 WeakPolarHBondContact O-CG 3.48Å; S114-F118 PolarHBondContact O-N 3.39Å; Q115-F118 PolarHBondContact O-N 3.13Å; V116-F118 PolarHBondContact O-N 3.41Å; F118-A121 PolarHBondContact O-N 3.45Å; F118-V122 WeakPolarHBondContact O-CB 3.38Å; F118-V122 WeakPolarHBondContact O-CG2 3.37Å; F118-V122 PolarHBondContact O-N 2.87Å; F118-Y134 AromaticContact CD1-CE2 3.92Å; F118-Y134 HydrophobicContact CD1-CE2 3.92Å; F118-Y134 AromaticContact CD1-CZ 3.92Å; F118-Y134 HydrophobicContact CE1-CE1 4.43Å; F118-Y134 HydrophobicContact CE1-CE2 4.2Å; F118-Y134 AromaticContact CE1-CZ 3.72Å; F118-Y134 WeakPolarHBondContact CE1-OH 3.47Å; F118-L141 HydrophobicContact CD1-CD1 4.29Å; F118-L141 HydrophobicContact CD1-CG 4.47Å; F118-L141 HydrophobicContact CE1-CB 3.87Å; F118-L141 HydrophobicContact CE1-CD1 3.99Å; F118-L141 HydrophobicContact CE1-CG 3.9Å; F118-L141 HydrophobicContact CZ-CB 4.32Å; F118-R145 HydrophobicContact CD2-CG 3.94Å; F118-R145 HydrophobicContact CE2-CG 4.28Å; F118-L146 HydrophobicContact CB-CD2 3.97Å; F118-L146 HydrophobicContact CD1-CD2 4.14Å; F118-L146 HydrophobicContact CG-CD2 4.22Å; F118-M149 HydrophobicContact CB-CE 3.63Å; F118-M149 HydrophobicContact CB-SD 3.71Å
119	G	96.9	Very high	95.6	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.4	-45.1	179.4	0	0	0	0	0	112.7	Q115 V116 V122 H123 W311	Q115-G119 PolarHBondContact O-N 3.42Å; V116-G119 PolarHBondContact O-N 3Å; G119-V122 PolarHBondContact O-N 3.41Å; G119-H123 VanDerWaalsContact O-CB 3.31Å; G119-H123 WeakPolarHBondContact O-CB 3.42Å; G119-H123 PolarHBondContact O-N 2.92Å; G119-W311 VanDerWaalsContact CA-CG 3.43Å
120	V	97.9	Very high	95.7	Very high	2 Å²	2	23.8 Å²	23.8	1%	0.012	13%	0.129	C	C	.	.	H	α-helix	trans	-61.3	-46.8	174.6	171.6	0	0	0	0	111	T84 L97 V116 V122 H123 I124 I204 L246	T84-V120 HydrophobicContact CG2-CG2 4.17Å; L97-V120 HydrophobicContact CD1-CG1 3.7Å; V116-V120 HydrophobicContact CG1-CG2 4.16Å; V116-V120 WeakPolarHBondContact O-CB 3.16Å; V116-V120 VanDerWaalsContact O-CG2 3.22Å; V116-V120 WeakPolarHBondContact O-CG2 3.26Å; V116-V120 PolarHBondContact O-N 2.86Å; V120-V122 PolarHBondContact O-N 2.8Å; V120-H123 PolarHBondContact O-N 2.84Å; V120-I124 HydrophobicContact CG1-CD1 3.63Å; V120-I124 HydrophobicContact CG1-CG1 4.37Å; V120-I124 VanDerWaalsContact O-CG1 3.29Å; V120-I124 WeakPolarHBondContact O-CG1 3.37Å; V120-I124 PolarHBondContact O-N 2.99Å; V120-I204 HydrophobicContact CG1-CD1 4.44Å; V120-L246 HydrophobicContact CB-CD2 4.48Å; V120-L246 HydrophobicContact CG1-CD2 4.36Å; V120-L246 HydrophobicContact CG2-CD2 4.43Å
121	A	97.9	Very high	95.9	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-60	-46.5	179.4	0	0	0	0	0	111.9	C117 F118 A125 V132 Y134 I167 I204	C117-A121 WeakPolarHBondContact O-CB 3.34Å; C117-A121 PolarHBondContact O-N 2.87Å; F118-A121 PolarHBondContact O-N 3.45Å; A121-A125 VanDerWaalsContact O-CB 3.25Å; A121-A125 WeakPolarHBondContact O-CB 3.31Å; A121-A125 PolarHBondContact O-N 3.28Å; A121-V132 HydrophobicContact CB-CG1 4.18Å; A121-Y134 HydrophobicContact CB-CD2 4.27Å; A121-I167 HydrophobicContact CB-CD1 4.32Å; A121-I204 HydrophobicContact CB-CD1 3.78Å
122	V	97.3	Very high	96.1	Very high	3 Å²	3	21.9 Å²	21.9	2%	0.018	11%	0.109	C	C	.	.	H	α-helix	trans	-62.5	-46	177.1	165.4	0	0	0	0	111.1	F118 G119 V120 A125 Y126 L146 M149 L150 I167	F118-V122 WeakPolarHBondContact O-CB 3.38Å; F118-V122 WeakPolarHBondContact O-CG2 3.37Å; F118-V122 PolarHBondContact O-N 2.87Å; G119-V122 PolarHBondContact O-N 3.41Å; V120-V122 PolarHBondContact O-N 2.8Å; V122-A125 PolarHBondContact O-N 3.41Å; V122-Y126 VanDerWaalsContact O-CB 3.27Å; V122-Y126 WeakPolarHBondContact O-CB 3.21Å; V122-Y126 PolarHBondContact O-N 2.81Å; V122-L146 HydrophobicContact CG2-CB 4.25Å; V122-L146 HydrophobicContact CG2-CD2 3.97Å; V122-M149 HydrophobicContact CB-CB 4.48Å; V122-M149 HydrophobicContact CG1-CB 4.15Å; V122-M149 HydrophobicContact CG2-CB 4.14Å; V122-M149 HydrophobicContact CG2-SD 4.23Å; V122-L150 HydrophobicContact CG1-CD2 3.65Å; V122-L150 HydrophobicContact CG1-CG 3.79Å; V122-L150 HydrophobicContact CG2-CG 4.36Å; V122-I167 HydrophobicContact CG2-CD1 4.38Å
123	H	96.6	Very high	96.2	Very high	31 Å²	31	21.5 Å²	21.5	14%	0.144	11%	0.105	C	C	.	.	H	α-helix	trans	-61	-48.1	179.6	-176.3	77.9	0	0	0	111.8	S83 G85 G119 V120 A125 Y126 Q127 L128	S83-H123 PolarHBondContact O-CD2 3.27Å; S83-H123 VanDerWaalsContact O-CD2 3.25Å; S83-H123 PolarHBondContact OG-NE2 3.24Å; G85-H123 VanDerWaalsContact CA-CG 3.49Å; G85-H123 WeakPolarHBondContact CA-ND1 3.48Å; G119-H123 VanDerWaalsContact O-CB 3.31Å; G119-H123 WeakPolarHBondContact O-CB 3.42Å; G119-H123 PolarHBondContact O-N 2.92Å; V120-H123 PolarHBondContact O-N 2.84Å; H123-A125 PolarHBondContact O-N 2.98Å; H123-Y126 PolarHBondContact O-N 2.77Å; H123-Q127 WeakPolarHBondContact O-CA 3.09Å; H123-Q127 VanDerWaalsContact O-CB 3.3Å; H123-Q127 WeakPolarHBondContact O-CB 3.39Å; H123-Q127 PolarHBondContact O-N 2.9Å; H123-L128 PolarHBondContact O-N 3.18Å
124	I	96.5	Very high	96.3	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-62.9	-43.3	178.7	-65.5	170.1	0	0	0	111	L82 V120 L128 K129 Q130 V132 A202	L82-I124 HydrophobicContact CB-CD1 4.33Å; L82-I124 HydrophobicContact CB-CG1 4.49Å; L82-I124 HydrophobicContact CD1-CD1 3.95Å; V120-I124 HydrophobicContact CG1-CD1 3.63Å; V120-I124 HydrophobicContact CG1-CG1 4.37Å; V120-I124 VanDerWaalsContact O-CG1 3.29Å; V120-I124 WeakPolarHBondContact O-CG1 3.37Å; V120-I124 PolarHBondContact O-N 2.99Å; I124-L128 HydrophobicContact CB-CD1 4.48Å; I124-L128 HydrophobicContact CG1-CD1 4.13Å; I124-L128 HydrophobicContact CG2-CD1 4.48Å; I124-L128 CarbonylContact O-C 3.58Å; I124-L128 WeakPolarHBondContact O-CB 3.46Å; I124-L128 PolarHBondContact O-N 2.86Å; I124-K129 PolarHBondContact O-N 3.26Å; I124-Q130 HydrophobicContact CG2-CB 3.84Å; I124-Q130 PolarHBondContact O-N 3.16Å; I124-V132 HydrophobicContact CB-CG2 3.74Å; I124-V132 HydrophobicContact CG2-CG2 3.49Å; I124-V132 VanDerWaalsContact CG2-CG2 3.49Å; I124-A202 HydrophobicContact CD1-CB 3.7Å
125	A	95.9	Very high	96.4	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-70	-38.6	-178.5	0	0	0	0	0	113.5	A121 V122 H123 K129 Q130 A163 R166 I167	A121-A125 VanDerWaalsContact O-CB 3.25Å; A121-A125 WeakPolarHBondContact O-CB 3.31Å; A121-A125 PolarHBondContact O-N 3.28Å; V122-A125 PolarHBondContact O-N 3.41Å; H123-A125 PolarHBondContact O-N 2.98Å; A125-K129 WeakPolarHBondContact O-CA 3.44Å; A125-Q130 WeakPolarHBondContact CA-O 3.48Å; A125-A163 WeakPolarHBondContact CB-O 3.33Å; A125-R166 HydrophobicContact CB-CB 4.12Å; A125-I167 HydrophobicContact CB-CD1 3.92Å; A125-I167 HydrophobicContact CB-CG1 3.6Å
126	Y	95.5	Very high	96.5	Very high	26 Å²	26	16.6 Å²	16.6	10%	0.102	8%	0.078	C	C	.	.	H	α-helix	trans	-91.4	-52.5	-175.6	179.9	-108.8	0	0	0	113.4	V122 H123 K129 L150 E153 T154 E159 A163	V122-Y126 VanDerWaalsContact O-CB 3.27Å; V122-Y126 WeakPolarHBondContact O-CB 3.21Å; V122-Y126 PolarHBondContact O-N 2.81Å; H123-Y126 PolarHBondContact O-N 2.77Å; Y126-K129 WeakPolarHBondContact O-CD 3.34Å; Y126-K129 WeakPolarHBondContact O-CE 3.26Å; Y126-K129 PolarHBondContact O-NZ 3.44Å; Y126-L150 HydrophobicContact CD2-CD2 4.2Å; Y126-L150 HydrophobicContact CG-CD2 3.97Å; Y126-E153 HydrophobicContact CD1-CB 3.67Å; Y126-E153 HydrophobicContact CD1-CG 4.17Å; Y126-E153 HydrophobicContact CE1-CB 3.61Å; Y126-T154 HydrophobicContact CD2-CG2 4.32Å; Y126-T154 HydrophobicContact CE1-CG2 4.47Å; Y126-T154 HydrophobicContact CE2-CG2 3.57Å; Y126-T154 VanDerWaalsContact OH-CB 3.3Å; Y126-T154 WeakPolarHBondContact OH-CB 3.46Å; Y126-E159 HydrophobicContact CE2-CB 4.07Å; Y126-E159 WeakPolarHBondContact CE2-OE2 3.26Å; Y126-E159 PolarHBondContact OH-OE2 2.76Å; Y126-A163 HydrophobicContact CD2-CB 4.14Å
127	Q	94.6	Very high	96.5	Very high	78 Å²	78	16.8 Å²	16.8	36%	0.364	8%	0.079	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-43.8	-174.8	-65.1	-68.8	-9.1	0	0	111.3	H123 E153	H123-Q127 WeakPolarHBondContact O-CA 3.09Å; H123-Q127 VanDerWaalsContact O-CB 3.3Å; H123-Q127 WeakPolarHBondContact O-CB 3.39Å; H123-Q127 PolarHBondContact O-N 2.9Å; Q127-E153 PolarHBondContact NE2-OE2 2.75Å
128	L	93.6	Very high	96.2	Very high	63 Å²	63	20 Å²	20	33%	0.33	10%	0.099	S	C	.	.	S	Bend	trans	-88.3	-9.1	-179.2	-48.6	-177.7	0	0	0	113.4	L82 H123 I124 Q130	L82-L128 HydrophobicContact CB-CD1 4.27Å; L82-L128 HydrophobicContact CD2-CD1 4.02Å; H123-L128 PolarHBondContact O-N 3.18Å; I124-L128 HydrophobicContact CB-CD1 4.48Å; I124-L128 HydrophobicContact CG1-CD1 4.13Å; I124-L128 HydrophobicContact CG2-CD1 4.48Å; I124-L128 CarbonylContact O-C 3.58Å; I124-L128 WeakPolarHBondContact O-CB 3.46Å; I124-L128 PolarHBondContact O-N 2.86Å; L128-Q130 HydrophobicContact CB-CG 4.06Å; L128-Q130 WeakPolarHBondContact O-CG 3.41Å; L128-Q130 PolarHBondContact O-N 3.37Å; L128-Q130 VanDerWaalsContact O-N 3.16Å; L128-Q130 PolarHBondContact O-NE2 2.99Å
129	K	93.5	Very high	95.9	Very high	79 Å²	79	21.5 Å²	21.5	34%	0.343	12%	0.116	S	C	.	.			trans	51.8	33	-176.2	-53.7	-64.8	-178.1	-160.4	0	113.1	I124 A125 Y126	I124-K129 PolarHBondContact O-N 3.26Å; A125-K129 WeakPolarHBondContact O-CA 3.44Å; Y126-K129 WeakPolarHBondContact O-CD 3.34Å; Y126-K129 WeakPolarHBondContact O-CE 3.26Å; Y126-K129 PolarHBondContact O-NZ 3.44Å
130	Q	93.7	Very high	95.6	Very high	51 Å²	51	23.4 Å²	23.4	24%	0.238	14%	0.136	C	C	.	.			trans	-104.8	155.9	179.2	-61	-58.3	-55.9	0	0	111.8	I124 A125 L128 S199 K201	I124-Q130 HydrophobicContact CG2-CB 3.84Å; I124-Q130 PolarHBondContact O-N 3.16Å; A125-Q130 WeakPolarHBondContact CA-O 3.48Å; L128-Q130 HydrophobicContact CB-CG 4.06Å; L128-Q130 WeakPolarHBondContact O-CG 3.41Å; L128-Q130 PolarHBondContact O-N 3.37Å; L128-Q130 VanDerWaalsContact O-N 3.16Å; L128-Q130 PolarHBondContact O-NE2 2.99Å; Q130-S199 PolarHBondContact OE1-O 3.03Å; Q130-S199 PolarHBondContact OE1-OG 2.84Å; Q130-K201 HydrophobicContact CB-CB 4.02Å; Q130-K201 HydrophobicContact CB-CG 4.01Å; Q130-K201 HydrophobicContact CG-CB 4.2Å; Q130-K201 HydrophobicContact CG-CG 3.8Å; Q130-K201 VanDerWaalsContact OE1-CG 3.28Å
131	S	94.9	Very high	95.4	Very high	6 Å²	6	23.7 Å²	23.7	4%	0.042	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	142.7	176.2	-66.7	0	0	0	0	112.2	R166 S199 V200 K201	S131-R166 CarbonylContact C-O 3.59Å; S131-R166 WeakPolarHBondContact CA-O 3.35Å; S131-S199 PolarHBondContact N-O 2.97Å; S131-V200 WeakPolarHBondContact O-CA 3.43Å; S131-K201 PolarHBondContact O-N 3.32Å
132	V	96.6	Very high	95.2	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	131.3	178.8	-177.3	0	0	0	0	108.8	A121 I124 R166 H168 A202 I204	A121-V132 HydrophobicContact CB-CG1 4.18Å; I124-V132 HydrophobicContact CB-CG2 3.74Å; I124-V132 HydrophobicContact CG2-CG2 3.49Å; I124-V132 VanDerWaalsContact CG2-CG2 3.49Å; V132-R166 PolarHBondContact N-O 3.19Å; V132-H168 PolarHBondContact O-N 3.39Å; V132-A202 HydrophobicContact CG1-CB 4.27Å; V132-A202 HydrophobicContact CG2-CB 4.39Å; V132-I204 HydrophobicContact CG1-CD1 3.82Å; V132-I204 HydrophobicContact CG1-CG1 4.2Å
133	I	97.6	Very high	95.1	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	123	166.6	-63.4	175.3	0	0	0	107.8	I135 H168 F170 L185 L190 V193 V200 A202 L203 I204	I133-I135 HydrophobicContact CG2-CG1 4.24Å; I133-H168 CarbonylContact C-O 3.58Å; I133-H168 WeakPolarHBondContact CA-O 3.49Å; I133-F170 HydrophobicContact CG2-CD2 3.83Å; I133-F170 HydrophobicContact CG2-CE2 3.84Å; I133-L185 HydrophobicContact CD1-CD1 3.94Å; I133-L185 HydrophobicContact CD1-CD2 3.8Å; I133-L185 HydrophobicContact CD1-CG 4.47Å; I133-L185 HydrophobicContact CG2-CD1 4.16Å; I133-L190 HydrophobicContact CD1-CD1 4.05Å; I133-L190 HydrophobicContact CD1-CG 4.32Å; I133-V193 HydrophobicContact CD1-CG1 4.46Å; I133-V193 HydrophobicContact CG1-CG1 4.26Å; I133-V200 HydrophobicContact CD1-CG1 3.97Å; I133-V200 HydrophobicContact CD1-CG2 4.22Å; I133-V200 HydrophobicContact CG1-CG1 3.93Å; I133-V200 HydrophobicContact CG1-CG2 4.26Å; I133-A202 PolarHBondContact N-O 3.27Å; I133-L203 HydrophobicContact CB-CD1 3.84Å; I133-L203 HydrophobicContact CG2-CD1 3.55Å; I133-L203 CarbonylContact O-C 3.54Å; I133-L203 WeakPolarHBondContact O-CA 3.32Å; I133-I204 PolarHBondContact O-N 2.82Å
134	Y	98.4	Very high	95	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	114.9	176.3	-161.3	-69.7	0	0	0	109.9	C117 F118 A121 D136 L141 H168 T169 F170 I204 D206	C117-Y134 HydrophobicContact CB-CE2 3.88Å; C117-Y134 WeakPolarHBondContact CB-OH 3.49Å; F118-Y134 AromaticContact CD1-CE2 3.92Å; F118-Y134 HydrophobicContact CD1-CE2 3.92Å; F118-Y134 AromaticContact CD1-CZ 3.92Å; F118-Y134 HydrophobicContact CE1-CE1 4.43Å; F118-Y134 HydrophobicContact CE1-CE2 4.2Å; F118-Y134 AromaticContact CE1-CZ 3.72Å; F118-Y134 WeakPolarHBondContact CE1-OH 3.47Å; A121-Y134 HydrophobicContact CB-CD2 4.27Å; Y134-D136 HydrophobicContact CD1-CB 4.11Å; Y134-D136 HydrophobicContact CE1-CB 4Å; Y134-L141 HydrophobicContact CD1-CD1 3.31Å; Y134-L141 HydrophobicContact CD2-CD1 3.81Å; Y134-L141 HydrophobicContact CE1-CB 4.31Å; Y134-L141 HydrophobicContact CE1-CD1 3.49Å; Y134-L141 VanDerWaalsContact CE1-CD1 3.49Å; Y134-L141 HydrophobicContact CE2-CD1 3.95Å; Y134-L141 HydrophobicContact CG-CD1 3.5Å; Y134-L141 VanDerWaalsContact CG-CD1 3.5Å; Y134-H168 PolarHBondContact N-O 2.93Å; Y134-T169 CarbonylContact O-C 3.39Å; Y134-T169 VanDerWaalsContact O-CA 3.24Å; Y134-T169 WeakPolarHBondContact O-CA 3.38Å; Y134-F170 PolarHBondContact O-N 3.4Å; Y134-I204 HydrophobicContact CD2-CB 3.94Å; Y134-I204 HydrophobicContact CD2-CD1 4.02Å; Y134-I204 HydrophobicContact CD2-CG2 3.87Å; Y134-I204 HydrophobicContact CE2-CB 4.23Å; Y134-I204 HydrophobicContact CE2-CD1 4.29Å; Y134-I204 HydrophobicContact CE2-CG2 3.63Å; Y134-I204 HydrophobicContact CG-CB 4.41Å; Y134-I204 HydrophobicContact CG-CG2 4.49Å; Y134-D206 HydrophobicContact CE1-CB 3.9Å; Y134-D206 VanDerWaalsContact OH-CB 3.24Å; Y134-D206 WeakPolarHBondContact OH-CB 3.45Å; Y134-D206 PolarHBondContact OH-OD2 3.22Å
135	I	98.5	Very high	95	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	107.2	172.8	-56.9	-177	0	0	0	108.1	I133 T137 F170 L172 L178 L182 L203 I204 V205 D206	I133-I135 HydrophobicContact CG2-CG1 4.24Å; I135-T137 HydrophobicContact CG2-CG2 3.95Å; I135-F170 CarbonylContact C-O 3.55Å; I135-F170 WeakPolarHBondContact CA-O 3.5Å; I135-F170 HydrophobicContact CG1-CB 4.39Å; I135-L172 HydrophobicContact CD1-CD1 4.42Å; I135-L172 HydrophobicContact CG2-CB 4.29Å; I135-L172 HydrophobicContact CG2-CD1 3.64Å; I135-L172 HydrophobicContact CG2-CG 4.08Å; I135-L178 HydrophobicContact CD1-CD1 3.86Å; I135-L178 HydrophobicContact CG2-CD1 3.95Å; I135-L182 HydrophobicContact CD1-CD2 4.14Å; I135-L203 HydrophobicContact CD1-CD1 3.89Å; I135-L203 HydrophobicContact CG1-CD1 4.08Å; I135-I204 PolarHBondContact N-O 3.13Å; I135-V205 HydrophobicContact CB-CG1 4.34Å; I135-V205 HydrophobicContact CB-CG2 4.29Å; I135-V205 HydrophobicContact CD1-CG2 4.26Å; I135-V205 HydrophobicContact CG2-CG1 4.34Å; I135-D206 PolarHBondContact O-N 3.03Å
136	D	98	Very high	95	Very high	0 Å²	0	34 Å²	34	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	113.4	174.9	178.5	12.2	0	0	0	109.5	Y134 T138 G139 G140 L141 F170 R171 L172	Y134-D136 HydrophobicContact CD1-CB 4.11Å; Y134-D136 HydrophobicContact CE1-CB 4Å; D136-T138 PolarHBondContact OD1-N 2.97Å; D136-T138 PolarHBondContact OD1-OG1 2.88Å; D136-G139 PolarHBondContact OD1-N 3.42Å; D136-G139 WeakPolarHBondContact OD2-CA 3.2Å; D136-G139 PolarHBondContact OD2-N 3.28Å; D136-G140 PolarHBondContact OD1-N 2.7Å; D136-G140 PolarHBondContact OD2-N 3.05Å; D136-G140 VanDerWaalsContact OD2-N 3.1Å; D136-L141 HydrophobicContact CB-CB 4.13Å; D136-L141 WeakPolarHBondContact OD2-CB 3.13Å; D136-L141 PolarHBondContact OD2-N 3.17Å; D136-F170 PolarHBondContact N-O 3.31Å; D136-R171 HydrophobicContact CB-CG 4.36Å; D136-R171 VanDerWaalsContact O-CA 3.27Å; D136-R171 WeakPolarHBondContact O-CA 3.3Å; D136-L172 PolarHBondContact O-N 2.88Å
137	T	97.4	Very high	95	Very high	7 Å²	7	35 Å²	35	4%	0.043	22%	0.216	C	C	.	.	S	Bend	trans	-106.1	1.8	178.9	77.3	0	0	0	0	113.3	I135 L172 V205 D206 S207 A210 V211	I135-T137 HydrophobicContact CG2-CG2 3.95Å; T137-L172 WeakPolarHBondContact CA-O 3.34Å; T137-L172 WeakPolarHBondContact CB-O 3.32Å; T137-L172 WeakPolarHBondContact CG2-O 3.42Å; T137-V205 HydrophobicContact CG2-CG1 4.27Å; T137-D206 PolarHBondContact N-O 3.28Å; T137-D206 PolarHBondContact OG1-O 2.78Å; T137-S207 PolarHBondContact OG1-N 2.89Å; T137-S207 PolarHBondContact OG1-O 3.3Å; T137-A210 WeakPolarHBondContact OG1-CB 3.29Å; T137-V211 HydrophobicContact CG2-CG1 4.1Å
138	T	91.8	Very high	95.1	Very high	66 Å²	66	36 Å²	36	41%	0.405	22%	0.221	S	C	.	.	S	Bend	trans	-115.6	-12.3	-177.5	61.5	0	0	0	0	112.3	D136 G140 A210	D136-T138 PolarHBondContact OD1-N 2.97Å; D136-T138 PolarHBondContact OD1-OG1 2.88Å; T138-G140 VanDerWaalsContact C-N 3.27Å; T138-A210 HydrophobicContact CG2-CB 3.8Å
139	G	91.4	Very high	95.2	Very high	38 Å²	38	33 Å²	33	39%	0.392	21%	0.205	S	C	.	.	S	Bend	trans	77.1	14.1	-177.1	0	0	0	0	0	113	D136	D136-G139 PolarHBondContact OD1-N 3.42Å; D136-G139 WeakPolarHBondContact OD2-CA 3.2Å; D136-G139 PolarHBondContact OD2-N 3.28Å
140	G	89.6	Confident	95.2	Very high	41 Å²	41	29.2 Å²	29.2	42%	0.423	19%	0.189	S	C	.	.			trans	-82.5	-14.7	-174.3	0	0	0	0	0	114.5	D136 T138	D136-G140 PolarHBondContact OD1-N 2.7Å; D136-G140 PolarHBondContact OD2-N 3.05Å; D136-G140 VanDerWaalsContact OD2-N 3.1Å; T138-G140 VanDerWaalsContact C-N 3.27Å
141	L	94.1	Very high	95.3	Very high	8 Å²	8	31.4 Å²	31.4	4%	0.042	20%	0.199	C	C	.	.			trans	-81.3	124.5	-177.8	-173.2	152.7	0	0	0	111.5	F118 Y134 D136 L146 T169 R171	F118-L141 HydrophobicContact CD1-CD1 4.29Å; F118-L141 HydrophobicContact CD1-CG 4.47Å; F118-L141 HydrophobicContact CE1-CB 3.87Å; F118-L141 HydrophobicContact CE1-CD1 3.99Å; F118-L141 HydrophobicContact CE1-CG 3.9Å; F118-L141 HydrophobicContact CZ-CB 4.32Å; Y134-L141 HydrophobicContact CD1-CD1 3.31Å; Y134-L141 HydrophobicContact CD2-CD1 3.81Å; Y134-L141 HydrophobicContact CE1-CB 4.31Å; Y134-L141 HydrophobicContact CE1-CD1 3.49Å; Y134-L141 VanDerWaalsContact CE1-CD1 3.49Å; Y134-L141 HydrophobicContact CE2-CD1 3.95Å; Y134-L141 HydrophobicContact CG-CD1 3.5Å; Y134-L141 VanDerWaalsContact CG-CD1 3.5Å; D136-L141 HydrophobicContact CB-CB 4.13Å; D136-L141 WeakPolarHBondContact OD2-CB 3.13Å; D136-L141 PolarHBondContact OD2-N 3.17Å; L141-L146 HydrophobicContact CD1-CD1 4.44Å; L141-L146 HydrophobicContact CD2-CD1 4.19Å; L141-T169 HydrophobicContact CD1-CG2 4.3Å; L141-T169 HydrophobicContact CD2-CG2 4.1Å; L141-R171 PolarHBondContact O-NH2 3Å
142	T	94.4	Very high	95	Very high	61 Å²	61	32.8 Å²	32.8	37%	0.374	21%	0.207	S	C	.	.			trans	-123.3	137.9	171.9	64.3	0	0	0	0	111	S144 R145 L146	T142-S144 PolarHBondContact O-N 3.12Å; T142-S144 PolarHBondContact OG1-OG 3.09Å; T142-R145 PolarHBondContact O-N 2.85Å; T142-R145 VanDerWaalsContact O-N 3.13Å; T142-R145 WeakPolarHBondContact OG1-CB 3.44Å; T142-R145 PolarHBondContact OG1-N 3.13Å; T142-L146 PolarHBondContact O-N 3.19Å
143	A	94.4	Very high	94.7	Very high	65 Å²	65	33.9 Å²	33.9	54%	0.537	21%	0.212	S	C	.	.	H	α-helix	trans	-60.6	-33.7	176.8	0	0	0	0	0	112.1	R145 L146 L147	A143-R145 VanDerWaalsContact C-N 3.3Å; A143-R145 PolarHBondContact O-N 3.3Å; A143-L146 PolarHBondContact O-N 3.32Å; A143-L147 WeakPolarHBondContact O-CB 3.22Å; A143-L147 PolarHBondContact O-N 3.29Å
144	S	95.2	Very high	94.4	Very high	86 Å²	86	34.7 Å²	34.7	60%	0.601	22%	0.217	S	C	*	.	H	α-helix	trans	-60.8	-37.3	175.8	54.1	0	0	0	0	112.6	T142 Q148	T142-S144 PolarHBondContact O-N 3.12Å; T142-S144 PolarHBondContact OG1-OG 3.09Å; S144-Q148 WeakPolarHBondContact O-CB 3.2Å; S144-Q148 PolarHBondContact O-N 3.43Å
145	R	95	Very high	94.2	Very high	34 Å²	34	41.9 Å²	41.9	13%	0.128	26%	0.256	C	S	.	.	H	α-helix	trans	-69	-40.6	177	-179.5	60.5	-171.4	118.8	-2.9	111.9	Q115 F118 T142 A143 Q148 M149 S312	Q115-R145 VanDerWaalsContact OE1-CZ 3.31Å; F118-R145 HydrophobicContact CD2-CG 3.94Å; F118-R145 HydrophobicContact CE2-CG 4.28Å; T142-R145 PolarHBondContact O-N 2.85Å; T142-R145 VanDerWaalsContact O-N 3.13Å; T142-R145 WeakPolarHBondContact OG1-CB 3.44Å; T142-R145 PolarHBondContact OG1-N 3.13Å; A143-R145 VanDerWaalsContact C-N 3.3Å; A143-R145 PolarHBondContact O-N 3.3Å; R145-Q148 PolarHBondContact O-N 2.82Å; R145-M149 VanDerWaalsContact CZ-CE 3.4Å; R145-M149 PolarHBondContact O-N 3.1Å; R145-S312 PolarHBondContact NH1-OG 3.49Å; R145-S312 VanDerWaalsContact NH1-OG 3.14Å; R145-S312 PolarHBondContact NH2-OG 3.1Å
146	L	96.9	Very high	94.1	Very high	5 Å²	5	45 Å²	45	3%	0.026	27%	0.272	C	S	.	.	H	α-helix	trans	-63.8	-45.5	175.4	-59.1	-179.7	0	0	0	110.9	F118 V122 L141 T142 A143 Q148 M149 L150 L164 I167	F118-L146 HydrophobicContact CB-CD2 3.97Å; F118-L146 HydrophobicContact CD1-CD2 4.14Å; F118-L146 HydrophobicContact CG-CD2 4.22Å; V122-L146 HydrophobicContact CG2-CB 4.25Å; V122-L146 HydrophobicContact CG2-CD2 3.97Å; L141-L146 HydrophobicContact CD1-CD1 4.44Å; L141-L146 HydrophobicContact CD2-CD1 4.19Å; T142-L146 PolarHBondContact O-N 3.19Å; A143-L146 PolarHBondContact O-N 3.32Å; L146-Q148 VanDerWaalsContact C-N 3.32Å; L146-Q148 PolarHBondContact O-N 3.44Å; L146-M149 PolarHBondContact O-N 3.39Å; L146-L150 PolarHBondContact O-N 3.41Å; L146-L164 HydrophobicContact CB-CD2 3.71Å; L146-L164 HydrophobicContact CD1-CD2 4.27Å; L146-I167 HydrophobicContact CD1-CD1 4.18Å; L146-I167 HydrophobicContact CD1-CG2 4.3Å
147	L	96.4	Very high	94	Very high	45 Å²	45	49.1 Å²	49.1	24%	0.236	30%	0.297	C	S	.	.	H	α-helix	trans	-60.2	-41.6	176.2	-177.8	62.1	0	0	0	111.6	A143 M149 L150 Q151 Q160 M161 L164	A143-L147 WeakPolarHBondContact O-CB 3.22Å; A143-L147 PolarHBondContact O-N 3.29Å; L147-M149 VanDerWaalsContact C-N 3.31Å; L147-M149 PolarHBondContact O-N 3.39Å; L147-L150 PolarHBondContact O-N 2.9Å; L147-Q151 HydrophobicContact CD1-CG 4.42Å; L147-Q151 HydrophobicContact CG-CG 4.42Å; L147-Q151 VanDerWaalsContact O-CG 3.29Å; L147-Q151 WeakPolarHBondContact O-CG 3.3Å; L147-Q151 PolarHBondContact O-N 2.96Å; L147-Q160 HydrophobicContact CD1-CB 4.02Å; L147-Q160 HydrophobicContact CD1-CG 4.34Å; L147-M161 HydrophobicContact CD1-CE 4.01Å; L147-L164 HydrophobicContact CD1-CD1 4.27Å
148	Q	95.1	Very high	93.9	Very high	100 Å²	100	54.4 Å²	54.4	47%	0.467	33%	0.326	S	S	.	.	H	α-helix	trans	-60	-39.6	176.4	-173.7	-170.4	8	0	0	112.3	S144 R145 L146	S144-Q148 WeakPolarHBondContact O-CB 3.2Å; S144-Q148 PolarHBondContact O-N 3.43Å; R145-Q148 PolarHBondContact O-N 2.82Å; L146-Q148 VanDerWaalsContact C-N 3.32Å; L146-Q148 PolarHBondContact O-N 3.44Å
149	M	95.3	Very high	94.1	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-66.8	-46.4	174.1	-67	178	163.2	0	0	110.7	F118 V122 R145 L146 L147 Q151 T152 W311	F118-M149 HydrophobicContact CB-CE 3.63Å; F118-M149 HydrophobicContact CB-SD 3.71Å; V122-M149 HydrophobicContact CB-CB 4.48Å; V122-M149 HydrophobicContact CG1-CB 4.15Å; V122-M149 HydrophobicContact CG2-CB 4.14Å; V122-M149 HydrophobicContact CG2-SD 4.23Å; R145-M149 VanDerWaalsContact CZ-CE 3.4Å; R145-M149 PolarHBondContact O-N 3.1Å; L146-M149 PolarHBondContact O-N 3.39Å; L147-M149 VanDerWaalsContact C-N 3.31Å; L147-M149 PolarHBondContact O-N 3.39Å; M149-Q151 VanDerWaalsContact C-N 3.3Å; M149-Q151 PolarHBondContact O-N 2.93Å; M149-T152 PolarHBondContact O-N 2.81Å; M149-T152 PolarHBondContact O-OG1 2.8Å; M149-W311 HydrophobicContact CE-CB 4.27Å; M149-W311 HydrophobicContact CG-CB 4.46Å; M149-W311 HydrophobicContact SD-CB 4.28Å
150	L	95.1	Very high	94.3	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-59.5	-37	179.1	-77.3	166	0	0	0	113.5	V122 Y126 L146 L147 T152 E153 T154 Q160 A163 L164	V122-L150 HydrophobicContact CG1-CD2 3.65Å; V122-L150 HydrophobicContact CG1-CG 3.79Å; V122-L150 HydrophobicContact CG2-CG 4.36Å; Y126-L150 HydrophobicContact CD2-CD2 4.2Å; Y126-L150 HydrophobicContact CG-CD2 3.97Å; L146-L150 PolarHBondContact O-N 3.41Å; L147-L150 PolarHBondContact O-N 2.9Å; L150-T152 PolarHBondContact O-N 3.46Å; L150-T152 VanDerWaalsContact O-N 3.14Å; L150-E153 WeakPolarHBondContact O-CB 3.42Å; L150-E153 PolarHBondContact O-N 3.42Å; L150-T154 PolarHBondContact O-N 3.31Å; L150-Q160 HydrophobicContact CB-CG 4.22Å; L150-A163 HydrophobicContact CD1-CB 4.04Å; L150-A163 HydrophobicContact CD2-CB 3.6Å; L150-L164 HydrophobicContact CD1-CD1 4.47Å; L150-L164 HydrophobicContact CD1-CD2 3.68Å; L150-L164 HydrophobicContact CD1-CG 3.66Å
151	Q	94.3	Very high	94.6	Very high	96 Å²	96	54.5 Å²	54.5	45%	0.449	30%	0.301	S	S	.	.	H	α-helix	trans	-60.6	-20.7	176.6	-78.4	172.6	-21.7	0	0	113.2	L147 M149 T154	L147-Q151 HydrophobicContact CD1-CG 4.42Å; L147-Q151 HydrophobicContact CG-CG 4.42Å; L147-Q151 VanDerWaalsContact O-CG 3.29Å; L147-Q151 WeakPolarHBondContact O-CG 3.3Å; L147-Q151 PolarHBondContact O-N 2.96Å; M149-Q151 VanDerWaalsContact C-N 3.3Å; M149-Q151 PolarHBondContact O-N 2.93Å; Q151-T154 WeakPolarHBondContact CA-O 3.42Å
152	T	90.4	Very high	94.6	Very high	35 Å²	35	58.2 Å²	58.2	22%	0.215	32%	0.318	C	S	.	.	H	α-helix	trans	-87.3	-16.9	175.4	70.6	0	0	0	0	113.4	M149 L150 W311 S312	M149-T152 PolarHBondContact O-N 2.81Å; M149-T152 PolarHBondContact O-OG1 2.8Å; L150-T152 PolarHBondContact O-N 3.46Å; L150-T152 VanDerWaalsContact O-N 3.14Å; T152-W311 PolarHBondContact OG1-O 3.3Å; T152-S312 WeakPolarHBondContact CG2-O 3.38Å
153	E	88.8	Confident	94.7	Very high	24 Å²	24	55.3 Å²	55.3	11%	0.112	30%	0.3	C	S	.	.	H	α-helix	trans	-90.4	-37.6	174.6	-57.2	-72.2	136.4	0	0	111.3	Y126 Q127 L150 K318	Y126-E153 HydrophobicContact CD1-CB 3.67Å; Y126-E153 HydrophobicContact CD1-CG 4.17Å; Y126-E153 HydrophobicContact CE1-CB 3.61Å; Q127-E153 PolarHBondContact NE2-OE2 2.75Å; L150-E153 WeakPolarHBondContact O-CB 3.42Å; L150-E153 PolarHBondContact O-N 3.42Å; E153-K318 IonicContact OE1-NZ 3.56Å; E153-K318 PolarHBondContact OE1-NZ 3.02Å
154	T	92.9	Very high	94.8	Very high	18 Å²	18	54 Å²	54	11%	0.11	28%	0.284	C	S	.	.			trans	-152	145.1	-179.3	-176.8	0	0	0	0	112.5	Y126 L150 Q151 N156 E159 Q160	Y126-T154 HydrophobicContact CD2-CG2 4.32Å; Y126-T154 HydrophobicContact CE1-CG2 4.47Å; Y126-T154 HydrophobicContact CE2-CG2 3.57Å; Y126-T154 VanDerWaalsContact OH-CB 3.3Å; Y126-T154 WeakPolarHBondContact OH-CB 3.46Å; L150-T154 PolarHBondContact O-N 3.31Å; Q151-T154 WeakPolarHBondContact CA-O 3.42Å; T154-N156 WeakPolarHBondContact OG1-CB 3.44Å; T154-N156 PolarHBondContact OG1-N 3.36Å; T154-N156 VanDerWaalsContact OG1-N 3.11Å; T154-E159 HydrophobicContact CG2-CB 4.12Å; T154-E159 PolarHBondContact OG1-OE2 2.96Å; T154-E159 VanDerWaalsContact OG1-OE2 3.08Å; T154-Q160 HydrophobicContact CG2-CG 3.9Å; T154-Q160 PolarHBondContact O-NE2 2.98Å
155	N	93.2	Very high	94.8	Very high	151 Å²	151	56.8 Å²	56.8	81%	0.807	29%	0.288	S	S	*	.	S	Bend	trans	-88.5	-7.5	171.2	-68.4	-43.6	0	0	0	112.7	T157	N155-T157 PolarHBondContact O-N 2.93Å
156	N	96.1	Very high	94.8	Very high	66 Å²	66	57.8 Å²	57.8	35%	0.353	29%	0.291	S	S	.	.			trans	-78.9	114.4	-178.2	-176.8	-9.7	0	0	0	110.7	T154 D158 E159 Q160	T154-N156 WeakPolarHBondContact OG1-CB 3.44Å; T154-N156 PolarHBondContact OG1-N 3.36Å; T154-N156 VanDerWaalsContact OG1-N 3.11Å; N156-D158 VanDerWaalsContact C-N 3.33Å; N156-D158 PolarHBondContact O-N 3.37Å; N156-D158 PolarHBondContact OD1-N 3.04Å; N156-E159 HydrophobicContact CB-CB 4.08Å; N156-E159 HydrophobicContact CB-CG 4.14Å; N156-E159 PolarHBondContact ND2-OE1 2.85Å; N156-E159 PolarHBondContact O-N 3.14Å; N156-Q160 VanDerWaalsContact O-CG 3.28Å; N156-Q160 WeakPolarHBondContact O-CG 3.49Å; N156-Q160 PolarHBondContact O-N 2.98Å; N156-Q160 VanDerWaalsContact O-N 3.11Å
157	T	95.9	Very high	94.7	Very high	85 Å²	85	58.2 Å²	58.2	52%	0.521	29%	0.294	S	S	.	.	H	α-helix	trans	-63.9	-35.4	-178.3	-51.6	0	0	0	0	112.9	N155 Q160 M161	N155-T157 PolarHBondContact O-N 2.93Å; T157-Q160 WeakPolarHBondContact O-CB 3.24Å; T157-Q160 PolarHBondContact O-N 2.69Å; T157-M161 HydrophobicContact CG2-CG 4.47Å; T157-M161 WeakPolarHBondContact O-CG 3.44Å; T157-M161 PolarHBondContact O-N 2.92Å
158	D	95.8	Very high	94.7	Very high	119 Å²	119	58 Å²	58	64%	0.636	29%	0.291	S	S	*	.	H	α-helix	trans	-66.6	-44.1	-179.6	-66.6	-29.2	0	0	0	110.6	N156 Q160 M161 E162	N156-D158 VanDerWaalsContact C-N 3.33Å; N156-D158 PolarHBondContact O-N 3.37Å; N156-D158 PolarHBondContact OD1-N 3.04Å; D158-Q160 VanDerWaalsContact C-N 3.32Å; D158-Q160 PolarHBondContact O-N 3.41Å; D158-M161 PolarHBondContact O-N 2.86Å; D158-E162 WeakPolarHBondContact O-CG 3.31Å; D158-E162 PolarHBondContact O-N 3.32Å
159	E	95.6	Very high	94.7	Very high	59 Å²	59	55.9 Å²	55.9	28%	0.276	29%	0.285	S	S	.	.	H	α-helix	trans	-61.5	-38.8	174.1	-79.3	174.7	-140.1	0	0	112.9	Y126 T154 N156 A163	Y126-E159 HydrophobicContact CE2-CB 4.07Å; Y126-E159 WeakPolarHBondContact CE2-OE2 3.26Å; Y126-E159 PolarHBondContact OH-OE2 2.76Å; T154-E159 HydrophobicContact CG2-CB 4.12Å; T154-E159 PolarHBondContact OG1-OE2 2.96Å; T154-E159 VanDerWaalsContact OG1-OE2 3.08Å; N156-E159 HydrophobicContact CB-CB 4.08Å; N156-E159 HydrophobicContact CB-CG 4.14Å; N156-E159 PolarHBondContact ND2-OE1 2.85Å; N156-E159 PolarHBondContact O-N 3.14Å; E159-A163 WeakPolarHBondContact O-CB 3.46Å; E159-A163 PolarHBondContact O-N 3.4Å
160	Q	96.5	Very high	94.8	Very high	11 Å²	11	59.1 Å²	59.1	5%	0.051	30%	0.299	C	S	.	.	H	α-helix	trans	-62.4	-45.5	174.7	-67.4	166.2	1.6	0	0	110.7	L147 L150 T154 N156 T157 D158 A163 L164	L147-Q160 HydrophobicContact CD1-CB 4.02Å; L147-Q160 HydrophobicContact CD1-CG 4.34Å; L150-Q160 HydrophobicContact CB-CG 4.22Å; T154-Q160 HydrophobicContact CG2-CG 3.9Å; T154-Q160 PolarHBondContact O-NE2 2.98Å; N156-Q160 VanDerWaalsContact O-CG 3.28Å; N156-Q160 WeakPolarHBondContact O-CG 3.49Å; N156-Q160 PolarHBondContact O-N 2.98Å; N156-Q160 VanDerWaalsContact O-N 3.11Å; T157-Q160 WeakPolarHBondContact O-CB 3.24Å; T157-Q160 PolarHBondContact O-N 2.69Å; D158-Q160 VanDerWaalsContact C-N 3.32Å; D158-Q160 PolarHBondContact O-N 3.41Å; Q160-A163 PolarHBondContact O-N 2.84Å; Q160-L164 WeakPolarHBondContact O-CG 3.44Å; Q160-L164 PolarHBondContact O-N 2.59Å
161	M	95.8	Very high	94.9	Very high	77 Å²	77	66.1 Å²	66.1	38%	0.379	33%	0.326	S	S	.	.	H	α-helix	trans	-65.6	-42.4	179.2	-67.9	-52.7	104.6	0	0	111.5	L147 T157 D158 A163 L164 Q165	L147-M161 HydrophobicContact CD1-CE 4.01Å; T157-M161 HydrophobicContact CG2-CG 4.47Å; T157-M161 WeakPolarHBondContact O-CG 3.44Å; T157-M161 PolarHBondContact O-N 2.92Å; D158-M161 PolarHBondContact O-N 2.86Å; M161-A163 VanDerWaalsContact C-N 3.34Å; M161-A163 PolarHBondContact O-N 2.98Å; M161-L164 HydrophobicContact CE-CD1 3.82Å; M161-L164 PolarHBondContact O-N 2.77Å; M161-L164 HydrophobicContact SD-CD1 4.4Å; M161-Q165 WeakPolarHBondContact O-CG 3.19Å; M161-Q165 PolarHBondContact O-N 3.12Å
162	E	94.6	Very high	95	Very high	86 Å²	86	62.7 Å²	62.7	40%	0.402	31%	0.31	S	S	.	.	H	α-helix	trans	-60.3	-42.4	174.5	-74.6	-171.8	-169.1	0	0	112.3	D158 Q165 R166	D158-E162 WeakPolarHBondContact O-CG 3.31Å; D158-E162 PolarHBondContact O-N 3.32Å; E162-Q165 PolarHBondContact O-N 3.06Å; E162-R166 WeakPolarHBondContact O-CG 3.47Å; E162-R166 PolarHBondContact O-N 2.67Å; E162-R166 PolarHBondContact O-NH1 3.47Å; E162-R166 IonicContact OE2-CZ 3.12Å; E162-R166 IonicContact OE2-NH1 3.36Å; E162-R166 IonicContact OE2-NH2 2.59Å; E162-R166 PolarHBondContact OE2-NH2 3.37Å
163	A	95.4	Very high	95.3	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-64.2	-42.8	177	0	0	0	0	0	111.5	A125 Y126 L150 E159 Q160 M161 Q165 R166	A125-A163 WeakPolarHBondContact CB-O 3.33Å; Y126-A163 HydrophobicContact CD2-CB 4.14Å; L150-A163 HydrophobicContact CD1-CB 4.04Å; L150-A163 HydrophobicContact CD2-CB 3.6Å; E159-A163 WeakPolarHBondContact O-CB 3.46Å; E159-A163 PolarHBondContact O-N 3.4Å; Q160-A163 PolarHBondContact O-N 2.84Å; M161-A163 VanDerWaalsContact C-N 3.34Å; M161-A163 PolarHBondContact O-N 2.98Å; A163-Q165 VanDerWaalsContact C-N 3.32Å; A163-Q165 PolarHBondContact O-N 3.13Å; A163-R166 PolarHBondContact O-N 3.49Å
164	L	96.1	Very high	95.6	Very high	37 Å²	37	70.1 Å²	70.1	19%	0.194	34%	0.344	C	S	.	.	H	α-helix	trans	-62.8	-37.3	175.3	-70.4	174.7	0	0	0	112.4	L146 L147 L150 Q160 M161 R166 I167	L146-L164 HydrophobicContact CB-CD2 3.71Å; L146-L164 HydrophobicContact CD1-CD2 4.27Å; L147-L164 HydrophobicContact CD1-CD1 4.27Å; L150-L164 HydrophobicContact CD1-CD1 4.47Å; L150-L164 HydrophobicContact CD1-CD2 3.68Å; L150-L164 HydrophobicContact CD1-CG 3.66Å; Q160-L164 WeakPolarHBondContact O-CG 3.44Å; Q160-L164 PolarHBondContact O-N 2.59Å; M161-L164 HydrophobicContact CE-CD1 3.82Å; M161-L164 PolarHBondContact O-N 2.77Å; M161-L164 HydrophobicContact SD-CD1 4.4Å; L164-R166 PolarHBondContact O-N 3.39Å; L164-I167 PolarHBondContact O-N 2.8Å; L164-I167 VanDerWaalsContact O-N 3.1Å
165	Q	94.8	Very high	95.8	Very high	145 Å²	145	69.9 Å²	69.9	68%	0.678	34%	0.342	S	S	*	.	H	α-helix	trans	-63.5	-27.4	176.2	-75.8	174.8	1.7	0	0	113.2	M161 E162 A163 I167 H168	M161-Q165 WeakPolarHBondContact O-CG 3.19Å; M161-Q165 PolarHBondContact O-N 3.12Å; E162-Q165 PolarHBondContact O-N 3.06Å; A163-Q165 VanDerWaalsContact C-N 3.32Å; A163-Q165 PolarHBondContact O-N 3.13Å; Q165-I167 VanDerWaalsContact C-N 3.3Å; Q165-H168 PolarHBondContact O-CE1 3.31Å; Q165-H168 VanDerWaalsContact O-CE1 3.3Å
166	R	94.9	Very high	95.9	Very high	55 Å²	55	64 Å²	64	21%	0.208	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-9.5	175.6	-66.9	-178.7	-167.8	96.1	7.2	113.4	A125 S131 V132 E162 A163 L164 H168	A125-R166 HydrophobicContact CB-CB 4.12Å; S131-R166 CarbonylContact C-O 3.59Å; S131-R166 WeakPolarHBondContact CA-O 3.35Å; V132-R166 PolarHBondContact N-O 3.19Å; E162-R166 WeakPolarHBondContact O-CG 3.47Å; E162-R166 PolarHBondContact O-N 2.67Å; E162-R166 PolarHBondContact O-NH1 3.47Å; E162-R166 IonicContact OE2-CZ 3.12Å; E162-R166 IonicContact OE2-NH1 3.36Å; E162-R166 IonicContact OE2-NH2 2.59Å; E162-R166 PolarHBondContact OE2-NH2 3.37Å; A163-R166 PolarHBondContact O-N 3.49Å; L164-R166 PolarHBondContact O-N 3.39Å; R166-H168 PolarHBondContact O-CD2 2.8Å
167	I	96.6	Very high	96	Very high	14 Å²	14	62.2 Å²	62.2	7%	0.072	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	99.4	178.3	-56.4	173	0	0	0	109.7	A121 V122 A125 L146 L164 Q165	A121-I167 HydrophobicContact CB-CD1 4.32Å; V122-I167 HydrophobicContact CG2-CD1 4.38Å; A125-I167 HydrophobicContact CB-CD1 3.92Å; A125-I167 HydrophobicContact CB-CG1 3.6Å; L146-I167 HydrophobicContact CD1-CD1 4.18Å; L146-I167 HydrophobicContact CD1-CG2 4.3Å; L164-I167 PolarHBondContact O-N 2.8Å; L164-I167 VanDerWaalsContact O-N 3.1Å; Q165-I167 VanDerWaalsContact C-N 3.3Å
168	H	95.5	Very high	96.1	Very high	40 Å²	40	58.1 Å²	58.1	19%	0.185	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	113.5	-177.9	-54.1	-82.7	0	0	0	110.4	V132 I133 Y134 Q165 R166 V193	V132-H168 PolarHBondContact O-N 3.39Å; I133-H168 CarbonylContact C-O 3.58Å; I133-H168 WeakPolarHBondContact CA-O 3.49Å; Y134-H168 PolarHBondContact N-O 2.93Å; Q165-H168 PolarHBondContact O-CE1 3.31Å; Q165-H168 VanDerWaalsContact O-CE1 3.3Å; R166-H168 PolarHBondContact O-CD2 2.8Å; H168-V193 HydrophobicContact CB-CG1 3.78Å; H168-V193 WeakPolarHBondContact CD2-CG1 3.46Å; H168-V193 PolarHBondContact CE1-O 3.48Å; H168-V193 PolarHBondContact NE2-O 2.87Å
169	T	95.9	Very high	96.1	Very high	56 Å²	56	52.9 Å²	52.9	34%	0.344	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	131.8	-173.1	-55.3	0	0	0	0	112.3	Y134 L141	Y134-T169 CarbonylContact O-C 3.39Å; Y134-T169 VanDerWaalsContact O-CA 3.24Å; Y134-T169 WeakPolarHBondContact O-CA 3.38Å; L141-T169 HydrophobicContact CD1-CG2 4.3Å; L141-T169 HydrophobicContact CD2-CG2 4.1Å
170	F	96.8	Very high	96.2	Very high	67 Å²	67	55.7 Å²	55.7	29%	0.294	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	133.9	168	-62.9	-87.8	0	0	0	109.6	I133 Y134 I135 D136 L172 L185	I133-F170 HydrophobicContact CG2-CD2 3.83Å; I133-F170 HydrophobicContact CG2-CE2 3.84Å; Y134-F170 PolarHBondContact O-N 3.4Å; I135-F170 CarbonylContact C-O 3.55Å; I135-F170 WeakPolarHBondContact CA-O 3.5Å; I135-F170 HydrophobicContact CG1-CB 4.39Å; D136-F170 PolarHBondContact N-O 3.31Å; F170-L172 HydrophobicContact CB-CD1 4.24Å; F170-L172 HydrophobicContact CB-CD2 4.42Å; F170-L172 HydrophobicContact CB-CG 4.14Å; F170-L185 HydrophobicContact CE2-CD2 4.49Å; F170-L185 HydrophobicContact CZ-CD2 4.44Å
171	R	97.3	Very high	96.2	Very high	148 Å²	148	56 Å²	56	56%	0.558	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.2	108.4	175.2	-71.9	-179.3	176.9	169.1	-1.2	109.8	D136 L141 F173	D136-R171 HydrophobicContact CB-CG 4.36Å; D136-R171 VanDerWaalsContact O-CA 3.27Å; D136-R171 WeakPolarHBondContact O-CA 3.3Å; L141-R171 PolarHBondContact O-NH2 3Å; R171-F173 HydrophobicContact CB-CE2 4.09Å; R171-F173 HydrophobicContact CB-CZ 4.05Å
172	L	97.1	Very high	96.2	Very high	23 Å²	23	52.4 Å²	52.4	12%	0.12	26%	0.261	C	S	.	.			trans	-131.1	116.1	-169.8	-51.4	176.3	0	0	0	109.8	I135 D136 T137 F170 A177 L178 C181	I135-L172 HydrophobicContact CD1-CD1 4.42Å; I135-L172 HydrophobicContact CG2-CB 4.29Å; I135-L172 HydrophobicContact CG2-CD1 3.64Å; I135-L172 HydrophobicContact CG2-CG 4.08Å; D136-L172 PolarHBondContact O-N 2.88Å; T137-L172 WeakPolarHBondContact CA-O 3.34Å; T137-L172 WeakPolarHBondContact CB-O 3.32Å; T137-L172 WeakPolarHBondContact CG2-O 3.42Å; F170-L172 HydrophobicContact CB-CD1 4.24Å; F170-L172 HydrophobicContact CB-CD2 4.42Å; F170-L172 HydrophobicContact CB-CG 4.14Å; L172-A177 HydrophobicContact CB-CB 4.39Å; L172-A177 HydrophobicContact CD2-CB 4.18Å; L172-L178 HydrophobicContact CD1-CD1 4.27Å; L172-C181 HydrophobicContact CD1-CB 3.48Å; L172-C181 VanDerWaalsContact CD1-CB 3.48Å
173	F	95.8	Very high	96.2	Very high	128 Å²	128	53.8 Å²	53.8	56%	0.561	26%	0.263	S	S	*	.			trans	-107.1	4.1	-169.3	-57.1	-73	0	0	0	114.3	R171	R171-F173 HydrophobicContact CB-CE2 4.09Å; R171-F173 HydrophobicContact CB-CZ 4.05Å
174	D	95.3	Very high	96	Very high	87 Å²	87	56 Å²	56	47%	0.465	29%	0.285	S	S	.	.	S	Bend	trans	-140.7	160.6	176.8	70.5	89.2	0	0	0	111	G176 A177 L178	D174-G176 VanDerWaalsContact C-N 3.31Å; D174-G176 PolarHBondContact O-N 3.4Å; D174-G176 WeakPolarHBondContact OD1-CA 3.06Å; D174-G176 PolarHBondContact OD1-N 3.02Å; D174-A177 PolarHBondContact OD1-N 3.29Å; D174-A177 WeakPolarHBondContact OD2-CB 3.46Å; D174-L178 PolarHBondContact O-N 3.22Å
175	V	96.1	Very high	95.7	Very high	14 Å²	14	54.5 Å²	54.5	9%	0.085	28%	0.278	C	S	.	.	H	α-helix	trans	-70.4	-28.3	-175.3	74.9	0	0	0	0	112.8	L178 L179 V211 L215 L226 V230	V175-L178 PolarHBondContact O-N 3.13Å; V175-L179 WeakPolarHBondContact O-CG 3.25Å; V175-L179 PolarHBondContact O-N 2.89Å; V175-V211 HydrophobicContact CB-CB 4.47Å; V175-L215 HydrophobicContact CB-CD1 3.84Å; V175-L215 HydrophobicContact CG1-CD1 3.38Å; V175-L215 HydrophobicContact CG2-CD1 4.4Å; V175-L226 HydrophobicContact CG1-CB 4.42Å; V175-L226 HydrophobicContact CG1-CD1 3.95Å; V175-L226 HydrophobicContact CG1-CD2 4.49Å; V175-L226 HydrophobicContact CG2-CB 4.29Å; V175-V230 HydrophobicContact CG2-CG2 3.65Å
176	G	96.6	Very high	95.3	Very high	28 Å²	28	48.9 Å²	48.9	29%	0.289	26%	0.259	S	S	.	.	H	α-helix	trans	-67.5	-51.6	179.5	0	0	0	0	0	110.3	D174 L178 L179 D180	D174-G176 VanDerWaalsContact C-N 3.31Å; D174-G176 PolarHBondContact O-N 3.4Å; D174-G176 WeakPolarHBondContact OD1-CA 3.06Å; D174-G176 PolarHBondContact OD1-N 3.02Å; G176-L178 VanDerWaalsContact C-N 3.26Å; G176-L178 PolarHBondContact O-N 3.42Å; G176-L179 PolarHBondContact O-N 3.24Å; G176-L179 VanDerWaalsContact O-N 3.08Å; G176-D180 PolarHBondContact O-N 2.95Å
177	A	97.1	Very high	94.5	Very high	27 Å²	27	49.8 Å²	49.8	22%	0.223	29%	0.285	C	S	.	.	H	α-helix	trans	-59.1	-37	175.1	0	0	0	0	0	112.5	L172 D174 C181	L172-A177 HydrophobicContact CB-CB 4.39Å; L172-A177 HydrophobicContact CD2-CB 4.18Å; D174-A177 PolarHBondContact OD1-N 3.29Å; D174-A177 WeakPolarHBondContact OD2-CB 3.46Å; A177-C181 VanDerWaalsContact O-CB 3.26Å; A177-C181 WeakPolarHBondContact O-CB 3.38Å; A177-C181 PolarHBondContact O-N 2.85Å
178	L	98	Very high	93.5	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-61.1	-49.4	172.6	177.2	61.6	0	0	0	111.7	I135 L172 D174 V175 G176 C181 L182 V205 V211 V230	I135-L178 HydrophobicContact CD1-CD1 3.86Å; I135-L178 HydrophobicContact CG2-CD1 3.95Å; L172-L178 HydrophobicContact CD1-CD1 4.27Å; D174-L178 PolarHBondContact O-N 3.22Å; V175-L178 PolarHBondContact O-N 3.13Å; G176-L178 VanDerWaalsContact C-N 3.26Å; G176-L178 PolarHBondContact O-N 3.42Å; L178-C181 PolarHBondContact O-N 2.75Å; L178-L182 HydrophobicContact CD1-CD1 4.09Å; L178-L182 HydrophobicContact CD1-CG 4.19Å; L178-L182 HydrophobicContact CG-CD1 4.09Å; L178-L182 VanDerWaalsContact O-CG 3.3Å; L178-L182 WeakPolarHBondContact O-CG 3.27Å; L178-L182 PolarHBondContact O-N 2.97Å; L178-V205 HydrophobicContact CD1-CG1 4.37Å; L178-V211 HydrophobicContact CD2-CG2 3.73Å; L178-V230 HydrophobicContact CD2-CG1 3.88Å; L178-V230 HydrophobicContact CD2-CG2 4.15Å
179	L	97.4	Very high	92.4	Very high	9 Å²	9	49.5 Å²	49.5	5%	0.047	30%	0.297	C	S	.	.	H	α-helix	trans	-62.4	-47.2	178.9	-77.3	170.3	0	0	0	111.8	V175 G176 C181 L182 Y183 L226 Q229 V230 A233	V175-L179 WeakPolarHBondContact O-CG 3.25Å; V175-L179 PolarHBondContact O-N 2.89Å; G176-L179 PolarHBondContact O-N 3.24Å; G176-L179 VanDerWaalsContact O-N 3.08Å; L179-C181 VanDerWaalsContact C-N 3.27Å; L179-C181 PolarHBondContact O-N 3.03Å; L179-L182 PolarHBondContact O-N 3.11Å; L179-L182 VanDerWaalsContact O-N 3.16Å; L179-Y183 HydrophobicContact CB-CD2 4.29Å; L179-Y183 HydrophobicContact CB-CE2 3.95Å; L179-Y183 HydrophobicContact CD2-CE2 4.07Å; L179-Y183 WeakPolarHBondContact O-CD2 3.44Å; L179-Y183 PolarHBondContact O-N 2.83Å; L179-L226 HydrophobicContact CD1-CD2 3.93Å; L179-Q229 HydrophobicContact CD1-CB 4.23Å; L179-Q229 HydrophobicContact CD2-CB 3.93Å; L179-V230 HydrophobicContact CD1-CG2 4.39Å; L179-V230 HydrophobicContact CD2-CB 4.36Å; L179-V230 HydrophobicContact CD2-CG2 3.67Å; L179-V230 HydrophobicContact CG-CG2 3.84Å; L179-A233 HydrophobicContact CD2-CB 4.5Å
180	D	96.6	Very high	91.4	Very high	117 Å²	117	47.7 Å²	47.7	63%	0.626	29%	0.285	S	S	*	.	H	α-helix	trans	-58.6	-41.5	178	-71.5	-17.8	0	0	0	111.4	G176 G184	G176-D180 PolarHBondContact O-N 2.95Å; D180-G184 PolarHBondContact O-N 2.91Å
181	C	96.1	Very high	90.1	Very high	18 Å²	18	52.2 Å²	52.2	12%	0.122	31%	0.307	C	S	.	.	H	α-helix	trans	-62.6	-49.8	174.5	-177.9	0	0	0	0	111.6	L172 A177 L178 L179 Y183 G184 L185	L172-C181 HydrophobicContact CD1-CB 3.48Å; L172-C181 VanDerWaalsContact CD1-CB 3.48Å; A177-C181 VanDerWaalsContact O-CB 3.26Å; A177-C181 WeakPolarHBondContact O-CB 3.38Å; A177-C181 PolarHBondContact O-N 2.85Å; L178-C181 PolarHBondContact O-N 2.75Å; L179-C181 VanDerWaalsContact C-N 3.27Å; L179-C181 PolarHBondContact O-N 3.03Å; C181-Y183 PolarHBondContact O-N 3.16Å; C181-G184 PolarHBondContact O-N 3.24Å; C181-L185 WeakPolarHBondContact O-CB 3.34Å; C181-L185 VanDerWaalsContact O-CG 3.23Å; C181-L185 WeakPolarHBondContact O-CG 3.22Å; C181-L185 PolarHBondContact O-N 3.42Å
182	L	96	Very high	88.4	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.01	32%	0.315	C	S	.	.	H	α-helix	trans	-61.8	-43.5	-179.9	-68.2	172.9	0	0	0	111.9	I135 L178 L179 L185 G186 L203 A233 L234 M237	I135-L182 HydrophobicContact CD1-CD2 4.14Å; L178-L182 HydrophobicContact CD1-CD1 4.09Å; L178-L182 HydrophobicContact CD1-CG 4.19Å; L178-L182 HydrophobicContact CG-CD1 4.09Å; L178-L182 VanDerWaalsContact O-CG 3.3Å; L178-L182 WeakPolarHBondContact O-CG 3.27Å; L178-L182 PolarHBondContact O-N 2.97Å; L179-L182 PolarHBondContact O-N 3.11Å; L179-L182 VanDerWaalsContact O-N 3.16Å; L182-L185 PolarHBondContact O-N 3.07Å; L182-G186 PolarHBondContact O-N 2.9Å; L182-L203 HydrophobicContact CD2-CD2 3.83Å; L182-A233 HydrophobicContact CB-CB 4.03Å; L182-A233 HydrophobicContact CD1-CB 3.88Å; L182-L234 HydrophobicContact CD1-CD2 4Å; L182-L234 HydrophobicContact CD1-CG 4.11Å; L182-L234 HydrophobicContact CD2-CD2 3.91Å; L182-M237 HydrophobicContact CD2-CG 4.17Å
183	Y	94.1	Very high	86.9	Confident	115 Å²	115	53.1 Å²	53.1	45%	0.451	32%	0.315	S	S	.	.	H	α-helix	trans	-66.8	-40.5	176.4	-64.4	-43.7	0	0	0	112.3	L179 C181 L185 G186 G187 A233	L179-Y183 HydrophobicContact CB-CD2 4.29Å; L179-Y183 HydrophobicContact CB-CE2 3.95Å; L179-Y183 HydrophobicContact CD2-CE2 4.07Å; L179-Y183 WeakPolarHBondContact O-CD2 3.44Å; L179-Y183 PolarHBondContact O-N 2.83Å; C181-Y183 PolarHBondContact O-N 3.16Å; Y183-L185 VanDerWaalsContact C-N 3.35Å; Y183-G186 PolarHBondContact O-N 2.81Å; Y183-G187 PolarHBondContact O-N 3.05Å; Y183-A233 HydrophobicContact CE1-CB 4.07Å
184	G	91.5	Very high	85.2	Confident	45 Å²	45	48.6 Å²	48.6	46%	0.464	30%	0.299	S	S	.	.	H	α-helix	trans	-64.1	-38.4	175.2	0	0	0	0	0	112.9	D180 C181 G187 G189	D180-G184 PolarHBondContact O-N 2.91Å; C181-G184 PolarHBondContact O-N 3.24Å; G184-G187 PolarHBondContact O-N 3.02Å; G184-G189 WeakPolarHBondContact O-CA 2.89Å; G184-G189 PolarHBondContact O-N 3.1Å
185	L	90.6	Very high	83.1	Confident	7 Å²	7	50.7 Å²	50.7	4%	0.037	32%	0.315	C	S	.	.	I	π-helix	trans	-64.3	-42.4	173.3	-74.1	176.1	0	0	0	111.6	I133 F170 C181 L182 Y183 G189 L190 V193 M237	I133-L185 HydrophobicContact CD1-CD1 3.94Å; I133-L185 HydrophobicContact CD1-CD2 3.8Å; I133-L185 HydrophobicContact CD1-CG 4.47Å; I133-L185 HydrophobicContact CG2-CD1 4.16Å; F170-L185 HydrophobicContact CE2-CD2 4.49Å; F170-L185 HydrophobicContact CZ-CD2 4.44Å; C181-L185 WeakPolarHBondContact O-CB 3.34Å; C181-L185 VanDerWaalsContact O-CG 3.23Å; C181-L185 WeakPolarHBondContact O-CG 3.22Å; C181-L185 PolarHBondContact O-N 3.42Å; L182-L185 PolarHBondContact O-N 3.07Å; Y183-L185 VanDerWaalsContact C-N 3.35Å; L185-G189 PolarHBondContact O-N 2.84Å; L185-G189 VanDerWaalsContact O-N 3.11Å; L185-L190 HydrophobicContact CB-CD1 3.91Å; L185-L190 HydrophobicContact CD2-CD1 4.4Å; L185-L190 PolarHBondContact O-N 2.91Å; L185-L190 VanDerWaalsContact O-N 3.07Å; L185-V193 HydrophobicContact CD2-CG2 4.14Å; L185-M237 HydrophobicContact CB-CE 3.76Å
186	G	85.2	Confident	81.1	Confident	27 Å²	27	54 Å²	54	28%	0.278	35%	0.351	S	S	.	.	I	π-helix	trans	-66.6	-34.4	175.3	0	0	0	0	0	114	L182 Y183 G188 F241	L182-G186 PolarHBondContact O-N 2.9Å; Y183-G186 PolarHBondContact O-N 2.81Å; G186-G188 PolarHBondContact O-N 2.97Å; G186-F241 VanDerWaalsContact O-CZ 3.28Å; G186-F241 WeakPolarHBondContact O-CZ 3.42Å
187	G	79.7	Confident	79.1	Confident	74 Å²	74	56.4 Å²	56.4	76%	0.763	38%	0.377	S	S	*	.	I	π-helix	trans	-73.8	19.9	178.8	0	0	0	0	0	115.8	Y183 G184	Y183-G187 PolarHBondContact O-N 3.05Å; G184-G187 PolarHBondContact O-N 3.02Å
188	G	75.1	Confident	77.5	Confident	34 Å²	34	56.3 Å²	56.3	35%	0.351	38%	0.378	S	S	.	.	I	π-helix	trans	105.1	3.9	-177.7	0	0	0	0	0	114.8	G186	G186-G188 PolarHBondContact O-N 2.97Å
189	G	72.4	Confident	76.7	Confident	14 Å²	14	58.9 Å²	58.9	14%	0.144	40%	0.396	C	S	.	.	I	π-helix	trans	-64.7	-35.6	174.9	0	0	0	0	0	113.2	G184 L185 H191 K192 V193	G184-G189 WeakPolarHBondContact O-CA 2.89Å; G184-G189 PolarHBondContact O-N 3.1Å; L185-G189 PolarHBondContact O-N 2.84Å; L185-G189 VanDerWaalsContact O-N 3.11Å; G189-H191 VanDerWaalsContact C-N 3.31Å; G189-H191 PolarHBondContact O-N 3.37Å; G189-K192 WeakPolarHBondContact O-CB 3.17Å; G189-K192 PolarHBondContact O-N 2.86Å; G189-V193 VanDerWaalsContact O-CG2 3.31Å; G189-V193 WeakPolarHBondContact O-CG2 3.41Å; G189-V193 PolarHBondContact O-N 3.46Å
190	L	75.6	Confident	76.4	Confident	17 Å²	17	58.9 Å²	58.9	9%	0.089	40%	0.396	C	S	.	.	H	α-helix	trans	-55.4	-45	178.5	-114.2	84.4	0	0	0	112.8	I133 L185 K192 V193 C194 V200 M237 F241 V243	I133-L190 HydrophobicContact CD1-CD1 4.05Å; I133-L190 HydrophobicContact CD1-CG 4.32Å; L185-L190 HydrophobicContact CB-CD1 3.91Å; L185-L190 HydrophobicContact CD2-CD1 4.4Å; L185-L190 PolarHBondContact O-N 2.91Å; L185-L190 VanDerWaalsContact O-N 3.07Å; L190-K192 VanDerWaalsContact C-N 3.28Å; L190-K192 PolarHBondContact O-N 3.25Å; L190-V193 PolarHBondContact O-N 3.38Å; L190-C194 PolarHBondContact O-N 3.44Å; L190-C194 PolarHBondContact O-SG 3.35Å; L190-V200 HydrophobicContact CD2-CB 3.97Å; L190-V200 HydrophobicContact CD2-CG1 4.27Å; L190-V200 HydrophobicContact CG-CB 4.19Å; L190-V200 HydrophobicContact CG-CG1 4.48Å; L190-V200 HydrophobicContact CG-CG2 4.32Å; L190-M237 HydrophobicContact CD1-CE 3.22Å; L190-F241 HydrophobicContact CB-CD1 4.44Å; L190-F241 HydrophobicContact CD2-CB 3.78Å; L190-F241 HydrophobicContact CD2-CD1 3.95Å; L190-F241 HydrophobicContact CD2-CG 4.01Å; L190-V243 HydrophobicContact CD2-CG1 4.08Å
191	H	67.7	Low	76.3	Confident	163 Å²	163	55.7 Å²	55.7	76%	0.755	38%	0.377	S	S	*	.	H	α-helix	trans	-68.6	-28.2	179.9	-169.4	-65.7	0	0	0	112.2	G189	G189-H191 VanDerWaalsContact C-N 3.31Å; G189-H191 PolarHBondContact O-N 3.37Å
192	K	63.1	Low	76.3	Confident	169 Å²	169	55 Å²	55	74%	0.735	37%	0.372	S	S	*	.	H	α-helix	trans	-76.4	-31.3	176.5	-67	178.3	-179.5	176.9	0	112.6	G189 L190 C194	G189-K192 WeakPolarHBondContact O-CB 3.17Å; G189-K192 PolarHBondContact O-N 2.86Å; L190-K192 VanDerWaalsContact C-N 3.28Å; L190-K192 PolarHBondContact O-N 3.25Å; K192-C194 PolarHBondContact O-N 2.93Å
193	V	64.4	Low	76.4	Confident	21 Å²	21	55 Å²	55	13%	0.127	37%	0.372	C	S	.	.	H	α-helix	trans	-68.9	-23	177.7	172.9	0	0	0	0	111.3	I133 H168 L185 G189 L190 V195 V200	I133-V193 HydrophobicContact CD1-CG1 4.46Å; I133-V193 HydrophobicContact CG1-CG1 4.26Å; H168-V193 HydrophobicContact CB-CG1 3.78Å; H168-V193 WeakPolarHBondContact CD2-CG1 3.46Å; H168-V193 PolarHBondContact CE1-O 3.48Å; H168-V193 PolarHBondContact NE2-O 2.87Å; L185-V193 HydrophobicContact CD2-CG2 4.14Å; G189-V193 VanDerWaalsContact O-CG2 3.31Å; G189-V193 WeakPolarHBondContact O-CG2 3.41Å; G189-V193 PolarHBondContact O-N 3.46Å; L190-V193 PolarHBondContact O-N 3.38Å; V193-V195 PolarHBondContact O-N 2.85Å; V193-V200 HydrophobicContact CG1-CG2 4.22Å
194	C	60.5	Low	76.7	Confident	32 Å²	32	49.5 Å²	49.5	22%	0.216	35%	0.351	C	S	.	.			trans	-73.7	53.4	178.3	-60.2	0	0	0	0	113.8	L190 K192 G196 G198	L190-C194 PolarHBondContact O-N 3.44Å; L190-C194 PolarHBondContact O-SG 3.35Å; K192-C194 PolarHBondContact O-N 2.93Å; C194-G196 PolarHBondContact O-N 3.41Å; C194-G196 VanDerWaalsContact O-N 3.17Å; C194-G198 WeakPolarHBondContact CB-O 3.4Å; C194-G198 PolarHBondContact SG-O 2.88Å
195	V	52.2	Low	77	Confident	131 Å²	131	47.4 Å²	47.4	79%	0.794	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	108.2	174	-176	0	0	0	0	108.3	V193	V193-V195 PolarHBondContact O-N 2.85Å
196	G	53.7	Low	77.3	Confident	83 Å²	83	47.2 Å²	47.2	86%	0.856	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	114	10.6	179.8	0	0	0	0	0	116.1	C194	C194-G196 PolarHBondContact O-N 3.41Å; C194-G196 VanDerWaalsContact O-N 3.17Å
197	G	53.3	Low	77.8	Confident	80 Å²	80	46 Å²	46	83%	0.825	32%	0.315	S	S	*	.	S	Bend	trans	86.7	4.4	166.4	0	0	0	0	0	116.6
198	G	64	Low	78.6	Confident	24 Å²	24	42.4 Å²	42.4	25%	0.247	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-91.8	143.8	171.7	0	0	0	0	0	112.3	C194	C194-G198 WeakPolarHBondContact CB-O 3.4Å; C194-G198 PolarHBondContact SG-O 2.88Å
199	S	81.1	Confident	79.6	Confident	55 Å²	55	40.9 Å²	40.9	39%	0.385	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-81.2	143.3	171.4	59.1	0	0	0	0	111.3	Q130 S131 K201	Q130-S199 PolarHBondContact OE1-O 3.03Å; Q130-S199 PolarHBondContact OE1-OG 2.84Å; S131-S199 PolarHBondContact N-O 2.97Å; S199-K201 PolarHBondContact O-N 2.81Å; S199-K201 WeakPolarHBondContact OG-CE 3.45Å
200	V	91.7	Very high	80.6	Confident	8 Å²	8	41.9 Å²	41.9	5%	0.048	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	126.6	166.8	177.4	0	0	0	0	108.8	S131 I133 L190 V193 V243	S131-V200 WeakPolarHBondContact O-CA 3.43Å; I133-V200 HydrophobicContact CD1-CG1 3.97Å; I133-V200 HydrophobicContact CD1-CG2 4.22Å; I133-V200 HydrophobicContact CG1-CG1 3.93Å; I133-V200 HydrophobicContact CG1-CG2 4.26Å; L190-V200 HydrophobicContact CD2-CB 3.97Å; L190-V200 HydrophobicContact CD2-CG1 4.27Å; L190-V200 HydrophobicContact CG-CB 4.19Å; L190-V200 HydrophobicContact CG-CG1 4.48Å; L190-V200 HydrophobicContact CG-CG2 4.32Å; V193-V200 HydrophobicContact CG1-CG2 4.22Å; V200-V243 HydrophobicContact CG1-CG1 4.3Å; V200-V243 WeakPolarHBondContact O-CG1 3.33Å
201	K	93.6	Very high	81.5	Confident	51 Å²	51	41.4 Å²	41.4	22%	0.222	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	-14.3	177.9	-71.6	-61.3	-169.9	-176.9	0	114.1	L82 Q130 S131 S199 V243 A244	L82-K201 HydrophobicContact CD1-CB 4.01Å; L82-K201 WeakPolarHBondContact CD1-O 3.36Å; L82-K201 HydrophobicContact CD2-CB 4.44Å; Q130-K201 HydrophobicContact CB-CB 4.02Å; Q130-K201 HydrophobicContact CB-CG 4.01Å; Q130-K201 HydrophobicContact CG-CB 4.2Å; Q130-K201 HydrophobicContact CG-CG 3.8Å; Q130-K201 VanDerWaalsContact OE1-CG 3.28Å; S131-K201 PolarHBondContact O-N 3.32Å; S199-K201 PolarHBondContact O-N 2.81Å; S199-K201 WeakPolarHBondContact OG-CE 3.45Å; K201-V243 WeakPolarHBondContact O-CA 3.49Å; K201-A244 PolarHBondContact O-N 2.93Å
202	A	97.5	Very high	82.8	Confident	2 Å²	2	33.7 Å²	33.7	2%	0.017	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	144.3	177.3	0	0	0	0	0	113	L82 I124 V132 I133 A244	L82-A202 HydrophobicContact CD1-CB 4.2Å; I124-A202 HydrophobicContact CD1-CB 3.7Å; V132-A202 HydrophobicContact CG1-CB 4.27Å; V132-A202 HydrophobicContact CG2-CB 4.39Å; I133-A202 PolarHBondContact N-O 3.27Å; A202-A244 VanDerWaalsContact CA-O 3.26Å; A202-A244 WeakPolarHBondContact CA-O 3.2Å
203	L	98.4	Very high	84.2	Confident	2 Å²	2	28.7 Å²	28.7	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	118.8	169.8	169.8	63.6	0	0	0	108.3	I133 I135 L182 V205 L234 M237 V243 A244 V245 L246	I133-L203 HydrophobicContact CB-CD1 3.84Å; I133-L203 HydrophobicContact CG2-CD1 3.55Å; I133-L203 CarbonylContact O-C 3.54Å; I133-L203 WeakPolarHBondContact O-CA 3.32Å; I135-L203 HydrophobicContact CD1-CD1 3.89Å; I135-L203 HydrophobicContact CG1-CD1 4.08Å; L182-L203 HydrophobicContact CD2-CD2 3.83Å; L203-V205 HydrophobicContact CG-CG2 4.42Å; L203-L234 HydrophobicContact CD2-CD2 3.95Å; L203-M237 HydrophobicContact CD2-CB 4.06Å; L203-M237 HydrophobicContact CD2-CG 4.13Å; L203-V243 HydrophobicContact CB-CG2 4.43Å; L203-A244 PolarHBondContact N-O 3.42Å; L203-V245 HydrophobicContact CB-CG2 4.28Å; L203-V245 HydrophobicContact CD2-CG2 4.36Å; L203-V245 CarbonylContact O-C 3.51Å; L203-V245 VanDerWaalsContact O-CA 3.31Å; L203-V245 WeakPolarHBondContact O-CA 3.4Å; L203-L246 PolarHBondContact O-N 3.01Å
204	I	98.7	Very high	85.4	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130.3	179.3	-59.4	173.7	0	0	0	108.7	C117 V120 A121 V132 I133 Y134 I135 L246	C117-I204 HydrophobicContact CB-CG2 3.87Å; V120-I204 HydrophobicContact CG1-CD1 4.44Å; A121-I204 HydrophobicContact CB-CD1 3.78Å; V132-I204 HydrophobicContact CG1-CD1 3.82Å; V132-I204 HydrophobicContact CG1-CG1 4.2Å; I133-I204 PolarHBondContact O-N 2.82Å; Y134-I204 HydrophobicContact CD2-CB 3.94Å; Y134-I204 HydrophobicContact CD2-CD1 4.02Å; Y134-I204 HydrophobicContact CD2-CG2 3.87Å; Y134-I204 HydrophobicContact CE2-CB 4.23Å; Y134-I204 HydrophobicContact CE2-CD1 4.29Å; Y134-I204 HydrophobicContact CE2-CG2 3.63Å; Y134-I204 HydrophobicContact CG-CB 4.41Å; Y134-I204 HydrophobicContact CG-CG2 4.49Å; I135-I204 PolarHBondContact N-O 3.13Å; I204-L246 CarbonylContact C-O 3.39Å; I204-L246 VanDerWaalsContact CA-O 3.26Å; I204-L246 WeakPolarHBondContact CA-O 3.43Å; I204-L246 HydrophobicContact CG1-CB 4.19Å; I204-L246 HydrophobicContact CG1-CD2 4.47Å
205	V	98.7	Very high	86.8	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	106.5	172.8	-170.8	0	0	0	0	109.6	I135 T137 L178 L203 V208 L234 L246 V247 T248	I135-V205 HydrophobicContact CB-CG1 4.34Å; I135-V205 HydrophobicContact CB-CG2 4.29Å; I135-V205 HydrophobicContact CD1-CG2 4.26Å; I135-V205 HydrophobicContact CG2-CG1 4.34Å; T137-V205 HydrophobicContact CG2-CG1 4.27Å; L178-V205 HydrophobicContact CD1-CG1 4.37Å; L203-V205 HydrophobicContact CG-CG2 4.42Å; V205-V208 HydrophobicContact CB-CG1 4.04Å; V205-V208 HydrophobicContact CG1-CG1 3.71Å; V205-L234 HydrophobicContact CG2-CD2 3.98Å; V205-L246 PolarHBondContact N-O 3.09Å; V205-V247 HydrophobicContact CB-CG1 4.2Å; V205-V247 HydrophobicContact CG2-CG1 4.43Å; V205-V247 WeakPolarHBondContact O-CA 3.4Å; V205-T248 PolarHBondContact O-N 3.36Å
206	D	97.7	Very high	88.3	Confident	3 Å²	3	30.2 Å²	30.2	2%	0.016	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	89.2	-178.9	-170.5	28.9	0	0	0	109.7	S114 Y134 I135 T137 T248	S114-D206 WeakPolarHBondContact CA-OD2 3.38Å; S114-D206 WeakPolarHBondContact CB-OD2 3.42Å; S114-D206 PolarHBondContact OG-OD1 3.01Å; S114-D206 PolarHBondContact OG-OD2 3.3Å; Y134-D206 HydrophobicContact CE1-CB 3.9Å; Y134-D206 VanDerWaalsContact OH-CB 3.24Å; Y134-D206 WeakPolarHBondContact OH-CB 3.45Å; Y134-D206 PolarHBondContact OH-OD2 3.22Å; I135-D206 PolarHBondContact O-N 3.03Å; T137-D206 PolarHBondContact N-O 3.28Å; T137-D206 PolarHBondContact OG1-O 2.78Å; D206-T248 WeakPolarHBondContact CA-OG1 3.15Å; D206-T248 HydrophobicContact CB-CG2 4.32Å; D206-T248 WeakPolarHBondContact OD1-CB 3.29Å; D206-T248 WeakPolarHBondContact OD1-CG2 3.41Å; D206-T248 PolarHBondContact OD1-OG1 3.44Å
207	S	95.5	Very high	89.2	Confident	1 Å²	1	30.4 Å²	30.4	1%	0.007	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	cis	-134.6	143.4	10.5	75.2	0	0	0	0	111.5	T137 S209 A210 T248	T137-S207 PolarHBondContact OG1-N 2.89Å; T137-S207 PolarHBondContact OG1-O 3.3Å; S207-S209 PolarHBondContact O-N 3.18Å; S207-S209 PolarHBondContact OG-OG 3.24Å; S207-A210 PolarHBondContact O-N 3.21Å; S207-A210 VanDerWaalsContact O-N 3.13Å; S207-A210 WeakPolarHBondContact OG-CB 3.23Å; S207-A210 PolarHBondContact OG-N 2.97Å; S207-A210 VanDerWaalsContact OG-N 3.09Å; S207-T248 WeakPolarHBondContact CA-OG1 3.28Å; S207-T248 WeakPolarHBondContact CB-O 3.31Å; S207-T248 WeakPolarHBondContact CB-OG1 3.49Å
208	V	96.8	Very high	90.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-58.9	-33.4	174.4	-69.8	0	0	0	0	111.8	V205 A210 I212 L234 V247 T248 L263 W267	V205-V208 HydrophobicContact CB-CG1 4.04Å; V205-V208 HydrophobicContact CG1-CG1 3.71Å; V208-A210 VanDerWaalsContact C-N 3.35Å; V208-A210 PolarHBondContact O-N 3.33Å; V208-I212 HydrophobicContact CB-CD1 4.13Å; V208-I212 WeakPolarHBondContact O-CB 3.31Å; V208-I212 WeakPolarHBondContact O-CD1 3.3Å; V208-I212 VanDerWaalsContact O-CG1 3.23Å; V208-I212 WeakPolarHBondContact O-CG1 3.38Å; V208-I212 PolarHBondContact O-N 3.01Å; V208-L234 HydrophobicContact CG1-CD1 4.11Å; V208-V247 HydrophobicContact CG1-CB 3.95Å; V208-V247 HydrophobicContact CG1-CG1 3.83Å; V208-V247 HydrophobicContact CG2-CB 4.17Å; V208-T248 WeakPolarHBondContact CG2-O 3.42Å; V208-T248 PolarHBondContact N-O 2.92Å; V208-T248 VanDerWaalsContact N-O 3.12Å; V208-L263 HydrophobicContact CG2-CD1 3.85Å; V208-W267 HydrophobicContact CB-CH2 4.24Å; V208-W267 HydrophobicContact CB-CZ2 4.18Å; V208-W267 HydrophobicContact CG1-CH2 4.17Å; V208-W267 HydrophobicContact CG1-CZ2 4.22Å; V208-W267 HydrophobicContact CG2-CH2 4.27Å; V208-W267 HydrophobicContact CG2-CZ2 3.72Å
209	S	94.4	Very high	90.1	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.007	24%	0.243	C	C	.	.	H	α-helix	trans	-65.3	-32.4	178.7	49.1	0	0	0	0	114.4	S207 V211 I212 T213 N249 H250	S207-S209 PolarHBondContact O-N 3.18Å; S207-S209 PolarHBondContact OG-OG 3.24Å; S209-V211 VanDerWaalsContact C-N 3.26Å; S209-V211 PolarHBondContact O-N 3.17Å; S209-I212 PolarHBondContact O-N 3.33Å; S209-T213 WeakPolarHBondContact O-CB 3.27Å; S209-T213 PolarHBondContact O-N 3.3Å; S209-T213 PolarHBondContact O-OG1 3.01Å; S209-N249 WeakPolarHBondContact CB-OD1 3.48Å; S209-H250 PolarHBondContact OG-N 3.31Å; S209-H250 PolarHBondContact OG-ND1 3.39Å
210	A	94.4	Very high	89.4	Confident	36 Å²	36	42 Å²	42	30%	0.298	26%	0.255	S	S	.	.	H	α-helix	trans	-65	-32.5	-175.5	0	0	0	0	0	112.4	T137 T138 S207 V208 P214	T137-A210 WeakPolarHBondContact OG1-CB 3.29Å; T138-A210 HydrophobicContact CG2-CB 3.8Å; S207-A210 PolarHBondContact O-N 3.21Å; S207-A210 VanDerWaalsContact O-N 3.13Å; S207-A210 WeakPolarHBondContact OG-CB 3.23Å; S207-A210 PolarHBondContact OG-N 2.97Å; S207-A210 VanDerWaalsContact OG-N 3.09Å; V208-A210 VanDerWaalsContact C-N 3.35Å; V208-A210 PolarHBondContact O-N 3.33Å; A210-P214 WeakPolarHBondContact O-CD 3.24Å; A210-P214 WeakPolarHBondContact O-CG 3.37Å
211	V	95.1	Very high	88.8	Confident	7 Å²	7	48 Å²	48	4%	0.042	29%	0.287	C	S	.	.	H	α-helix	trans	-96.4	-24.1	179.4	-59.8	0	0	0	0	113.3	T137 V175 L178 S209	T137-V211 HydrophobicContact CG2-CG1 4.1Å; V175-V211 HydrophobicContact CB-CB 4.47Å; L178-V211 HydrophobicContact CD2-CG2 3.73Å; S209-V211 VanDerWaalsContact C-N 3.26Å; S209-V211 PolarHBondContact O-N 3.17Å
212	I	94.3	Very high	88.4	Confident	1 Å²	1	52 Å²	52	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-89.9	-46.8	-178.4	-63.3	171.4	0	0	0	111.6	V208 S209 P214 L215 L216 M227 V230 L263 W267	V208-I212 HydrophobicContact CB-CD1 4.13Å; V208-I212 WeakPolarHBondContact O-CB 3.31Å; V208-I212 WeakPolarHBondContact O-CD1 3.3Å; V208-I212 VanDerWaalsContact O-CG1 3.23Å; V208-I212 WeakPolarHBondContact O-CG1 3.38Å; V208-I212 PolarHBondContact O-N 3.01Å; S209-I212 PolarHBondContact O-N 3.33Å; I212-P214 VanDerWaalsContact C-CD 3.43Å; I212-L215 WeakPolarHBondContact O-CB 3.44Å; I212-L215 PolarHBondContact O-N 2.83Å; I212-L216 HydrophobicContact CG2-CD1 3.87Å; I212-L216 HydrophobicContact CG2-CD2 4.27Å; I212-L216 HydrophobicContact CG2-CG 4.02Å; I212-M227 HydrophobicContact CD1-CB 4.49Å; I212-M227 HydrophobicContact CD1-CG 4.17Å; I212-M227 HydrophobicContact CG2-CB 3.76Å; I212-M227 HydrophobicContact CG2-CG 3.88Å; I212-M227 HydrophobicContact CG2-SD 3.96Å; I212-V230 HydrophobicContact CD1-CB 4.38Å; I212-V230 HydrophobicContact CD1-CG1 4.23Å; I212-L263 HydrophobicContact CB-CD2 3.99Å; I212-L263 HydrophobicContact CD1-CD1 4.3Å; I212-L263 HydrophobicContact CG2-CD2 3.68Å; I212-W267 HydrophobicContact CD1-CH2 4.35Å; I212-W267 HydrophobicContact CD1-CZ3 4.03Å
213	T	91.9	Very high	88	Confident	63 Å²	63	52.2 Å²	52.2	39%	0.387	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-54.5	-40.6	-173.1	-63.6	0	0	0	0	114	S209 L215 L216	S209-T213 WeakPolarHBondContact O-CB 3.27Å; S209-T213 PolarHBondContact O-N 3.3Å; S209-T213 PolarHBondContact O-OG1 3.01Å; T213-L215 PolarHBondContact O-N 3.46Å; T213-L215 VanDerWaalsContact O-N 3.09Å; T213-L216 PolarHBondContact O-N 2.78Å
214	P	90.9	Very high	87.6	Confident	101 Å²	101	55.7 Å²	55.7	66%	0.656	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-60.5	-19.5	177.2	-25	35.8	0	0	0	114.7	A210 I212	A210-P214 WeakPolarHBondContact O-CD 3.24Å; A210-P214 WeakPolarHBondContact O-CG 3.37Å; I212-P214 VanDerWaalsContact C-CD 3.43Å
215	L	88.2	Confident	87.3	Confident	69 Å²	69	58.6 Å²	58.6	36%	0.361	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-93	-10.6	-179.7	-50.2	175	0	0	0	112.1	V175 I212 T213 L226	V175-L215 HydrophobicContact CB-CD1 3.84Å; V175-L215 HydrophobicContact CG1-CD1 3.38Å; V175-L215 HydrophobicContact CG2-CD1 4.4Å; I212-L215 WeakPolarHBondContact O-CB 3.44Å; I212-L215 PolarHBondContact O-N 2.83Å; T213-L215 PolarHBondContact O-N 3.46Å; T213-L215 VanDerWaalsContact O-N 3.09Å; L215-L226 HydrophobicContact CD1-CD1 4.11Å
216	L	85.2	Confident	87.1	Confident	47 Å²	47	61 Å²	61	25%	0.246	36%	0.359	C	S	.	.	S	Bend	trans	-94.4	136.8	-179.6	-56.9	-176.9	0	0	0	110.1	I212 T213 M224 M227 L263	I212-L216 HydrophobicContact CG2-CD1 3.87Å; I212-L216 HydrophobicContact CG2-CD2 4.27Å; I212-L216 HydrophobicContact CG2-CG 4.02Å; T213-L216 PolarHBondContact O-N 2.78Å; L216-M224 HydrophobicContact CD2-CG 4.48Å; L216-M224 HydrophobicContact CD2-SD 3.84Å; L216-M227 HydrophobicContact CD1-SD 4.21Å; L216-L263 HydrophobicContact CD1-CD2 3.75Å
217	G	73	Confident	87	Confident	87 Å²	87	60.9 Å²	60.9	90%	0.897	36%	0.358	S	S	*	.	S	Bend	trans	108.5	-1.6	175.9	0	0	0	0	0	115.8
218	G	70.5	Confident	87	Confident	58 Å²	58	64.7 Å²	64.7	60%	0.598	38%	0.378	S	S	*	.	S	Bend	trans	-78.1	171.1	168.7	0	0	0	0	0	113.2	Q220	G218-Q220 PolarHBondContact O-N 2.89Å
219	K	64.7	Low	87	Confident	207 Å²	207	68.2 Å²	68.2	90%	0.9	39%	0.394	S	S	*	.	S	Bend	trans	-69.4	-14.8	171.3	-69	-177.5	179	178.5	0	113.2
220	Q	66.4	Low	87.2	Confident	136 Å²	136	68.1 Å²	68.1	64%	0.636	39%	0.394	S	S	*	.	S	Bend	trans	-95.7	140.2	-174	-56.8	-61.5	-2.8	0	0	111.3	G218 E222	G218-Q220 PolarHBondContact O-N 2.89Å; Q220-E222 HydrophobicContact CB-CG 4.43Å; Q220-E222 PolarHBondContact O-N 3.19Å
221	N	79.9	Confident	87.3	Confident	135 Å²	135	66.6 Å²	66.6	72%	0.722	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	0	179	-68.6	-23.7	0	0	0	113.5	G223 M224 S225	N221-G223 PolarHBondContact O-N 2.97Å; N221-M224 WeakPolarHBondContact O-CB 3.42Å; N221-M224 PolarHBondContact O-N 3.43Å; N221-S225 PolarHBondContact O-N 3.27Å
222	E	84.4	Confident	87.4	Confident	136 Å²	136	68.7 Å²	68.7	64%	0.636	40%	0.399	S	S	*	.	H	α-helix	trans	-59.5	-44.2	-176	-68.9	173.7	-176.5	0	0	112.5	Q220 M224 S225 L226	Q220-E222 HydrophobicContact CB-CG 4.43Å; Q220-E222 PolarHBondContact O-N 3.19Å; E222-M224 VanDerWaalsContact C-N 3.29Å; E222-M224 PolarHBondContact O-N 2.89Å; E222-S225 WeakPolarHBondContact O-CB 3.27Å; E222-S225 PolarHBondContact O-N 2.98Å; E222-S225 VanDerWaalsContact O-N 3.13Å; E222-L226 WeakPolarHBondContact O-CG 3.17Å; E222-L226 PolarHBondContact O-N 2.87Å
223	G	89.3	Confident	87.5	Confident	5 Å²	5	69 Å²	69	5%	0.052	40%	0.402	C	S	.	.	H	α-helix	trans	-61.8	-36.7	177.7	0	0	0	0	0	113	N221 L226 M227	N221-G223 PolarHBondContact O-N 2.97Å; G223-L226 PolarHBondContact O-N 3.29Å; G223-M227 WeakPolarHBondContact O-CB 3.38Å; G223-M227 PolarHBondContact O-N 2.87Å
224	M	90.4	Very high	87.8	Confident	76 Å²	76	66 Å²	66	37%	0.374	38%	0.383	S	S	.	.	H	α-helix	trans	-67.1	-42.5	174.6	-65.1	-67.1	-74.4	0	0	111	L216 N221 E222 M227 I228 S266	L216-M224 HydrophobicContact CD2-CG 4.48Å; L216-M224 HydrophobicContact CD2-SD 3.84Å; N221-M224 WeakPolarHBondContact O-CB 3.42Å; N221-M224 PolarHBondContact O-N 3.43Å; E222-M224 VanDerWaalsContact C-N 3.29Å; E222-M224 PolarHBondContact O-N 2.89Å; M224-M227 HydrophobicContact CE-CE 3.83Å; M224-M227 PolarHBondContact O-N 3.46Å; M224-M227 HydrophobicContact SD-CE 3.6Å; M224-I228 VanDerWaalsContact O-CG1 3.31Å; M224-I228 WeakPolarHBondContact O-CG1 3.46Å; M224-I228 PolarHBondContact O-N 2.85Å; M224-S266 WeakPolarHBondContact CE-OG 3.38Å
225	S	92.6	Very high	88.1	Confident	62 Å²	62	65.3 Å²	65.3	43%	0.434	37%	0.37	S	S	.	.	H	α-helix	trans	-58.9	-47.6	175.4	179.5	0	0	0	0	111.7	N221 E222 M227 I228 Q229	N221-S225 PolarHBondContact O-N 3.27Å; E222-S225 WeakPolarHBondContact O-CB 3.27Å; E222-S225 PolarHBondContact O-N 2.98Å; E222-S225 VanDerWaalsContact O-N 3.13Å; S225-M227 PolarHBondContact O-N 3.41Å; S225-I228 PolarHBondContact O-N 3.16Å; S225-Q229 WeakPolarHBondContact O-CG 3.19Å; S225-Q229 PolarHBondContact O-N 3.35Å; S225-Q229 PolarHBondContact OG-NE2 3Å
226	L	94.5	Very high	88.4	Confident	50 Å²	50	65.1 Å²	65.1	26%	0.262	37%	0.371	S	S	.	.	H	α-helix	trans	-63.8	-41.3	178.8	-69.6	166.6	0	0	0	112	V175 L179 L215 E222 G223 I228 Q229 V230	V175-L226 HydrophobicContact CG1-CB 4.42Å; V175-L226 HydrophobicContact CG1-CD1 3.95Å; V175-L226 HydrophobicContact CG1-CD2 4.49Å; V175-L226 HydrophobicContact CG2-CB 4.29Å; L179-L226 HydrophobicContact CD1-CD2 3.93Å; L215-L226 HydrophobicContact CD1-CD1 4.11Å; E222-L226 WeakPolarHBondContact O-CG 3.17Å; E222-L226 PolarHBondContact O-N 2.87Å; G223-L226 PolarHBondContact O-N 3.29Å; L226-I228 VanDerWaalsContact C-N 3.31Å; L226-I228 PolarHBondContact O-N 2.97Å; L226-Q229 PolarHBondContact O-N 3.38Å; L226-V230 WeakPolarHBondContact O-CG2 3.37Å; L226-V230 PolarHBondContact O-N 3.08Å
227	M	95.3	Very high	88.8	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-58.6	-42.5	173.3	177.7	174.1	65.4	0	0	112	I212 L216 G223 M224 S225 V230 A231 L263 W267	I212-M227 HydrophobicContact CD1-CB 4.49Å; I212-M227 HydrophobicContact CD1-CG 4.17Å; I212-M227 HydrophobicContact CG2-CB 3.76Å; I212-M227 HydrophobicContact CG2-CG 3.88Å; I212-M227 HydrophobicContact CG2-SD 3.96Å; L216-M227 HydrophobicContact CD1-SD 4.21Å; G223-M227 WeakPolarHBondContact O-CB 3.38Å; G223-M227 PolarHBondContact O-N 2.87Å; M224-M227 HydrophobicContact CE-CE 3.83Å; M224-M227 PolarHBondContact O-N 3.46Å; M224-M227 HydrophobicContact SD-CE 3.6Å; S225-M227 PolarHBondContact O-N 3.41Å; M227-V230 PolarHBondContact O-N 2.99Å; M227-A231 WeakPolarHBondContact O-CB 3.45Å; M227-A231 PolarHBondContact O-N 3.2Å; M227-L263 HydrophobicContact SD-CB 4.11Å; M227-L263 HydrophobicContact SD-CD2 4.43Å; M227-W267 HydrophobicContact CG-CE3 3.56Å; M227-W267 HydrophobicContact CG-CZ3 4.01Å; M227-W267 HydrophobicContact SD-CB 4.03Å; M227-W267 HydrophobicContact SD-CE3 4.06Å
228	I	95.1	Very high	89.9	Confident	82 Å²	82	59 Å²	59	42%	0.421	32%	0.319	S	S	.	.	H	α-helix	trans	-68.2	-36.3	177.6	-66.1	-59.8	0	0	0	111.4	M224 S225 L226 A231 A232	M224-I228 VanDerWaalsContact O-CG1 3.31Å; M224-I228 WeakPolarHBondContact O-CG1 3.46Å; M224-I228 PolarHBondContact O-N 2.85Å; S225-I228 PolarHBondContact O-N 3.16Å; L226-I228 VanDerWaalsContact C-N 3.31Å; L226-I228 PolarHBondContact O-N 2.97Å; I228-A231 WeakPolarHBondContact O-CB 3.29Å; I228-A231 PolarHBondContact O-N 3.3Å; I228-A232 WeakPolarHBondContact O-CB 3.13Å; I228-A232 PolarHBondContact O-N 3.4Å
229	Q	96.3	Very high	90.9	Very high	73 Å²	73	63.4 Å²	63.4	34%	0.341	32%	0.321	S	S	.	.	H	α-helix	trans	-63.4	-44.6	173	-71	178.3	57.1	0	0	111.8	L179 S225 L226 A231 A232 A233	L179-Q229 HydrophobicContact CD1-CB 4.23Å; L179-Q229 HydrophobicContact CD2-CB 3.93Å; S225-Q229 WeakPolarHBondContact O-CG 3.19Å; S225-Q229 PolarHBondContact O-N 3.35Å; S225-Q229 PolarHBondContact OG-NE2 3Å; L226-Q229 PolarHBondContact O-N 3.38Å; Q229-A231 VanDerWaalsContact C-N 3.32Å; Q229-A231 PolarHBondContact O-N 3.47Å; Q229-A232 PolarHBondContact O-N 2.93Å; Q229-A233 WeakPolarHBondContact O-CB 3.11Å; Q229-A233 PolarHBondContact O-N 3.41Å
230	V	97.8	Very high	92.1	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-61.2	-44.1	175.1	172.5	0	0	0	0	110.3	V175 L178 L179 I212 L226 M227 A232 A233 L234 W267	V175-V230 HydrophobicContact CG2-CG2 3.65Å; L178-V230 HydrophobicContact CD2-CG1 3.88Å; L178-V230 HydrophobicContact CD2-CG2 4.15Å; L179-V230 HydrophobicContact CD1-CG2 4.39Å; L179-V230 HydrophobicContact CD2-CB 4.36Å; L179-V230 HydrophobicContact CD2-CG2 3.67Å; L179-V230 HydrophobicContact CG-CG2 3.84Å; I212-V230 HydrophobicContact CD1-CB 4.38Å; I212-V230 HydrophobicContact CD1-CG1 4.23Å; L226-V230 WeakPolarHBondContact O-CG2 3.37Å; L226-V230 PolarHBondContact O-N 3.08Å; M227-V230 PolarHBondContact O-N 2.99Å; V230-A232 PolarHBondContact O-N 3.21Å; V230-A233 PolarHBondContact O-N 3.18Å; V230-L234 HydrophobicContact CG1-CD1 3.84Å; V230-L234 HydrophobicContact CG1-CG 4.31Å; V230-L234 WeakPolarHBondContact O-CB 3.38Å; V230-L234 VanDerWaalsContact O-CG 3.29Å; V230-L234 WeakPolarHBondContact O-CG 3.46Å; V230-L234 PolarHBondContact O-N 3.01Å; V230-W267 HydrophobicContact CG1-CH2 4.38Å
231	A	97.6	Very high	93.2	Very high	4 Å²	4	56 Å²	56	3%	0.033	29%	0.293	C	S	.	.	H	α-helix	trans	-60	-43.4	176.4	0	0	0	0	0	112.8	M227 I228 Q229 K235 W267 V270	M227-A231 WeakPolarHBondContact O-CB 3.45Å; M227-A231 PolarHBondContact O-N 3.2Å; I228-A231 WeakPolarHBondContact O-CB 3.29Å; I228-A231 PolarHBondContact O-N 3.3Å; Q229-A231 VanDerWaalsContact C-N 3.32Å; Q229-A231 PolarHBondContact O-N 3.47Å; A231-K235 WeakPolarHBondContact O-CB 3.13Å; A231-K235 WeakPolarHBondContact O-CG 3.23Å; A231-K235 PolarHBondContact O-N 3.37Å; A231-W267 HydrophobicContact CB-CE3 4.19Å; A231-W267 HydrophobicContact CB-CZ3 3.77Å; A231-V270 HydrophobicContact CB-CB 4.14Å; A231-V270 HydrophobicContact CB-CG1 3.57Å; A231-V270 HydrophobicContact CB-CG2 3.46Å; A231-V270 VanDerWaalsContact CB-CG2 3.46Å
232	A	96.6	Very high	93.8	Very high	51 Å²	51	51.5 Å²	51.5	42%	0.421	27%	0.269	S	S	.	.	H	α-helix	trans	-64.4	-48.8	177.2	0	0	0	0	0	110.7	I228 Q229 V230 L234 K235 T236	I228-A232 WeakPolarHBondContact O-CB 3.13Å; I228-A232 PolarHBondContact O-N 3.4Å; Q229-A232 PolarHBondContact O-N 2.93Å; V230-A232 PolarHBondContact O-N 3.21Å; A232-L234 PolarHBondContact O-N 2.92Å; A232-K235 PolarHBondContact O-N 2.99Å; A232-K235 VanDerWaalsContact O-N 3.14Å; A232-T236 PolarHBondContact O-N 3.09Å; A232-T236 PolarHBondContact O-OG1 3.48Å
233	A	96.9	Very high	94.3	Very high	7 Å²	7	45.1 Å²	45.1	6%	0.058	24%	0.239	C	C	.	.	H	α-helix	trans	-57.1	-48.5	177.3	0	0	0	0	0	111.4	L179 L182 Y183 Q229 V230 K235 T236 M237	L179-A233 HydrophobicContact CD2-CB 4.5Å; L182-A233 HydrophobicContact CB-CB 4.03Å; L182-A233 HydrophobicContact CD1-CB 3.88Å; Y183-A233 HydrophobicContact CE1-CB 4.07Å; Q229-A233 WeakPolarHBondContact O-CB 3.11Å; Q229-A233 PolarHBondContact O-N 3.41Å; V230-A233 PolarHBondContact O-N 3.18Å; A233-K235 VanDerWaalsContact C-N 3.33Å; A233-K235 PolarHBondContact O-N 3.02Å; A233-T236 WeakPolarHBondContact O-CB 3.32Å; A233-T236 PolarHBondContact O-N 3.22Å; A233-M237 VanDerWaalsContact O-CG 3.27Å; A233-M237 WeakPolarHBondContact O-CG 3.11Å; A233-M237 PolarHBondContact O-N 3.48Å
234	L	98	Very high	94.7	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.9	-37.1	177.1	-69.6	170.7	0	0	0	113.1	I102 L182 L203 V205 V208 V230 A232 M237 A238 V245 V247 W267	I102-L234 HydrophobicContact CD1-CB 3.79Å; L182-L234 HydrophobicContact CD1-CD2 4Å; L182-L234 HydrophobicContact CD1-CG 4.11Å; L182-L234 HydrophobicContact CD2-CD2 3.91Å; L203-L234 HydrophobicContact CD2-CD2 3.95Å; V205-L234 HydrophobicContact CG2-CD2 3.98Å; V208-L234 HydrophobicContact CG1-CD1 4.11Å; V230-L234 HydrophobicContact CG1-CD1 3.84Å; V230-L234 HydrophobicContact CG1-CG 4.31Å; V230-L234 WeakPolarHBondContact O-CB 3.38Å; V230-L234 VanDerWaalsContact O-CG 3.29Å; V230-L234 WeakPolarHBondContact O-CG 3.46Å; V230-L234 PolarHBondContact O-N 3.01Å; A232-L234 PolarHBondContact O-N 2.92Å; L234-M237 PolarHBondContact O-N 3.48Å; L234-A238 WeakPolarHBondContact O-CB 3.5Å; L234-A238 PolarHBondContact O-N 3.23Å; L234-V245 HydrophobicContact CD2-CG1 4.03Å; L234-V247 HydrophobicContact CD1-CG1 3.97Å; L234-W267 HydrophobicContact CD1-CH2 4.01Å
235	K	96.7	Very high	95.1	Very high	87 Å²	87	41.4 Å²	41.4	38%	0.378	22%	0.22	S	C	.	.	H	α-helix	trans	-66.7	-42.6	176	-79.2	-180	177.6	-179	0	111.5	I102 A231 A232 A233 A238 K239 V270	I102-K235 HydrophobicContact CD1-CB 4.45Å; I102-K235 HydrophobicContact CD1-CG 3.64Å; A231-K235 WeakPolarHBondContact O-CB 3.13Å; A231-K235 WeakPolarHBondContact O-CG 3.23Å; A231-K235 PolarHBondContact O-N 3.37Å; A232-K235 PolarHBondContact O-N 2.99Å; A232-K235 VanDerWaalsContact O-N 3.14Å; A233-K235 VanDerWaalsContact C-N 3.33Å; A233-K235 PolarHBondContact O-N 3.02Å; K235-A238 PolarHBondContact O-N 2.94Å; K235-K239 WeakPolarHBondContact O-CB 3.48Å; K235-K239 PolarHBondContact O-N 2.99Å; K235-V270 VanDerWaalsContact CE-O 3.31Å; K235-V270 WeakPolarHBondContact CE-O 3.37Å
236	T	94.2	Very high	95.4	Very high	64 Å²	64	38.6 Å²	38.6	39%	0.393	20%	0.2	S	C	.	.	H	α-helix	trans	-60.4	-46.1	173	-63.3	0	0	0	0	110.4	A232 A233 A238 K239 D240	A232-T236 PolarHBondContact O-N 3.09Å; A232-T236 PolarHBondContact O-OG1 3.48Å; A233-T236 WeakPolarHBondContact O-CB 3.32Å; A233-T236 PolarHBondContact O-N 3.22Å; T236-A238 PolarHBondContact O-N 3.25Å; T236-K239 PolarHBondContact O-N 3.47Å; T236-D240 HydrophobicContact CG2-CB 4.44Å; T236-D240 WeakPolarHBondContact CG2-OD2 3.29Å; T236-D240 VanDerWaalsContact O-CB 3.3Å; T236-D240 WeakPolarHBondContact O-CB 3.35Å; T236-D240 PolarHBondContact O-N 3.39Å
237	M	94.3	Very high	95.6	Very high	5 Å²	5	36.2 Å²	36.2	3%	0.025	19%	0.188	C	C	.	.	H	α-helix	trans	-56.1	-50.9	175.2	-65.9	-49.5	-70.2	0	0	111.2	L182 L185 L190 L203 A233 L234 F241 V243	L182-M237 HydrophobicContact CD2-CG 4.17Å; L185-M237 HydrophobicContact CB-CE 3.76Å; L190-M237 HydrophobicContact CD1-CE 3.22Å; L203-M237 HydrophobicContact CD2-CB 4.06Å; L203-M237 HydrophobicContact CD2-CG 4.13Å; A233-M237 VanDerWaalsContact O-CG 3.27Å; A233-M237 WeakPolarHBondContact O-CG 3.11Å; A233-M237 PolarHBondContact O-N 3.48Å; L234-M237 PolarHBondContact O-N 3.48Å; M237-F241 HydrophobicContact CE-CD2 4.22Å; M237-F241 HydrophobicContact CE-CE2 4.45Å; M237-F241 WeakPolarHBondContact O-CB 3.26Å; M237-F241 PolarHBondContact O-N 3.27Å; M237-F241 HydrophobicContact SD-CD2 4.1Å; M237-F241 HydrophobicContact SD-CE2 4Å; M237-V243 WeakPolarHBondContact O-CG2 3.26Å
238	A	95.6	Very high	95.7	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.008	19%	0.188	C	C	.	.	H	α-helix	trans	-58.9	-53.3	-178.3	0	0	0	0	0	112	G100 I102 L234 K235 T236 N242 V243 V245	G100-A238 WeakPolarHBondContact CA-O 3.44Å; G100-A238 PolarHBondContact N-O 3.05Å; I102-A238 HydrophobicContact CG1-CB 4.31Å; L234-A238 WeakPolarHBondContact O-CB 3.5Å; L234-A238 PolarHBondContact O-N 3.23Å; K235-A238 PolarHBondContact O-N 2.94Å; T236-A238 PolarHBondContact O-N 3.25Å; A238-N242 WeakPolarHBondContact O-CA 3.33Å; A238-N242 PolarHBondContact O-N 3.37Å; A238-N242 VanDerWaalsContact O-N 3.13Å; A238-V243 WeakPolarHBondContact CA-O 3.2Å; A238-V243 PolarHBondContact O-N 3.41Å; A238-V243 VanDerWaalsContact O-N 3.12Å; A238-V245 HydrophobicContact CB-CB 4.36Å; A238-V245 HydrophobicContact CB-CG2 3.59Å
239	K	92	Very high	95.8	Very high	150 Å²	150	32.3 Å²	32.3	65%	0.652	17%	0.167	S	C	*	.	H	α-helix	trans	-75.7	-54.8	-172.8	-71.8	-169.3	171.9	-165.8	0	113.3	G100 K235 T236 F241 N242	G100-K239 WeakPolarHBondContact O-CG 3.37Å; K235-K239 WeakPolarHBondContact O-CB 3.48Å; K235-K239 PolarHBondContact O-N 2.99Å; T236-K239 PolarHBondContact O-N 3.47Å; K239-F241 VanDerWaalsContact C-N 3.3Å; K239-F241 PolarHBondContact O-N 3.44Å; K239-N242 PolarHBondContact O-N 2.84Å
240	D	89.4	Confident	95.8	Very high	120 Å²	120	31.9 Å²	31.9	64%	0.642	17%	0.165	S	C	*	.	H	α-helix	trans	-74	-27.4	-167.8	-61.6	10.9	0	0	0	111.5	T236	T236-D240 HydrophobicContact CG2-CB 4.44Å; T236-D240 WeakPolarHBondContact CG2-OD2 3.29Å; T236-D240 VanDerWaalsContact O-CB 3.3Å; T236-D240 WeakPolarHBondContact O-CB 3.35Å; T236-D240 PolarHBondContact O-N 3.39Å
241	F	90.1	Very high	95.6	Very high	67 Å²	67	33.6 Å²	33.6	29%	0.294	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	1.3	177.1	-56.7	-87.6	0	0	0	113.4	G186 L190 M237 K239 V243	G186-F241 VanDerWaalsContact O-CZ 3.28Å; G186-F241 WeakPolarHBondContact O-CZ 3.42Å; L190-F241 HydrophobicContact CB-CD1 4.44Å; L190-F241 HydrophobicContact CD2-CB 3.78Å; L190-F241 HydrophobicContact CD2-CD1 3.95Å; L190-F241 HydrophobicContact CD2-CG 4.01Å; M237-F241 HydrophobicContact CE-CD2 4.22Å; M237-F241 HydrophobicContact CE-CE2 4.45Å; M237-F241 WeakPolarHBondContact O-CB 3.26Å; M237-F241 PolarHBondContact O-N 3.27Å; M237-F241 HydrophobicContact SD-CD2 4.1Å; M237-F241 HydrophobicContact SD-CE2 4Å; K239-F241 VanDerWaalsContact C-N 3.3Å; K239-F241 PolarHBondContact O-N 3.44Å; F241-V243 VanDerWaalsContact C-N 3.3Å; F241-V243 HydrophobicContact CB-CG1 4.19Å; F241-V243 PolarHBondContact O-N 3.25Å
242	N	92.3	Very high	95.3	Very high	42 Å²	42	36.5 Å²	36.5	23%	0.225	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.5	50.9	179.5	-169.4	27.2	0	0	0	112.7	S78 T99 A238 K239	S78-N242 PolarHBondContact O-ND2 2.96Å; S78-N242 PolarHBondContact O-OD1 3.32Å; T99-N242 WeakPolarHBondContact CB-O 3.31Å; T99-N242 WeakPolarHBondContact CB-OD1 3.32Å; T99-N242 WeakPolarHBondContact CG2-O 3.47Å; T99-N242 PolarHBondContact OG1-OD1 3.28Å; A238-N242 WeakPolarHBondContact O-CA 3.33Å; A238-N242 PolarHBondContact O-N 3.37Å; A238-N242 VanDerWaalsContact O-N 3.13Å; K239-N242 PolarHBondContact O-N 2.84Å
243	V	95.4	Very high	95	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.006	21%	0.207	C	C	.	.			trans	-109.1	149.8	175.5	-57.5	0	0	0	0	110.4	G100 L190 V200 K201 L203 M237 A238 F241 V245	G100-V243 PolarHBondContact N-O 2.9Å; G100-V243 VanDerWaalsContact N-O 3.13Å; L190-V243 HydrophobicContact CD2-CG1 4.08Å; V200-V243 HydrophobicContact CG1-CG1 4.3Å; V200-V243 WeakPolarHBondContact O-CG1 3.33Å; K201-V243 WeakPolarHBondContact O-CA 3.49Å; L203-V243 HydrophobicContact CB-CG2 4.43Å; M237-V243 WeakPolarHBondContact O-CG2 3.26Å; A238-V243 WeakPolarHBondContact CA-O 3.2Å; A238-V243 PolarHBondContact O-N 3.41Å; A238-V243 VanDerWaalsContact O-N 3.12Å; F241-V243 VanDerWaalsContact C-N 3.3Å; F241-V243 HydrophobicContact CB-CG1 4.19Å; F241-V243 PolarHBondContact O-N 3.25Å; V243-V245 HydrophobicContact CG2-CG2 4.04Å
244	A	98.1	Very high	94.5	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.008	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	119.2	170.5	0	0	0	0	0	109.1	L82 L97 T99 K201 A202 L203	L82-A244 HydrophobicContact CD1-CB 3.75Å; L82-A244 HydrophobicContact CG-CB 4.41Å; L97-A244 HydrophobicContact CB-CB 4.04Å; T99-A244 HydrophobicContact CG2-CB 4.26Å; K201-A244 PolarHBondContact O-N 2.93Å; A202-A244 VanDerWaalsContact CA-O 3.26Å; A202-A244 WeakPolarHBondContact CA-O 3.2Å; L203-A244 PolarHBondContact N-O 3.42Å
245	V	98.7	Very high	93.8	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.012	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	121.5	179.2	179.4	0	0	0	0	109.6	E101 I102 T103 L203 L234 A238 V243 V247	E101-V245 PolarHBondContact O-N 3.34Å; I102-V245 CarbonylContact C-O 3.52Å; I102-V245 WeakPolarHBondContact CA-O 3.12Å; I102-V245 HydrophobicContact CB-CB 4.39Å; I102-V245 HydrophobicContact CG1-CB 3.93Å; I102-V245 HydrophobicContact CG1-CG1 4.04Å; I102-V245 HydrophobicContact CG2-CG1 4.2Å; T103-V245 PolarHBondContact N-O 2.93Å; L203-V245 HydrophobicContact CB-CG2 4.28Å; L203-V245 HydrophobicContact CD2-CG2 4.36Å; L203-V245 CarbonylContact O-C 3.51Å; L203-V245 VanDerWaalsContact O-CA 3.31Å; L203-V245 WeakPolarHBondContact O-CA 3.4Å; L234-V245 HydrophobicContact CD2-CG1 4.03Å; A238-V245 HydrophobicContact CB-CB 4.36Å; A238-V245 HydrophobicContact CB-CG2 3.59Å; V243-V245 HydrophobicContact CG2-CG2 4.04Å; V245-V247 HydrophobicContact CG1-CG1 3.98Å
246	L	98.8	Very high	93.3	Very high	4 Å²	4	50.4 Å²	50.4	2%	0.021	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	120.3	175	-176.4	65.8	0	0	0	109.4	L97 T103 L105 V120 L203 I204 V205	L97-L246 HydrophobicContact CD1-CB 4.47Å; L97-L246 HydrophobicContact CD1-CD2 4.31Å; L97-L246 HydrophobicContact CD2-CD1 4.19Å; T103-L246 HydrophobicContact CG2-CD1 4.08Å; T103-L246 WeakPolarHBondContact O-CA 3.47Å; L105-L246 HydrophobicContact CD1-CD1 4.02Å; L105-L246 HydrophobicContact CD1-CD2 4.26Å; L105-L246 HydrophobicContact CD1-CG 4.42Å; L105-L246 HydrophobicContact CD2-CD1 4.38Å; L105-L246 HydrophobicContact CG-CD1 3.79Å; V120-L246 HydrophobicContact CB-CD2 4.48Å; V120-L246 HydrophobicContact CG1-CD2 4.36Å; V120-L246 HydrophobicContact CG2-CD2 4.43Å; L203-L246 PolarHBondContact O-N 3.01Å; I204-L246 CarbonylContact C-O 3.39Å; I204-L246 VanDerWaalsContact CA-O 3.26Å; I204-L246 WeakPolarHBondContact CA-O 3.43Å; I204-L246 HydrophobicContact CG1-CB 4.19Å; I204-L246 HydrophobicContact CG1-CD2 4.47Å; V205-L246 PolarHBondContact N-O 3.09Å
247	V	98.8	Very high	92.9	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	145.3	178.4	-61	0	0	0	0	110.3	I102 T103 E104 L105 V205 V208 L234 V245 W267	I102-V247 HydrophobicContact CG2-CG1 4.24Å; I102-V247 HydrophobicContact CG2-CG2 3.89Å; T103-V247 PolarHBondContact O-N 3.19Å; E104-V247 CarbonylContact C-O 3.54Å; E104-V247 WeakPolarHBondContact CA-O 3.45Å; E104-V247 HydrophobicContact CB-CG2 3.76Å; E104-V247 HydrophobicContact CG-CG2 4.11Å; L105-V247 PolarHBondContact N-O 3.17Å; V205-V247 HydrophobicContact CB-CG1 4.2Å; V205-V247 HydrophobicContact CG2-CG1 4.43Å; V205-V247 WeakPolarHBondContact O-CA 3.4Å; V208-V247 HydrophobicContact CG1-CB 3.95Å; V208-V247 HydrophobicContact CG1-CG1 3.83Å; V208-V247 HydrophobicContact CG2-CB 4.17Å; L234-V247 HydrophobicContact CD1-CG1 3.97Å; V245-V247 HydrophobicContact CG1-CG1 3.98Å; V247-W267 HydrophobicContact CG2-CZ2 4.47Å
248	T	98.3	Very high	92.5	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	144.4	171	73.5	0	0	0	0	111.5	L105 K113 C117 V205 D206 S207 V208	L105-T248 HydrophobicContact CB-CG2 4.4Å; L105-T248 CarbonylContact O-C 3.6Å; L105-T248 VanDerWaalsContact O-CA 3.3Å; L105-T248 WeakPolarHBondContact O-CA 3.48Å; K113-T248 HydrophobicContact CB-CG2 3.96Å; C117-T248 WeakPolarHBondContact SG-CG2 3.25Å; V205-T248 PolarHBondContact O-N 3.36Å; D206-T248 WeakPolarHBondContact CA-OG1 3.15Å; D206-T248 HydrophobicContact CB-CG2 4.32Å; D206-T248 WeakPolarHBondContact OD1-CB 3.29Å; D206-T248 WeakPolarHBondContact OD1-CG2 3.41Å; D206-T248 PolarHBondContact OD1-OG1 3.44Å; S207-T248 WeakPolarHBondContact CA-OG1 3.28Å; S207-T248 WeakPolarHBondContact CB-O 3.31Å; S207-T248 WeakPolarHBondContact CB-OG1 3.49Å; V208-T248 WeakPolarHBondContact CG2-O 3.42Å; V208-T248 PolarHBondContact N-O 2.92Å; V208-T248 VanDerWaalsContact N-O 3.12Å
249	N	96.8	Very high	92.2	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	149.6	-179.1	-166.2	-1.1	0	0	0	110.5	E104 L105 T106 G107 K113 S209	E104-N249 HydrophobicContact CG-CB 4.12Å; E104-N249 VanDerWaalsContact OE1-CB 3.27Å; E104-N249 WeakPolarHBondContact OE1-CB 3.27Å; E104-N249 PolarHBondContact OE1-ND2 2.95Å; L105-N249 PolarHBondContact O-N 2.99Å; T106-N249 WeakPolarHBondContact CA-O 3.32Å; T106-N249 HydrophobicContact CG2-CB 4.35Å; G107-N249 PolarHBondContact N-O 3.35Å; G107-N249 VanDerWaalsContact N-O 3.16Å; K113-N249 WeakPolarHBondContact CD-O 3.45Å; K113-N249 WeakPolarHBondContact CE-O 3.4Å; S209-N249 WeakPolarHBondContact CB-OD1 3.48Å
250	H	95.2	Very high	92.2	Very high	64 Å²	64	55.5 Å²	55.5	30%	0.296	30%	0.304	S	S	.	.			trans	-83	162.2	170.6	-70.4	91.6	0	0	0	111	S209 G262	S209-H250 PolarHBondContact OG-N 3.31Å; S209-H250 PolarHBondContact OG-ND1 3.39Å; H250-G262 WeakPolarHBondContact O-CA 3.35Å; H250-G262 PolarHBondContact O-N 3.25Å
251	V	94.4	Very high	92.4	Very high	36 Å²	36	51.1 Å²	51.1	22%	0.218	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	151.6	169.5	-64.1	0	0	0	0	110.6	T106 V259 Q260 L276	T106-V251 HydrophobicContact CG2-CG1 3.5Å; T106-V251 VanDerWaalsContact CG2-CG1 3.5Å; V251-V259 HydrophobicContact CB-CG1 3.58Å; V251-V259 HydrophobicContact CG1-CG1 3.62Å; V251-V259 HydrophobicContact CG2-CG1 3.81Å; V251-Q260 CarbonylContact C-O 3.58Å; V251-Q260 WeakPolarHBondContact CA-O 3.29Å; V251-Q260 WeakPolarHBondContact CB-O 3.41Å; V251-L276 HydrophobicContact CG1-CD1 3.7Å
252	T	91.4	Very high	92.4	Very high	64 Å²	64	48.7 Å²	48.7	39%	0.393	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	172.7	164.7	58.3	0	0	0	0	108.9	Q260	T252-Q260 PolarHBondContact N-O 3.05Å; T252-Q260 PolarHBondContact O-N 3.02Å
253	R	89.4	Confident	92.4	Very high	193 Å²	193	47 Å²	47	73%	0.728	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	138.1	171.4	-69	-171.7	177.2	-161	-2.3	109.9	E258	R253-E258 CarbonylContact C-O 3.53Å; R253-E258 VanDerWaalsContact CA-O 3.29Å; R253-E258 WeakPolarHBondContact CA-O 3.34Å
254	S	86	Confident	92.2	Very high	25 Å²	25	48.8 Å²	48.8	18%	0.175	29%	0.285	C	S	.	.			trans	-68.8	172.5	169.8	66.9	0	0	0	0	111	S256 G257 E258	S254-S256 PolarHBondContact O-N 3.09Å; S254-S256 PolarHBondContact OG-N 2.76Å; S254-S256 PolarHBondContact OG-OG 3.29Å; S254-G257 PolarHBondContact O-N 3.42Å; S254-G257 PolarHBondContact OG-N 3.49Å; S254-E258 PolarHBondContact N-O 3.38Å; S254-E258 PolarHBondContact OG-N 3.47Å; S254-E258 PolarHBondContact OG-O 3.39Å
255	S	84.1	Confident	91.8	Very high	138 Å²	138	54 Å²	54	97%	0.965	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-26	169.6	50.5	0	0	0	0	112.9	G257	S255-G257 VanDerWaalsContact C-N 3.26Å
256	S	86.6	Confident	91.4	Very high	82 Å²	82	56.5 Å²	56.5	57%	0.573	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-4.9	172.1	55	0	0	0	0	113.6	S254 E258	S254-S256 PolarHBondContact O-N 3.09Å; S254-S256 PolarHBondContact OG-N 2.76Å; S254-S256 PolarHBondContact OG-OG 3.29Å; S256-E258 VanDerWaalsContact C-N 3.32Å
257	G	84.9	Confident	91.2	Very high	37 Å²	37	56.3 Å²	56.3	38%	0.381	33%	0.334	S	S	.	.			trans	85.2	0.2	-178.8	0	0	0	0	0	114.7	S254 S255	S254-G257 PolarHBondContact O-N 3.42Å; S254-G257 PolarHBondContact OG-N 3.49Å; S255-G257 VanDerWaalsContact C-N 3.26Å
258	E	86.8	Confident	91	Very high	138 Å²	138	57.6 Å²	57.6	65%	0.645	34%	0.343	S	S	*	.			trans	-73	141.9	178.7	-65.2	179.7	157.7	0	0	111.5	R253 S254 S256	R253-E258 CarbonylContact C-O 3.53Å; R253-E258 VanDerWaalsContact CA-O 3.29Å; R253-E258 WeakPolarHBondContact CA-O 3.34Å; S254-E258 PolarHBondContact N-O 3.38Å; S254-E258 PolarHBondContact OG-N 3.47Å; S254-E258 PolarHBondContact OG-O 3.39Å; S256-E258 VanDerWaalsContact C-N 3.32Å
259	V	89.5	Confident	90.6	Very high	66 Å²	66	63.7 Å²	63.7	40%	0.4	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	125.7	178.1	-179.7	0	0	0	0	109.4	V251 L276	V251-V259 HydrophobicContact CB-CG1 3.58Å; V251-V259 HydrophobicContact CG1-CG1 3.62Å; V251-V259 HydrophobicContact CG2-CG1 3.81Å; V259-L276 HydrophobicContact CG1-CD1 4.44Å
260	Q	91	Very high	90.6	Very high	86 Å²	86	64.3 Å²	64.3	40%	0.402	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	157.2	180	60.7	178.1	-12.7	0	0	111.9	V251 T252	V251-Q260 CarbonylContact C-O 3.58Å; V251-Q260 WeakPolarHBondContact CA-O 3.29Å; V251-Q260 WeakPolarHBondContact CB-O 3.41Å; T252-Q260 PolarHBondContact N-O 3.05Å; T252-Q260 PolarHBondContact O-N 3.02Å
261	P	93.4	Very high	90.7	Very high	27 Å²	27	61.3 Å²	61.3	18%	0.175	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	137.6	173.4	-23.2	33.5	0	0	0	113.3	T106 L263 I293	T106-P261 HydrophobicContact CG2-CB 3.71Å; T106-P261 HydrophobicContact CG2-CG 3.93Å; P261-L263 PolarHBondContact O-N 2.67Å; P261-I293 HydrophobicContact CG-CD1 3.82Å
262	G	91.1	Very high	90.8	Very high	17 Å²	17	64.9 Å²	64.9	18%	0.175	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-13	-164.1	0	0	0	0	0	116.7	H250	H250-G262 WeakPolarHBondContact O-CA 3.35Å; H250-G262 PolarHBondContact O-N 3.25Å
263	L	92.6	Very high	91	Very high	6 Å²	6	62 Å²	62	3%	0.031	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	5.2	-178.3	-64.2	178.6	0	0	0	113.7	V208 I212 L216 M227 P261 W267	V208-L263 HydrophobicContact CG2-CD1 3.85Å; I212-L263 HydrophobicContact CB-CD2 3.99Å; I212-L263 HydrophobicContact CD1-CD1 4.3Å; I212-L263 HydrophobicContact CG2-CD2 3.68Å; L216-L263 HydrophobicContact CD1-CD2 3.75Å; M227-L263 HydrophobicContact SD-CB 4.11Å; M227-L263 HydrophobicContact SD-CD2 4.43Å; P261-L263 PolarHBondContact O-N 2.67Å; L263-W267 HydrophobicContact CB-CB 3.49Å; L263-W267 VanDerWaalsContact CB-CB 3.49Å; L263-W267 HydrophobicContact CB-CD2 4.29Å; L263-W267 HydrophobicContact CB-CG 3.6Å; L263-W267 HydrophobicContact CD1-CD2 3.7Å; L263-W267 HydrophobicContact CD1-CE3 4.2Å; L263-W267 HydrophobicContact CD1-CG 3.84Å; L263-W267 HydrophobicContact CD1-CZ2 4.31Å; L263-W267 HydrophobicContact CG-CG 4.38Å; L263-W267 WeakPolarHBondContact O-CB 3.32Å
264	G	90.4	Very high	91.4	Very high	38 Å²	38	53.5 Å²	53.5	39%	0.392	32%	0.32	S	S	.	.	H	α-helix	trans	69.6	-170	171.3	0	0	0	0	0	115.5	S266 W267 S268	G264-S266 PolarHBondContact O-N 2.79Å; G264-W267 PolarHBondContact O-N 2.85Å; G264-S268 PolarHBondContact O-N 2.95Å; G264-S268 VanDerWaalsContact O-N 3.13Å
265	V	89.1	Confident	92	Very high	111 Å²	111	52.3 Å²	52.3	67%	0.673	31%	0.312	S	S	*	.	H	α-helix	trans	-67.2	-36.9	-170	-178.6	0	0	0	0	112.6	W267 S268 H269	V265-W267 VanDerWaalsContact C-N 3.3Å; V265-W267 PolarHBondContact O-N 2.87Å; V265-S268 WeakPolarHBondContact O-CA 3.3Å; V265-S268 WeakPolarHBondContact O-CB 3.24Å; V265-S268 PolarHBondContact O-N 2.83Å; V265-S268 PolarHBondContact O-OG 3.5Å; V265-H269 PolarHBondContact O-CD2 3.05Å
266	S	90.9	Very high	92.6	Very high	54 Å²	54	46.8 Å²	46.8	38%	0.378	27%	0.271	S	S	.	.	H	α-helix	trans	-62.3	-38.6	179.1	-56.5	0	0	0	0	112.3	M224 G264 S268	M224-S266 WeakPolarHBondContact CE-OG 3.38Å; G264-S266 PolarHBondContact O-N 2.79Å; S266-S268 VanDerWaalsContact C-N 3.26Å; S266-S268 PolarHBondContact O-N 3.45Å
267	W	95.2	Very high	93.1	Very high	1 Å²	1	42.9 Å²	42.9	0%	0.004	24%	0.244	C	C	.	.	H	α-helix	trans	-74	-20	171	-170.3	-102.2	0	0	0	112.2	E104 V208 I212 M227 V230 A231 L234 V247 L263 G264 V265 H269 V270 P271 R274	E104-W267 VanDerWaalsContact OE1-CD1 3.24Å; E104-W267 PolarHBondContact OE1-NE1 3.39Å; V208-W267 HydrophobicContact CB-CH2 4.24Å; V208-W267 HydrophobicContact CB-CZ2 4.18Å; V208-W267 HydrophobicContact CG1-CH2 4.17Å; V208-W267 HydrophobicContact CG1-CZ2 4.22Å; V208-W267 HydrophobicContact CG2-CH2 4.27Å; V208-W267 HydrophobicContact CG2-CZ2 3.72Å; I212-W267 HydrophobicContact CD1-CH2 4.35Å; I212-W267 HydrophobicContact CD1-CZ3 4.03Å; M227-W267 HydrophobicContact CG-CE3 3.56Å; M227-W267 HydrophobicContact CG-CZ3 4.01Å; M227-W267 HydrophobicContact SD-CB 4.03Å; M227-W267 HydrophobicContact SD-CE3 4.06Å; V230-W267 HydrophobicContact CG1-CH2 4.38Å; A231-W267 HydrophobicContact CB-CE3 4.19Å; A231-W267 HydrophobicContact CB-CZ3 3.77Å; L234-W267 HydrophobicContact CD1-CH2 4.01Å; V247-W267 HydrophobicContact CG2-CZ2 4.47Å; L263-W267 HydrophobicContact CB-CB 3.49Å; L263-W267 VanDerWaalsContact CB-CB 3.49Å; L263-W267 HydrophobicContact CB-CD2 4.29Å; L263-W267 HydrophobicContact CB-CG 3.6Å; L263-W267 HydrophobicContact CD1-CD2 3.7Å; L263-W267 HydrophobicContact CD1-CE3 4.2Å; L263-W267 HydrophobicContact CD1-CG 3.84Å; L263-W267 HydrophobicContact CD1-CZ2 4.31Å; L263-W267 HydrophobicContact CG-CG 4.38Å; L263-W267 WeakPolarHBondContact O-CB 3.32Å; G264-W267 PolarHBondContact O-N 2.85Å; V265-W267 VanDerWaalsContact C-N 3.3Å; V265-W267 PolarHBondContact O-N 2.87Å; W267-H269 PolarHBondContact O-N 3.13Å; W267-V270 HydrophobicContact CD2-CB 4.26Å; W267-V270 HydrophobicContact CD2-CG2 4.42Å; W267-V270 HydrophobicContact CE3-CB 4.41Å; W267-V270 HydrophobicContact CE3-CG1 4.49Å; W267-V270 HydrophobicContact CE3-CG2 4.23Å; W267-V270 HydrophobicContact CH2-CG1 4.33Å; W267-V270 HydrophobicContact CZ2-CG1 4.35Å; W267-V270 HydrophobicContact CZ3-CG1 4.4Å; W267-V270 WeakPolarHBondContact O-CB 3.32Å; W267-V270 PolarHBondContact O-N 3.35Å; W267-P271 VanDerWaalsContact O-CD 3.25Å; W267-P271 WeakPolarHBondContact O-CD 3.22Å; W267-R274 PolarHBondContact O-NH2 3.49Å
268	S	93.4	Very high	93.5	Very high	27 Å²	27	44.5 Å²	44.5	19%	0.189	24%	0.242	C	C	.	.	H	α-helix	trans	-59.5	-28.6	-170.9	83.3	0	0	0	0	114.9	G264 V265 S266 R274 K294	G264-S268 PolarHBondContact O-N 2.95Å; G264-S268 VanDerWaalsContact O-N 3.13Å; V265-S268 WeakPolarHBondContact O-CA 3.3Å; V265-S268 WeakPolarHBondContact O-CB 3.24Å; V265-S268 PolarHBondContact O-N 2.83Å; V265-S268 PolarHBondContact O-OG 3.5Å; S266-S268 VanDerWaalsContact C-N 3.26Å; S266-S268 PolarHBondContact O-N 3.45Å; S268-R274 VanDerWaalsContact CA-NH1 3.26Å; S268-R274 PolarHBondContact O-NE 3.34Å; S268-R274 PolarHBondContact O-NH2 2.95Å; S268-K294 PolarHBondContact O-NZ 3.49Å
269	H	91.1	Very high	93.7	Very high	128 Å²	128	45.2 Å²	45.2	59%	0.593	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-1.5	-179.6	-53.8	-71	0	0	0	113.4	V265 W267	V265-H269 PolarHBondContact O-CD2 3.05Å; W267-H269 PolarHBondContact O-N 3.13Å
270	V	95.8	Very high	93.6	Very high	13 Å²	13	44.2 Å²	44.2	8%	0.079	23%	0.233	C	C	.	.	S	Bend	trans	-79.3	-58.5	-175.2	175.3	0	0	0	0	111.1	I102 A231 K235 W267	I102-V270 HydrophobicContact CD1-CG1 3.94Å; A231-V270 HydrophobicContact CB-CB 4.14Å; A231-V270 HydrophobicContact CB-CG1 3.57Å; A231-V270 HydrophobicContact CB-CG2 3.46Å; A231-V270 VanDerWaalsContact CB-CG2 3.46Å; K235-V270 VanDerWaalsContact CE-O 3.31Å; K235-V270 WeakPolarHBondContact CE-O 3.37Å; W267-V270 HydrophobicContact CD2-CB 4.26Å; W267-V270 HydrophobicContact CD2-CG2 4.42Å; W267-V270 HydrophobicContact CE3-CB 4.41Å; W267-V270 HydrophobicContact CE3-CG1 4.49Å; W267-V270 HydrophobicContact CE3-CG2 4.23Å; W267-V270 HydrophobicContact CH2-CG1 4.33Å; W267-V270 HydrophobicContact CZ2-CG1 4.35Å; W267-V270 HydrophobicContact CZ3-CG1 4.4Å; W267-V270 WeakPolarHBondContact O-CB 3.32Å; W267-V270 PolarHBondContact O-N 3.35Å
271	P	97.1	Very high	92.7	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.257	C	S	.	.			trans	-71.6	141.2	174.8	-16.9	34.7	0	0	0	111.5	I102 E104 W267 R274 K294	I102-P271 HydrophobicContact CG2-CB 4.07Å; I102-P271 HydrophobicContact CG2-CG 4.29Å; I102-P271 CarbonylContact O-C 3.53Å; I102-P271 WeakPolarHBondContact O-CA 3.07Å; E104-P271 HydrophobicContact CB-CB 3.7Å; E104-P271 HydrophobicContact CB-CG 3.56Å; E104-P271 HydrophobicContact CG-CG 4.28Å; E104-P271 WeakPolarHBondContact OE2-CG 3.45Å; W267-P271 VanDerWaalsContact O-CD 3.25Å; W267-P271 WeakPolarHBondContact O-CD 3.22Å; P271-R274 HydrophobicContact CB-CG 4.06Å; P271-K294 PolarHBondContact O-NZ 3Å
272	R	96.3	Very high	91.3	Very high	112 Å²	112	54.1 Å²	54.1	42%	0.423	29%	0.29	S	S	.	.	S	Bend	trans	-76.1	-40.7	173.1	-175	146.5	177.7	-164	7.9	110.6	E101 I102 S296	E101-R272 HydrophobicContact CB-CB 4.35Å; E101-R272 VanDerWaalsContact CD-CD 3.4Å; E101-R272 WeakPolarHBondContact OE1-CD 3.43Å; E101-R272 IonicContact OE1-CZ 2.79Å; E101-R272 IonicContact OE1-NE 3.24Å; E101-R272 PolarHBondContact OE1-NE 3.45Å; E101-R272 IonicContact OE1-NH1 3.98Å; E101-R272 PolarHBondContact OE1-NH1 3.34Å; E101-R272 WeakPolarHBondContact OE2-CD 3.32Å; E101-R272 IonicContact OE2-NE 3.78Å; I102-R272 PolarHBondContact O-N 2.92Å; R272-S296 PolarHBondContact NE-OG 2.96Å; R272-S296 PolarHBondContact NH2-OG 3.35Å
273	T	97.3	Very high	89.6	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.012	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	142.1	179.3	-58	0	0	0	0	110.7	L93 I102 T103 E104 L292 K294	L93-T273 HydrophobicContact CD2-CG2 3.67Å; I102-T273 PolarHBondContact O-N 3.29Å; T103-T273 WeakPolarHBondContact CA-O 3.4Å; T103-T273 HydrophobicContact CG2-CG2 4.36Å; E104-T273 PolarHBondContact N-O 3.2Å; T273-L292 HydrophobicContact CG2-CD1 3.66Å; T273-K294 CarbonylContact C-O 3.3Å; T273-K294 VanDerWaalsContact CA-O 3.31Å; T273-K294 WeakPolarHBondContact CA-O 3.3Å
274	R	97.7	Very high	88	Confident	15 Å²	15	58.4 Å²	58.4	6%	0.057	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	134.3	179.9	-59.2	177.2	170.7	-137	-41.6	111.6	E104 W267 S268 P271 I293 K294	E104-R274 HydrophobicContact CB-CG 4.22Å; E104-R274 CarbonylContact O-C 3.51Å; E104-R274 WeakPolarHBondContact O-CA 3.42Å; E104-R274 IonicContact OE1-NH2 3.96Å; E104-R274 WeakPolarHBondContact OE2-CD 3.34Å; E104-R274 WeakPolarHBondContact OE2-CG 3.4Å; E104-R274 IonicContact OE2-CZ 3.04Å; E104-R274 IonicContact OE2-NE 3.18Å; E104-R274 PolarHBondContact OE2-NE 2.99Å; E104-R274 IonicContact OE2-NH1 3.81Å; E104-R274 IonicContact OE2-NH2 2.75Å; E104-R274 PolarHBondContact OE2-NH2 3.36Å; W267-R274 PolarHBondContact O-NH2 3.49Å; S268-R274 VanDerWaalsContact CA-NH1 3.26Å; S268-R274 PolarHBondContact O-NE 3.34Å; S268-R274 PolarHBondContact O-NH2 2.95Å; P271-R274 HydrophobicContact CB-CG 4.06Å; R274-I293 HydrophobicContact CB-CD1 3.89Å; R274-I293 HydrophobicContact CB-CG1 3.42Å; R274-I293 VanDerWaalsContact CB-CG1 3.42Å; R274-I293 WeakPolarHBondContact O-CG1 3.36Å; R274-I293 PolarHBondContact O-N 3.43Å; R274-K294 HydrophobicContact CB-CB 3.83Å; R274-K294 HydrophobicContact CG-CB 3.84Å; R274-K294 HydrophobicContact CG-CD 4.1Å; R274-K294 PolarHBondContact N-O 3.47Å; R274-K294 PolarHBondContact O-N 3.32Å
275	I	97.6	Very high	86.9	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.005	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	134.2	175.9	-62.4	167.9	0	0	0	109	L92 L93 E104 L105 T106 L277 A290 T291 L292	L92-I275 HydrophobicContact CD2-CD1 4.14Å; L92-I275 HydrophobicContact CD2-CG1 4.19Å; L92-I275 HydrophobicContact CD2-CG2 4.24Å; L93-I275 HydrophobicContact CD1-CD1 4.05Å; L93-I275 HydrophobicContact CD2-CD1 3.52Å; L93-I275 HydrophobicContact CD2-CG1 4.29Å; L93-I275 HydrophobicContact CG-CD1 3.8Å; E104-I275 PolarHBondContact O-N 2.79Å; L105-I275 HydrophobicContact CD2-CB 3.93Å; L105-I275 HydrophobicContact CD2-CD1 3.9Å; L105-I275 HydrophobicContact CD2-CG1 4.42Å; L105-I275 HydrophobicContact CD2-CG2 4.44Å; T106-I275 PolarHBondContact N-O 3.34Å; I275-L277 HydrophobicContact CG2-CD2 3.75Å; I275-L277 HydrophobicContact CG2-CG 4.3Å; I275-A290 HydrophobicContact CG2-CB 3.7Å; I275-T291 CarbonylContact C-O 3.59Å; I275-T291 VanDerWaalsContact CA-O 3.32Å; I275-T291 WeakPolarHBondContact CA-O 3.48Å; I275-L292 HydrophobicContact CG1-CD1 4.15Å
276	L	97.4	Very high	86.5	Confident	21 Å²	21	57 Å²	57	11%	0.11	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	121.5	166	178.3	65.2	0	0	0	109.2	T106 V251 V259 E278 A290 T291 I293	T106-L276 CarbonylContact O-C 3.48Å; T106-L276 WeakPolarHBondContact O-CA 3.06Å; V251-L276 HydrophobicContact CG1-CD1 3.7Å; V259-L276 HydrophobicContact CG1-CD1 4.44Å; L276-E278 HydrophobicContact CD2-CG 4.26Å; L276-E278 HydrophobicContact CG-CG 4.02Å; L276-A290 WeakPolarHBondContact O-CA 3.5Å; L276-T291 PolarHBondContact N-O 3.47Å; L276-T291 PolarHBondContact O-N 3.29Å; L276-I293 HydrophobicContact CB-CD1 4.48Å; L276-I293 HydrophobicContact CB-CG2 3.69Å
277	L	96.8	Very high	86.5	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	125	176.9	-64.1	-175.6	0	0	0	110.9	L105 T106 S111 K113 V116 I275 S289 A290 F306	L105-L277 HydrophobicContact CB-CD1 4.41Å; T106-L277 PolarHBondContact O-N 2.96Å; S111-L277 VanDerWaalsContact CB-O 3.27Å; S111-L277 WeakPolarHBondContact CB-O 3.36Å; K113-L277 HydrophobicContact CG-CD1 4.14Å; V116-L277 HydrophobicContact CG2-CD1 4.11Å; I275-L277 HydrophobicContact CG2-CD2 3.75Å; I275-L277 HydrophobicContact CG2-CG 4.3Å; L277-S289 WeakPolarHBondContact CA-O 3.28Å; L277-A290 HydrophobicContact CD2-CB 3.7Å; L277-F306 HydrophobicContact CD2-CE1 3.86Å; L277-F306 HydrophobicContact CD2-CZ 3.92Å
278	E	94.1	Very high	86.4	Confident	71 Å²	71	59.7 Å²	59.7	33%	0.332	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	153.3	-178.8	-60.3	-175.8	105.3	0	0	111.3	L276 R288 S289	L276-E278 HydrophobicContact CD2-CG 4.26Å; L276-E278 HydrophobicContact CG-CG 4.02Å; E278-R288 VanDerWaalsContact O-CA 3.32Å; E278-R288 WeakPolarHBondContact O-CA 3.46Å; E278-R288 WeakPolarHBondContact O-CD 3.41Å; E278-S289 PolarHBondContact N-O 3.33Å; E278-S289 PolarHBondContact O-N 3.06Å
279	R	90.3	Very high	86.5	Confident	153 Å²	153	59 Å²	59	58%	0.577	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	135.2	170.9	-71.6	-175.6	174.4	-178.3	-3	108.9	G110	G110-R279 PolarHBondContact O-NE 3.46Å; G110-R279 PolarHBondContact O-NH2 2.86Å
280	V	86.8	Confident	86.8	Confident	45 Å²	45	53 Å²	53	27%	0.273	29%	0.288	S	S	.	.			trans	-84.8	114.3	171.7	-178.3	0	0	0	0	108	S282 R287	V280-S282 VanDerWaalsContact C-N 3.32Å; V280-S282 PolarHBondContact O-N 3.27Å; V280-R287 HydrophobicContact CB-CB 4.39Å
281	E	72.6	Confident	86.8	Confident	195 Å²	195	52.6 Å²	52.6	91%	0.911	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-27.9	-174.5	-66.5	-175.8	162.8	0	0	113.3
282	S	63	Low	86.8	Confident	125 Å²	125	52.6 Å²	52.6	87%	0.874	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	12.2	-174.9	-47.9	0	0	0	0	114.6	V280	V280-S282 VanDerWaalsContact C-N 3.32Å; V280-S282 PolarHBondContact O-N 3.27Å
283	G	55.8	Low	86.8	Confident	33 Å²	33	49.9 Å²	49.9	34%	0.34	28%	0.279	S	S	.	.	S	Bend	trans	-107	162.9	-174.3	0	0	0	0	0	114.5
284	A	59.6	Low	86.7	Confident	80 Å²	80	52.7 Å²	52.7	66%	0.661	29%	0.291	S	S	*	.	S	Bend	trans	-52.7	148.2	167.3	0	0	0	0	0	111.4	G286 R287	A284-G286 PolarHBondContact O-N 2.99Å; A284-R287 PolarHBondContact O-N 3.44Å
285	S	68.1	Low	86.6	Confident	108 Å²	108	53.1 Å²	53.1	76%	0.755	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47	105.6	176.2	147.5	0	0	0	0	111.2
286	G	80.6	Confident	86.1	Confident	12 Å²	12	56.5 Å²	56.5	12%	0.124	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	130.3	-22.9	175.4	0	0	0	0	0	115.4	A284 R288 L308	A284-G286 PolarHBondContact O-N 2.99Å; G286-R288 PolarHBondContact O-NH1 3.4Å; G286-L308 PolarHBondContact O-N 3.24Å; G286-L308 VanDerWaalsContact O-N 3.15Å
287	R	90.3	Very high	85.7	Confident	81 Å²	81	58.7 Å²	58.7	31%	0.306	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	139	179.2	-70.8	-174.4	74.6	96.8	-3	112.7	V280 A284 D305 F306	V280-R287 HydrophobicContact CB-CB 4.39Å; A284-R287 PolarHBondContact O-N 3.44Å; R287-D305 IonicContact NH2-OD2 2.86Å; R287-F306 CarbonylContact C-O 3.56Å; R287-F306 WeakPolarHBondContact CA-O 3.36Å
288	R	93.5	Very high	85.5	Confident	31 Å²	31	60.8 Å²	60.8	12%	0.117	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	149.8	176.4	-63.1	-60.8	-178.9	-89.3	-3.1	109.5	G110 S111 E278 G286 D305 F306 L308	G110-R288 PolarHBondContact O-NH2 3.17Å; S111-R288 WeakPolarHBondContact O-CD 3.34Å; S111-R288 WeakPolarHBondContact O-CG 3.45Å; S111-R288 PolarHBondContact O-NE 3.12Å; E278-R288 VanDerWaalsContact O-CA 3.32Å; E278-R288 WeakPolarHBondContact O-CA 3.46Å; E278-R288 WeakPolarHBondContact O-CD 3.41Å; G286-R288 PolarHBondContact O-NH1 3.4Å; R288-D305 WeakPolarHBondContact O-CA 3.44Å; R288-F306 HydrophobicContact CB-CD1 4.22Å; R288-F306 HydrophobicContact CB-CE1 3.66Å; R288-F306 HydrophobicContact CB-CE2 4.45Å; R288-F306 HydrophobicContact CB-CZ 3.81Å; R288-F306 HydrophobicContact CG-CZ 4.49Å; R288-F306 PolarHBondContact N-O 3.11Å; R288-F306 PolarHBondContact O-N 3.02Å; R288-L308 HydrophobicContact CG-CD1 3.66Å; R288-L308 HydrophobicContact CG-CD2 3.97Å; R288-L308 HydrophobicContact CG-CG 3.53Å; R288-L308 VanDerWaalsContact CZ-CD1 3.45Å
289	S	95	Very high	85.4	Confident	13 Å²	13	60.7 Å²	60.7	9%	0.091	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	129.8	170.6	-158.7	0	0	0	0	108.6	L277 E278 D305	L277-S289 WeakPolarHBondContact CA-O 3.28Å; E278-S289 PolarHBondContact N-O 3.33Å; E278-S289 PolarHBondContact O-N 3.06Å; S289-D305 WeakPolarHBondContact CA-OD1 3.12Å; S289-D305 VanDerWaalsContact CB-OD1 3.25Å; S289-D305 WeakPolarHBondContact CB-OD1 3.31Å; S289-D305 PolarHBondContact OG-OD1 3.28Å
290	A	97	Very high	85.5	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	117.9	174	0	0	0	0	0	109.1	L89 L92 I275 L276 L277 K303 E304 F306	L89-A290 HydrophobicContact CD2-CB 3.82Å; L92-A290 HydrophobicContact CD2-CB 3.52Å; I275-A290 HydrophobicContact CG2-CB 3.7Å; L276-A290 WeakPolarHBondContact O-CA 3.5Å; L277-A290 HydrophobicContact CD2-CB 3.7Å; A290-K303 VanDerWaalsContact O-CA 3.3Å; A290-K303 WeakPolarHBondContact O-CA 3.3Å; A290-E304 PolarHBondContact N-O 3.26Å; A290-E304 PolarHBondContact O-N 3.4Å; A290-F306 HydrophobicContact CB-CD1 4.17Å; A290-F306 HydrophobicContact CB-CE1 3.79Å
291	T	97	Very high	85.8	Confident	6 Å²	6	60.5 Å²	60.5	4%	0.037	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	126.1	176.5	-54.4	0	0	0	0	110	I275 L276 I293 I302 K303	I275-T291 CarbonylContact C-O 3.59Å; I275-T291 VanDerWaalsContact CA-O 3.32Å; I275-T291 WeakPolarHBondContact CA-O 3.48Å; L276-T291 PolarHBondContact N-O 3.47Å; L276-T291 PolarHBondContact O-N 3.29Å; T291-I293 HydrophobicContact CG2-CG2 4.22Å; T291-I293 PolarHBondContact O-N 2.89Å; T291-I293 VanDerWaalsContact O-N 3.16Å; T291-I302 WeakPolarHBondContact CA-O 3.26Å; T291-K303 HydrophobicContact CG2-CD 4.47Å; T291-K303 HydrophobicContact CG2-CG 3.95Å; T291-K303 WeakPolarHBondContact OG1-CD 3.24Å; T291-K303 WeakPolarHBondContact OG1-CE 3.37Å; T291-K303 WeakPolarHBondContact OG1-CG 3.43Å
292	L	97	Very high	86.9	Confident	0 Å²	0	54 Å²	54	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	98.4	176.2	-170.8	65.2	0	0	0	110.3	L92 T273 I275 Q298 C300 L301 I302	L92-L292 HydrophobicContact CD1-CB 3.87Å; L92-L292 HydrophobicContact CG-CB 4.19Å; T273-L292 HydrophobicContact CG2-CD1 3.66Å; I275-L292 HydrophobicContact CG1-CD1 4.15Å; L292-Q298 HydrophobicContact CD2-CB 3.75Å; L292-C300 CarbonylContact O-C 3.58Å; L292-C300 WeakPolarHBondContact O-CA 3.38Å; L292-L301 PolarHBondContact O-N 3.04Å; L292-I302 PolarHBondContact N-O 2.85Å
293	I	95.3	Very high	88.4	Confident	54 Å²	54	53.6 Å²	53.6	28%	0.277	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-19	-175.3	65.6	177	0	0	0	113.3	P261 R274 L276 T291	P261-I293 HydrophobicContact CG-CD1 3.82Å; R274-I293 HydrophobicContact CB-CD1 3.89Å; R274-I293 HydrophobicContact CB-CG1 3.42Å; R274-I293 VanDerWaalsContact CB-CG1 3.42Å; R274-I293 WeakPolarHBondContact O-CG1 3.36Å; R274-I293 PolarHBondContact O-N 3.43Å; L276-I293 HydrophobicContact CB-CD1 4.48Å; L276-I293 HydrophobicContact CB-CG2 3.69Å; T291-I293 HydrophobicContact CG2-CG2 4.22Å; T291-I293 PolarHBondContact O-N 2.89Å; T291-I293 VanDerWaalsContact O-N 3.16Å
294	K	95.7	Very high	90.3	Very high	62 Å²	62	53.8 Å²	53.8	27%	0.27	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	130.3	175	-174.7	-172.6	178.4	-171.4	0	109.7	S268 P271 T273 R274	S268-K294 PolarHBondContact O-NZ 3.49Å; P271-K294 PolarHBondContact O-NZ 3Å; T273-K294 CarbonylContact C-O 3.3Å; T273-K294 VanDerWaalsContact CA-O 3.31Å; T273-K294 WeakPolarHBondContact CA-O 3.3Å; R274-K294 HydrophobicContact CB-CB 3.83Å; R274-K294 HydrophobicContact CG-CB 3.84Å; R274-K294 HydrophobicContact CG-CD 4.1Å; R274-K294 PolarHBondContact N-O 3.47Å; R274-K294 PolarHBondContact O-N 3.32Å
295	S	94.7	Very high	92	Very high	24 Å²	24	52.9 Å²	52.9	17%	0.168	29%	0.29	C	S	.	.			trans	-156	148.9	170.3	-178.2	0	0	0	0	110	R297 Q298 C300	S295-R297 PolarHBondContact OG-N 2.79Å; S295-R297 VanDerWaalsContact OG-N 3.08Å; S295-Q298 PolarHBondContact OG-N 2.8Å; S295-Q298 VanDerWaalsContact OG-N 3.15Å; S295-C300 PolarHBondContact N-SG 3.46Å; S295-C300 VanDerWaalsContact N-SG 3.4Å
296	S	87.7	Confident	93.1	Very high	72 Å²	72	47.9 Å²	47.9	50%	0.503	26%	0.255	S	S	.	.	S	Bend	trans	-97.5	-2.7	168.5	60	0	0	0	0	113.2	R272	R272-S296 PolarHBondContact NE-OG 2.96Å; R272-S296 PolarHBondContact NH2-OG 3.35Å
297	R	89.4	Confident	93.6	Very high	66 Å²	66	48 Å²	48	25%	0.249	25%	0.253	C	S	.	.	S	Bend	trans	-112.5	-37.7	-174.6	-73.8	-175.1	-75.9	-79.4	2.4	113	Y98 E101 S295	Y98-R297 VanDerWaalsContact CD2-NH2 3.34Å; E101-R297 IonicContact OE1-CZ 2.77Å; E101-R297 IonicContact OE1-NH1 3.91Å; E101-R297 PolarHBondContact OE1-NH1 2.89Å; E101-R297 IonicContact OE2-CZ 3.62Å; E101-R297 VanDerWaalsContact OE2-CZ 3.24Å; E101-R297 IonicContact OE2-NH1 2.67Å; E101-R297 PolarHBondContact OE2-NH1 2.92Å; E101-R297 IonicContact OE2-NH2 2.61Å; E101-R297 PolarHBondContact OE2-NH2 3.05Å; S295-R297 PolarHBondContact OG-N 2.79Å; S295-R297 VanDerWaalsContact OG-N 3.08Å
298	Q	91.4	Very high	93.5	Very high	46 Å²	46	44.9 Å²	44.9	22%	0.215	24%	0.242	C	C	.	.	S	Bend	trans	-119.1	159.4	179.8	-68.1	-158.3	38.3	0	0	111.7	K91 L92 D94 L292 S295 C300	K91-Q298 PolarHBondContact O-NE2 3.01Å; L92-Q298 PolarHBondContact O-NE2 3.17Å; D94-Q298 HydrophobicContact CB-CG 4.04Å; D94-Q298 VanDerWaalsContact CB-NE2 3.32Å; L292-Q298 HydrophobicContact CD2-CB 3.75Å; S295-Q298 PolarHBondContact OG-N 2.8Å; S295-Q298 VanDerWaalsContact OG-N 3.15Å; Q298-C300 PolarHBondContact O-N 3.37Å
299	A	92.4	Very high	93.1	Very high	69 Å²	69	48.1 Å²	48.1	57%	0.57	26%	0.258	S	S	*	.			trans	-60.9	136.6	171	0	0	0	0	0	110.4	I302	A299-I302 HydrophobicContact CB-CD1 4.12Å; A299-I302 HydrophobicContact CB-CG1 4.49Å; A299-I302 VanDerWaalsContact O-CD1 3.27Å; A299-I302 WeakPolarHBondContact O-CD1 3.26Å; A299-I302 WeakPolarHBondContact O-CG1 3.46Å
300	C	93.1	Very high	92.7	Very high	59 Å²	59	48.8 Å²	48.8	40%	0.399	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	164.9	176.9	-63.3	0	0	0	0	110.7	L292 S295 Q298 I302	L292-C300 CarbonylContact O-C 3.58Å; L292-C300 WeakPolarHBondContact O-CA 3.38Å; S295-C300 PolarHBondContact N-SG 3.46Å; S295-C300 VanDerWaalsContact N-SG 3.4Å; Q298-C300 PolarHBondContact O-N 3.37Å; C300-I302 PolarHBondContact O-N 3.44Å
301	L	93.3	Very high	92.1	Very high	134 Å²	134	49 Å²	49	70%	0.702	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	7.5	-178.5	-49.4	175.9	0	0	0	115.2	L292	L292-L301 PolarHBondContact O-N 3.04Å
302	I	95.1	Very high	91.4	Very high	58 Å²	58	50.4 Å²	50.4	30%	0.297	27%	0.269	S	S	.	.			trans	-63.6	138.8	163.9	-58.5	173.1	0	0	0	108.3	L92 T291 L292 A299 C300	L92-I302 HydrophobicContact CD1-CB 4.18Å; L92-I302 HydrophobicContact CD1-CG2 3.94Å; T291-I302 WeakPolarHBondContact CA-O 3.26Å; L292-I302 PolarHBondContact N-O 2.85Å; A299-I302 HydrophobicContact CB-CD1 4.12Å; A299-I302 HydrophobicContact CB-CG1 4.49Å; A299-I302 VanDerWaalsContact O-CD1 3.27Å; A299-I302 WeakPolarHBondContact O-CD1 3.26Å; A299-I302 WeakPolarHBondContact O-CG1 3.46Å; C300-I302 PolarHBondContact O-N 3.44Å
303	K	95.1	Very high	90.6	Very high	118 Å²	118	52.4 Å²	52.4	51%	0.513	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	138.8	177.8	-60.4	-162.9	178.6	-165.1	0	110.5	A290 T291	A290-K303 VanDerWaalsContact O-CA 3.3Å; A290-K303 WeakPolarHBondContact O-CA 3.3Å; T291-K303 HydrophobicContact CG2-CD 4.47Å; T291-K303 HydrophobicContact CG2-CG 3.95Å; T291-K303 WeakPolarHBondContact OG1-CD 3.24Å; T291-K303 WeakPolarHBondContact OG1-CE 3.37Å; T291-K303 WeakPolarHBondContact OG1-CG 3.43Å
304	E	95.4	Very high	89.2	Confident	37 Å²	37	52.2 Å²	52.2	17%	0.173	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	134.2	170	-72.4	-66.9	160.4	0	0	108.9	K91 L92 A290	K91-E304 WeakPolarHBondContact CD-OE1 3.49Å; K91-E304 VanDerWaalsContact CE-OE1 3.24Å; K91-E304 WeakPolarHBondContact CE-OE1 3.36Å; K91-E304 IonicContact NZ-OE1 3.55Å; K91-E304 PolarHBondContact NZ-OE1 2.85Å; K91-E304 IonicContact NZ-OE2 3.73Å; L92-E304 HydrophobicContact CB-CB 4.32Å; L92-E304 HydrophobicContact CB-CG 4.06Å; L92-E304 HydrophobicContact CD1-CB 4.39Å; L92-E304 HydrophobicContact CD1-CG 4.03Å; A290-E304 PolarHBondContact N-O 3.26Å; A290-E304 PolarHBondContact O-N 3.4Å
305	D	94.2	Very high	87.6	Confident	60 Å²	60	55.2 Å²	55.2	32%	0.321	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	142.2	173.9	-77.1	-2.3	0	0	0	109.9	S88 R287 R288 S289	S88-D305 PolarHBondContact OG-O 2.98Å; R287-D305 IonicContact NH2-OD2 2.86Å; R288-D305 WeakPolarHBondContact O-CA 3.44Å; S289-D305 WeakPolarHBondContact CA-OD1 3.12Å; S289-D305 VanDerWaalsContact CB-OD1 3.25Å; S289-D305 WeakPolarHBondContact CB-OD1 3.31Å; S289-D305 PolarHBondContact OG-OD1 3.28Å
306	F	92.9	Very high	85.8	Confident	4 Å²	4	57.8 Å²	57.8	2%	0.018	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	159.8	178.7	71.2	-75	0	0	0	111	L89 V116 L277 R287 R288 A290 L308 W311	L89-F306 HydrophobicContact CD1-CD2 4.34Å; L89-F306 HydrophobicContact CD1-CE2 4.06Å; L89-F306 HydrophobicContact CD1-CZ 4.31Å; L89-F306 HydrophobicContact CD2-CD1 4.05Å; L89-F306 HydrophobicContact CD2-CE1 3.91Å; L89-F306 HydrophobicContact CD2-CG 4.48Å; L89-F306 HydrophobicContact CD2-CZ 4.15Å; L89-F306 HydrophobicContact CG-CD1 4.43Å; L89-F306 HydrophobicContact CG-CD2 4.37Å; L89-F306 HydrophobicContact CG-CE2 4.42Å; L89-F306 HydrophobicContact CG-CG 4.37Å; V116-F306 HydrophobicContact CG2-CE2 3.87Å; V116-F306 HydrophobicContact CG2-CZ 3.94Å; L277-F306 HydrophobicContact CD2-CE1 3.86Å; L277-F306 HydrophobicContact CD2-CZ 3.92Å; R287-F306 CarbonylContact C-O 3.56Å; R287-F306 WeakPolarHBondContact CA-O 3.36Å; R288-F306 HydrophobicContact CB-CD1 4.22Å; R288-F306 HydrophobicContact CB-CE1 3.66Å; R288-F306 HydrophobicContact CB-CE2 4.45Å; R288-F306 HydrophobicContact CB-CZ 3.81Å; R288-F306 HydrophobicContact CG-CZ 4.49Å; R288-F306 PolarHBondContact N-O 3.11Å; R288-F306 PolarHBondContact O-N 3.02Å; A290-F306 HydrophobicContact CB-CD1 4.17Å; A290-F306 HydrophobicContact CB-CE1 3.79Å; F306-L308 HydrophobicContact CE2-CD2 3.78Å; F306-L308 HydrophobicContact CZ-CD2 4.23Å; F306-W311 HydrophobicContact CD2-CH2 4.32Å; F306-W311 HydrophobicContact CD2-CZ3 4.4Å; F306-W311 HydrophobicContact CE2-CH2 4.05Å; F306-W311 HydrophobicContact CE2-CZ3 4.14Å
307	D	91.1	Very high	84.4	Confident	15 Å²	15	60.4 Å²	60.4	8%	0.08	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	129.5	173.8	-168.6	-9.8	0	0	0	110.5	Q309 W310 R313	D307-Q309 PolarHBondContact O-N 3.48Å; D307-Q309 PolarHBondContact OD1-N 3.07Å; D307-W310 WeakPolarHBondContact O-CB 3.42Å; D307-W310 PolarHBondContact O-N 2.89Å; D307-R313 IonicContact OD2-CZ 2.91Å; D307-R313 IonicContact OD2-NE 2.69Å; D307-R313 IonicContact OD2-NH2 3.73Å; D307-R313 PolarHBondContact OD2-NH2 3.15Å
308	L	86.9	Confident	83	Confident	15 Å²	15	59 Å²	59	8%	0.079	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-62.9	-23.4	172.5	-70.8	176.7	0	0	0	113.2	Q115 V116 G286 R288 F306 W310	Q115-L308 HydrophobicContact CB-CD2 4.1Å; V116-L308 HydrophobicContact CG2-CD2 4.11Å; G286-L308 PolarHBondContact O-N 3.24Å; G286-L308 VanDerWaalsContact O-N 3.15Å; R288-L308 HydrophobicContact CG-CD1 3.66Å; R288-L308 HydrophobicContact CG-CD2 3.97Å; R288-L308 HydrophobicContact CG-CG 3.53Å; R288-L308 VanDerWaalsContact CZ-CD1 3.45Å; F306-L308 HydrophobicContact CE2-CD2 3.78Å; F306-L308 HydrophobicContact CZ-CD2 4.23Å; L308-W310 PolarHBondContact O-N 3.43Å
309	Q	85.6	Confident	80.8	Confident	99 Å²	99	59.4 Å²	59.4	46%	0.463	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-76.7	-3.1	176.3	-60.1	-173.4	-0.5	0	0	112.6	D307 W311 S312 R313	D307-Q309 PolarHBondContact O-N 3.48Å; D307-Q309 PolarHBondContact OD1-N 3.07Å; Q309-W311 VanDerWaalsContact C-N 3.3Å; Q309-W311 PolarHBondContact O-N 3.44Å; Q309-S312 CarbonylContact O-C 3.55Å; Q309-S312 VanDerWaalsContact O-C 3.3Å; Q309-S312 VanDerWaalsContact O-CA 3.3Å; Q309-S312 WeakPolarHBondContact O-CA 3.41Å; Q309-S312 WeakPolarHBondContact O-CB 3.5Å; Q309-S312 PolarHBondContact O-N 3.49Å; Q309-R313 WeakPolarHBondContact O-CG 3.5Å; Q309-R313 PolarHBondContact O-N 3.36Å; Q309-R313 VanDerWaalsContact O-N 3.11Å
310	W	86.8	Confident	78.3	Confident	26 Å²	26	59.3 Å²	59.3	10%	0.098	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-52.1	-45.5	-178.9	-178.3	-92.6	0	0	0	113.4	G85 N86 P87 D307 L308 S312 R313 K318	G85-W310 VanDerWaalsContact O-CD1 3.24Å; G85-W310 PolarHBondContact O-NE1 2.87Å; N86-W310 WeakPolarHBondContact ND2-CB 3.34Å; N86-W310 VanDerWaalsContact ND2-CG 3.25Å; P87-W310 VanDerWaalsContact CD-CE2 3.44Å; P87-W310 HydrophobicContact CG-CH2 4.14Å; P87-W310 HydrophobicContact CG-CZ2 3.59Å; D307-W310 WeakPolarHBondContact O-CB 3.42Å; D307-W310 PolarHBondContact O-N 2.89Å; L308-W310 PolarHBondContact O-N 3.43Å; W310-S312 PolarHBondContact O-N 3.47Å; W310-R313 PolarHBondContact O-N 3.4Å; W310-K318 HydrophobicContact CD2-CG 4.29Å; W310-K318 HydrophobicContact CE3-CG 4.43Å; W310-K318 HydrophobicContact CH2-CB 3.59Å; W310-K318 HydrophobicContact CH2-CG 4.02Å; W310-K318 WeakPolarHBondContact CH2-O 3.31Å; W310-K318 HydrophobicContact CZ2-CB 3.65Å; W310-K318 HydrophobicContact CZ2-CD 4.01Å; W310-K318 HydrophobicContact CZ2-CG 3.79Å; W310-K318 HydrophobicContact CZ3-CB 4.17Å; W310-K318 HydrophobicContact CZ3-CG 4.31Å; W310-K318 WeakPolarHBondContact O-CE 3.16Å
311	W	84.6	Confident	76.1	Confident	6 Å²	6	61.8 Å²	61.8	2%	0.023	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-74.5	0.3	176.2	-58.7	-86.8	0	0	0	114.4	T84 N86 L89 V116 G119 M149 T152 F306 Q309	T84-W311 PolarHBondContact O-NE1 2.86Å; N86-W311 HydrophobicContact CB-CH2 3.98Å; N86-W311 HydrophobicContact CB-CZ2 3.53Å; L89-W311 HydrophobicContact CD1-CH2 3.7Å; L89-W311 HydrophobicContact CD1-CZ2 4.01Å; V116-W311 HydrophobicContact CB-CH2 4.2Å; V116-W311 HydrophobicContact CG1-CH2 4.1Å; V116-W311 HydrophobicContact CG1-CZ2 4.41Å; V116-W311 HydrophobicContact CG2-CH2 3.91Å; V116-W311 HydrophobicContact CG2-CZ3 4.23Å; G119-W311 VanDerWaalsContact CA-CG 3.43Å; M149-W311 HydrophobicContact CE-CB 4.27Å; M149-W311 HydrophobicContact CG-CB 4.46Å; M149-W311 HydrophobicContact SD-CB 4.28Å; T152-W311 PolarHBondContact OG1-O 3.3Å; F306-W311 HydrophobicContact CD2-CH2 4.32Å; F306-W311 HydrophobicContact CD2-CZ3 4.4Å; F306-W311 HydrophobicContact CE2-CH2 4.05Å; F306-W311 HydrophobicContact CE2-CZ3 4.14Å; Q309-W311 VanDerWaalsContact C-N 3.3Å; Q309-W311 PolarHBondContact O-N 3.44Å
312	S	82.2	Confident	73.5	Confident	34 Å²	34	61.7 Å²	61.7	24%	0.238	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-118.1	11.2	174.2	-56.8	0	0	0	0	111.7	R145 T152 Q309 W310	R145-S312 PolarHBondContact NH1-OG 3.49Å; R145-S312 VanDerWaalsContact NH1-OG 3.14Å; R145-S312 PolarHBondContact NH2-OG 3.1Å; T152-S312 WeakPolarHBondContact CG2-O 3.38Å; Q309-S312 CarbonylContact O-C 3.55Å; Q309-S312 VanDerWaalsContact O-C 3.3Å; Q309-S312 VanDerWaalsContact O-CA 3.3Å; Q309-S312 WeakPolarHBondContact O-CA 3.41Å; Q309-S312 WeakPolarHBondContact O-CB 3.5Å; Q309-S312 PolarHBondContact O-N 3.49Å; W310-S312 PolarHBondContact O-N 3.47Å
313	R	80.9	Confident	70.6	Confident	43 Å²	43	63.5 Å²	63.5	16%	0.162	38%	0.38	C	S	.	.	S	Bend	trans	-95.2	143.3	174.6	-73	-178.8	-172.7	-175	0.8	109.4	D307 Q309 W310 E317 K318 E321	D307-R313 IonicContact OD2-CZ 2.91Å; D307-R313 IonicContact OD2-NE 2.69Å; D307-R313 IonicContact OD2-NH2 3.73Å; D307-R313 PolarHBondContact OD2-NH2 3.15Å; Q309-R313 WeakPolarHBondContact O-CG 3.5Å; Q309-R313 PolarHBondContact O-N 3.36Å; Q309-R313 VanDerWaalsContact O-N 3.11Å; W310-R313 PolarHBondContact O-N 3.4Å; R313-E317 HydrophobicContact CB-CB 4.35Å; R313-K318 HydrophobicContact CB-CG 4.18Å; R313-K318 WeakPolarHBondContact O-CE 3.42Å; R313-E321 IonicContact CZ-OE1 3.9Å; R313-E321 IonicContact NH1-OE1 3.77Å; R313-E321 PolarHBondContact NH1-OE1 2.8Å; R313-E321 IonicContact NH2-OE1 3.06Å
314	A	65.7	Low	67.7	Low	50 Å²	50	61.3 Å²	61.3	41%	0.413	39%	0.391	S	S	.	.			trans	-64.6	150.7	170.9	0	0	0	0	0	110.3	G316 E317	A314-G316 PolarHBondContact O-N 3.33Å; A314-G316 VanDerWaalsContact O-N 3.08Å; A314-E317 PolarHBondContact O-N 3.32Å
315	E	62	Low	64.7	Low	125 Å²	125	68.5 Å²	68.5	58%	0.584	42%	0.421	S	S	*	.	H	α-helix	trans	-52.1	-35.9	-177.6	-72.9	-167.1	147	0	0	113.8	E317 K318	E315-E317 VanDerWaalsContact C-N 3.27Å; E315-E317 PolarHBondContact O-N 3.37Å; E315-K318 PolarHBondContact O-N 2.91Å
316	G	56.2	Low	61.8	Low	78 Å²	78	76.9 Å²	76.9	80%	0.804	45%	0.448	S	S	*	.	H	α-helix	trans	-64.8	-24	178.2	0	0	0	0	0	115	A314	A314-G316 PolarHBondContact O-N 3.33Å; A314-G316 VanDerWaalsContact O-N 3.08Å
317	E	58.5	Low	58.8	Low	127 Å²	127	85.5 Å²	85.5	59%	0.593	49%	0.486	S	S	*	.	H	α-helix	trans	-91.3	-16.2	-178.9	-64.2	179.9	165	0	0	112.8	R313 A314 E315 G319	R313-E317 HydrophobicContact CB-CB 4.35Å; A314-E317 PolarHBondContact O-N 3.32Å; E315-E317 VanDerWaalsContact C-N 3.27Å; E315-E317 PolarHBondContact O-N 3.37Å; E317-G319 VanDerWaalsContact C-N 3.33Å
318	K	60.1	Low	56.2	Low	36 Å²	36	92.4 Å²	92.4	16%	0.157	52%	0.522	C	S	.	.	H	α-helix	trans	-73.1	-24	178.5	-68.3	177.9	-176.8	165.9	0	112.5	E153 W310 R313 E315 G320	E153-K318 IonicContact OE1-NZ 3.56Å; E153-K318 PolarHBondContact OE1-NZ 3.02Å; W310-K318 HydrophobicContact CD2-CG 4.29Å; W310-K318 HydrophobicContact CE3-CG 4.43Å; W310-K318 HydrophobicContact CH2-CB 3.59Å; W310-K318 HydrophobicContact CH2-CG 4.02Å; W310-K318 WeakPolarHBondContact CH2-O 3.31Å; W310-K318 HydrophobicContact CZ2-CB 3.65Å; W310-K318 HydrophobicContact CZ2-CD 4.01Å; W310-K318 HydrophobicContact CZ2-CG 3.79Å; W310-K318 HydrophobicContact CZ3-CB 4.17Å; W310-K318 HydrophobicContact CZ3-CG 4.31Å; W310-K318 WeakPolarHBondContact O-CE 3.16Å; R313-K318 HydrophobicContact CB-CG 4.18Å; R313-K318 WeakPolarHBondContact O-CE 3.42Å; E315-K318 PolarHBondContact O-N 2.91Å; K318-G320 PolarHBondContact O-N 3.27Å
319	G	44.5	Very low	53.6	Low	55 Å²	55	98.8 Å²	98.8	57%	0.567	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-78	-12.9	-177.4	0	0	0	0	0	116.4	E317 E321	E317-G319 VanDerWaalsContact C-N 3.33Å; G319-E321 PolarHBondContact O-N 2.91Å
320	G	40.1	Very low	51.4	Low	66 Å²	66	102.5 Å²	102.5	68%	0.68	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-78.2	-17.8	-167	0	0	0	0	0	117	K318	K318-G320 PolarHBondContact O-N 3.27Å
321	E	46.2	Very low	49.2	Very low	111 Å²	111	107 Å²	107	52%	0.519	60%	0.604	S	S	.	*	G	3₁₀ helix	trans	-92.4	-2.9	-170.6	-73.8	179.7	-160.3	0	0	114.5	R313 G319	R313-E321 IonicContact CZ-OE1 3.9Å; R313-E321 IonicContact NH1-OE1 3.77Å; R313-E321 PolarHBondContact NH1-OE1 2.8Å; R313-E321 IonicContact NH2-OE1 3.06Å; G319-E321 PolarHBondContact O-N 2.91Å
322	T	38.9	Very low	47.1	Very low	133 Å²	133	113.4 Å²	113.4	82%	0.816	64%	0.639	S	S	*	*	S	Bend	trans	-95.6	-5.6	-176.8	51.5	0	0	0	0	115.8	G324	T322-G324 PolarHBondContact O-N 3.45Å
323	S	35.4	Very low	45.2	Very low	96 Å²	96	121.9 Å²	121.9	67%	0.671	69%	0.689	S	S	*	*			trans	-96.2	66.3	179.1	178.7	0	0	0	0	112.8	K325	S323-K325 PolarHBondContact O-N 2.65Å
324	G	33.5	Very low	43.4	Very low	72 Å²	72	125.9 Å²	125.9	74%	0.742	72%	0.716	S	S	*	*			trans	-67.1	95.1	158.7	0	0	0	0	0	109.6	T322 R326	T322-G324 PolarHBondContact O-N 3.45Å; G324-R326 PolarHBondContact O-N 2.66Å; G324-R326 VanDerWaalsContact O-N 3.1Å
325	K	32.5	Very low	42.2	Very low	188 Å²	188	129.8 Å²	129.8	82%	0.817	73%	0.732	S	S	*	*			trans	-51.7	115.8	172.6	-76.7	178.3	174.7	176.5	0	109.3	S323 K327	S323-K325 PolarHBondContact O-N 2.65Å; K325-K327 PolarHBondContact O-N 3.45Å
326	R	33.5	Very low	41.1	Very low	236 Å²	236	130.1 Å²	130.1	89%	0.891	74%	0.74	S	S	*	*			trans	-59.2	108.7	157.1	-69.2	-178.7	-154.8	165.4	6.8	106.5	G324 L328	G324-R326 PolarHBondContact O-N 2.66Å; G324-R326 VanDerWaalsContact O-N 3.1Å; R326-L328 PolarHBondContact O-N 2.96Å
327	K	30.5	Very low	40.2	Very low	185 Å²	185	133.2 Å²	133.2	80%	0.804	74%	0.736	S	S	*	*			trans	-69	109.3	155.1	-85.1	-177.4	170.9	-175.3	0	105.6	K325 D329	K325-K327 PolarHBondContact O-N 3.45Å; K327-D329 PolarHBondContact O-N 3.17Å
328	L	35.2	Very low	39.1	Very low	159 Å²	159	133.6 Å²	133.6	83%	0.832	75%	0.745	S	S	*	*			trans	-63.3	116.9	153.6	-87.6	115.5	0	0	0	105.6	R326 E330	R326-L328 PolarHBondContact O-N 2.96Å; L328-E330 PolarHBondContact O-N 2.97Å
329	D	32.9	Very low	37.7	Very low	149 Å²	149	140.1 Å²	140.1	80%	0.797	78%	0.784	S	S	*	*			trans	-71.8	101.6	163.8	-77.1	-28.3	0	0	0	107.2	K327	K327-D329 PolarHBondContact O-N 3.17Å
330	E	40.3	Very low	37.2	Very low	178 Å²	178	146.1 Å²	146.1	83%	0.832	80%	0.8	S	S	*	*			trans	-80.9	118.6	151.7	-79.8	-178.1	157.5	0	0	107.7	L328	L328-E330 PolarHBondContact O-N 2.97Å
331	T	40.2	Very low	37	Very low	121 Å²	121	152.3 Å²	152.3	74%	0.742	81%	0.809	S	S	*	*			trans	163.4	133.3	152.4	36.3	0	0	0	0	105.9
332	D	40.8	Very low	36.2	Very low	140 Å²	140	155.8 Å²	155.8	75%	0.749	83%	0.833	S	S	*	*			cis	-169.3	156.7	-4.7	-116.9	-26.1	0	0	0	105.7
333	T	40.9	Very low	36	Very low	212 Å²	212	157.8 Å²	157.8	100%	1.301	83%	0.834	S	S	*	*			trans	75.9	0	169.6	59.2	0	0	0	0	120.5

Retrieved 333 of 333 residues in 267.5 ms (Link to these results)

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