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Polyadenylate-binding protein 1

Binds the poly(A) tail of mRNA, including that of its own transcript, and regulates processes of mRNA metabolism such as pre-mRNA splicing and mRNA stability^1,2,3. Its function in translational initiation regulation can either be enhanced by PAIP1 or repressed by PAIP2^4,5. Can probably bind to cytoplasmic RNA sequences other than poly(A) in vivo. Binds to N6-methyladenosine (m6A)-containing mRNAs and contributes to MYC stability by binding to m6A-containing MYC mRNAs⁶. Involved in translationally coupled mRNA turnover⁷. Implicated with other RNA-binding proteins in the cytoplasmic deadenylation/translational and decay interplay of the FOS mRNA mediated by the major coding-region determinant of instability (mCRD) domain⁸. Involved in regulation of nonsense-mediated decay (NMD) of mRNAs containing premature stop codons; for the recognition of premature termination codons (PTC) and initiation of NMD a competitive interaction between UPF1 and PABPC1 with the ribosome-bound release factors is proposed⁹. By binding to long poly(A) tails, may protect them from uridylation by ZCCHC6/ZCCHC11 and hence contribute to mRNA stability¹⁰. (Microbial infection) Positively regulates the replication of dengue virus (DENV).

AlphaFold DB , UniProt , Accession P11940, Species HUMAN (Homo sapiens, Human), Gene PABPC1, Length 636 aa.

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.7	Very low	50.9	Low	247 Å²	247	103.6 Å²	103.6	100%	1.217	62%	0.62	S	S	*	*				0	108	0	-75.6	174.2	168.1	0	0	107.6
2	N	34.6	Very low	54.5	Low	140 Å²	140	95.8 Å²	95.8	75%	0.749	57%	0.573	S	S	*	*			trans	-111	111	-178.2	-155.1	17.1	0	0	0	108.1	S4	N2-S4 PolarHBondContact O-N 3.3Å; N2-S4 VanDerWaalsContact O-N 3.11Å
3	P	36.6	Very low	57.7	Low	133 Å²	133	88.4 Å²	88.4	86%	0.864	53%	0.529	S	S	*	.	S	Bend	trans	-86.2	32.7	-166.7	34.4	-34.9	0	0	0	114.2
4	S	41.6	Very low	60.4	Low	86 Å²	86	85.9 Å²	85.9	60%	0.601	51%	0.506	S	S	*	.			trans	-134.9	30.1	-175.1	67.6	0	0	0	0	113.9	N2 P6	N2-S4 PolarHBondContact O-N 3.3Å; N2-S4 VanDerWaalsContact O-N 3.11Å; S4-P6 WeakPolarHBondContact O-CD 3.42Å
5	A	45.9	Very low	62.9	Low	80 Å²	80	80.1 Å²	80.1	66%	0.661	47%	0.472	S	S	*	.			trans	-68.9	122.7	169.3	0	0	0	0	0	108.4	S7	A5-S7 PolarHBondContact O-N 3.39Å
6	P	51.7	Low	64.9	Low	55 Å²	55	75.1 Å²	75.1	36%	0.357	44%	0.443	S	S	.	.			trans	-54.8	120.7	171.4	21	-30.5	0	0	0	107.9	S4 Y8 E146	S4-P6 WeakPolarHBondContact O-CD 3.42Å; P6-Y8 VanDerWaalsContact C-N 3.34Å; P6-Y8 HydrophobicContact CB-CE2 4.37Å; P6-Y8 HydrophobicContact CG-CE2 3.69Å; P6-Y8 WeakPolarHBondContact O-CD2 2.99Å; P6-Y8 PolarHBondContact O-N 3.49Å; P6-E146 WeakPolarHBondContact CD-OE1 3.42Å; P6-E146 WeakPolarHBondContact CG-OE1 3.37Å
7	S	43.8	Very low	66.7	Low	111 Å²	111	73.3 Å²	73.3	78%	0.776	43%	0.431	S	S	*	.			trans	-61.4	100	176.6	-177.5	0	0	0	0	107.3	A5 P9	A5-S7 PolarHBondContact O-N 3.39Å; S7-P9 WeakPolarHBondContact O-CD 3.38Å
8	Y	60.1	Low	68.3	Low	54 Å²	54	69.6 Å²	69.6	21%	0.212	41%	0.409	C	S	.	.			trans	-76.8	103.1	166.4	-65.7	-78.8	0	0	0	105.3	P6 M10 W86	P6-Y8 VanDerWaalsContact C-N 3.34Å; P6-Y8 HydrophobicContact CB-CE2 4.37Å; P6-Y8 HydrophobicContact CG-CE2 3.69Å; P6-Y8 WeakPolarHBondContact O-CD2 2.99Å; P6-Y8 PolarHBondContact O-N 3.49Å; Y8-M10 PolarHBondContact O-N 3.18Å; Y8-W86 HydrophobicContact CD1-CB 3.97Å; Y8-W86 HydrophobicContact CD1-CG 4.27Å; Y8-W86 HydrophobicContact CD2-CB 4.26Å; Y8-W86 AromaticContact CD2-CD1 3.96Å; Y8-W86 AromaticContact CD2-CD2 3.59Å; Y8-W86 HydrophobicContact CD2-CD2 3.59Å; Y8-W86 AromaticContact CD2-CE2 3.87Å; Y8-W86 HydrophobicContact CD2-CE3 4.03Å; Y8-W86 AromaticContact CD2-CG 3.68Å; Y8-W86 HydrophobicContact CD2-CG 3.68Å; Y8-W86 HydrophobicContact CE1-CB 3.74Å; Y8-W86 HydrophobicContact CE1-CG 4.17Å; Y8-W86 HydrophobicContact CE2-CB 4.05Å; Y8-W86 AromaticContact CE2-CD1 3.49Å; Y8-W86 VanDerWaalsContact CE2-CD1 3.49Å; Y8-W86 AromaticContact CE2-CD2 3.96Å; Y8-W86 HydrophobicContact CE2-CD2 3.96Å; Y8-W86 AromaticContact CE2-CG 3.56Å; Y8-W86 HydrophobicContact CE2-CG 3.56Å; Y8-W86 AromaticContact CE2-NE1 3.85Å; Y8-W86 HydrophobicContact CG-CB 4.23Å; Y8-W86 AromaticContact CG-CD2 3.94Å; Y8-W86 HydrophobicContact CG-CD2 3.94Å; Y8-W86 AromaticContact CG-CE3 3.98Å; Y8-W86 HydrophobicContact CG-CE3 3.98Å; Y8-W86 HydrophobicContact CG-CG 4.05Å; Y8-W86 AromaticContact CZ-CD1 3.92Å; Y8-W86 AromaticContact CZ-CG 3.83Å
9	P	57.4	Low	69.8	Low	121 Å²	121	68.3 Å²	68.3	79%	0.786	40%	0.398	S	S	*	.	S	Bend	trans	-67.3	-3.3	-172	29.2	-35.6	0	0	0	112.4	S7	S7-P9 WeakPolarHBondContact O-CD 3.38Å
10	M	67.6	Low	71	Confident	102 Å²	102	68.3 Å²	68.3	50%	0.502	40%	0.4	S	S	.	.	S	Bend	trans	-123.8	127.5	178.1	-48.1	-162.6	90	0	0	108.5	Y8 S12	Y8-M10 PolarHBondContact O-N 3.18Å; M10-S12 WeakPolarHBondContact CB-OG 3.43Å; M10-S12 PolarHBondContact O-N 3.11Å
11	A	89.3	Confident	72.1	Confident	11 Å²	11	69.1 Å²	69.1	9%	0.091	40%	0.403	C	S	.	.			trans	-70.6	49.3	170.7	0	0	0	0	0	111.3	N58 F59 P62 A65	A11-N58 CarbonylContact O-C 3.54Å; A11-N58 WeakPolarHBondContact O-CA 3.38Å; A11-F59 HydrophobicContact CB-CB 4.08Å; A11-F59 WeakPolarHBondContact CB-O 3.41Å; A11-F59 PolarHBondContact O-N 3.14Å; A11-P62 HydrophobicContact CB-CB 4.42Å; A11-P62 HydrophobicContact CB-CG 4.22Å; A11-A65 HydrophobicContact CB-CB 4.22Å
12	S	93.9	Very high	75.2	Confident	9 Å²	9	57.3 Å²	57.3	6%	0.063	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	120.2	-168.3	-69.3	0	0	0	0	110.2	M10 N58 S87	M10-S12 WeakPolarHBondContact CB-OG 3.43Å; M10-S12 PolarHBondContact O-N 3.11Å; S12-N58 VanDerWaalsContact CB-OD1 3.23Å; S12-N58 WeakPolarHBondContact CB-OD1 3.21Å; S12-N58 PolarHBondContact OG-OD1 3.19Å; S12-S87 WeakPolarHBondContact O-CB 3.41Å; S12-S87 PolarHBondContact O-N 3.29Å
13	L	96.1	Very high	78.2	Confident	0 Å²	0	53 Å²	53	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	141.2	175.3	-57.3	-179.3	0	0	0	111	Y56 V57 F59 A65 A68 L69 I84 M85 W86	L13-Y56 WeakPolarHBondContact O-CA 3.34Å; L13-V57 PolarHBondContact N-O 2.89Å; L13-V57 PolarHBondContact O-N 3.45Å; L13-F59 HydrophobicContact CD1-CD2 4.32Å; L13-F59 HydrophobicContact CD1-CE2 3.75Å; L13-F59 HydrophobicContact CG-CE2 4.41Å; L13-A65 HydrophobicContact CD1-CB 4.28Å; L13-A65 WeakPolarHBondContact CD1-O 3.47Å; L13-A65 HydrophobicContact CD2-CB 4.04Å; L13-A65 HydrophobicContact CG-CB 4.02Å; L13-A68 HydrophobicContact CD1-CB 3.83Å; L13-L69 HydrophobicContact CD2-CB 4.41Å; L13-L69 HydrophobicContact CD2-CD1 4.15Å; L13-I84 HydrophobicContact CB-CG2 4.12Å; L13-I84 HydrophobicContact CD1-CG2 3.77Å; L13-I84 HydrophobicContact CD2-CG2 4.43Å; L13-I84 HydrophobicContact CG-CG2 4.33Å; L13-M85 CarbonylContact C-O 3.41Å; L13-M85 WeakPolarHBondContact CA-O 3.43Å; L13-W86 HydrophobicContact CD2-CD2 4.19Å; L13-W86 HydrophobicContact CD2-CE3 3.85Å; L13-W86 HydrophobicContact CD2-CZ3 4.06Å
14	Y	95.7	Very high	81.1	Confident	53 Å²	53	50 Å²	50	21%	0.208	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	126.5	161.3	171.6	-88.8	0	0	0	108.4	G16 Y54 Y56 I84 M85	Y14-G16 VanDerWaalsContact CE1-CA 3.5Å; Y14-Y54 HydrophobicContact CD2-CD2 4.09Å; Y14-Y54 AromaticContact CE2-CD2 3.47Å; Y14-Y54 HydrophobicContact CE2-CD2 3.47Å; Y14-Y54 VanDerWaalsContact CE2-CD2 3.47Å; Y14-Y54 HydrophobicContact CE2-CE2 4.27Å; Y14-Y54 AromaticContact CE2-CG 3.67Å; Y14-Y54 HydrophobicContact CE2-CG 3.67Å; Y14-Y54 WeakPolarHBondContact OH-CB 3.42Å; Y14-Y56 AromaticContact CD2-CE1 3.84Å; Y14-Y56 HydrophobicContact CD2-CE1 3.84Å; Y14-I84 CarbonylContact O-C 3.57Å; Y14-I84 WeakPolarHBondContact O-CA 3.3Å; Y14-M85 HydrophobicContact CD1-CB 4.38Å; Y14-M85 HydrophobicContact CD1-CG 4.43Å; Y14-M85 HydrophobicContact CD1-SD 4.26Å; Y14-M85 PolarHBondContact N-O 3.3Å; Y14-M85 PolarHBondContact O-N 3.43Å
15	V	97.1	Very high	83.7	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	103	176.2	-171.2	0	0	0	0	108	L18 F31 Y54 A55 V57 V82 I84	V15-L18 HydrophobicContact CG1-CD2 3.71Å; V15-L18 HydrophobicContact CG1-CG 4.39Å; V15-F31 HydrophobicContact CG1-CE2 4.23Å; V15-F31 HydrophobicContact CG1-CZ 4.16Å; V15-F31 HydrophobicContact CG2-CE2 4.03Å; V15-F31 HydrophobicContact CG2-CZ 3.94Å; V15-Y54 CarbonylContact O-C 3.59Å; V15-Y54 WeakPolarHBondContact O-CA 3.44Å; V15-Y54 WeakPolarHBondContact O-CB 3.43Å; V15-A55 PolarHBondContact N-O 3.46Å; V15-A55 PolarHBondContact O-N 2.91Å; V15-V57 HydrophobicContact CG2-CB 4.48Å; V15-V57 HydrophobicContact CG2-CG2 3.78Å; V15-V82 HydrophobicContact CG1-CB 4.03Å; V15-V82 HydrophobicContact CG1-CG1 4.48Å; V15-V82 HydrophobicContact CG1-CG2 4.5Å; V15-I84 HydrophobicContact CG1-CG1 4.46Å
16	G	95.9	Very high	86.1	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	177.4	-177.6	0	0	0	0	0	113.9	Y14 L18 G53 R83	Y14-G16 VanDerWaalsContact CE1-CA 3.5Å; G16-L18 PolarHBondContact O-N 3.17Å; G16-G53 CarbonylContact C-O 3.52Å; G16-R83 PolarHBondContact N-O 3.26Å; G16-R83 PolarHBondContact O-N 3.08Å
17	D	94.5	Very high	88.3	Confident	44 Å²	44	45.6 Å²	45.6	24%	0.235	26%	0.261	C	S	.	.	S	Bend	trans	59.6	26.2	178.3	-60.6	-51.3	0	0	0	113.9	G53 R83 K129	D17-G53 PolarHBondContact N-O 3.37Å; D17-R83 HydrophobicContact CB-CB 4.43Å; D17-R83 WeakPolarHBondContact OD2-CB 3.46Å; D17-R83 IonicContact OD2-CZ 3.51Å; D17-R83 IonicContact OD2-NE 2.8Å; D17-R83 PolarHBondContact OD2-NE 3.31Å; D17-R83 IonicContact OD2-NH2 2.8Å; D17-K129 IonicContact OD1-NZ 3.5Å; D17-K129 PolarHBondContact OD1-NZ 2.96Å; D17-K129 WeakPolarHBondContact OD2-CD 3.33Å; D17-K129 IonicContact OD2-NZ 3.25Å; D17-K129 PolarHBondContact OD2-NZ 2.91Å
18	L	96.6	Very high	90.9	Very high	6 Å²	6	46.4 Å²	46.4	3%	0.031	25%	0.248	C	C	.	.			trans	-65.4	143.2	177.7	-62.2	-178.7	0	0	0	111.4	V15 G16 V22 L27 G53 A55 V82	V15-L18 HydrophobicContact CG1-CD2 3.71Å; V15-L18 HydrophobicContact CG1-CG 4.39Å; G16-L18 PolarHBondContact O-N 3.17Å; L18-V22 HydrophobicContact CB-CB 4.31Å; L18-V22 HydrophobicContact CB-CG2 4.42Å; L18-V22 HydrophobicContact CD1-CG1 4.3Å; L18-V22 HydrophobicContact CD2-CG1 4.3Å; L18-L27 HydrophobicContact CD1-CD1 4.15Å; L18-L27 HydrophobicContact CD1-CD2 4.41Å; L18-L27 HydrophobicContact CD2-CD2 4.05Å; L18-G53 PolarHBondContact N-O 3.44Å; L18-A55 HydrophobicContact CD1-CB 3.63Å; L18-V82 HydrophobicContact CD2-CB 4.33Å; L18-V82 HydrophobicContact CD2-CG1 3.65Å
19	H	95.4	Very high	92.6	Very high	45 Å²	45	50.5 Å²	50.5	21%	0.208	27%	0.269	C	S	.	.			trans	-62.5	141.8	167.3	-174.9	-79.9	0	0	0	110.3	D21 V22 K78 K80	H19-D21 IonicContact CE1-OD2 2.78Å; H19-D21 PolarHBondContact CE1-OD2 3.05Å; H19-D21 VanDerWaalsContact CE1-OD2 3.25Å; H19-D21 PolarHBondContact ND1-N 2.9Å; H19-D21 IonicContact ND1-OD2 3.4Å; H19-D21 PolarHBondContact O-N 3.45Å; H19-V22 HydrophobicContact CB-CG2 3.88Å; H19-V22 WeakPolarHBondContact O-CB 3.36Å; H19-V22 WeakPolarHBondContact O-CG2 3.2Å; H19-V22 PolarHBondContact O-N 3.2Å; H19-K78 HydrophobicContact CB-CB 3.89Å; H19-K78 PolarHBondContact CD2-O 3.01Å; H19-K80 HydrophobicContact CB-CB 4.49Å; H19-K80 HydrophobicContact CB-CD 4.17Å; H19-K80 HydrophobicContact CB-CG 4.48Å
20	P	94.5	Very high	94.4	Very high	68 Å²	68	48.1 Å²	48.1	44%	0.442	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-31.2	-175.4	-30.4	36.2	0	0	0	115.3	S51	P20-S51 VanDerWaalsContact O-CB 3.23Å; P20-S51 WeakPolarHBondContact O-CB 3.43Å
21	D	95	Very high	95.9	Very high	86 Å²	86	43.2 Å²	43.2	46%	0.46	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-1.7	179.6	-55.6	-16.3	0	0	0	114.7	H19 T23 K78	H19-D21 IonicContact CE1-OD2 2.78Å; H19-D21 PolarHBondContact CE1-OD2 3.05Å; H19-D21 VanDerWaalsContact CE1-OD2 3.25Å; H19-D21 PolarHBondContact ND1-N 2.9Å; H19-D21 IonicContact ND1-OD2 3.4Å; H19-D21 PolarHBondContact O-N 3.45Å; D21-T23 PolarHBondContact O-N 3.39Å; D21-K78 HydrophobicContact CB-CD 3.9Å; D21-K78 IonicContact OD2-NZ 3.52Å; D21-K78 PolarHBondContact OD2-NZ 3.22Å
22	V	96.8	Very high	96.2	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.233	C	C	.	.			trans	-64	127	178.1	173.7	0	0	0	0	109	L18 H19 L27 I77	L18-V22 HydrophobicContact CB-CB 4.31Å; L18-V22 HydrophobicContact CB-CG2 4.42Å; L18-V22 HydrophobicContact CD1-CG1 4.3Å; L18-V22 HydrophobicContact CD2-CG1 4.3Å; H19-V22 HydrophobicContact CB-CG2 3.88Å; H19-V22 WeakPolarHBondContact O-CB 3.36Å; H19-V22 WeakPolarHBondContact O-CG2 3.2Å; H19-V22 PolarHBondContact O-N 3.2Å; V22-L27 HydrophobicContact CG1-CD1 4.21Å; V22-L27 HydrophobicContact CG1-CD2 3.77Å; V22-L27 HydrophobicContact CG1-CG 3.72Å; V22-I77 HydrophobicContact CG2-CB 4.49Å; V22-I77 HydrophobicContact CG2-CG2 3.78Å
23	T	96.2	Very high	96.3	Very high	49 Å²	49	49.1 Å²	49.1	30%	0.301	26%	0.26	S	S	.	.			trans	-105.2	164.5	178.7	65.5	0	0	0	0	111.3	D21 A25 M26 L27	D21-T23 PolarHBondContact O-N 3.39Å; T23-A25 PolarHBondContact O-N 2.77Å; T23-M26 PolarHBondContact O-N 3.24Å; T23-M26 WeakPolarHBondContact OG1-CG 3.07Å; T23-M26 PolarHBondContact OG1-N 3.43Å; T23-L27 PolarHBondContact O-N 3.4Å; T23-L27 VanDerWaalsContact O-N 3.17Å
24	E	97.2	Very high	96.4	Very high	69 Å²	69	49.1 Å²	49.1	32%	0.322	26%	0.26	S	S	.	.	H	α-helix	trans	-55.5	-37.5	173.7	-67.3	79.4	171.4	0	0	111.7	L27 Y28 I40 V42 R44	E24-L27 PolarHBondContact O-N 3.25Å; E24-Y28 PolarHBondContact O-N 3.03Å; E24-I40 HydrophobicContact CB-CG2 4.34Å; E24-I40 HydrophobicContact CG-CG2 4.38Å; E24-V42 HydrophobicContact CG-CB 4.36Å; E24-V42 HydrophobicContact CG-CG2 3.9Å; E24-V42 WeakPolarHBondContact OE1-CB 3.32Å; E24-R44 IonicContact OE1-NE 2.74Å; E24-R44 IonicContact OE1-NH2 3.66Å; E24-R44 IonicContact OE2-NH2 3.87Å; E24-R44 PolarHBondContact OE2-NH2 3.35Å
25	A	97	Very high	96.3	Very high	60 Å²	60	47.2 Å²	47.2	50%	0.496	26%	0.256	S	S	.	.	H	α-helix	trans	-65.6	-45.1	177.8	0	0	0	0	0	112.4	T23 L27 Y28 E29	T23-A25 PolarHBondContact O-N 2.77Å; A25-L27 VanDerWaalsContact C-N 3.27Å; A25-L27 PolarHBondContact O-N 3.1Å; A25-Y28 WeakPolarHBondContact O-CB 3.39Å; A25-Y28 PolarHBondContact O-N 3.44Å; A25-Y28 VanDerWaalsContact O-N 3.1Å; A25-E29 PolarHBondContact O-N 3.33Å
26	M	96.9	Very high	96.3	Very high	69 Å²	69	50.7 Å²	50.7	34%	0.34	28%	0.279	S	S	.	.	H	α-helix	trans	-61.2	-38.3	176.5	-67	173.8	-179.4	0	0	111.7	T23 K30 K78	T23-M26 PolarHBondContact O-N 3.24Å; T23-M26 WeakPolarHBondContact OG1-CG 3.07Å; T23-M26 PolarHBondContact OG1-N 3.43Å; M26-K30 WeakPolarHBondContact O-CB 3.32Å; M26-K30 PolarHBondContact O-N 2.97Å; M26-K30 VanDerWaalsContact O-N 3.09Å; M26-K78 HydrophobicContact CE-CD 4.38Å; M26-K78 HydrophobicContact SD-CD 4.17Å
27	L	97.6	Very high	96.3	Very high	0 Å²	0	52 Å²	52	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-68.8	-39.1	174.9	-65.2	174	0	0	0	111.4	L18 V22 T23 E24 A25 K30 F31 I40 V42 A55 I77	L18-L27 HydrophobicContact CD1-CD1 4.15Å; L18-L27 HydrophobicContact CD1-CD2 4.41Å; L18-L27 HydrophobicContact CD2-CD2 4.05Å; V22-L27 HydrophobicContact CG1-CD1 4.21Å; V22-L27 HydrophobicContact CG1-CD2 3.77Å; V22-L27 HydrophobicContact CG1-CG 3.72Å; T23-L27 PolarHBondContact O-N 3.4Å; T23-L27 VanDerWaalsContact O-N 3.17Å; E24-L27 PolarHBondContact O-N 3.25Å; A25-L27 VanDerWaalsContact C-N 3.27Å; A25-L27 PolarHBondContact O-N 3.1Å; L27-K30 PolarHBondContact O-N 2.83Å; L27-F31 HydrophobicContact CB-CD2 4.25Å; L27-F31 HydrophobicContact CD2-CD2 4.38Å; L27-F31 HydrophobicContact CD2-CE2 3.9Å; L27-F31 WeakPolarHBondContact O-CB 3.42Å; L27-F31 WeakPolarHBondContact O-CD2 3.29Å; L27-F31 PolarHBondContact O-N 2.65Å; L27-I40 HydrophobicContact CB-CD1 3.97Å; L27-I40 HydrophobicContact CB-CG2 3.99Å; L27-I40 HydrophobicContact CD1-CG2 3.81Å; L27-V42 HydrophobicContact CD1-CG2 3.67Å; L27-A55 HydrophobicContact CD1-CB 3.47Å; L27-A55 VanDerWaalsContact CD1-CB 3.47Å; L27-I77 HydrophobicContact CD2-CD1 4.17Å
28	Y	97.4	Very high	96.3	Very high	129 Å²	129	56.2 Å²	56.2	51%	0.506	31%	0.308	S	S	.	.	H	α-helix	trans	-61.1	-49	176.7	-175.3	-90.6	0	0	0	111.7	E24 A25 K30 F31 S32 I37 I40	E24-Y28 PolarHBondContact O-N 3.03Å; A25-Y28 WeakPolarHBondContact O-CB 3.39Å; A25-Y28 PolarHBondContact O-N 3.44Å; A25-Y28 VanDerWaalsContact O-N 3.1Å; Y28-K30 VanDerWaalsContact C-N 3.28Å; Y28-K30 PolarHBondContact O-N 3.11Å; Y28-F31 PolarHBondContact O-N 2.76Å; Y28-S32 WeakPolarHBondContact O-CB 3.48Å; Y28-S32 PolarHBondContact O-N 3.17Å; Y28-S32 PolarHBondContact O-OG 2.64Å; Y28-S32 VanDerWaalsContact O-OG 3.08Å; Y28-I37 HydrophobicContact CD2-CB 4.39Å; Y28-I37 HydrophobicContact CD2-CD1 3.95Å; Y28-I37 HydrophobicContact CE2-CB 4.25Å; Y28-I37 HydrophobicContact CE2-CD1 4.32Å; Y28-I40 VanDerWaalsContact CA-CD1 3.41Å; Y28-I40 HydrophobicContact CD2-CD1 4.23Å; Y28-I40 HydrophobicContact CG-CD1 4.49Å; Y28-I40 VanDerWaalsContact N-CD1 3.3Å
29	E	96.5	Very high	96.3	Very high	140 Å²	140	58.2 Å²	58.2	65%	0.654	32%	0.322	S	S	*	.	H	α-helix	trans	-56.8	-44.1	175.2	-71.8	174.7	-177.4	0	0	111.2	A25 S32 P33	A25-E29 PolarHBondContact O-N 3.33Å; E29-S32 PolarHBondContact O-OG 3.29Å; E29-P33 WeakPolarHBondContact O-CD 3.37Å
30	K	96.3	Very high	96.4	Very high	70 Å²	70	57.6 Å²	57.6	30%	0.304	32%	0.32	S	S	.	.	H	α-helix	trans	-66.4	-43.7	-179.1	-175.1	60.4	179.3	172.8	0	113.4	M26 L27 Y28 P33 M72 D75 I77	M26-K30 WeakPolarHBondContact O-CB 3.32Å; M26-K30 PolarHBondContact O-N 2.97Å; M26-K30 VanDerWaalsContact O-N 3.09Å; L27-K30 PolarHBondContact O-N 2.83Å; Y28-K30 VanDerWaalsContact C-N 3.28Å; Y28-K30 PolarHBondContact O-N 3.11Å; K30-P33 WeakPolarHBondContact O-CD 3.09Å; K30-M72 VanDerWaalsContact O-CE 3.32Å; K30-M72 WeakPolarHBondContact O-CE 3.28Å; K30-D75 WeakPolarHBondContact CE-OD2 3.47Å; K30-D75 VanDerWaalsContact NZ-CG 3.33Å; K30-D75 IonicContact NZ-OD2 3.63Å; K30-D75 PolarHBondContact NZ-OD2 2.77Å; K30-I77 HydrophobicContact CB-CD1 4.26Å; K30-I77 HydrophobicContact CG-CD1 3.95Å
31	F	97.1	Very high	96.4	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-94.2	-18.7	-170.6	-75	-66.6	0	0	0	114.3	V15 L27 Y28 P33 A34 I37 V57 F59 A68 M72 I84	V15-F31 HydrophobicContact CG1-CE2 4.23Å; V15-F31 HydrophobicContact CG1-CZ 4.16Å; V15-F31 HydrophobicContact CG2-CE2 4.03Å; V15-F31 HydrophobicContact CG2-CZ 3.94Å; L27-F31 HydrophobicContact CB-CD2 4.25Å; L27-F31 HydrophobicContact CD2-CD2 4.38Å; L27-F31 HydrophobicContact CD2-CE2 3.9Å; L27-F31 WeakPolarHBondContact O-CB 3.42Å; L27-F31 WeakPolarHBondContact O-CD2 3.29Å; L27-F31 PolarHBondContact O-N 2.65Å; Y28-F31 PolarHBondContact O-N 2.76Å; F31-P33 VanDerWaalsContact C-N 3.34Å; F31-A34 WeakPolarHBondContact O-CB 3.17Å; F31-A34 PolarHBondContact O-N 3.03Å; F31-I37 HydrophobicContact CB-CD1 3.69Å; F31-V57 HydrophobicContact CB-CG1 4.36Å; F31-V57 HydrophobicContact CD2-CG2 3.99Å; F31-V57 HydrophobicContact CE2-CG2 4.23Å; F31-V57 HydrophobicContact CG-CG1 4.4Å; F31-F59 HydrophobicContact CB-CZ 4Å; F31-F59 HydrophobicContact CD1-CZ 4.25Å; F31-F59 HydrophobicContact CG-CZ 4.46Å; F31-A68 HydrophobicContact CD1-CB 4Å; F31-A68 HydrophobicContact CE1-CB 4.35Å; F31-M72 HydrophobicContact CD1-SD 3.45Å; F31-M72 WeakPolarHBondContact CD1-SD 3.24Å; F31-M72 HydrophobicContact CE1-CB 4.07Å; F31-M72 HydrophobicContact CE1-SD 3.8Å; F31-M72 HydrophobicContact CG-SD 4.31Å; F31-I84 HydrophobicContact CE1-CD1 3.5Å; F31-I84 VanDerWaalsContact CE1-CD1 3.5Å; F31-I84 HydrophobicContact CZ-CD1 3.66Å; F31-I84 HydrophobicContact CZ-CG1 4.27Å
32	S	96.4	Very high	96.5	Very high	46 Å²	46	58.9 Å²	58.9	32%	0.322	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-59.4	-31.7	-178.5	61.6	0	0	0	0	114.9	Y28 E29 A34 G35	Y28-S32 WeakPolarHBondContact O-CB 3.48Å; Y28-S32 PolarHBondContact O-N 3.17Å; Y28-S32 PolarHBondContact O-OG 2.64Å; Y28-S32 VanDerWaalsContact O-OG 3.08Å; E29-S32 PolarHBondContact O-OG 3.29Å; S32-A34 PolarHBondContact O-N 3.38Å; S32-G35 PolarHBondContact O-N 2.91Å
33	P	96.9	Very high	96.5	Very high	97 Å²	97	59.7 Å²	59.7	63%	0.63	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-63.6	-22.9	174	-22.8	35.7	0	0	0	113.4	E29 K30 F31 G35 M72	E29-P33 WeakPolarHBondContact O-CD 3.37Å; K30-P33 WeakPolarHBondContact O-CD 3.09Å; F31-P33 VanDerWaalsContact C-N 3.34Å; P33-G35 VanDerWaalsContact C-N 3.28Å; P33-G35 PolarHBondContact O-N 3.31Å; P33-M72 HydrophobicContact CB-CE 4.25Å
34	A	96.4	Very high	96.5	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.008	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-78.8	-6.8	175.8	0	0	0	0	0	113.3	F31 S32 F59 D64 R67 A68 M72	F31-A34 WeakPolarHBondContact O-CB 3.17Å; F31-A34 PolarHBondContact O-N 3.03Å; S32-A34 PolarHBondContact O-N 3.38Å; A34-F59 HydrophobicContact CB-CE1 4.02Å; A34-F59 HydrophobicContact CB-CZ 4.17Å; A34-D64 WeakPolarHBondContact O-CA 3.18Å; A34-D64 VanDerWaalsContact O-CB 3.26Å; A34-D64 WeakPolarHBondContact O-CB 3.47Å; A34-R67 PolarHBondContact O-NE 2.95Å; A34-R67 VanDerWaalsContact O-NE 3.16Å; A34-R67 PolarHBondContact O-NH2 2.76Å; A34-A68 HydrophobicContact CB-CB 3.6Å; A34-M72 HydrophobicContact CB-CE 3.65Å; A34-M72 HydrophobicContact CB-SD 4.3Å
35	G	95.3	Very high	96.3	Very high	12 Å²	12	61 Å²	61	12%	0.124	32%	0.316	C	S	.	.	S	Bend	trans	133.6	177.3	174.8	0	0	0	0	0	114	S32 P33 I37	S32-G35 PolarHBondContact O-N 2.91Å; P33-G35 VanDerWaalsContact C-N 3.28Å; P33-G35 PolarHBondContact O-N 3.31Å; G35-I37 PolarHBondContact O-N 3.46Å
36	P	96.1	Very high	96.1	Very high	73 Å²	73	65.1 Å²	65.1	47%	0.474	33%	0.327	S	S	.	.			trans	-60.7	124.1	-177.1	-23.5	34.6	0	0	0	112.9	Q60 D64	P36-Q60 HydrophobicContact CB-CB 4.12Å; P36-Q60 PolarHBondContact O-N 3.06Å; P36-D64 WeakPolarHBondContact CD-OD2 3.36Å
37	I	96.2	Very high	95.8	Very high	29 Å²	29	69.2 Å²	69.2	15%	0.149	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	123	-179.9	-57	177.7	0	0	0	109.6	Y28 F31 G35 I40 V57 N58 F59	Y28-I37 HydrophobicContact CD2-CB 4.39Å; Y28-I37 HydrophobicContact CD2-CD1 3.95Å; Y28-I37 HydrophobicContact CE2-CB 4.25Å; Y28-I37 HydrophobicContact CE2-CD1 4.32Å; F31-I37 HydrophobicContact CB-CD1 3.69Å; G35-I37 PolarHBondContact O-N 3.46Å; I37-I40 HydrophobicContact CD1-CD1 4.07Å; I37-I40 HydrophobicContact CG2-CD1 4.14Å; I37-I40 HydrophobicContact CG2-CG1 3.66Å; I37-V57 HydrophobicContact CG2-CG1 4.17Å; I37-N58 CarbonylContact C-O 3.59Å; I37-N58 WeakPolarHBondContact CG2-O 3.48Å; I37-F59 HydrophobicContact CG1-CD1 4.15Å; I37-F59 HydrophobicContact CG1-CE1 3.88Å; I37-F59 HydrophobicContact CG1-CZ 4.47Å
38	L	94.9	Very high	95.7	Very high	132 Å²	132	72.1 Å²	72.1	69%	0.691	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	-43.5	175.3	-178.5	66.6	0	0	0	111.9	N58	L38-N58 WeakPolarHBondContact CA-O 3.38Å; L38-N58 HydrophobicContact CB-CB 4.27Å; L38-N58 WeakPolarHBondContact CB-O 3.39Å; L38-N58 PolarHBondContact N-O 2.99Å
39	S	95.6	Very high	95.4	Very high	48 Å²	48	74.2 Å²	74.2	34%	0.336	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.7	148.9	178.2	70.4	0	0	0	0	112.5	N58	S39-N58 PolarHBondContact N-O 3.01Å; S39-N58 PolarHBondContact O-N 3.17Å; S39-N58 PolarHBondContact OG-ND2 3.17Å
40	I	97.1	Very high	95.1	Very high	32 Å²	32	75.7 Å²	75.7	16%	0.164	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	137.6	169.1	-56.3	-176.2	0	0	0	109.4	E24 L27 Y28 I37 Y56 V57	E24-I40 HydrophobicContact CB-CG2 4.34Å; E24-I40 HydrophobicContact CG-CG2 4.38Å; L27-I40 HydrophobicContact CB-CD1 3.97Å; L27-I40 HydrophobicContact CB-CG2 3.99Å; L27-I40 HydrophobicContact CD1-CG2 3.81Å; Y28-I40 VanDerWaalsContact CA-CD1 3.41Å; Y28-I40 HydrophobicContact CD2-CD1 4.23Å; Y28-I40 HydrophobicContact CG-CD1 4.49Å; Y28-I40 VanDerWaalsContact N-CD1 3.3Å; I37-I40 HydrophobicContact CD1-CD1 4.07Å; I37-I40 HydrophobicContact CG2-CD1 4.14Å; I37-I40 HydrophobicContact CG2-CG1 3.66Å; I40-Y56 WeakPolarHBondContact CA-O 3.3Å; I40-V57 HydrophobicContact CG1-CG1 4.31Å; I40-V57 HydrophobicContact CG1-CG2 4.39Å; I40-V57 HydrophobicContact CG2-CG2 4.35Å
41	R	96.2	Very high	95	Very high	172 Å²	172	73.2 Å²	73.2	65%	0.649	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.1	107.9	174.6	-178.9	-174.7	-62.9	-84.1	-1.2	110.7	A55 Y56	R41-A55 CarbonylContact O-C 3.56Å; R41-A55 WeakPolarHBondContact O-CA 3.37Å; R41-A55 WeakPolarHBondContact O-CB 3.46Å; R41-Y56 PolarHBondContact N-O 3.47Å; R41-Y56 PolarHBondContact O-N 2.81Å
42	V	97.3	Very high	95	Very high	8 Å²	8	77.4 Å²	77.4	5%	0.048	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	124.4	166.1	179.5	0	0	0	0	108.3	E24 L27 R44 A55	E24-V42 HydrophobicContact CG-CB 4.36Å; E24-V42 HydrophobicContact CG-CG2 3.9Å; E24-V42 WeakPolarHBondContact OE1-CB 3.32Å; L27-V42 HydrophobicContact CD1-CG2 3.67Å; V42-R44 HydrophobicContact CG1-CG 4.27Å; V42-R44 PolarHBondContact O-N 2.88Å; V42-A55 HydrophobicContact CB-CB 4.48Å; V42-A55 HydrophobicContact CG2-CB 4.09Å
43	C	95.6	Very high	94.9	Very high	17 Å²	17	76.1 Å²	76.1	12%	0.115	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	122.2	179.5	-68.5	0	0	0	0	109.4	L52 Y54	C43-L52 HydrophobicContact CB-CD1 4.35Å; C43-L52 WeakPolarHBondContact O-CB 3.34Å; C43-L52 PolarHBondContact O-N 2.87Å; C43-Y54 HydrophobicContact CB-CD1 4.41Å; C43-Y54 HydrophobicContact CB-CD2 3.88Å; C43-Y54 HydrophobicContact CB-CE1 3.97Å; C43-Y54 HydrophobicContact CB-CE2 3.39Å; C43-Y54 HydrophobicContact CB-CG 4.36Å; C43-Y54 VanDerWaalsContact CB-CZ 3.42Å; C43-Y54 PolarHBondContact N-O 2.97Å; C43-Y54 WeakPolarHBondContact SG-CE2 3.46Å
44	R	96.8	Very high	94.9	Very high	90 Å²	90	74.4 Å²	74.4	34%	0.34	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	147.2	-176.2	-62.1	171.6	-172.8	-85.4	-1.5	109.7	E24 V42 M46 R49 R50	E24-R44 IonicContact OE1-NE 2.74Å; E24-R44 IonicContact OE1-NH2 3.66Å; E24-R44 IonicContact OE2-NH2 3.87Å; E24-R44 PolarHBondContact OE2-NH2 3.35Å; V42-R44 HydrophobicContact CG1-CG 4.27Å; V42-R44 PolarHBondContact O-N 2.88Å; R44-M46 PolarHBondContact O-N 3.48Å; R44-R49 WeakPolarHBondContact CD-O 3.23Å; R44-R50 CarbonylContact C-O 3.57Å; R44-R50 WeakPolarHBondContact CA-O 3.32Å; R44-R50 WeakPolarHBondContact CB-O 3.5Å
45	D	92.9	Very high	95	Very high	55 Å²	55	74.3 Å²	74.3	29%	0.294	36%	0.362	S	S	.	.			trans	-59.4	132.7	172.4	178.4	-99.2	0	0	0	110	I47 T48 R49 R50 L52	D45-I47 PolarHBondContact O-N 3.44Å; D45-I47 PolarHBondContact OD1-N 3.21Å; D45-I47 VanDerWaalsContact OD1-N 3.13Å; D45-T48 VanDerWaalsContact CB-OG1 3.3Å; D45-T48 WeakPolarHBondContact CB-OG1 3.22Å; D45-T48 WeakPolarHBondContact OD1-CB 3.33Å; D45-T48 PolarHBondContact OD1-N 3.46Å; D45-T48 PolarHBondContact OD1-OG1 2.97Å; D45-R49 VanDerWaalsContact O-CA 3.24Å; D45-R49 WeakPolarHBondContact O-CA 3.39Å; D45-R49 PolarHBondContact O-N 3.29Å; D45-R50 PolarHBondContact N-O 3.37Å; D45-L52 HydrophobicContact CB-CD2 3.95Å
46	M	92.3	Very high	95.1	Very high	148 Å²	148	76.2 Å²	76.2	73%	0.729	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-31.2	-172	-170.9	66.1	72.9	0	0	112.3	R44	R44-M46 PolarHBondContact O-N 3.48Å
47	I	91.7	Very high	95.1	Very high	155 Å²	155	72.7 Å²	72.7	80%	0.795	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-52	-174.2	-58.5	175.2	0	0	0	110.1	D45	D45-I47 PolarHBondContact O-N 3.44Å; D45-I47 PolarHBondContact OD1-N 3.21Å; D45-I47 VanDerWaalsContact OD1-N 3.13Å
48	T	93.9	Very high	95.1	Very high	61 Å²	61	73 Å²	73	37%	0.374	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-10.5	-171.8	63.1	0	0	0	0	113.7	D45 R50	D45-T48 VanDerWaalsContact CB-OG1 3.3Å; D45-T48 WeakPolarHBondContact CB-OG1 3.22Å; D45-T48 WeakPolarHBondContact OD1-CB 3.33Å; D45-T48 PolarHBondContact OD1-N 3.46Å; D45-T48 PolarHBondContact OD1-OG1 2.97Å; T48-R50 PolarHBondContact O-N 3.3Å
49	R	91	Very high	95.2	Very high	172 Å²	172	67 Å²	67	65%	0.649	31%	0.313	S	S	*	.			trans	56.6	8.9	-174.6	-57.3	-61.7	-169.8	175.9	0.9	114.9	R44 D45	R44-R49 WeakPolarHBondContact CD-O 3.23Å; D45-R49 VanDerWaalsContact O-CA 3.24Å; D45-R49 WeakPolarHBondContact O-CA 3.39Å; D45-R49 PolarHBondContact O-N 3.29Å
50	R	91.4	Very high	95.1	Very high	172 Å²	172	70.6 Å²	70.6	65%	0.649	33%	0.325	S	S	*	.			trans	-75.5	145.2	175.7	-70.9	-166.5	-75	-106	4.4	110.6	R44 D45 T48 L52	R44-R50 CarbonylContact C-O 3.57Å; R44-R50 WeakPolarHBondContact CA-O 3.32Å; R44-R50 WeakPolarHBondContact CB-O 3.5Å; D45-R50 PolarHBondContact N-O 3.37Å; T48-R50 PolarHBondContact O-N 3.3Å; R50-L52 PolarHBondContact O-N 2.99Å
51	S	94.6	Very high	94.9	Very high	18 Å²	18	74.3 Å²	74.3	13%	0.126	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	136.4	175.4	179.6	0	0	0	0	110.8	P20 G53	P20-S51 VanDerWaalsContact O-CB 3.23Å; P20-S51 WeakPolarHBondContact O-CB 3.43Å; S51-G53 PolarHBondContact O-N 2.75Å; S51-G53 PolarHBondContact OG-N 3.47Å
52	L	95.2	Very high	94.8	Very high	88 Å²	88	69.1 Å²	69.1	46%	0.461	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	5.6	170	-62.6	175.2	0	0	0	111.9	C43 D45 R50 Y54	C43-L52 HydrophobicContact CB-CD1 4.35Å; C43-L52 WeakPolarHBondContact O-CB 3.34Å; C43-L52 PolarHBondContact O-N 2.87Å; D45-L52 HydrophobicContact CB-CD2 3.95Å; R50-L52 PolarHBondContact O-N 2.99Å; L52-Y54 HydrophobicContact CB-CD1 3.85Å; L52-Y54 HydrophobicContact CB-CE1 3.48Å; L52-Y54 VanDerWaalsContact CB-CE1 3.48Å; L52-Y54 HydrophobicContact CD1-CE1 4.02Å; L52-Y54 HydrophobicContact CG-CE1 4.41Å
53	G	95.7	Very high	94.7	Very high	19 Å²	19	71.5 Å²	71.5	20%	0.196	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	81.4	16.6	177.7	0	0	0	0	0	114.3	G16 D17 L18 S51	G16-G53 CarbonylContact C-O 3.52Å; D17-G53 PolarHBondContact N-O 3.37Å; L18-G53 PolarHBondContact N-O 3.44Å; S51-G53 PolarHBondContact O-N 2.75Å; S51-G53 PolarHBondContact OG-N 3.47Å
54	Y	97	Very high	94.7	Very high	60 Å²	60	71.5 Å²	71.5	24%	0.235	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	159.1	175.4	70.3	-84.9	0	0	0	113.1	Y14 V15 C43 L52 Y56	Y14-Y54 HydrophobicContact CD2-CD2 4.09Å; Y14-Y54 AromaticContact CE2-CD2 3.47Å; Y14-Y54 HydrophobicContact CE2-CD2 3.47Å; Y14-Y54 VanDerWaalsContact CE2-CD2 3.47Å; Y14-Y54 HydrophobicContact CE2-CE2 4.27Å; Y14-Y54 AromaticContact CE2-CG 3.67Å; Y14-Y54 HydrophobicContact CE2-CG 3.67Å; Y14-Y54 WeakPolarHBondContact OH-CB 3.42Å; V15-Y54 CarbonylContact O-C 3.59Å; V15-Y54 WeakPolarHBondContact O-CA 3.44Å; V15-Y54 WeakPolarHBondContact O-CB 3.43Å; C43-Y54 HydrophobicContact CB-CD1 4.41Å; C43-Y54 HydrophobicContact CB-CD2 3.88Å; C43-Y54 HydrophobicContact CB-CE1 3.97Å; C43-Y54 HydrophobicContact CB-CE2 3.39Å; C43-Y54 HydrophobicContact CB-CG 4.36Å; C43-Y54 VanDerWaalsContact CB-CZ 3.42Å; C43-Y54 PolarHBondContact N-O 2.97Å; C43-Y54 WeakPolarHBondContact SG-CE2 3.46Å; L52-Y54 HydrophobicContact CB-CD1 3.85Å; L52-Y54 HydrophobicContact CB-CE1 3.48Å; L52-Y54 VanDerWaalsContact CB-CE1 3.48Å; L52-Y54 HydrophobicContact CD1-CE1 4.02Å; L52-Y54 HydrophobicContact CG-CE1 4.41Å; Y54-Y56 HydrophobicContact CD2-CE2 4.2Å; Y54-Y56 AromaticContact CE2-CE2 3.77Å; Y54-Y56 HydrophobicContact CE2-CE2 3.77Å
55	A	97.8	Very high	94.6	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	166.1	178	0	0	0	0	0	111.5	V15 L18 L27 R41 V42	V15-A55 PolarHBondContact N-O 3.46Å; V15-A55 PolarHBondContact O-N 2.91Å; L18-A55 HydrophobicContact CD1-CB 3.63Å; L27-A55 HydrophobicContact CD1-CB 3.47Å; L27-A55 VanDerWaalsContact CD1-CB 3.47Å; R41-A55 CarbonylContact O-C 3.56Å; R41-A55 WeakPolarHBondContact O-CA 3.37Å; R41-A55 WeakPolarHBondContact O-CB 3.46Å; V42-A55 HydrophobicContact CB-CB 4.48Å; V42-A55 HydrophobicContact CG2-CB 4.09Å
56	Y	96.8	Very high	94.7	Very high	51 Å²	51	69.4 Å²	69.4	20%	0.2	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	131	167.4	-64.3	-75.3	0	0	0	109.8	L13 Y14 I40 R41 Y54 S87	L13-Y56 WeakPolarHBondContact O-CA 3.34Å; Y14-Y56 AromaticContact CD2-CE1 3.84Å; Y14-Y56 HydrophobicContact CD2-CE1 3.84Å; I40-Y56 WeakPolarHBondContact CA-O 3.3Å; R41-Y56 PolarHBondContact N-O 3.47Å; R41-Y56 PolarHBondContact O-N 2.81Å; Y54-Y56 HydrophobicContact CD2-CE2 4.2Å; Y54-Y56 AromaticContact CE2-CE2 3.77Å; Y54-Y56 HydrophobicContact CE2-CE2 3.77Å; Y56-S87 WeakPolarHBondContact CE1-OG 3.39Å
57	V	97.2	Very high	94.9	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	118.5	176	-178.2	0	0	0	0	107.5	L13 V15 F31 I37 I40 F59	L13-V57 PolarHBondContact N-O 2.89Å; L13-V57 PolarHBondContact O-N 3.45Å; V15-V57 HydrophobicContact CG2-CB 4.48Å; V15-V57 HydrophobicContact CG2-CG2 3.78Å; F31-V57 HydrophobicContact CB-CG1 4.36Å; F31-V57 HydrophobicContact CD2-CG2 3.99Å; F31-V57 HydrophobicContact CE2-CG2 4.23Å; F31-V57 HydrophobicContact CG-CG1 4.4Å; I37-V57 HydrophobicContact CG2-CG1 4.17Å; I40-V57 HydrophobicContact CG1-CG1 4.31Å; I40-V57 HydrophobicContact CG1-CG2 4.39Å; I40-V57 HydrophobicContact CG2-CG2 4.35Å; V57-F59 HydrophobicContact CB-CE2 4.43Å; V57-F59 HydrophobicContact CG1-CD2 4.1Å; V57-F59 HydrophobicContact CG1-CE2 3.57Å; V57-F59 HydrophobicContact CG1-CZ 4.01Å
58	N	95.7	Very high	95.1	Very high	34 Å²	34	59.9 Å²	59.9	18%	0.182	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	119.2	177.6	-59.8	-39.2	0	0	0	108.4	A11 S12 I37 L38 S39	A11-N58 CarbonylContact O-C 3.54Å; A11-N58 WeakPolarHBondContact O-CA 3.38Å; S12-N58 VanDerWaalsContact CB-OD1 3.23Å; S12-N58 WeakPolarHBondContact CB-OD1 3.21Å; S12-N58 PolarHBondContact OG-OD1 3.19Å; I37-N58 CarbonylContact C-O 3.59Å; I37-N58 WeakPolarHBondContact CG2-O 3.48Å; L38-N58 WeakPolarHBondContact CA-O 3.38Å; L38-N58 HydrophobicContact CB-CB 4.27Å; L38-N58 WeakPolarHBondContact CB-O 3.39Å; L38-N58 PolarHBondContact N-O 2.99Å; S39-N58 PolarHBondContact N-O 3.01Å; S39-N58 PolarHBondContact O-N 3.17Å; S39-N58 PolarHBondContact OG-ND2 3.17Å
59	F	96.7	Very high	95.2	Very high	6 Å²	6	58.2 Å²	58.2	3%	0.026	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	162	171.7	-71.4	-91.4	0	0	0	110.8	A11 L13 F31 A34 I37 V57 D64 A65 A68	A11-F59 HydrophobicContact CB-CB 4.08Å; A11-F59 WeakPolarHBondContact CB-O 3.41Å; A11-F59 PolarHBondContact O-N 3.14Å; L13-F59 HydrophobicContact CD1-CD2 4.32Å; L13-F59 HydrophobicContact CD1-CE2 3.75Å; L13-F59 HydrophobicContact CG-CE2 4.41Å; F31-F59 HydrophobicContact CB-CZ 4Å; F31-F59 HydrophobicContact CD1-CZ 4.25Å; F31-F59 HydrophobicContact CG-CZ 4.46Å; A34-F59 HydrophobicContact CB-CE1 4.02Å; A34-F59 HydrophobicContact CB-CZ 4.17Å; I37-F59 HydrophobicContact CG1-CD1 4.15Å; I37-F59 HydrophobicContact CG1-CE1 3.88Å; I37-F59 HydrophobicContact CG1-CZ 4.47Å; V57-F59 HydrophobicContact CB-CE2 4.43Å; V57-F59 HydrophobicContact CG1-CD2 4.1Å; V57-F59 HydrophobicContact CG1-CE2 3.57Å; V57-F59 HydrophobicContact CG1-CZ 4.01Å; F59-D64 HydrophobicContact CB-CB 4.07Å; F59-D64 HydrophobicContact CD1-CB 3.66Å; F59-D64 HydrophobicContact CE1-CB 4.39Å; F59-D64 HydrophobicContact CG-CB 4.05Å; F59-A65 HydrophobicContact CB-CB 4.23Å; F59-A65 HydrophobicContact CD2-CB 3.71Å; F59-A65 HydrophobicContact CE2-CB 4.45Å; F59-A65 HydrophobicContact CG-CB 4.21Å; F59-A68 HydrophobicContact CE1-CB 4.47Å; F59-A68 HydrophobicContact CE2-CB 3.8Å; F59-A68 HydrophobicContact CZ-CB 3.56Å
60	Q	93.9	Very high	95.2	Very high	125 Å²	125	55 Å²	55	58%	0.584	27%	0.272	S	S	*	.	S	Bend	trans	-73.1	-36	173.8	-169	171.2	12	0	0	111.7	P36	P36-Q60 HydrophobicContact CB-CB 4.12Å; P36-Q60 PolarHBondContact O-N 3.06Å
61	Q	93.5	Very high	95.3	Very high	109 Å²	109	51 Å²	51	51%	0.509	27%	0.266	S	S	.	.	S	Bend	trans	-121.2	141.5	-179.9	-59.9	-63.9	-22.7	0	0	111.6	A63 D64 A65	Q61-A63 VanDerWaalsContact C-N 3.26Å; Q61-A63 PolarHBondContact O-N 3.04Å; Q61-D64 WeakPolarHBondContact CB-OD2 3.29Å; Q61-D64 WeakPolarHBondContact O-CB 3.06Å; Q61-D64 PolarHBondContact O-N 2.8Å; Q61-D64 VanDerWaalsContact O-N 3.15Å; Q61-A65 PolarHBondContact O-N 2.9Å
62	P	94.2	Very high	95.4	Very high	64 Å²	64	50.9 Å²	50.9	42%	0.416	26%	0.264	S	S	.	.	H	α-helix	trans	-58.5	-34.8	176.1	-26	34.9	0	0	0	114	A11 D64 A65 E66	A11-P62 HydrophobicContact CB-CB 4.42Å; A11-P62 HydrophobicContact CB-CG 4.22Å; P62-D64 PolarHBondContact O-N 2.88Å; P62-A65 WeakPolarHBondContact O-CB 3.08Å; P62-A65 PolarHBondContact O-N 3.36Å; P62-A65 VanDerWaalsContact O-N 3.14Å; P62-E66 PolarHBondContact O-N 3.45Å
63	A	94.8	Very high	95.3	Very high	58 Å²	58	48 Å²	48	48%	0.479	25%	0.249	S	C	.	.	H	α-helix	trans	-63.7	-28.8	178.2	0	0	0	0	0	113.2	Q61 R67	Q61-A63 VanDerWaalsContact C-N 3.26Å; Q61-A63 PolarHBondContact O-N 3.04Å; A63-R67 WeakPolarHBondContact O-CB 3.47Å; A63-R67 PolarHBondContact O-N 3.37Å; A63-R67 PolarHBondContact O-NH1 3.31Å
64	D	95.5	Very high	95.2	Very high	16 Å²	16	48.4 Å²	48.4	9%	0.086	25%	0.246	C	C	.	.	H	α-helix	trans	-75.4	-36.8	175.2	-61.5	-29.8	0	0	0	111.1	A34 P36 F59 Q61 P62 R67 A68	A34-D64 WeakPolarHBondContact O-CA 3.18Å; A34-D64 VanDerWaalsContact O-CB 3.26Å; A34-D64 WeakPolarHBondContact O-CB 3.47Å; P36-D64 WeakPolarHBondContact CD-OD2 3.36Å; F59-D64 HydrophobicContact CB-CB 4.07Å; F59-D64 HydrophobicContact CD1-CB 3.66Å; F59-D64 HydrophobicContact CE1-CB 4.39Å; F59-D64 HydrophobicContact CG-CB 4.05Å; Q61-D64 WeakPolarHBondContact CB-OD2 3.29Å; Q61-D64 WeakPolarHBondContact O-CB 3.06Å; Q61-D64 PolarHBondContact O-N 2.8Å; Q61-D64 VanDerWaalsContact O-N 3.15Å; P62-D64 PolarHBondContact O-N 2.88Å; D64-R67 PolarHBondContact O-N 3.35Å; D64-R67 IonicContact OD1-CZ 2.71Å; D64-R67 VanDerWaalsContact OD1-CZ 3.22Å; D64-R67 IonicContact OD1-NH1 3.28Å; D64-R67 PolarHBondContact OD1-NH1 2.78Å; D64-R67 IonicContact OD1-NH2 2.61Å; D64-R67 PolarHBondContact OD1-NH2 3.32Å; D64-A68 WeakPolarHBondContact O-CB 3.48Å; D64-A68 PolarHBondContact O-N 2.91Å
65	A	95.5	Very high	95.1	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-66.3	-41.9	173.5	0	0	0	0	0	112	A11 L13 F59 Q61 P62 A68 L69 W86	A11-A65 HydrophobicContact CB-CB 4.22Å; L13-A65 HydrophobicContact CD1-CB 4.28Å; L13-A65 WeakPolarHBondContact CD1-O 3.47Å; L13-A65 HydrophobicContact CD2-CB 4.04Å; L13-A65 HydrophobicContact CG-CB 4.02Å; F59-A65 HydrophobicContact CB-CB 4.23Å; F59-A65 HydrophobicContact CD2-CB 3.71Å; F59-A65 HydrophobicContact CE2-CB 4.45Å; F59-A65 HydrophobicContact CG-CB 4.21Å; Q61-A65 PolarHBondContact O-N 2.9Å; P62-A65 WeakPolarHBondContact O-CB 3.08Å; P62-A65 PolarHBondContact O-N 3.36Å; P62-A65 VanDerWaalsContact O-N 3.14Å; A65-A68 PolarHBondContact O-N 2.92Å; A65-L69 WeakPolarHBondContact O-CB 3.44Å; A65-L69 PolarHBondContact O-N 3.07Å; A65-W86 HydrophobicContact CB-CH2 3.86Å; A65-W86 HydrophobicContact CB-CZ3 3.81Å
66	E	94.6	Very high	94.9	Very high	102 Å²	102	52.5 Å²	52.5	48%	0.477	28%	0.275	S	S	.	.	H	α-helix	trans	-61.9	-47.8	174.1	-172.9	172.2	-156	0	0	110.8	P62 A68 L69 D70 W86	P62-E66 PolarHBondContact O-N 3.45Å; E66-A68 VanDerWaalsContact C-N 3.31Å; E66-A68 PolarHBondContact O-N 2.82Å; E66-L69 WeakPolarHBondContact O-CB 3.3Å; E66-L69 PolarHBondContact O-N 3.45Å; E66-D70 PolarHBondContact O-N 3.11Å; E66-W86 HydrophobicContact CB-CH2 4.31Å; E66-W86 HydrophobicContact CB-CZ2 4.06Å
67	R	95.9	Very high	94.9	Very high	102 Å²	102	51 Å²	51	39%	0.385	27%	0.27	S	S	.	.	H	α-helix	trans	-56.7	-43	175.1	-177.1	163.7	68.6	-102.5	15.2	112.5	A34 A63 D64 D70 T71	A34-R67 PolarHBondContact O-NE 2.95Å; A34-R67 VanDerWaalsContact O-NE 3.16Å; A34-R67 PolarHBondContact O-NH2 2.76Å; A63-R67 WeakPolarHBondContact O-CB 3.47Å; A63-R67 PolarHBondContact O-N 3.37Å; A63-R67 PolarHBondContact O-NH1 3.31Å; D64-R67 PolarHBondContact O-N 3.35Å; D64-R67 IonicContact OD1-CZ 2.71Å; D64-R67 VanDerWaalsContact OD1-CZ 3.22Å; D64-R67 IonicContact OD1-NH1 3.28Å; D64-R67 PolarHBondContact OD1-NH1 2.78Å; D64-R67 IonicContact OD1-NH2 2.61Å; D64-R67 PolarHBondContact OD1-NH2 3.32Å; R67-D70 PolarHBondContact O-N 2.69Å; R67-T71 HydrophobicContact CG-CG2 4.48Å; R67-T71 WeakPolarHBondContact O-CB 3.36Å; R67-T71 WeakPolarHBondContact O-CG2 3.23Å; R67-T71 PolarHBondContact O-N 3.15Å; R67-T71 PolarHBondContact O-OG1 3.47Å
68	A	96.6	Very high	94.7	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.1	-41.4	175.7	0	0	0	0	0	112.5	L13 F31 A34 F59 D64 A65 E66 M72	L13-A68 HydrophobicContact CD1-CB 3.83Å; F31-A68 HydrophobicContact CD1-CB 4Å; F31-A68 HydrophobicContact CE1-CB 4.35Å; A34-A68 HydrophobicContact CB-CB 3.6Å; F59-A68 HydrophobicContact CE1-CB 4.47Å; F59-A68 HydrophobicContact CE2-CB 3.8Å; F59-A68 HydrophobicContact CZ-CB 3.56Å; D64-A68 WeakPolarHBondContact O-CB 3.48Å; D64-A68 PolarHBondContact O-N 2.91Å; A65-A68 PolarHBondContact O-N 2.92Å; E66-A68 VanDerWaalsContact C-N 3.31Å; E66-A68 PolarHBondContact O-N 2.82Å; A68-M72 HydrophobicContact CB-SD 4.42Å; A68-M72 VanDerWaalsContact O-CB 3.29Å; A68-M72 WeakPolarHBondContact O-CB 3.37Å; A68-M72 PolarHBondContact O-N 2.91Å
69	L	94.4	Very high	94.5	Very high	26 Å²	26	57.3 Å²	57.3	14%	0.136	32%	0.315	C	S	.	.	H	α-helix	trans	-65.1	-40.4	178	-177.2	131.8	0	0	0	111.7	L13 A65 E66 N73 I84 W86	L13-L69 HydrophobicContact CD2-CB 4.41Å; L13-L69 HydrophobicContact CD2-CD1 4.15Å; A65-L69 WeakPolarHBondContact O-CB 3.44Å; A65-L69 PolarHBondContact O-N 3.07Å; E66-L69 WeakPolarHBondContact O-CB 3.3Å; E66-L69 PolarHBondContact O-N 3.45Å; L69-N73 WeakPolarHBondContact O-CB 3.37Å; L69-I84 HydrophobicContact CB-CG2 4.25Å; L69-I84 HydrophobicContact CD1-CG2 4.11Å; L69-I84 HydrophobicContact CG-CG2 4.34Å; L69-W86 HydrophobicContact CD1-CG 4.5Å
70	D	92.4	Very high	94.3	Very high	105 Å²	105	61.5 Å²	61.5	56%	0.561	33%	0.333	S	S	*	.	H	α-helix	trans	-76.1	-36.5	-178.6	-69.1	-18	0	0	0	113.2	E66 R67	E66-D70 PolarHBondContact O-N 3.11Å; R67-D70 PolarHBondContact O-N 2.69Å
71	T	94	Very high	94.2	Very high	87 Å²	87	57.7 Å²	57.7	53%	0.534	32%	0.319	S	S	.	.	H	α-helix	trans	-97.5	-23.6	-171.1	60.6	0	0	0	0	114.5	R67	R67-T71 HydrophobicContact CG-CG2 4.48Å; R67-T71 WeakPolarHBondContact O-CB 3.36Å; R67-T71 WeakPolarHBondContact O-CG2 3.23Å; R67-T71 PolarHBondContact O-N 3.15Å; R67-T71 PolarHBondContact O-OG1 3.47Å
72	M	95.2	Very high	94.3	Very high	16 Å²	16	52.6 Å²	52.6	8%	0.079	30%	0.295	C	S	.	.	H	α-helix	trans	-117.8	-0	-171.5	-53.8	175.2	179.2	0	0	113.9	K30 F31 P33 A34 A68 D75 I84	K30-M72 VanDerWaalsContact O-CE 3.32Å; K30-M72 WeakPolarHBondContact O-CE 3.28Å; F31-M72 HydrophobicContact CD1-SD 3.45Å; F31-M72 WeakPolarHBondContact CD1-SD 3.24Å; F31-M72 HydrophobicContact CE1-CB 4.07Å; F31-M72 HydrophobicContact CE1-SD 3.8Å; F31-M72 HydrophobicContact CG-SD 4.31Å; P33-M72 HydrophobicContact CB-CE 4.25Å; A34-M72 HydrophobicContact CB-CE 3.65Å; A34-M72 HydrophobicContact CB-SD 4.3Å; A68-M72 HydrophobicContact CB-SD 4.42Å; A68-M72 VanDerWaalsContact O-CB 3.29Å; A68-M72 WeakPolarHBondContact O-CB 3.37Å; A68-M72 PolarHBondContact O-N 2.91Å; M72-D75 WeakPolarHBondContact CA-OD2 3.3Å; M72-D75 VanDerWaalsContact O-CB 3.32Å; M72-D75 WeakPolarHBondContact O-CB 3.28Å; M72-D75 PolarHBondContact O-N 2.8Å; M72-I84 VanDerWaalsContact C-CD1 3.5Å; M72-I84 HydrophobicContact CB-CD1 3.94Å; M72-I84 WeakPolarHBondContact O-CD1 3.41Å
73	N	94.1	Very high	94.4	Very high	27 Å²	27	52.2 Å²	52.2	14%	0.144	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	137.4	177	-165.5	17.4	0	0	0	110.1	L69 D75 I84	L69-N73 WeakPolarHBondContact O-CB 3.37Å; N73-D75 PolarHBondContact O-N 3.06Å; N73-I84 HydrophobicContact CB-CB 4.21Å; N73-I84 HydrophobicContact CB-CD1 4.31Å; N73-I84 HydrophobicContact CB-CG1 4.34Å; N73-I84 PolarHBondContact OD1-N 3.29Å
74	F	93.9	Very high	94.5	Very high	28 Å²	28	49.5 Å²	49.5	12%	0.123	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	3.2	-172.7	-39	-57.2	0	0	0	116.2	P81 V82 N112 K113 Y116 C128	F74-P81 VanDerWaalsContact O-CB 3.3Å; F74-P81 WeakPolarHBondContact O-CB 3.48Å; F74-V82 WeakPolarHBondContact CA-O 3.23Å; F74-V82 PolarHBondContact N-O 3.45Å; F74-N112 HydrophobicContact CB-CB 4.22Å; F74-N112 HydrophobicContact CD1-CB 3.27Å; F74-N112 HydrophobicContact CD2-CB 4.4Å; F74-N112 HydrophobicContact CE1-CB 3.67Å; F74-N112 HydrophobicContact CG-CB 3.69Å; F74-N112 HydrophobicContact CZ-CB 4.39Å; F74-K113 HydrophobicContact CD2-CB 4.14Å; F74-Y116 HydrophobicContact CE2-CD2 4.16Å; F74-Y116 AromaticContact CE2-CG 3.98Å; F74-Y116 HydrophobicContact CE2-CG 3.98Å; F74-Y116 HydrophobicContact CZ-CD2 4.13Å; F74-Y116 HydrophobicContact CZ-CG 4.33Å; F74-C128 WeakPolarHBondContact CZ-SG 3.38Å
75	D	94.9	Very high	94.4	Very high	49 Å²	49	50.6 Å²	50.6	26%	0.262	27%	0.268	S	S	.	.			trans	-60.9	140.9	174.4	-82.1	-18	0	0	0	112.1	K30 M72 N73 P81 V82	K30-D75 WeakPolarHBondContact CE-OD2 3.47Å; K30-D75 VanDerWaalsContact NZ-CG 3.33Å; K30-D75 IonicContact NZ-OD2 3.63Å; K30-D75 PolarHBondContact NZ-OD2 2.77Å; M72-D75 WeakPolarHBondContact CA-OD2 3.3Å; M72-D75 VanDerWaalsContact O-CB 3.32Å; M72-D75 WeakPolarHBondContact O-CB 3.28Å; M72-D75 PolarHBondContact O-N 2.8Å; N73-D75 PolarHBondContact O-N 3.06Å; D75-P81 CarbonylContact O-C 3.51Å; D75-P81 WeakPolarHBondContact O-CA 3.23Å; D75-V82 HydrophobicContact CB-CG2 4.41Å; D75-V82 WeakPolarHBondContact O-CG2 3.16Å; D75-V82 PolarHBondContact O-N 3.38Å
76	V	93.7	Very high	94.3	Very high	97 Å²	97	53 Å²	53	59%	0.588	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	119.9	-175	-178.8	0	0	0	0	110.6	G79 K80 P81	V76-G79 VanDerWaalsContact CG1-CA 3.49Å; V76-K80 WeakPolarHBondContact CA-O 3.27Å; V76-P81 HydrophobicContact CG2-CB 4.43Å
77	I	95.2	Very high	94.1	Very high	19 Å²	19	49.2 Å²	49.2	10%	0.097	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	121.9	171.5	-53.1	-179.1	0	0	0	108.5	V22 L27 K30 G79 K80 V82	V22-I77 HydrophobicContact CG2-CB 4.49Å; V22-I77 HydrophobicContact CG2-CG2 3.78Å; L27-I77 HydrophobicContact CD2-CD1 4.17Å; K30-I77 HydrophobicContact CB-CD1 4.26Å; K30-I77 HydrophobicContact CG-CD1 3.95Å; I77-G79 VanDerWaalsContact C-N 3.25Å; I77-G79 PolarHBondContact O-N 2.93Å; I77-K80 PolarHBondContact N-O 2.79Å; I77-K80 PolarHBondContact O-N 2.79Å; I77-K80 VanDerWaalsContact O-N 3.13Å; I77-V82 HydrophobicContact CB-CG1 4.13Å; I77-V82 HydrophobicContact CD1-CG1 3.59Å; I77-V82 HydrophobicContact CG1-CG1 3.74Å
78	K	93.7	Very high	93.6	Very high	101 Å²	101	47.1 Å²	47.1	44%	0.439	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.1	45.7	-174.3	-57.8	-162.2	79.5	179.4	0	113	H19 D21 M26 K80	H19-K78 HydrophobicContact CB-CB 3.89Å; H19-K78 PolarHBondContact CD2-O 3.01Å; D21-K78 HydrophobicContact CB-CD 3.9Å; D21-K78 IonicContact OD2-NZ 3.52Å; D21-K78 PolarHBondContact OD2-NZ 3.22Å; M26-K78 HydrophobicContact CE-CD 4.38Å; M26-K78 HydrophobicContact SD-CD 4.17Å; K78-K80 VanDerWaalsContact C-N 3.29Å; K78-K80 PolarHBondContact O-N 2.87Å
79	G	91.6	Very high	93	Very high	66 Å²	66	55.4 Å²	55.4	68%	0.68	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	4	176.6	0	0	0	0	0	115.7	V76 I77	V76-G79 VanDerWaalsContact CG1-CA 3.49Å; I77-G79 VanDerWaalsContact C-N 3.25Å; I77-G79 PolarHBondContact O-N 2.93Å
80	K	91.6	Very high	92.4	Very high	95 Å²	95	57.6 Å²	57.6	41%	0.413	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	129.9	174.3	-71.7	-172.9	172.8	178.3	0	111.9	H19 V76 I77 K78 V82	H19-K80 HydrophobicContact CB-CB 4.49Å; H19-K80 HydrophobicContact CB-CD 4.17Å; H19-K80 HydrophobicContact CB-CG 4.48Å; V76-K80 WeakPolarHBondContact CA-O 3.27Å; I77-K80 PolarHBondContact N-O 2.79Å; I77-K80 PolarHBondContact O-N 2.79Å; I77-K80 VanDerWaalsContact O-N 3.13Å; K78-K80 VanDerWaalsContact C-N 3.29Å; K78-K80 PolarHBondContact O-N 2.87Å; K80-V82 PolarHBondContact O-N 3.23Å
81	P	93.6	Very high	91.9	Very high	44 Å²	44	55.9 Å²	55.9	29%	0.286	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	128.3	173	28.3	-32.8	0	0	0	109.8	F74 D75 V76 N112	F74-P81 VanDerWaalsContact O-CB 3.3Å; F74-P81 WeakPolarHBondContact O-CB 3.48Å; D75-P81 CarbonylContact O-C 3.51Å; D75-P81 WeakPolarHBondContact O-CA 3.23Å; V76-P81 HydrophobicContact CG2-CB 4.43Å; P81-N112 WeakPolarHBondContact CG-ND2 3.45Å
82	V	95.6	Very high	91.3	Very high	2 Å²	2	54.9 Å²	54.9	1%	0.012	29%	0.291	C	S	.	.			trans	-78.6	144.1	177.8	-57	0	0	0	0	110.6	V15 L18 F74 D75 I77 K80 I84	V15-V82 HydrophobicContact CG1-CB 4.03Å; V15-V82 HydrophobicContact CG1-CG1 4.48Å; V15-V82 HydrophobicContact CG1-CG2 4.5Å; L18-V82 HydrophobicContact CD2-CB 4.33Å; L18-V82 HydrophobicContact CD2-CG1 3.65Å; F74-V82 WeakPolarHBondContact CA-O 3.23Å; F74-V82 PolarHBondContact N-O 3.45Å; D75-V82 HydrophobicContact CB-CG2 4.41Å; D75-V82 WeakPolarHBondContact O-CG2 3.16Å; D75-V82 PolarHBondContact O-N 3.38Å; I77-V82 HydrophobicContact CB-CG1 4.13Å; I77-V82 HydrophobicContact CD1-CG1 3.59Å; I77-V82 HydrophobicContact CG1-CG1 3.74Å; K80-V82 PolarHBondContact O-N 3.23Å; V82-I84 HydrophobicContact CG2-CD1 4.33Å; V82-I84 HydrophobicContact CG2-CG1 4.1Å
83	R	95.6	Very high	90.5	Very high	57 Å²	57	58.7 Å²	58.7	22%	0.215	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	107.9	176.6	-175.2	165.5	61	124.7	3.2	110.2	G16 D17 S127 C128	G16-R83 PolarHBondContact N-O 3.26Å; G16-R83 PolarHBondContact O-N 3.08Å; D17-R83 HydrophobicContact CB-CB 4.43Å; D17-R83 WeakPolarHBondContact OD2-CB 3.46Å; D17-R83 IonicContact OD2-CZ 3.51Å; D17-R83 IonicContact OD2-NE 2.8Å; D17-R83 PolarHBondContact OD2-NE 3.31Å; D17-R83 IonicContact OD2-NH2 2.8Å; R83-S127 WeakPolarHBondContact CD-OG 3.43Å; R83-S127 PolarHBondContact NH1-OG 3Å; R83-C128 WeakPolarHBondContact CD-O 3.3Å
84	I	95.9	Very high	89.8	Confident	1 Å²	1	63.4 Å²	63.4	1%	0.005	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	137	-177.9	-49.5	179.3	0	0	0	109.3	L13 Y14 V15 F31 L69 M72 N73 V82	L13-I84 HydrophobicContact CB-CG2 4.12Å; L13-I84 HydrophobicContact CD1-CG2 3.77Å; L13-I84 HydrophobicContact CD2-CG2 4.43Å; L13-I84 HydrophobicContact CG-CG2 4.33Å; Y14-I84 CarbonylContact O-C 3.57Å; Y14-I84 WeakPolarHBondContact O-CA 3.3Å; V15-I84 HydrophobicContact CG1-CG1 4.46Å; F31-I84 HydrophobicContact CE1-CD1 3.5Å; F31-I84 VanDerWaalsContact CE1-CD1 3.5Å; F31-I84 HydrophobicContact CZ-CD1 3.66Å; F31-I84 HydrophobicContact CZ-CG1 4.27Å; L69-I84 HydrophobicContact CB-CG2 4.25Å; L69-I84 HydrophobicContact CD1-CG2 4.11Å; L69-I84 HydrophobicContact CG-CG2 4.34Å; M72-I84 VanDerWaalsContact C-CD1 3.5Å; M72-I84 HydrophobicContact CB-CD1 3.94Å; M72-I84 WeakPolarHBondContact O-CD1 3.41Å; N73-I84 HydrophobicContact CB-CB 4.21Å; N73-I84 HydrophobicContact CB-CD1 4.31Å; N73-I84 HydrophobicContact CB-CG1 4.34Å; N73-I84 PolarHBondContact OD1-N 3.29Å; V82-I84 HydrophobicContact CG2-CD1 4.33Å; V82-I84 HydrophobicContact CG2-CG1 4.1Å
85	M	94.1	Very high	89.1	Confident	38 Å²	38	70.3 Å²	70.3	19%	0.187	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	158	176.4	-55.7	175.7	56.6	0	0	109.6	L13 Y14 S87 L126 S127	L13-M85 CarbonylContact C-O 3.41Å; L13-M85 WeakPolarHBondContact CA-O 3.43Å; Y14-M85 HydrophobicContact CD1-CB 4.38Å; Y14-M85 HydrophobicContact CD1-CG 4.43Å; Y14-M85 HydrophobicContact CD1-SD 4.26Å; Y14-M85 PolarHBondContact N-O 3.3Å; Y14-M85 PolarHBondContact O-N 3.43Å; M85-S87 PolarHBondContact O-N 3.25Å; M85-L126 WeakPolarHBondContact CG-O 3.38Å; M85-S127 VanDerWaalsContact SD-CB 3.6Å; M85-S127 PolarHBondContact SD-OG 3.15Å
86	W	93.2	Very high	88.4	Confident	52 Å²	52	71 Å²	71	20%	0.197	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	137.9	164	-71.3	106.7	0	0	0	110.8	Y8 L13 A65 E66 L69 Q88	Y8-W86 HydrophobicContact CD1-CB 3.97Å; Y8-W86 HydrophobicContact CD1-CG 4.27Å; Y8-W86 HydrophobicContact CD2-CB 4.26Å; Y8-W86 AromaticContact CD2-CD1 3.96Å; Y8-W86 AromaticContact CD2-CD2 3.59Å; Y8-W86 HydrophobicContact CD2-CD2 3.59Å; Y8-W86 AromaticContact CD2-CE2 3.87Å; Y8-W86 HydrophobicContact CD2-CE3 4.03Å; Y8-W86 AromaticContact CD2-CG 3.68Å; Y8-W86 HydrophobicContact CD2-CG 3.68Å; Y8-W86 HydrophobicContact CE1-CB 3.74Å; Y8-W86 HydrophobicContact CE1-CG 4.17Å; Y8-W86 HydrophobicContact CE2-CB 4.05Å; Y8-W86 AromaticContact CE2-CD1 3.49Å; Y8-W86 VanDerWaalsContact CE2-CD1 3.49Å; Y8-W86 AromaticContact CE2-CD2 3.96Å; Y8-W86 HydrophobicContact CE2-CD2 3.96Å; Y8-W86 AromaticContact CE2-CG 3.56Å; Y8-W86 HydrophobicContact CE2-CG 3.56Å; Y8-W86 AromaticContact CE2-NE1 3.85Å; Y8-W86 HydrophobicContact CG-CB 4.23Å; Y8-W86 AromaticContact CG-CD2 3.94Å; Y8-W86 HydrophobicContact CG-CD2 3.94Å; Y8-W86 AromaticContact CG-CE3 3.98Å; Y8-W86 HydrophobicContact CG-CE3 3.98Å; Y8-W86 HydrophobicContact CG-CG 4.05Å; Y8-W86 AromaticContact CZ-CD1 3.92Å; Y8-W86 AromaticContact CZ-CG 3.83Å; L13-W86 HydrophobicContact CD2-CD2 4.19Å; L13-W86 HydrophobicContact CD2-CE3 3.85Å; L13-W86 HydrophobicContact CD2-CZ3 4.06Å; A65-W86 HydrophobicContact CB-CH2 3.86Å; A65-W86 HydrophobicContact CB-CZ3 3.81Å; E66-W86 HydrophobicContact CB-CH2 4.31Å; E66-W86 HydrophobicContact CB-CZ2 4.06Å; L69-W86 HydrophobicContact CD1-CG 4.5Å; W86-Q88 PolarHBondContact O-N 3.34Å; W86-Q88 VanDerWaalsContact O-N 3.07Å
87	S	91.7	Very high	87.8	Confident	22 Å²	22	67.8 Å²	67.8	15%	0.154	35%	0.351	C	S	.	.			trans	-72.5	104.6	-178.3	-174.6	0	0	0	0	111.1	S12 Y56 M85	S12-S87 WeakPolarHBondContact O-CB 3.41Å; S12-S87 PolarHBondContact O-N 3.29Å; Y56-S87 WeakPolarHBondContact CE1-OG 3.39Å; M85-S87 PolarHBondContact O-N 3.25Å
88	Q	84.8	Confident	87.4	Confident	58 Å²	58	70.1 Å²	70.1	27%	0.271	37%	0.367	S	S	.	.			trans	-94	113.3	174.6	-169.5	58.8	41	0	0	110.9	W86 L93 R94	W86-Q88 PolarHBondContact O-N 3.34Å; W86-Q88 VanDerWaalsContact O-N 3.07Å; Q88-L93 HydrophobicContact CG-CB 3.8Å; Q88-R94 HydrophobicContact CB-CG 3.79Å; Q88-R94 HydrophobicContact CG-CG 3.83Å; Q88-R94 WeakPolarHBondContact O-CD 3.41Å; Q88-R94 PolarHBondContact O-NE 3.28Å; Q88-R94 VanDerWaalsContact O-NE 3.15Å; Q88-R94 PolarHBondContact O-NH1 3.46Å
89	R	83	Confident	87.3	Confident	174 Å²	174	65.5 Å²	65.5	66%	0.657	35%	0.348	S	S	*	.			trans	-79.3	-36.8	177.9	-71.8	-175.7	-179.5	-91	-1.2	112.7	P91 R94	R89-P91 VanDerWaalsContact O-CD 3.24Å; R89-P91 WeakPolarHBondContact O-CD 3.4Å; R89-R94 PolarHBondContact O-NH2 2.82Å
90	D	81.9	Confident	87.5	Confident	71 Å²	71	64.1 Å²	64.1	38%	0.38	33%	0.325	S	S	.	.			trans	-65.6	117.3	-177.9	-166.6	-23.3	0	0	0	111	S92 L93 R94	D90-S92 PolarHBondContact O-N 2.8Å; D90-S92 WeakPolarHBondContact OD1-CB 3.48Å; D90-S92 PolarHBondContact OD1-N 3.39Å; D90-S92 PolarHBondContact OD1-OG 3.27Å; D90-S92 PolarHBondContact OD2-OG 3.46Å; D90-L93 HydrophobicContact CB-CB 4.41Å; D90-L93 HydrophobicContact CB-CD1 4.14Å; D90-L93 HydrophobicContact CB-CG 4.38Å; D90-R94 PolarHBondContact O-N 3.02Å
91	P	81.8	Confident	87.7	Confident	69 Å²	69	59.7 Å²	59.7	45%	0.448	31%	0.305	S	S	.	.	H	α-helix	trans	-60.9	-29.4	175	-21.4	34.1	0	0	0	113.7	R89 R94 K95	R89-P91 VanDerWaalsContact O-CD 3.24Å; R89-P91 WeakPolarHBondContact O-CD 3.4Å; P91-R94 PolarHBondContact O-N 3.19Å; P91-K95 VanDerWaalsContact O-CB 3.24Å; P91-K95 WeakPolarHBondContact O-CB 3.47Å; P91-K95 VanDerWaalsContact O-CG 3.31Å; P91-K95 WeakPolarHBondContact O-CG 3.39Å; P91-K95 PolarHBondContact O-N 3.47Å
92	S	82.1	Confident	87.8	Confident	67 Å²	67	59.1 Å²	59.1	47%	0.469	30%	0.299	S	S	.	.	H	α-helix	trans	-65	-47.3	-178.3	69.3	0	0	0	0	110.9	D90 R94 K95 S96	D90-S92 PolarHBondContact O-N 2.8Å; D90-S92 WeakPolarHBondContact OD1-CB 3.48Å; D90-S92 PolarHBondContact OD1-N 3.39Å; D90-S92 PolarHBondContact OD1-OG 3.27Å; D90-S92 PolarHBondContact OD2-OG 3.46Å; S92-R94 VanDerWaalsContact C-N 3.31Å; S92-R94 PolarHBondContact O-N 2.91Å; S92-K95 PolarHBondContact O-N 3.48Å; S92-S96 WeakPolarHBondContact O-CB 3.5Å; S92-S96 PolarHBondContact O-N 3.09Å
93	L	78.1	Confident	87.9	Confident	96 Å²	96	59 Å²	59	50%	0.503	30%	0.298	S	S	.	.	H	α-helix	trans	-66.1	-31.6	176.3	-68.5	171.4	0	0	0	112.5	Q88 D90	Q88-L93 HydrophobicContact CG-CB 3.8Å; D90-L93 HydrophobicContact CB-CB 4.41Å; D90-L93 HydrophobicContact CB-CD1 4.14Å; D90-L93 HydrophobicContact CB-CG 4.38Å
94	R	80.2	Confident	87.8	Confident	125 Å²	125	62.1 Å²	62.1	47%	0.472	31%	0.313	S	S	.	.	H	α-helix	trans	-77.1	-24.3	174.9	-71	-172.2	-68.7	-163.5	2.2	114.4	Q88 R89 D90 P91 S92	Q88-R94 HydrophobicContact CB-CG 3.79Å; Q88-R94 HydrophobicContact CG-CG 3.83Å; Q88-R94 WeakPolarHBondContact O-CD 3.41Å; Q88-R94 PolarHBondContact O-NE 3.28Å; Q88-R94 VanDerWaalsContact O-NE 3.15Å; Q88-R94 PolarHBondContact O-NH1 3.46Å; R89-R94 PolarHBondContact O-NH2 2.82Å; D90-R94 PolarHBondContact O-N 3.02Å; P91-R94 PolarHBondContact O-N 3.19Å; S92-R94 VanDerWaalsContact C-N 3.31Å; S92-R94 PolarHBondContact O-N 2.91Å
95	K	78.7	Confident	87.8	Confident	174 Å²	174	65.7 Å²	65.7	76%	0.757	33%	0.332	S	S	*	.	H	α-helix	trans	-113.9	-2.7	-172.6	-66.5	-178	178.2	-177.8	0	113.9	P91 S92 G97	P91-K95 VanDerWaalsContact O-CB 3.24Å; P91-K95 WeakPolarHBondContact O-CB 3.47Å; P91-K95 VanDerWaalsContact O-CG 3.31Å; P91-K95 WeakPolarHBondContact O-CG 3.39Å; P91-K95 PolarHBondContact O-N 3.47Å; S92-K95 PolarHBondContact O-N 3.48Å; K95-G97 PolarHBondContact O-N 3.47Å
96	S	81.3	Confident	87.8	Confident	63 Å²	63	64 Å²	64	44%	0.441	32%	0.324	S	S	.	.	S	Bend	trans	-59.8	-35.4	-179	65.3	0	0	0	0	111.9	S92 V98	S92-S96 WeakPolarHBondContact O-CB 3.5Å; S92-S96 PolarHBondContact O-N 3.09Å; S96-V98 PolarHBondContact O-N 3.28Å; S96-V98 PolarHBondContact OG-N 3.13Å
97	G	80.9	Confident	87.9	Confident	29 Å²	29	62.9 Å²	62.9	30%	0.299	32%	0.322	S	S	.	.			trans	70.6	3	-172.5	0	0	0	0	0	113.5	K95 G99 N100	K95-G97 PolarHBondContact O-N 3.47Å; G97-G99 PolarHBondContact O-N 3.24Å; G97-N100 WeakPolarHBondContact CA-OD1 3.4Å; G97-N100 WeakPolarHBondContact O-CB 3.47Å; G97-N100 PolarHBondContact O-N 3.29Å; G97-N100 VanDerWaalsContact O-N 3.15Å; G97-N100 PolarHBondContact O-OD1 2.9Å
98	V	86.4	Confident	88	Confident	69 Å²	69	68.5 Å²	68.5	42%	0.418	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	127.9	178.2	177.9	0	0	0	0	108.5	S96 N100 H144 Q148	S96-V98 PolarHBondContact O-N 3.28Å; S96-V98 PolarHBondContact OG-N 3.13Å; V98-N100 VanDerWaalsContact C-N 3.27Å; V98-N100 PolarHBondContact O-N 2.8Å; V98-N100 PolarHBondContact O-OD1 3.47Å; V98-H144 PolarHBondContact O-CD2 3.36Å; V98-H144 PolarHBondContact O-NE2 2.9Å; V98-Q148 HydrophobicContact CG1-CB 3.92Å
99	G	92.3	Very high	88.4	Confident	4 Å²	4	69.5 Å²	69.5	4%	0.041	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	-2.9	-174.8	0	0	0	0	0	114.4	G97 F145	G97-G99 PolarHBondContact O-N 3.24Å; G99-F145 PolarHBondContact O-N 3.35Å
100	N	94.6	Very high	88.9	Confident	37 Å²	37	61.6 Å²	61.6	20%	0.198	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	123.7	179.9	-60	57.3	0	0	0	111	G97 V98 H144 F173	G97-N100 WeakPolarHBondContact CA-OD1 3.4Å; G97-N100 WeakPolarHBondContact O-CB 3.47Å; G97-N100 PolarHBondContact O-N 3.29Å; G97-N100 VanDerWaalsContact O-N 3.15Å; G97-N100 PolarHBondContact O-OD1 2.9Å; V98-N100 VanDerWaalsContact C-N 3.27Å; V98-N100 PolarHBondContact O-N 2.8Å; V98-N100 PolarHBondContact O-OD1 3.47Å; N100-H144 PolarHBondContact ND2-ND1 3.48Å; N100-H144 PolarHBondContact OD1-CD2 3.44Å; N100-H144 PolarHBondContact OD1-CE1 3.47Å; N100-H144 VanDerWaalsContact OD1-CG 3.31Å; N100-H144 PolarHBondContact OD1-ND1 2.94Å; N100-H144 PolarHBondContact OD1-NE2 3.02Å; N100-F173 HydrophobicContact CB-CB 3.6Å; N100-F173 HydrophobicContact CB-CD1 4.33Å; N100-F173 HydrophobicContact CB-CG 4.11Å; N100-F173 VanDerWaalsContact O-CB 3.23Å; N100-F173 WeakPolarHBondContact O-CB 3.3Å; N100-F173 PolarHBondContact O-N 3.27Å
101	I	96.5	Very high	89.4	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.005	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	151.5	173.2	65.5	162.7	0	0	0	110.9	I103 F119 F142 V143 F145 A151 A154 I155 V170 G171	I101-I103 HydrophobicContact CD1-CD1 3.92Å; I101-I103 HydrophobicContact CD1-CG1 4.24Å; I101-I103 HydrophobicContact CG1-CD1 3.96Å; I101-F119 HydrophobicContact CD1-CD1 3.82Å; I101-F119 HydrophobicContact CD1-CE1 3.71Å; I101-F142 WeakPolarHBondContact O-CA 3.37Å; I101-V143 HydrophobicContact CD1-CB 4.01Å; I101-V143 HydrophobicContact CG1-CB 3.69Å; I101-V143 HydrophobicContact CG1-CG1 4.43Å; I101-V143 WeakPolarHBondContact CG1-O 3.44Å; I101-V143 PolarHBondContact N-O 3.01Å; I101-V143 PolarHBondContact O-N 3.06Å; I101-V143 VanDerWaalsContact O-N 3.11Å; I101-F145 HydrophobicContact CD1-CD2 4.48Å; I101-F145 HydrophobicContact CD1-CE2 3.7Å; I101-F145 HydrophobicContact CG1-CD2 4.45Å; I101-F145 HydrophobicContact CG1-CE2 4.12Å; I101-A151 HydrophobicContact CG2-CB 3.57Å; I101-A154 HydrophobicContact CD1-CB 4.19Å; I101-I155 HydrophobicContact CG2-CD1 3.84Å; I101-I155 HydrophobicContact CG2-CG1 3.94Å; I101-V170 HydrophobicContact CD1-CG1 3.77Å; I101-G171 CarbonylContact C-O 3.55Å; I101-G171 WeakPolarHBondContact CA-O 3.43Å
102	F	95.7	Very high	90	Very high	33 Å²	33	59.8 Å²	59.8	15%	0.145	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	130.5	174.1	168.3	-111.2	0	0	0	109	K104 Y140 F142 F169 G171	F102-K104 HydrophobicContact CE1-CB 3.65Å; F102-K104 HydrophobicContact CE1-CD 4.1Å; F102-K104 HydrophobicContact CE1-CG 4.14Å; F102-K104 HydrophobicContact CZ-CB 3.74Å; F102-K104 HydrophobicContact CZ-CD 4.13Å; F102-K104 HydrophobicContact CZ-CG 3.91Å; F102-Y140 HydrophobicContact CD2-CD2 4.43Å; F102-Y140 AromaticContact CE2-CD2 3.59Å; F102-Y140 HydrophobicContact CE2-CD2 3.59Å; F102-Y140 HydrophobicContact CE2-CE2 4.39Å; F102-Y140 HydrophobicContact CE2-CG 4.01Å; F102-Y140 HydrophobicContact CZ-CD2 4.46Å; F102-F142 HydrophobicContact CB-CD1 4.29Å; F102-F142 HydrophobicContact CB-CE1 4.32Å; F102-F142 AromaticContact CD2-CD1 3.88Å; F102-F142 HydrophobicContact CD2-CD1 3.88Å; F102-F142 AromaticContact CD2-CE1 3.38Å; F102-F142 HydrophobicContact CD2-CE1 3.38Å; F102-F142 HydrophobicContact CD2-CZ 4.06Å; F102-F142 HydrophobicContact CE2-CE1 4.1Å; F102-F142 HydrophobicContact CE2-CZ 4.35Å; F102-F142 HydrophobicContact CG-CE1 4.26Å; F102-F169 HydrophobicContact CD1-CE1 4.44Å; F102-G171 PolarHBondContact N-O 3.41Å; F102-G171 PolarHBondContact O-N 2.74Å
103	I	96.4	Very high	90.6	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	126.1	178.2	-49.2	88.5	0	0	0	108.8	I101 L106 F119 Y140 G141 V143 V168 F169 V170	I101-I103 HydrophobicContact CD1-CD1 3.92Å; I101-I103 HydrophobicContact CD1-CG1 4.24Å; I101-I103 HydrophobicContact CG1-CD1 3.96Å; I103-L106 HydrophobicContact CB-CD1 4.34Å; I103-L106 HydrophobicContact CB-CD2 4.36Å; I103-L106 HydrophobicContact CB-CG 4.37Å; I103-L106 HydrophobicContact CG2-CD1 4.28Å; I103-L106 HydrophobicContact CG2-CD2 3.47Å; I103-L106 VanDerWaalsContact CG2-CD2 3.47Å; I103-L106 HydrophobicContact CG2-CG 3.8Å; I103-F119 HydrophobicContact CG1-CE1 4.33Å; I103-F119 HydrophobicContact CG1-CE2 4.23Å; I103-F119 HydrophobicContact CG1-CZ 3.8Å; I103-Y140 CarbonylContact O-C 3.51Å; I103-Y140 WeakPolarHBondContact O-CA 3.48Å; I103-Y140 VanDerWaalsContact O-CB 3.25Å; I103-Y140 WeakPolarHBondContact O-CB 3.49Å; I103-G141 PolarHBondContact N-O 2.83Å; I103-G141 PolarHBondContact O-N 3.44Å; I103-V143 HydrophobicContact CD1-CB 4.1Å; I103-V143 HydrophobicContact CD1-CG2 3.66Å; I103-V168 HydrophobicContact CG2-CB 4.21Å; I103-F169 CarbonylContact C-O 3.56Å; I103-F169 VanDerWaalsContact CA-O 3.3Å; I103-F169 WeakPolarHBondContact CA-O 3.36Å; I103-V170 HydrophobicContact CG1-CG1 4.29Å; I103-V170 HydrophobicContact CG1-CG2 4.26Å; I103-V170 HydrophobicContact CG2-CG2 4.05Å
104	K	95	Very high	91.3	Very high	121 Å²	121	59.1 Å²	59.1	53%	0.526	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	159.9	179.6	-160.1	-175.1	175.9	-172.8	0	110.5	F102 L106 F169	F102-K104 HydrophobicContact CE1-CB 3.65Å; F102-K104 HydrophobicContact CE1-CD 4.1Å; F102-K104 HydrophobicContact CE1-CG 4.14Å; F102-K104 HydrophobicContact CZ-CB 3.74Å; F102-K104 HydrophobicContact CZ-CD 4.13Å; F102-K104 HydrophobicContact CZ-CG 3.91Å; K104-L106 PolarHBondContact O-N 3.34Å; K104-F169 HydrophobicContact CB-CB 4.25Å; K104-F169 HydrophobicContact CB-CD1 4.24Å; K104-F169 PolarHBondContact N-O 3.21Å; K104-F169 PolarHBondContact O-N 2.99Å
105	N	94.7	Very high	92	Very high	77 Å²	77	53.2 Å²	53.2	41%	0.412	28%	0.283	S	S	.	.	S	Bend	trans	62.3	32.2	-177.6	-160.2	40.9	0	0	0	112.1	G139 K167	N105-G139 PolarHBondContact N-O 3.26Å; N105-K167 PolarHBondContact ND2-O 2.87Å
106	L	94.8	Very high	92.8	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	26%	0.258	C	S	.	.			trans	-63.9	141.9	168.1	-68.8	174.9	0	0	0	108.8	I103 K104 I110 L115 G139 V168	I103-L106 HydrophobicContact CB-CD1 4.34Å; I103-L106 HydrophobicContact CB-CD2 4.36Å; I103-L106 HydrophobicContact CB-CG 4.37Å; I103-L106 HydrophobicContact CG2-CD1 4.28Å; I103-L106 HydrophobicContact CG2-CD2 3.47Å; I103-L106 VanDerWaalsContact CG2-CD2 3.47Å; I103-L106 HydrophobicContact CG2-CG 3.8Å; K104-L106 PolarHBondContact O-N 3.34Å; L106-I110 HydrophobicContact CD2-CD1 4.26Å; L106-L115 HydrophobicContact CD1-CD1 4.15Å; L106-L115 HydrophobicContact CD2-CD1 4.2Å; L106-G139 PolarHBondContact N-O 2.8Å; L106-G139 WeakPolarHBondContact O-CA 3.21Å; L106-V168 HydrophobicContact CD2-CG1 3.95Å
107	D	94.6	Very high	93.4	Very high	29 Å²	29	48.5 Å²	48.5	16%	0.155	26%	0.257	C	S	.	.			trans	-62.5	143.8	167.6	-168.2	-86.1	0	0	0	110.2	S109 I110 N164 R166	D107-S109 PolarHBondContact O-N 2.79Å; D107-S109 VanDerWaalsContact OD1-CB 3.27Å; D107-S109 WeakPolarHBondContact OD1-CB 3.01Å; D107-S109 PolarHBondContact OD1-N 2.69Å; D107-S109 PolarHBondContact OD1-OG 2.77Å; D107-I110 HydrophobicContact CB-CD1 4.2Å; D107-I110 HydrophobicContact CB-CG1 4.27Å; D107-I110 PolarHBondContact O-N 3.25Å; D107-I110 VanDerWaalsContact O-N 3.12Å; D107-N164 HydrophobicContact CB-CB 3.93Å; D107-R166 HydrophobicContact CB-CG 4.21Å; D107-R166 IonicContact OD2-CZ 3.32Å; D107-R166 VanDerWaalsContact OD2-CZ 3.32Å; D107-R166 IonicContact OD2-NE 3.16Å; D107-R166 PolarHBondContact OD2-NE 3.29Å; D107-R166 IonicContact OD2-NH2 3.24Å; D107-R166 PolarHBondContact OD2-NH2 3.13Å
108	K	93.7	Very high	94	Very high	140 Å²	140	49.3 Å²	49.3	61%	0.609	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-17.5	-175.8	-67.9	-172.5	175.8	-173.8	0	112.9	I110 S137	K108-I110 VanDerWaalsContact C-N 3.33Å; K108-S137 WeakPolarHBondContact O-CB 3.26Å
109	S	93.9	Very high	94.5	Very high	79 Å²	79	46 Å²	46	55%	0.552	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-17.9	173.6	60.9	0	0	0	0	113.9	D107 D111 N164	D107-S109 PolarHBondContact O-N 2.79Å; D107-S109 VanDerWaalsContact OD1-CB 3.27Å; D107-S109 WeakPolarHBondContact OD1-CB 3.01Å; D107-S109 PolarHBondContact OD1-N 2.69Å; D107-S109 PolarHBondContact OD1-OG 2.77Å; S109-D111 PolarHBondContact O-N 3.35Å; S109-N164 PolarHBondContact OG-ND2 2.85Å; S109-N164 VanDerWaalsContact OG-ND2 3.17Å
110	I	93.4	Very high	94.7	Very high	8 Å²	8	48.4 Å²	48.4	4%	0.041	25%	0.252	C	S	.	.			trans	-78.5	117.9	-179	-60.1	174.8	0	0	0	109.4	L106 D107 K108 A114 L115 L163	L106-I110 HydrophobicContact CD2-CD1 4.26Å; D107-I110 HydrophobicContact CB-CD1 4.2Å; D107-I110 HydrophobicContact CB-CG1 4.27Å; D107-I110 PolarHBondContact O-N 3.25Å; D107-I110 VanDerWaalsContact O-N 3.12Å; K108-I110 VanDerWaalsContact C-N 3.33Å; I110-A114 HydrophobicContact CG2-CB 4.07Å; I110-L115 HydrophobicContact CG2-CB 4.24Å; I110-L163 HydrophobicContact CD1-CB 4.13Å; I110-L163 HydrophobicContact CD1-CD2 4.26Å
111	D	93.2	Very high	94.7	Very high	86 Å²	86	50.8 Å²	50.8	46%	0.46	28%	0.277	S	S	.	.			trans	-96.9	-175.7	175.9	73	-2.4	0	0	0	112.3	S109 K113 A114 L115	S109-D111 PolarHBondContact O-N 3.35Å; D111-K113 VanDerWaalsContact C-N 3.3Å; D111-K113 PolarHBondContact O-N 2.85Å; D111-K113 PolarHBondContact OD1-N 3.33Å; D111-A114 VanDerWaalsContact OD1-CB 3.3Å; D111-A114 WeakPolarHBondContact OD1-CB 3.49Å; D111-A114 PolarHBondContact OD1-N 3.28Å; D111-L115 VanDerWaalsContact O-CB 3.32Å; D111-L115 WeakPolarHBondContact O-CB 3.37Å; D111-L115 PolarHBondContact O-N 3.4Å
112	N	94.3	Very high	94.7	Very high	16 Å²	16	52 Å²	52	9%	0.086	28%	0.282	C	S	.	.	H	α-helix	trans	-63	-37.3	-179	-56	-73.3	0	0	0	112.3	F74 P81 Y116 C128 K129 V130	F74-N112 HydrophobicContact CB-CB 4.22Å; F74-N112 HydrophobicContact CD1-CB 3.27Å; F74-N112 HydrophobicContact CD2-CB 4.4Å; F74-N112 HydrophobicContact CE1-CB 3.67Å; F74-N112 HydrophobicContact CG-CB 3.69Å; F74-N112 HydrophobicContact CZ-CB 4.39Å; P81-N112 WeakPolarHBondContact CG-ND2 3.45Å; N112-Y116 WeakPolarHBondContact O-CB 3.36Å; N112-Y116 PolarHBondContact O-N 2.87Å; N112-C128 PolarHBondContact O-SG 3.45Å; N112-C128 VanDerWaalsContact O-SG 3.41Å; N112-K129 VanDerWaalsContact OD1-CA 3.32Å; N112-K129 WeakPolarHBondContact OD1-CA 3.17Å; N112-V130 PolarHBondContact OD1-N 2.99Å
113	K	93.2	Very high	94.6	Very high	114 Å²	114	51.6 Å²	51.6	50%	0.496	29%	0.287	S	S	.	.	H	α-helix	trans	-71	-48.1	-177.7	-173.2	-178.9	-180	-62.3	0	110.8	F74 D111 L115 Y116 D117	F74-K113 HydrophobicContact CD2-CB 4.14Å; D111-K113 VanDerWaalsContact C-N 3.3Å; D111-K113 PolarHBondContact O-N 2.85Å; D111-K113 PolarHBondContact OD1-N 3.33Å; K113-L115 VanDerWaalsContact C-N 3.27Å; K113-L115 PolarHBondContact O-N 3.46Å; K113-Y116 WeakPolarHBondContact O-CB 3.44Å; K113-Y116 PolarHBondContact O-N 3.48Å; K113-Y116 VanDerWaalsContact O-N 3.12Å; K113-D117 IonicContact NZ-OD1 2.71Å; K113-D117 IonicContact NZ-OD2 3.97Å; K113-D117 PolarHBondContact NZ-OD2 3.19Å; K113-D117 WeakPolarHBondContact O-CB 3.32Å; K113-D117 PolarHBondContact O-N 3.46Å
114	A	93.6	Very high	94.5	Very high	35 Å²	35	55.6 Å²	55.6	29%	0.289	31%	0.309	S	S	.	.	H	α-helix	trans	-60.1	-38.7	175	0	0	0	0	0	111.9	I110 D111 T118	I110-A114 HydrophobicContact CG2-CB 4.07Å; D111-A114 VanDerWaalsContact OD1-CB 3.3Å; D111-A114 WeakPolarHBondContact OD1-CB 3.49Å; D111-A114 PolarHBondContact OD1-N 3.28Å; A114-T118 WeakPolarHBondContact O-CB 3.46Å; A114-T118 PolarHBondContact O-N 2.9Å; A114-T118 PolarHBondContact O-OG1 2.8Å
115	L	95.1	Very high	94.5	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-64.7	-43.1	174	-173.1	69.7	0	0	0	111.8	L106 I110 D111 K113 F119 C128 V130 V143	L106-L115 HydrophobicContact CD1-CD1 4.15Å; L106-L115 HydrophobicContact CD2-CD1 4.2Å; I110-L115 HydrophobicContact CG2-CB 4.24Å; D111-L115 VanDerWaalsContact O-CB 3.32Å; D111-L115 WeakPolarHBondContact O-CB 3.37Å; D111-L115 PolarHBondContact O-N 3.4Å; K113-L115 VanDerWaalsContact C-N 3.27Å; K113-L115 PolarHBondContact O-N 3.46Å; L115-F119 HydrophobicContact CD1-CD2 3.67Å; L115-F119 HydrophobicContact CD1-CE2 3.58Å; L115-F119 HydrophobicContact CG-CD2 4.3Å; L115-F119 WeakPolarHBondContact O-CD2 3.39Å; L115-F119 PolarHBondContact O-N 3.39Å; L115-F119 VanDerWaalsContact O-N 3.15Å; L115-C128 HydrophobicContact CD2-CB 4.44Å; L115-V130 HydrophobicContact CB-CG2 4.2Å; L115-V130 HydrophobicContact CD2-CG2 3.81Å; L115-V143 HydrophobicContact CD1-CG2 4.44Å; L115-V143 HydrophobicContact CD2-CG2 3.95Å; L115-V143 HydrophobicContact CG-CG2 3.97Å
116	Y	95.4	Very high	94.3	Very high	58 Å²	58	48.9 Å²	48.9	23%	0.227	28%	0.278	C	S	.	.	H	α-helix	trans	-60.4	-53.3	174.9	-176.3	-92	0	0	0	111.4	F74 N112 K113 T118 F119 S120 I125	F74-Y116 HydrophobicContact CE2-CD2 4.16Å; F74-Y116 AromaticContact CE2-CG 3.98Å; F74-Y116 HydrophobicContact CE2-CG 3.98Å; F74-Y116 HydrophobicContact CZ-CD2 4.13Å; F74-Y116 HydrophobicContact CZ-CG 4.33Å; N112-Y116 WeakPolarHBondContact O-CB 3.36Å; N112-Y116 PolarHBondContact O-N 2.87Å; K113-Y116 WeakPolarHBondContact O-CB 3.44Å; K113-Y116 PolarHBondContact O-N 3.48Å; K113-Y116 VanDerWaalsContact O-N 3.12Å; Y116-T118 VanDerWaalsContact C-N 3.27Å; Y116-T118 PolarHBondContact O-N 2.96Å; Y116-F119 PolarHBondContact O-N 3.5Å; Y116-S120 VanDerWaalsContact O-CB 3.24Å; Y116-S120 WeakPolarHBondContact O-CB 3.27Å; Y116-S120 PolarHBondContact O-N 3.27Å; Y116-S120 PolarHBondContact O-OG 2.88Å; Y116-I125 HydrophobicContact CD2-CB 4.03Å; Y116-I125 HydrophobicContact CD2-CD1 3.97Å; Y116-I125 HydrophobicContact CD2-CG2 3.89Å; Y116-I125 HydrophobicContact CE2-CB 3.67Å; Y116-I125 HydrophobicContact CE2-CD1 4.27Å; Y116-I125 HydrophobicContact CE2-CG1 4.49Å; Y116-I125 HydrophobicContact CE2-CG2 3.91Å; Y116-I125 HydrophobicContact CG-CD1 4.47Å
117	D	94.3	Very high	94.2	Very high	80 Å²	80	49.1 Å²	49.1	43%	0.428	28%	0.28	S	S	.	.	H	α-helix	trans	-56.4	-43.8	-177.5	-67	-16.6	0	0	0	110.4	K113 S120	K113-D117 IonicContact NZ-OD1 2.71Å; K113-D117 IonicContact NZ-OD2 3.97Å; K113-D117 PolarHBondContact NZ-OD2 3.19Å; K113-D117 WeakPolarHBondContact O-CB 3.32Å; K113-D117 PolarHBondContact O-N 3.46Å; D117-S120 PolarHBondContact O-OG 3.46Å
118	T	94.1	Very high	94.2	Very high	46 Å²	46	47.8 Å²	47.8	28%	0.282	27%	0.273	S	S	.	.	H	α-helix	trans	-62.6	-49.2	177.5	-57.4	0	0	0	0	112.8	A114 Y116 M158 L163	A114-T118 WeakPolarHBondContact O-CB 3.46Å; A114-T118 PolarHBondContact O-N 2.9Å; A114-T118 PolarHBondContact O-OG1 2.8Å; Y116-T118 VanDerWaalsContact C-N 3.27Å; Y116-T118 PolarHBondContact O-N 2.96Å; T118-M158 HydrophobicContact CG2-CE 3.92Å; T118-L163 HydrophobicContact CG2-CD1 4.41Å; T118-L163 HydrophobicContact CG2-CD2 3.86Å
119	F	96	Very high	94.2	Very high	0 Å²	0	44 Å²	44	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-87.8	-15	-171.1	-79.9	-91.7	0	0	0	113.3	I101 I103 L115 Y116 A121 F122 I125 V143 F145 A154 M158 V170	I101-F119 HydrophobicContact CD1-CD1 3.82Å; I101-F119 HydrophobicContact CD1-CE1 3.71Å; I103-F119 HydrophobicContact CG1-CE1 4.33Å; I103-F119 HydrophobicContact CG1-CE2 4.23Å; I103-F119 HydrophobicContact CG1-CZ 3.8Å; L115-F119 HydrophobicContact CD1-CD2 3.67Å; L115-F119 HydrophobicContact CD1-CE2 3.58Å; L115-F119 HydrophobicContact CG-CD2 4.3Å; L115-F119 WeakPolarHBondContact O-CD2 3.39Å; L115-F119 PolarHBondContact O-N 3.39Å; L115-F119 VanDerWaalsContact O-N 3.15Å; Y116-F119 PolarHBondContact O-N 3.5Å; F119-A121 PolarHBondContact O-N 3.31Å; F119-A121 VanDerWaalsContact O-N 3.13Å; F119-F122 HydrophobicContact CD1-CD2 4.07Å; F119-F122 HydrophobicContact CD1-CE2 4.23Å; F119-F122 WeakPolarHBondContact O-CD2 3.44Å; F119-F122 PolarHBondContact O-N 2.88Å; F119-F122 VanDerWaalsContact O-N 3.09Å; F119-I125 HydrophobicContact CB-CD1 3.83Å; F119-V143 HydrophobicContact CB-CG1 4.23Å; F119-V143 HydrophobicContact CB-CG2 4.28Å; F119-V143 HydrophobicContact CD2-CG2 4.36Å; F119-V143 HydrophobicContact CG-CG2 4.2Å; F119-F145 HydrophobicContact CB-CZ 4.02Å; F119-F145 HydrophobicContact CD1-CE2 4.48Å; F119-F145 HydrophobicContact CD1-CZ 4.17Å; F119-F145 VanDerWaalsContact O-CE1 3.3Å; F119-F145 WeakPolarHBondContact O-CE1 3.4Å; F119-F145 WeakPolarHBondContact O-CZ 3.46Å; F119-A154 HydrophobicContact CD1-CB 4.14Å; F119-A154 HydrophobicContact CE1-CB 4.34Å; F119-M158 HydrophobicContact CE1-CB 4.14Å; F119-M158 HydrophobicContact CE1-CG 4.02Å; F119-M158 HydrophobicContact CZ-CB 4.28Å; F119-M158 HydrophobicContact CZ-CG 4.34Å; F119-V170 HydrophobicContact CE1-CG1 4.3Å; F119-V170 HydrophobicContact CE1-CG2 4.39Å; F119-V170 HydrophobicContact CZ-CG2 4.09Å
120	S	95.7	Very high	94.3	Very high	53 Å²	53	40.5 Å²	40.5	37%	0.371	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-58.5	-25.7	178.4	67.7	0	0	0	0	112.8	Y116 D117 F122 G123	Y116-S120 VanDerWaalsContact O-CB 3.24Å; Y116-S120 WeakPolarHBondContact O-CB 3.27Å; Y116-S120 PolarHBondContact O-N 3.27Å; Y116-S120 PolarHBondContact O-OG 2.88Å; D117-S120 PolarHBondContact O-OG 3.46Å; S120-F122 PolarHBondContact O-N 3.38Å; S120-G123 PolarHBondContact O-N 2.86Å
121	A	95.9	Very high	94.3	Very high	87 Å²	87	41.3 Å²	41.3	72%	0.719	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-63.2	-19.8	176.5	0	0	0	0	0	114.5	F119	F119-A121 PolarHBondContact O-N 3.31Å; F119-A121 VanDerWaalsContact O-N 3.13Å
122	F	96.2	Very high	94.2	Very high	27 Å²	27	40.8 Å²	40.8	12%	0.118	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-91.2	-19.3	-177.9	-59.3	-74.6	0	0	0	113.8	F119 S120 F145 A150 R153 A154 K157 M158	F119-F122 HydrophobicContact CD1-CD2 4.07Å; F119-F122 HydrophobicContact CD1-CE2 4.23Å; F119-F122 WeakPolarHBondContact O-CD2 3.44Å; F119-F122 PolarHBondContact O-N 2.88Å; F119-F122 VanDerWaalsContact O-N 3.09Å; S120-F122 PolarHBondContact O-N 3.38Å; F122-F145 HydrophobicContact CB-CE1 3.97Å; F122-F145 HydrophobicContact CB-CZ 3.9Å; F122-F145 HydrophobicContact CD2-CZ 4.46Å; F122-A150 WeakPolarHBondContact O-CB 3.34Å; F122-R153 PolarHBondContact O-NH2 3.18Å; F122-A154 HydrophobicContact CB-CB 3.91Å; F122-A154 HydrophobicContact CD1-CB 4.21Å; F122-A154 HydrophobicContact CD2-CB 3.81Å; F122-A154 HydrophobicContact CE2-CB 4.48Å; F122-A154 HydrophobicContact CG-CB 3.68Å; F122-K157 HydrophobicContact CD1-CD 4.42Å; F122-K157 HydrophobicContact CE1-CB 3.81Å; F122-K157 HydrophobicContact CE1-CD 3.79Å; F122-K157 HydrophobicContact CE1-CG 4.38Å; F122-K157 HydrophobicContact CZ-CB 4.33Å; F122-M158 HydrophobicContact CE1-CG 4.27Å; F122-M158 HydrophobicContact CE2-CG 3.44Å; F122-M158 VanDerWaalsContact CE2-CG 3.44Å; F122-M158 HydrophobicContact CE2-SD 3.89Å; F122-M158 HydrophobicContact CZ-CG 3.3Å; F122-M158 HydrophobicContact CZ-SD 3.52Å; F122-M158 VanDerWaalsContact CZ-SD 3.52Å
123	G	94.3	Very high	94	Very high	24 Å²	24	43.4 Å²	43.4	25%	0.247	25%	0.253	C	S	.	.	S	Bend	trans	159.1	175.2	-178.9	0	0	0	0	0	112	S120 I125	S120-G123 PolarHBondContact O-N 2.86Å; G123-I125 PolarHBondContact O-N 3.29Å
124	N	93.2	Very high	93.7	Very high	85 Å²	85	47.4 Å²	47.4	46%	0.455	27%	0.274	S	S	.	.			trans	-63.8	127.9	179.4	-173.1	26.5	0	0	0	111.2	F145 E146	N124-F145 WeakPolarHBondContact O-CA 3.48Å; N124-E146 HydrophobicContact CB-CB 4.18Å; N124-E146 WeakPolarHBondContact CB-OE2 3.39Å; N124-E146 PolarHBondContact ND2-OE2 3.45Å; N124-E146 PolarHBondContact O-N 3.19Å
125	I	94.2	Very high	93.3	Very high	11 Å²	11	53 Å²	53	6%	0.056	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	114.8	-179.3	-66	174.4	0	0	0	108.7	Y116 F119 G123 S127 C128 V143 H144 F145	Y116-I125 HydrophobicContact CD2-CB 4.03Å; Y116-I125 HydrophobicContact CD2-CD1 3.97Å; Y116-I125 HydrophobicContact CD2-CG2 3.89Å; Y116-I125 HydrophobicContact CE2-CB 3.67Å; Y116-I125 HydrophobicContact CE2-CD1 4.27Å; Y116-I125 HydrophobicContact CE2-CG1 4.49Å; Y116-I125 HydrophobicContact CE2-CG2 3.91Å; Y116-I125 HydrophobicContact CG-CD1 4.47Å; F119-I125 HydrophobicContact CB-CD1 3.83Å; G123-I125 PolarHBondContact O-N 3.29Å; I125-S127 VanDerWaalsContact CG2-C 3.45Å; I125-S127 WeakPolarHBondContact CG2-O 3.47Å; I125-C128 HydrophobicContact CG2-CB 4.12Å; I125-V143 HydrophobicContact CD1-CG1 3.82Å; I125-V143 HydrophobicContact CG1-CG1 3.85Å; I125-V143 HydrophobicContact CG2-CG1 4.04Å; I125-H144 CarbonylContact C-O 3.47Å; I125-F145 HydrophobicContact CD1-CE1 4.28Å; I125-F145 HydrophobicContact CG1-CD1 3.91Å; I125-F145 HydrophobicContact CG1-CE1 3.67Å; I125-F145 HydrophobicContact CG1-CZ 4.41Å
126	L	91.8	Very high	93	Very high	45 Å²	45	54.4 Å²	54.4	24%	0.236	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	-31.9	173.1	-60.7	-179	0	0	0	112.2	M85 H144 E146	M85-L126 WeakPolarHBondContact CG-O 3.38Å; L126-H144 PolarHBondContact N-O 2.89Å; L126-E146 HydrophobicContact CD1-CB 4.38Å; L126-E146 HydrophobicContact CD2-CB 4.08Å; L126-E146 HydrophobicContact CD2-CG 4.34Å; L126-E146 HydrophobicContact CG-CB 4.05Å
127	S	92.4	Very high	92.9	Very high	7 Å²	7	52.3 Å²	52.3	5%	0.049	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	139.6	179.7	-158.6	0	0	0	0	111	R83 M85 I125 V143 H144	R83-S127 WeakPolarHBondContact CD-OG 3.43Å; R83-S127 PolarHBondContact NH1-OG 3Å; M85-S127 VanDerWaalsContact SD-CB 3.6Å; M85-S127 PolarHBondContact SD-OG 3.15Å; I125-S127 VanDerWaalsContact CG2-C 3.45Å; I125-S127 WeakPolarHBondContact CG2-O 3.47Å; S127-V143 CarbonylContact O-C 3.43Å; S127-H144 PolarHBondContact N-O 2.95Å; S127-H144 PolarHBondContact O-N 3.05Å
128	C	93.9	Very high	92.8	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.007	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	156.2	159.8	74.3	0	0	0	0	110.8	F74 R83 N112 L115 I125 F142 V143	F74-C128 WeakPolarHBondContact CZ-SG 3.38Å; R83-C128 WeakPolarHBondContact CD-O 3.3Å; N112-C128 PolarHBondContact O-SG 3.45Å; N112-C128 VanDerWaalsContact O-SG 3.41Å; L115-C128 HydrophobicContact CD2-CB 4.44Å; I125-C128 HydrophobicContact CG2-CB 4.12Å; C128-F142 CarbonylContact C-O 3.53Å; C128-F142 WeakPolarHBondContact CA-O 3.38Å; C128-V143 HydrophobicContact CB-CB 4.47Å; C128-V143 HydrophobicContact CB-CG2 3.89Å
129	K	94.5	Very high	92.8	Very high	61 Å²	61	51.9 Å²	51.9	27%	0.265	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	126.6	177.9	-177.3	175.2	-178.3	175.7	0	111.5	D17 N112 G141 F142	D17-K129 IonicContact OD1-NZ 3.5Å; D17-K129 PolarHBondContact OD1-NZ 2.96Å; D17-K129 WeakPolarHBondContact OD2-CD 3.33Å; D17-K129 IonicContact OD2-NZ 3.25Å; D17-K129 PolarHBondContact OD2-NZ 2.91Å; N112-K129 VanDerWaalsContact OD1-CA 3.32Å; N112-K129 WeakPolarHBondContact OD1-CA 3.17Å; K129-G141 CarbonylContact O-C 3.58Å; K129-G141 WeakPolarHBondContact O-CA 3.43Å; K129-F142 PolarHBondContact N-O 2.95Å; K129-F142 PolarHBondContact O-N 2.92Å
130	V	95.6	Very high	92.8	Very high	4 Å²	4	54.8 Å²	54.8	2%	0.024	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	132.1	160.1	178.4	0	0	0	0	108.3	N112 L115 S137	N112-V130 PolarHBondContact OD1-N 2.99Å; L115-V130 HydrophobicContact CB-CG2 4.2Å; L115-V130 HydrophobicContact CD2-CG2 3.81Å; V130-S137 WeakPolarHBondContact CG1-OG 3.38Å
131	V	94.3	Very high	92.8	Very high	26 Å²	26	52.2 Å²	52.2	16%	0.158	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	120.8	177.3	-176.3	0	0	0	0	109.4	K138 Y140 F142	V131-K138 HydrophobicContact CG1-CD 3.89Å; V131-K138 HydrophobicContact CG1-CG 4.38Å; V131-K138 WeakPolarHBondContact O-CB 3.02Å; V131-K138 WeakPolarHBondContact O-CG 3.36Å; V131-K138 PolarHBondContact O-N 3.23Å; V131-Y140 HydrophobicContact CB-CD2 4.15Å; V131-Y140 HydrophobicContact CB-CE1 4.21Å; V131-Y140 HydrophobicContact CB-CE2 3.66Å; V131-Y140 HydrophobicContact CG1-CE1 4.4Å; V131-Y140 HydrophobicContact CG1-CE2 4.19Å; V131-Y140 HydrophobicContact CG2-CD2 3.87Å; V131-Y140 HydrophobicContact CG2-CE2 3.33Å; V131-Y140 PolarHBondContact N-O 3.07Å; V131-F142 HydrophobicContact CG2-CD2 4.06Å; V131-F142 HydrophobicContact CG2-CE2 3.6Å
132	C	91.3	Very high	92.8	Very high	74 Å²	74	50.6 Å²	50.6	50%	0.5	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	148.8	176.2	-55.6	0	0	0	0	111.5	G136	C132-G136 CarbonylContact C-O 3.51Å; C132-G136 WeakPolarHBondContact CA-O 3.24Å; C132-G136 WeakPolarHBondContact CB-O 3.3Å
133	D	88.2	Confident	92.8	Very high	71 Å²	71	49.3 Å²	49.3	38%	0.38	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	-168.5	162.7	57.3	29.6	0	0	0	110.3	N135 G136 K138	D133-N135 PolarHBondContact O-N 3.47Å; D133-N135 WeakPolarHBondContact OD1-CA 3.46Å; D133-N135 WeakPolarHBondContact OD1-CB 3.26Å; D133-N135 PolarHBondContact OD1-N 3.36Å; D133-G136 PolarHBondContact N-O 3.19Å; D133-G136 PolarHBondContact O-N 3.43Å; D133-G136 VanDerWaalsContact O-N 3.14Å; D133-G136 PolarHBondContact OD1-N 3.42Å; D133-K138 HydrophobicContact CB-CD 4.15Å; D133-K138 HydrophobicContact CB-CG 4.2Å; D133-K138 WeakPolarHBondContact OD2-CG 3.38Å
134	E	87.1	Confident	92.8	Very high	199 Å²	199	49.6 Å²	49.6	93%	0.93	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-21.3	178.8	-62.7	177.7	169.6	0	0	112.6
135	N	85.3	Confident	92.9	Very high	153 Å²	153	45.5 Å²	45.5	82%	0.818	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.4	7	178.6	-59.4	90.4	0	0	0	113	D133	D133-N135 PolarHBondContact O-N 3.47Å; D133-N135 WeakPolarHBondContact OD1-CA 3.46Å; D133-N135 WeakPolarHBondContact OD1-CB 3.26Å; D133-N135 PolarHBondContact OD1-N 3.36Å
136	G	88.8	Confident	92.8	Very high	30 Å²	30	48.4 Å²	48.4	31%	0.309	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	100.9	-148.1	-179.8	0	0	0	0	0	113.3	C132 D133 K138	C132-G136 CarbonylContact C-O 3.51Å; C132-G136 WeakPolarHBondContact CA-O 3.24Å; C132-G136 WeakPolarHBondContact CB-O 3.3Å; D133-G136 PolarHBondContact N-O 3.19Å; D133-G136 PolarHBondContact O-N 3.43Å; D133-G136 VanDerWaalsContact O-N 3.14Å; D133-G136 PolarHBondContact OD1-N 3.42Å; G136-K138 PolarHBondContact O-N 3.4Å
137	S	93.1	Very high	92.8	Very high	14 Å²	14	48.9 Å²	48.9	10%	0.098	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	131.6	-174.4	177.2	0	0	0	0	112.5	K108 V130 G139	K108-S137 WeakPolarHBondContact O-CB 3.26Å; V130-S137 WeakPolarHBondContact CG1-OG 3.38Å; S137-G139 PolarHBondContact O-N 3.26Å; S137-G139 PolarHBondContact OG-N 3.05Å; S137-G139 VanDerWaalsContact OG-N 3.15Å
138	K	93.9	Very high	92.9	Very high	106 Å²	106	52 Å²	52	46%	0.461	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	2.4	172.7	-57	-167.1	74.7	155.1	0	113	V131 D133 G136 Y140	V131-K138 HydrophobicContact CG1-CD 3.89Å; V131-K138 HydrophobicContact CG1-CG 4.38Å; V131-K138 WeakPolarHBondContact O-CB 3.02Å; V131-K138 WeakPolarHBondContact O-CG 3.36Å; V131-K138 PolarHBondContact O-N 3.23Å; D133-K138 HydrophobicContact CB-CD 4.15Å; D133-K138 HydrophobicContact CB-CG 4.2Å; D133-K138 WeakPolarHBondContact OD2-CG 3.38Å; G136-K138 PolarHBondContact O-N 3.4Å; K138-Y140 HydrophobicContact CB-CD1 3.78Å; K138-Y140 HydrophobicContact CB-CE1 3.55Å; K138-Y140 HydrophobicContact CD-CE1 4.13Å; K138-Y140 HydrophobicContact CG-CE1 4.43Å
139	G	93.5	Very high	93	Very high	12 Å²	12	57.1 Å²	57.1	12%	0.124	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	74.5	23.3	178.9	0	0	0	0	0	114.3	N105 L106 S137	N105-G139 PolarHBondContact N-O 3.26Å; L106-G139 PolarHBondContact N-O 2.8Å; L106-G139 WeakPolarHBondContact O-CA 3.21Å; S137-G139 PolarHBondContact O-N 3.26Å; S137-G139 PolarHBondContact OG-N 3.05Å; S137-G139 VanDerWaalsContact OG-N 3.15Å
140	Y	95.6	Very high	93.1	Very high	60 Å²	60	54.2 Å²	54.2	24%	0.235	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	156.3	172.6	73.2	-91.1	0	0	0	111.9	F102 I103 V131 K138 F142	F102-Y140 HydrophobicContact CD2-CD2 4.43Å; F102-Y140 AromaticContact CE2-CD2 3.59Å; F102-Y140 HydrophobicContact CE2-CD2 3.59Å; F102-Y140 HydrophobicContact CE2-CE2 4.39Å; F102-Y140 HydrophobicContact CE2-CG 4.01Å; F102-Y140 HydrophobicContact CZ-CD2 4.46Å; I103-Y140 CarbonylContact O-C 3.51Å; I103-Y140 WeakPolarHBondContact O-CA 3.48Å; I103-Y140 VanDerWaalsContact O-CB 3.25Å; I103-Y140 WeakPolarHBondContact O-CB 3.49Å; V131-Y140 HydrophobicContact CB-CD2 4.15Å; V131-Y140 HydrophobicContact CB-CE1 4.21Å; V131-Y140 HydrophobicContact CB-CE2 3.66Å; V131-Y140 HydrophobicContact CG1-CE1 4.4Å; V131-Y140 HydrophobicContact CG1-CE2 4.19Å; V131-Y140 HydrophobicContact CG2-CD2 3.87Å; V131-Y140 HydrophobicContact CG2-CE2 3.33Å; V131-Y140 PolarHBondContact N-O 3.07Å; K138-Y140 HydrophobicContact CB-CD1 3.78Å; K138-Y140 HydrophobicContact CB-CE1 3.55Å; K138-Y140 HydrophobicContact CD-CE1 4.13Å; K138-Y140 HydrophobicContact CG-CE1 4.43Å; Y140-F142 HydrophobicContact CD2-CE2 4.18Å; Y140-F142 HydrophobicContact CD2-CZ 4.14Å; Y140-F142 AromaticContact CE2-CE2 3.87Å; Y140-F142 HydrophobicContact CE2-CE2 3.87Å; Y140-F142 AromaticContact CE2-CZ 3.87Å; Y140-F142 HydrophobicContact CE2-CZ 3.87Å
141	G	95.8	Very high	93.2	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	178.2	-178.3	0	0	0	0	0	112.8	I103 K129	I103-G141 PolarHBondContact N-O 2.83Å; I103-G141 PolarHBondContact O-N 3.44Å; K129-G141 CarbonylContact O-C 3.58Å; K129-G141 WeakPolarHBondContact O-CA 3.43Å
142	F	95.9	Very high	93.3	Very high	52 Å²	52	56.5 Å²	56.5	23%	0.228	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	139	179.4	-55.2	-77	0	0	0	108.9	I101 F102 C128 K129 V131 Y140 F173	I101-F142 WeakPolarHBondContact O-CA 3.37Å; F102-F142 HydrophobicContact CB-CD1 4.29Å; F102-F142 HydrophobicContact CB-CE1 4.32Å; F102-F142 AromaticContact CD2-CD1 3.88Å; F102-F142 HydrophobicContact CD2-CD1 3.88Å; F102-F142 AromaticContact CD2-CE1 3.38Å; F102-F142 HydrophobicContact CD2-CE1 3.38Å; F102-F142 HydrophobicContact CD2-CZ 4.06Å; F102-F142 HydrophobicContact CE2-CE1 4.1Å; F102-F142 HydrophobicContact CE2-CZ 4.35Å; F102-F142 HydrophobicContact CG-CE1 4.26Å; C128-F142 CarbonylContact C-O 3.53Å; C128-F142 WeakPolarHBondContact CA-O 3.38Å; K129-F142 PolarHBondContact N-O 2.95Å; K129-F142 PolarHBondContact O-N 2.92Å; V131-F142 HydrophobicContact CG2-CD2 4.06Å; V131-F142 HydrophobicContact CG2-CE2 3.6Å; Y140-F142 HydrophobicContact CD2-CE2 4.18Å; Y140-F142 HydrophobicContact CD2-CZ 4.14Å; Y140-F142 AromaticContact CE2-CE2 3.87Å; Y140-F142 HydrophobicContact CE2-CE2 3.87Å; Y140-F142 AromaticContact CE2-CZ 3.87Å; Y140-F142 HydrophobicContact CE2-CZ 3.87Å; F142-F173 AromaticContact CD1-CD2 3.45Å; F142-F173 HydrophobicContact CD1-CD2 3.45Å; F142-F173 VanDerWaalsContact CD1-CD2 3.45Å; F142-F173 AromaticContact CD1-CE2 3.64Å; F142-F173 HydrophobicContact CD1-CE2 3.64Å; F142-F173 AromaticContact CE1-CD2 3.47Å; F142-F173 HydrophobicContact CE1-CD2 3.47Å; F142-F173 VanDerWaalsContact CE1-CD2 3.47Å; F142-F173 AromaticContact CE1-CE2 3.35Å; F142-F173 HydrophobicContact CE1-CE2 3.35Å; F142-F173 HydrophobicContact CZ-CE2 4.12Å
143	V	96.1	Very high	93.6	Very high	1 Å²	1	58.4 Å²	58.4	1%	0.006	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	132.2	170.6	176.1	0	0	0	0	106.9	I101 I103 L115 F119 I125 S127 C128 F145	I101-V143 HydrophobicContact CD1-CB 4.01Å; I101-V143 HydrophobicContact CG1-CB 3.69Å; I101-V143 HydrophobicContact CG1-CG1 4.43Å; I101-V143 WeakPolarHBondContact CG1-O 3.44Å; I101-V143 PolarHBondContact N-O 3.01Å; I101-V143 PolarHBondContact O-N 3.06Å; I101-V143 VanDerWaalsContact O-N 3.11Å; I103-V143 HydrophobicContact CD1-CB 4.1Å; I103-V143 HydrophobicContact CD1-CG2 3.66Å; L115-V143 HydrophobicContact CD1-CG2 4.44Å; L115-V143 HydrophobicContact CD2-CG2 3.95Å; L115-V143 HydrophobicContact CG-CG2 3.97Å; F119-V143 HydrophobicContact CB-CG1 4.23Å; F119-V143 HydrophobicContact CB-CG2 4.28Å; F119-V143 HydrophobicContact CD2-CG2 4.36Å; F119-V143 HydrophobicContact CG-CG2 4.2Å; I125-V143 HydrophobicContact CD1-CG1 3.82Å; I125-V143 HydrophobicContact CG1-CG1 3.85Å; I125-V143 HydrophobicContact CG2-CG1 4.04Å; S127-V143 CarbonylContact O-C 3.43Å; C128-V143 HydrophobicContact CB-CB 4.47Å; C128-V143 HydrophobicContact CB-CG2 3.89Å; V143-F145 HydrophobicContact CB-CE2 4.5Å; V143-F145 HydrophobicContact CG1-CD2 4.07Å; V143-F145 HydrophobicContact CG1-CE1 4.32Å; V143-F145 HydrophobicContact CG1-CE2 3.71Å; V143-F145 HydrophobicContact CG1-CZ 3.85Å
144	H	94.8	Very high	94	Very high	29 Å²	29	55 Å²	55	13%	0.134	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	106.1	177.3	-173.5	178.2	0	0	0	107.7	V98 N100 I125 L126 S127	V98-H144 PolarHBondContact O-CD2 3.36Å; V98-H144 PolarHBondContact O-NE2 2.9Å; N100-H144 PolarHBondContact ND2-ND1 3.48Å; N100-H144 PolarHBondContact OD1-CD2 3.44Å; N100-H144 PolarHBondContact OD1-CE1 3.47Å; N100-H144 VanDerWaalsContact OD1-CG 3.31Å; N100-H144 PolarHBondContact OD1-ND1 2.94Å; N100-H144 PolarHBondContact OD1-NE2 3.02Å; I125-H144 CarbonylContact C-O 3.47Å; L126-H144 PolarHBondContact N-O 2.89Å; S127-H144 PolarHBondContact N-O 2.95Å; S127-H144 PolarHBondContact O-N 3.05Å
145	F	95.2	Very high	94.5	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	151.9	172.1	-69.7	-77.3	0	0	0	111.4	G99 I101 F119 F122 N124 I125 V143 T147 A150 A151 A154	G99-F145 PolarHBondContact O-N 3.35Å; I101-F145 HydrophobicContact CD1-CD2 4.48Å; I101-F145 HydrophobicContact CD1-CE2 3.7Å; I101-F145 HydrophobicContact CG1-CD2 4.45Å; I101-F145 HydrophobicContact CG1-CE2 4.12Å; F119-F145 HydrophobicContact CB-CZ 4.02Å; F119-F145 HydrophobicContact CD1-CE2 4.48Å; F119-F145 HydrophobicContact CD1-CZ 4.17Å; F119-F145 VanDerWaalsContact O-CE1 3.3Å; F119-F145 WeakPolarHBondContact O-CE1 3.4Å; F119-F145 WeakPolarHBondContact O-CZ 3.46Å; F122-F145 HydrophobicContact CB-CE1 3.97Å; F122-F145 HydrophobicContact CB-CZ 3.9Å; F122-F145 HydrophobicContact CD2-CZ 4.46Å; N124-F145 WeakPolarHBondContact O-CA 3.48Å; I125-F145 HydrophobicContact CD1-CE1 4.28Å; I125-F145 HydrophobicContact CG1-CD1 3.91Å; I125-F145 HydrophobicContact CG1-CE1 3.67Å; I125-F145 HydrophobicContact CG1-CZ 4.41Å; V143-F145 HydrophobicContact CB-CE2 4.5Å; V143-F145 HydrophobicContact CG1-CD2 4.07Å; V143-F145 HydrophobicContact CG1-CE1 4.32Å; V143-F145 HydrophobicContact CG1-CE2 3.71Å; V143-F145 HydrophobicContact CG1-CZ 3.85Å; F145-T147 WeakPolarHBondContact CB-O 3.41Å; F145-T147 PolarHBondContact O-N 2.87Å; F145-A150 HydrophobicContact CB-CB 3.9Å; F145-A150 HydrophobicContact CD1-CB 3.81Å; F145-A150 HydrophobicContact CE1-CB 4.5Å; F145-A150 HydrophobicContact CG-CB 3.87Å; F145-A151 HydrophobicContact CB-CB 4.46Å; F145-A151 HydrophobicContact CD2-CB 3.87Å; F145-A154 HydrophobicContact CE2-CB 3.67Å; F145-A154 HydrophobicContact CZ-CB 3.86Å
146	E	91.2	Very high	95	Very high	72 Å²	72	47.3 Å²	47.3	34%	0.336	23%	0.23	S	C	.	.	S	Bend	trans	-60	-34.1	172.2	-176.3	172.2	-163.2	0	0	112.3	P6 N124 L126	P6-E146 WeakPolarHBondContact CD-OE1 3.42Å; P6-E146 WeakPolarHBondContact CG-OE1 3.37Å; N124-E146 HydrophobicContact CB-CB 4.18Å; N124-E146 WeakPolarHBondContact CB-OE2 3.39Å; N124-E146 PolarHBondContact ND2-OE2 3.45Å; N124-E146 PolarHBondContact O-N 3.19Å; L126-E146 HydrophobicContact CD1-CB 4.38Å; L126-E146 HydrophobicContact CD2-CB 4.08Å; L126-E146 HydrophobicContact CD2-CG 4.34Å; L126-E146 HydrophobicContact CG-CB 4.05Å
147	T	93.1	Very high	95.3	Very high	55 Å²	55	52.1 Å²	52.1	34%	0.337	24%	0.242	S	C	.	.	S	Bend	trans	-122.5	150.3	-175.4	74	0	0	0	0	112.4	F145 E149 A150 A151	F145-T147 WeakPolarHBondContact CB-O 3.41Å; F145-T147 PolarHBondContact O-N 2.87Å; T147-E149 VanDerWaalsContact C-N 3.29Å; T147-E149 VanDerWaalsContact CB-OE2 3.24Å; T147-E149 WeakPolarHBondContact CB-OE2 3.35Å; T147-A150 WeakPolarHBondContact OG1-CB 3.48Å; T147-A150 PolarHBondContact OG1-N 2.88Å; T147-A151 PolarHBondContact O-N 3.46Å
148	Q	93.8	Very high	95.5	Very high	71 Å²	71	52.4 Å²	52.4	33%	0.332	24%	0.242	S	C	.	.	H	α-helix	trans	-67.3	-35	176	-177.9	172.3	-32.9	0	0	111.1	V98 A150 A151 E152	V98-Q148 HydrophobicContact CG1-CB 3.92Å; Q148-A150 VanDerWaalsContact C-N 3.32Å; Q148-A150 PolarHBondContact O-N 3.33Å; Q148-A151 WeakPolarHBondContact O-CB 3.41Å; Q148-A151 PolarHBondContact O-N 3.33Å; Q148-A151 VanDerWaalsContact O-N 3.17Å; Q148-E152 HydrophobicContact CG-CG 4.3Å; Q148-E152 PolarHBondContact NE2-OE1 2.94Å; Q148-E152 WeakPolarHBondContact O-CG 3.19Å; Q148-E152 PolarHBondContact O-N 3.37Å
149	E	96.4	Very high	95.5	Very high	109 Å²	109	50.9 Å²	50.9	51%	0.509	24%	0.239	S	C	.	.	H	α-helix	trans	-64.2	-39.2	-179.3	-58.9	75.7	-165.4	0	0	110.9	T147 E152 R153	T147-E149 VanDerWaalsContact C-N 3.29Å; T147-E149 VanDerWaalsContact CB-OE2 3.24Å; T147-E149 WeakPolarHBondContact CB-OE2 3.35Å; E149-E152 PolarHBondContact O-N 2.8Å; E149-R153 VanDerWaalsContact O-CG 3.32Å; E149-R153 WeakPolarHBondContact O-CG 3.23Å; E149-R153 PolarHBondContact O-N 3.45Å
150	A	97.1	Very high	95.5	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-64	-42	174.2	0	0	0	0	0	111.8	F122 F145 T147 Q148 A154	F122-A150 WeakPolarHBondContact O-CB 3.34Å; F145-A150 HydrophobicContact CB-CB 3.9Å; F145-A150 HydrophobicContact CD1-CB 3.81Å; F145-A150 HydrophobicContact CE1-CB 4.5Å; F145-A150 HydrophobicContact CG-CB 3.87Å; T147-A150 WeakPolarHBondContact OG1-CB 3.48Å; T147-A150 PolarHBondContact OG1-N 2.88Å; Q148-A150 VanDerWaalsContact C-N 3.32Å; Q148-A150 PolarHBondContact O-N 3.33Å; A150-A154 WeakPolarHBondContact O-CB 3.48Å; A150-A154 PolarHBondContact O-N 3.27Å
151	A	96.7	Very high	95.4	Very high	5 Å²	5	53.4 Å²	53.4	4%	0.041	26%	0.259	C	S	.	.	H	α-helix	trans	-62.5	-42.7	175.1	0	0	0	0	0	112.7	I101 F145 T147 Q148 A154 I155	I101-A151 HydrophobicContact CG2-CB 3.57Å; F145-A151 HydrophobicContact CB-CB 4.46Å; F145-A151 HydrophobicContact CD2-CB 3.87Å; T147-A151 PolarHBondContact O-N 3.46Å; Q148-A151 WeakPolarHBondContact O-CB 3.41Å; Q148-A151 PolarHBondContact O-N 3.33Å; Q148-A151 VanDerWaalsContact O-N 3.17Å; A151-A154 PolarHBondContact O-N 3.13Å; A151-I155 WeakPolarHBondContact O-CD1 3.34Å; A151-I155 VanDerWaalsContact O-CG1 3.27Å; A151-I155 WeakPolarHBondContact O-CG1 3.27Å; A151-I155 PolarHBondContact O-N 3.19Å
152	E	96.7	Very high	95.1	Very high	74 Å²	74	59 Å²	59	35%	0.346	29%	0.288	S	S	.	.	H	α-helix	trans	-65.9	-45	178.1	-73.5	175.9	177.3	0	0	111.9	Q148 E149 A154 I155 E156 R172	Q148-E152 HydrophobicContact CG-CG 4.3Å; Q148-E152 PolarHBondContact NE2-OE1 2.94Å; Q148-E152 WeakPolarHBondContact O-CG 3.19Å; Q148-E152 PolarHBondContact O-N 3.37Å; E149-E152 PolarHBondContact O-N 2.8Å; E152-A154 VanDerWaalsContact C-N 3.3Å; E152-A154 PolarHBondContact O-N 3.23Å; E152-I155 PolarHBondContact O-N 3.1Å; E152-E156 WeakPolarHBondContact O-CB 3.45Å; E152-E156 PolarHBondContact O-N 3.25Å; E152-R172 IonicContact OE1-CZ 2.91Å; E152-R172 IonicContact OE1-NH1 3.81Å; E152-R172 PolarHBondContact OE1-NH1 2.85Å; E152-R172 IonicContact OE1-NH2 3.22Å; E152-R172 PolarHBondContact OE1-NH2 3.03Å
153	R	97.3	Very high	94.8	Very high	113 Å²	113	57.5 Å²	57.5	43%	0.426	28%	0.282	S	S	.	.	H	α-helix	trans	-59.6	-40.6	173.5	-71.6	-171.6	-55.6	-107.2	4.1	112.3	F122 E149 K157	F122-R153 PolarHBondContact O-NH2 3.18Å; E149-R153 VanDerWaalsContact O-CG 3.32Å; E149-R153 WeakPolarHBondContact O-CG 3.23Å; E149-R153 PolarHBondContact O-N 3.45Å; R153-K157 WeakPolarHBondContact O-CB 3.49Å; R153-K157 WeakPolarHBondContact O-CG 3.48Å; R153-K157 PolarHBondContact O-N 3.45Å
154	A	97.3	Very high	94.5	Very high	0 Å²	0	62 Å²	62	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-64.5	-42.4	176.6	0	0	0	0	0	111.6	I101 F119 F122 F145 A150 A151 E152 M158	I101-A154 HydrophobicContact CD1-CB 4.19Å; F119-A154 HydrophobicContact CD1-CB 4.14Å; F119-A154 HydrophobicContact CE1-CB 4.34Å; F122-A154 HydrophobicContact CB-CB 3.91Å; F122-A154 HydrophobicContact CD1-CB 4.21Å; F122-A154 HydrophobicContact CD2-CB 3.81Å; F122-A154 HydrophobicContact CE2-CB 4.48Å; F122-A154 HydrophobicContact CG-CB 3.68Å; F145-A154 HydrophobicContact CE2-CB 3.67Å; F145-A154 HydrophobicContact CZ-CB 3.86Å; A150-A154 WeakPolarHBondContact O-CB 3.48Å; A150-A154 PolarHBondContact O-N 3.27Å; A151-A154 PolarHBondContact O-N 3.13Å; E152-A154 VanDerWaalsContact C-N 3.3Å; E152-A154 PolarHBondContact O-N 3.23Å; A154-M158 WeakPolarHBondContact O-CB 3.28Å; A154-M158 WeakPolarHBondContact O-CG 3.32Å; A154-M158 PolarHBondContact O-N 3.24Å
155	I	96.7	Very high	94.3	Very high	33 Å²	33	67.9 Å²	67.9	17%	0.169	34%	0.339	C	S	.	.	H	α-helix	trans	-62.2	-51.1	175.4	-69.7	161.3	0	0	0	110.4	I101 A151 E152 K157 N159 V170 R172	I101-I155 HydrophobicContact CG2-CD1 3.84Å; I101-I155 HydrophobicContact CG2-CG1 3.94Å; A151-I155 WeakPolarHBondContact O-CD1 3.34Å; A151-I155 VanDerWaalsContact O-CG1 3.27Å; A151-I155 WeakPolarHBondContact O-CG1 3.27Å; A151-I155 PolarHBondContact O-N 3.19Å; E152-I155 PolarHBondContact O-N 3.1Å; I155-K157 VanDerWaalsContact C-N 3.34Å; I155-K157 PolarHBondContact O-N 3.32Å; I155-N159 WeakPolarHBondContact O-CB 3.23Å; I155-N159 PolarHBondContact O-N 3.16Å; I155-V170 HydrophobicContact CB-CG1 4.48Å; I155-V170 HydrophobicContact CG1-CG1 3.92Å; I155-R172 HydrophobicContact CD1-CG 3.83Å
156	E	96.5	Very high	94.1	Very high	157 Å²	157	72.4 Å²	72.4	73%	0.734	36%	0.356	S	S	*	.	H	α-helix	trans	-59.5	-44.9	-176.6	-175.9	-179.1	-165.5	0	0	111.9	E152	E152-E156 WeakPolarHBondContact O-CB 3.45Å; E152-E156 PolarHBondContact O-N 3.25Å
157	K	95.6	Very high	94.2	Very high	132 Å²	132	75.5 Å²	75.5	57%	0.574	37%	0.368	S	S	*	.	H	α-helix	trans	-81.5	-42.3	-176.1	-69.7	-178.8	172.9	-173.8	0	113	F122 R153 I155 M161	F122-K157 HydrophobicContact CD1-CD 4.42Å; F122-K157 HydrophobicContact CE1-CB 3.81Å; F122-K157 HydrophobicContact CE1-CD 3.79Å; F122-K157 HydrophobicContact CE1-CG 4.38Å; F122-K157 HydrophobicContact CZ-CB 4.33Å; R153-K157 WeakPolarHBondContact O-CB 3.49Å; R153-K157 WeakPolarHBondContact O-CG 3.48Å; R153-K157 PolarHBondContact O-N 3.45Å; I155-K157 VanDerWaalsContact C-N 3.34Å; I155-K157 PolarHBondContact O-N 3.32Å; K157-M161 WeakPolarHBondContact O-CG 3.33Å
158	M	95.5	Very high	94.3	Very high	20 Å²	20	73 Å²	73	10%	0.099	35%	0.352	C	S	.	.	H	α-helix	trans	-93.6	-18.9	-170.6	-61.3	-61.5	-67.2	0	0	114.2	T118 F119 F122 A154 G160 M161 L163 V168 V170	T118-M158 HydrophobicContact CG2-CE 3.92Å; F119-M158 HydrophobicContact CE1-CB 4.14Å; F119-M158 HydrophobicContact CE1-CG 4.02Å; F119-M158 HydrophobicContact CZ-CB 4.28Å; F119-M158 HydrophobicContact CZ-CG 4.34Å; F122-M158 HydrophobicContact CE1-CG 4.27Å; F122-M158 HydrophobicContact CE2-CG 3.44Å; F122-M158 VanDerWaalsContact CE2-CG 3.44Å; F122-M158 HydrophobicContact CE2-SD 3.89Å; F122-M158 HydrophobicContact CZ-CG 3.3Å; F122-M158 HydrophobicContact CZ-SD 3.52Å; F122-M158 VanDerWaalsContact CZ-SD 3.52Å; A154-M158 WeakPolarHBondContact O-CB 3.28Å; A154-M158 WeakPolarHBondContact O-CG 3.32Å; A154-M158 PolarHBondContact O-N 3.24Å; M158-G160 PolarHBondContact O-N 3.36Å; M158-G160 VanDerWaalsContact O-N 3.11Å; M158-M161 HydrophobicContact CE-SD 4.48Å; M158-M161 WeakPolarHBondContact O-CB 3.26Å; M158-M161 PolarHBondContact O-N 3.48Å; M158-M161 HydrophobicContact SD-SD 3.69Å; M158-M161 VanDerWaalsContact SD-SD 3.69Å; M158-L163 HydrophobicContact CE-CD1 3.56Å; M158-L163 HydrophobicContact CE-CG 4.25Å; M158-V168 WeakPolarHBondContact O-CG2 3.46Å; M158-V170 HydrophobicContact CB-CG2 3.88Å
159	N	95	Very high	94.5	Very high	74 Å²	74	74.6 Å²	74.6	40%	0.396	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	117.1	-179.4	-176.4	41.7	0	0	0	110.7	I155 F169 V170	I155-N159 WeakPolarHBondContact O-CB 3.23Å; I155-N159 PolarHBondContact O-N 3.16Å; N159-F169 WeakPolarHBondContact OD1-CA 3.29Å; N159-V170 HydrophobicContact CB-CB 4.08Å; N159-V170 WeakPolarHBondContact CB-O 3.44Å; N159-V170 VanDerWaalsContact CG-O 3.31Å; N159-V170 PolarHBondContact OD1-N 3.41Å; N159-V170 PolarHBondContact OD1-O 3.18Å
160	G	92.8	Very high	94.5	Very high	28 Å²	28	69.5 Å²	69.5	29%	0.289	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	3.9	-176.6	0	0	0	0	0	115	M158 K167 V168	M158-G160 PolarHBondContact O-N 3.36Å; M158-G160 VanDerWaalsContact O-N 3.11Å; G160-K167 VanDerWaalsContact CA-CE 3.47Å; G160-K167 VanDerWaalsContact O-CE 3.26Å; G160-K167 WeakPolarHBondContact O-CE 3.32Å; G160-K167 WeakPolarHBondContact O-CG 3.5Å; G160-V168 VanDerWaalsContact CA-O 3.31Å; G160-V168 WeakPolarHBondContact CA-O 3.44Å; G160-V168 PolarHBondContact N-O 2.95Å
161	M	93	Very high	94.4	Very high	96 Å²	96	70 Å²	70	47%	0.473	34%	0.34	S	S	.	.			trans	-75.3	159.6	170.1	-69.9	-163.5	79.5	0	0	111.9	K157 M158 K167 V168	K157-M161 WeakPolarHBondContact O-CG 3.33Å; M158-M161 HydrophobicContact CE-SD 4.48Å; M158-M161 WeakPolarHBondContact O-CB 3.26Å; M158-M161 PolarHBondContact O-N 3.48Å; M158-M161 HydrophobicContact SD-SD 3.69Å; M158-M161 VanDerWaalsContact SD-SD 3.69Å; M161-K167 WeakPolarHBondContact O-CA 3.09Å; M161-V168 WeakPolarHBondContact O-CG2 3.5Å; M161-V168 PolarHBondContact O-N 2.69Å
162	L	90.9	Very high	94.2	Very high	118 Å²	118	76.8 Å²	76.8	62%	0.618	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	126.3	173.6	-64.7	172.7	0	0	0	110.2	R166 K167	L162-R166 CarbonylContact C-O 3.51Å; L162-R166 WeakPolarHBondContact CA-O 3.33Å; L162-K167 HydrophobicContact CD2-CB 4.09Å
163	L	89.9	Confident	94	Very high	20 Å²	20	76.8 Å²	76.8	11%	0.105	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	112.9	171.4	-97.4	147.6	0	0	0	107.2	I110 T118 M158 D165 R166 V168	I110-L163 HydrophobicContact CD1-CB 4.13Å; I110-L163 HydrophobicContact CD1-CD2 4.26Å; T118-L163 HydrophobicContact CG2-CD1 4.41Å; T118-L163 HydrophobicContact CG2-CD2 3.86Å; M158-L163 HydrophobicContact CE-CD1 3.56Å; M158-L163 HydrophobicContact CE-CG 4.25Å; L163-D165 PolarHBondContact O-N 3.15Å; L163-R166 PolarHBondContact N-O 3.23Å; L163-R166 PolarHBondContact O-N 3.3Å; L163-R166 VanDerWaalsContact O-N 3.15Å; L163-V168 HydrophobicContact CB-CG1 3.76Å; L163-V168 HydrophobicContact CD1-CB 4.34Å; L163-V168 HydrophobicContact CD1-CG1 3.81Å; L163-V168 HydrophobicContact CD1-CG2 3.68Å; L163-V168 HydrophobicContact CG-CG1 4.43Å
164	N	90	Very high	93.6	Very high	95 Å²	95	74.8 Å²	74.8	51%	0.508	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.6	56.4	-169.4	-66.5	5.6	0	0	0	111.8	D107 S109 R166	D107-N164 HydrophobicContact CB-CB 3.93Å; S109-N164 PolarHBondContact OG-ND2 2.85Å; S109-N164 VanDerWaalsContact OG-ND2 3.17Å; N164-R166 PolarHBondContact O-N 2.92Å
165	D	88.8	Confident	93	Very high	153 Å²	153	77.2 Å²	77.2	82%	0.818	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	9.4	179.9	-55	-42.4	0	0	0	116.1	L163	L163-D165 PolarHBondContact O-N 3.15Å
166	R	91	Very high	92.4	Very high	95 Å²	95	84.1 Å²	84.1	36%	0.358	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	131.1	172.7	-64.7	-161.1	-167.5	-151	-3.2	112.2	D107 L162 L163 N164 V168	D107-R166 HydrophobicContact CB-CG 4.21Å; D107-R166 IonicContact OD2-CZ 3.32Å; D107-R166 VanDerWaalsContact OD2-CZ 3.32Å; D107-R166 IonicContact OD2-NE 3.16Å; D107-R166 PolarHBondContact OD2-NE 3.29Å; D107-R166 IonicContact OD2-NH2 3.24Å; D107-R166 PolarHBondContact OD2-NH2 3.13Å; L162-R166 CarbonylContact C-O 3.51Å; L162-R166 WeakPolarHBondContact CA-O 3.33Å; L163-R166 PolarHBondContact N-O 3.23Å; L163-R166 PolarHBondContact O-N 3.3Å; L163-R166 VanDerWaalsContact O-N 3.15Å; N164-R166 PolarHBondContact O-N 2.92Å; R166-V168 PolarHBondContact O-N 3.31Å; R166-V168 VanDerWaalsContact O-N 3.13Å
167	K	94.3	Very high	91.9	Very high	137 Å²	137	84.9 Å²	84.9	60%	0.596	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.9	105.2	172.6	-171.9	168.2	-175	173.5	0	110	N105 G160 M161 L162	N105-K167 PolarHBondContact ND2-O 2.87Å; G160-K167 VanDerWaalsContact CA-CE 3.47Å; G160-K167 VanDerWaalsContact O-CE 3.26Å; G160-K167 WeakPolarHBondContact O-CE 3.32Å; G160-K167 WeakPolarHBondContact O-CG 3.5Å; M161-K167 WeakPolarHBondContact O-CA 3.09Å; L162-K167 HydrophobicContact CD2-CB 4.09Å
168	V	95.9	Very high	91.4	Very high	2 Å²	2	82.6 Å²	82.6	1%	0.012	39%	0.391	C	S	.	.			trans	-79.1	149	-179.8	-64.4	0	0	0	0	111.1	I103 L106 M158 G160 M161 L163 R166 V170	I103-V168 HydrophobicContact CG2-CB 4.21Å; L106-V168 HydrophobicContact CD2-CG1 3.95Å; M158-V168 WeakPolarHBondContact O-CG2 3.46Å; G160-V168 VanDerWaalsContact CA-O 3.31Å; G160-V168 WeakPolarHBondContact CA-O 3.44Å; G160-V168 PolarHBondContact N-O 2.95Å; M161-V168 WeakPolarHBondContact O-CG2 3.5Å; M161-V168 PolarHBondContact O-N 2.69Å; L163-V168 HydrophobicContact CB-CG1 3.76Å; L163-V168 HydrophobicContact CD1-CB 4.34Å; L163-V168 HydrophobicContact CD1-CG1 3.81Å; L163-V168 HydrophobicContact CD1-CG2 3.68Å; L163-V168 HydrophobicContact CG-CG1 4.43Å; R166-V168 PolarHBondContact O-N 3.31Å; R166-V168 VanDerWaalsContact O-N 3.13Å; V168-V170 HydrophobicContact CG2-CG2 4.05Å
169	F	96.2	Very high	90.9	Very high	106 Å²	106	86.3 Å²	86.3	47%	0.465	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	123.9	167.1	172.1	-90.8	0	0	0	108.3	F102 I103 K104 N159	F102-F169 HydrophobicContact CD1-CE1 4.44Å; I103-F169 CarbonylContact C-O 3.56Å; I103-F169 VanDerWaalsContact CA-O 3.3Å; I103-F169 WeakPolarHBondContact CA-O 3.36Å; K104-F169 HydrophobicContact CB-CB 4.25Å; K104-F169 HydrophobicContact CB-CD1 4.24Å; K104-F169 PolarHBondContact N-O 3.21Å; K104-F169 PolarHBondContact O-N 2.99Å; N159-F169 WeakPolarHBondContact OD1-CA 3.29Å
170	V	96.6	Very high	90.2	Very high	1 Å²	1	87.6 Å²	87.6	1%	0.006	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	126.2	177.9	-173.1	0	0	0	0	107.8	I101 I103 F119 I155 M158 N159 V168	I101-V170 HydrophobicContact CD1-CG1 3.77Å; I103-V170 HydrophobicContact CG1-CG1 4.29Å; I103-V170 HydrophobicContact CG1-CG2 4.26Å; I103-V170 HydrophobicContact CG2-CG2 4.05Å; F119-V170 HydrophobicContact CE1-CG1 4.3Å; F119-V170 HydrophobicContact CE1-CG2 4.39Å; F119-V170 HydrophobicContact CZ-CG2 4.09Å; I155-V170 HydrophobicContact CB-CG1 4.48Å; I155-V170 HydrophobicContact CG1-CG1 3.92Å; M158-V170 HydrophobicContact CB-CG2 3.88Å; N159-V170 HydrophobicContact CB-CB 4.08Å; N159-V170 WeakPolarHBondContact CB-O 3.44Å; N159-V170 VanDerWaalsContact CG-O 3.31Å; N159-V170 PolarHBondContact OD1-N 3.41Å; N159-V170 PolarHBondContact OD1-O 3.18Å; V168-V170 HydrophobicContact CG2-CG2 4.05Å
171	G	95.1	Very high	89.6	Confident	10 Å²	10	89.2 Å²	89.2	10%	0.103	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	172.5	-179.5	0	0	0	0	0	112.7	I101 F102	I101-G171 CarbonylContact C-O 3.55Å; I101-G171 WeakPolarHBondContact CA-O 3.43Å; F102-G171 PolarHBondContact N-O 3.41Å; F102-G171 PolarHBondContact O-N 2.74Å
172	R	93.9	Very high	88.9	Confident	149 Å²	149	88.8 Å²	88.8	56%	0.562	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.8	139.1	174.7	-64.4	-177.3	-176.4	-107	-2.5	110.3	E152 I155 K174	E152-R172 IonicContact OE1-CZ 2.91Å; E152-R172 IonicContact OE1-NH1 3.81Å; E152-R172 PolarHBondContact OE1-NH1 2.85Å; E152-R172 IonicContact OE1-NH2 3.22Å; E152-R172 PolarHBondContact OE1-NH2 3.03Å; I155-R172 HydrophobicContact CD1-CG 3.83Å; R172-K174 PolarHBondContact O-N 2.87Å
173	F	92	Very high	88.1	Confident	73 Å²	73	88.6 Å²	88.6	32%	0.32	41%	0.414	S	S	.	.			trans	-65.9	128.8	174.8	174.6	-99.2	0	0	0	110.4	N100 F142	N100-F173 HydrophobicContact CB-CB 3.6Å; N100-F173 HydrophobicContact CB-CD1 4.33Å; N100-F173 HydrophobicContact CB-CG 4.11Å; N100-F173 VanDerWaalsContact O-CB 3.23Å; N100-F173 WeakPolarHBondContact O-CB 3.3Å; N100-F173 PolarHBondContact O-N 3.27Å; F142-F173 AromaticContact CD1-CD2 3.45Å; F142-F173 HydrophobicContact CD1-CD2 3.45Å; F142-F173 VanDerWaalsContact CD1-CD2 3.45Å; F142-F173 AromaticContact CD1-CE2 3.64Å; F142-F173 HydrophobicContact CD1-CE2 3.64Å; F142-F173 AromaticContact CE1-CD2 3.47Å; F142-F173 HydrophobicContact CE1-CD2 3.47Å; F142-F173 VanDerWaalsContact CE1-CD2 3.47Å; F142-F173 AromaticContact CE1-CE2 3.35Å; F142-F173 HydrophobicContact CE1-CE2 3.35Å; F142-F173 HydrophobicContact CZ-CE2 4.12Å
174	K	88	Confident	87.2	Confident	71 Å²	71	89.3 Å²	89.3	31%	0.309	43%	0.426	S	S	.	.			trans	-111.4	133.5	171.2	-62.5	-169.8	-173.1	-173.3	0	110	R172 E178 R179 E182	R172-K174 PolarHBondContact O-N 2.87Å; K174-E178 WeakPolarHBondContact CA-OE2 3.45Å; K174-E178 HydrophobicContact CB-CB 4.49Å; K174-E178 HydrophobicContact CB-CG 4.34Å; K174-E178 HydrophobicContact CD-CG 4.41Å; K174-R179 HydrophobicContact CB-CG 3.62Å; K174-R179 PolarHBondContact O-NE 3.47Å; K174-E182 WeakPolarHBondContact CD-OE2 3.25Å; K174-E182 IonicContact NZ-OE1 3.59Å; K174-E182 PolarHBondContact NZ-OE1 3.3Å; K174-E182 IonicContact NZ-OE2 2.84Å; K174-E182 PolarHBondContact NZ-OE2 3.49Å
175	S	85.9	Confident	86.2	Confident	51 Å²	51	87.3 Å²	87.3	36%	0.357	42%	0.423	S	S	.	.			trans	-61.6	158.5	178.4	74.3	0	0	0	0	110.9	K177 E178 R179	S175-K177 PolarHBondContact O-N 3.45Å; S175-E178 PolarHBondContact N-OE2 3.15Å; S175-E178 PolarHBondContact O-N 2.79Å; S175-E178 WeakPolarHBondContact OG-CB 3.12Å; S175-E178 PolarHBondContact OG-N 2.75Å; S175-R179 WeakPolarHBondContact O-CG 3.25Å; S175-R179 PolarHBondContact O-N 2.99Å
176	R	83.9	Confident	85.3	Confident	179 Å²	179	88.7 Å²	88.7	68%	0.675	42%	0.417	S	S	*	.	H	α-helix	trans	-54.3	-43.8	176.2	-179.4	177.4	177.3	173.8	2.6	111.9	R179 E180	R176-R179 PolarHBondContact O-N 2.99Å; R176-E180 HydrophobicContact CG-CG 4.44Å; R176-E180 WeakPolarHBondContact CG-OE1 3.5Å; R176-E180 IonicContact CZ-OE1 2.74Å; R176-E180 IonicContact NE-OE1 3.53Å; R176-E180 PolarHBondContact NE-OE1 3.38Å; R176-E180 IonicContact NH2-OE1 2.61Å; R176-E180 WeakPolarHBondContact O-CB 3.22Å; R176-E180 VanDerWaalsContact O-CG 3.3Å; R176-E180 WeakPolarHBondContact O-CG 3.36Å; R176-E180 PolarHBondContact O-N 3.45Å
177	K	85.4	Confident	84.1	Confident	173 Å²	173	86.8 Å²	86.8	75%	0.752	42%	0.421	S	S	*	.	H	α-helix	trans	-62.7	-42.8	179.5	-175.1	-178.1	177.9	-174.1	0	112.2	S175 E180 A181	S175-K177 PolarHBondContact O-N 3.45Å; K177-E180 PolarHBondContact O-N 2.93Å; K177-A181 WeakPolarHBondContact O-CB 3.34Å; K177-A181 PolarHBondContact O-N 2.98Å
178	E	85.7	Confident	82.9	Confident	84 Å²	84	87.6 Å²	87.6	39%	0.393	43%	0.425	S	S	.	.	H	α-helix	trans	-67	-45.4	178	-175.1	-174.1	175.2	0	0	111.4	K174 S175 E180 A181 E182	K174-E178 WeakPolarHBondContact CA-OE2 3.45Å; K174-E178 HydrophobicContact CB-CB 4.49Å; K174-E178 HydrophobicContact CB-CG 4.34Å; K174-E178 HydrophobicContact CD-CG 4.41Å; S175-E178 PolarHBondContact N-OE2 3.15Å; S175-E178 PolarHBondContact O-N 2.79Å; S175-E178 WeakPolarHBondContact OG-CB 3.12Å; S175-E178 PolarHBondContact OG-N 2.75Å; E178-E180 VanDerWaalsContact C-N 3.32Å; E178-E180 PolarHBondContact O-N 2.96Å; E178-A181 WeakPolarHBondContact O-CB 3.24Å; E178-A181 PolarHBondContact O-N 3.09Å; E178-A181 VanDerWaalsContact O-N 3.13Å; E178-E182 WeakPolarHBondContact O-CG 3.33Å; E178-E182 PolarHBondContact O-N 3.08Å
179	R	84.9	Confident	82.2	Confident	97 Å²	97	92.8 Å²	92.8	37%	0.366	45%	0.449	S	S	.	.	H	α-helix	trans	-59.5	-42.5	174.4	-69.7	-172.2	-66.5	163.1	1.7	111.9	K174 S175 R176 A181 E182 L183	K174-R179 HydrophobicContact CB-CG 3.62Å; K174-R179 PolarHBondContact O-NE 3.47Å; S175-R179 WeakPolarHBondContact O-CG 3.25Å; S175-R179 PolarHBondContact O-N 2.99Å; R176-R179 PolarHBondContact O-N 2.99Å; R179-A181 VanDerWaalsContact C-N 3.34Å; R179-E182 PolarHBondContact O-N 3.39Å; R179-L183 VanDerWaalsContact O-CB 3.25Å; R179-L183 WeakPolarHBondContact O-CB 3.13Å; R179-L183 WeakPolarHBondContact O-CD1 2.86Å; R179-L183 PolarHBondContact O-N 2.98Å
180	E	79.7	Confident	81.9	Confident	101 Å²	101	89 Å²	89	47%	0.472	43%	0.432	S	S	.	.	H	α-helix	trans	-65.4	-36.2	176	-75.6	170.6	-178.4	0	0	112.1	R176 K177 E178 G184	R176-E180 HydrophobicContact CG-CG 4.44Å; R176-E180 WeakPolarHBondContact CG-OE1 3.5Å; R176-E180 IonicContact CZ-OE1 2.74Å; R176-E180 IonicContact NE-OE1 3.53Å; R176-E180 PolarHBondContact NE-OE1 3.38Å; R176-E180 IonicContact NH2-OE1 2.61Å; R176-E180 WeakPolarHBondContact O-CB 3.22Å; R176-E180 VanDerWaalsContact O-CG 3.3Å; R176-E180 WeakPolarHBondContact O-CG 3.36Å; R176-E180 PolarHBondContact O-N 3.45Å; K177-E180 PolarHBondContact O-N 2.93Å; E178-E180 VanDerWaalsContact C-N 3.32Å; E178-E180 PolarHBondContact O-N 2.96Å; E180-G184 WeakPolarHBondContact O-CA 3.3Å; E180-G184 PolarHBondContact O-N 3.39Å
181	A	81.1	Confident	81.7	Confident	63 Å²	63	91.3 Å²	91.3	52%	0.521	45%	0.446	S	S	.	.	H	α-helix	trans	-67.7	-44.2	174.7	0	0	0	0	0	112.1	K177 E178 R179 G184 A185	K177-A181 WeakPolarHBondContact O-CB 3.34Å; K177-A181 PolarHBondContact O-N 2.98Å; E178-A181 WeakPolarHBondContact O-CB 3.24Å; E178-A181 PolarHBondContact O-N 3.09Å; E178-A181 VanDerWaalsContact O-N 3.13Å; R179-A181 VanDerWaalsContact C-N 3.34Å; A181-G184 PolarHBondContact O-N 3.14Å; A181-A185 WeakPolarHBondContact O-CB 3.38Å; A181-A185 PolarHBondContact O-N 3.09Å
182	E	78.2	Confident	81.7	Confident	86 Å²	86	94.3 Å²	94.3	40%	0.402	46%	0.46	S	S	.	.	H	α-helix	trans	-65.7	-44.8	175.8	-71.7	-176.1	172	0	0	112	K174 E178 R179 G184 A185 R186	K174-E182 WeakPolarHBondContact CD-OE2 3.25Å; K174-E182 IonicContact NZ-OE1 3.59Å; K174-E182 PolarHBondContact NZ-OE1 3.3Å; K174-E182 IonicContact NZ-OE2 2.84Å; K174-E182 PolarHBondContact NZ-OE2 3.49Å; E178-E182 WeakPolarHBondContact O-CG 3.33Å; E178-E182 PolarHBondContact O-N 3.08Å; R179-E182 PolarHBondContact O-N 3.39Å; E182-G184 VanDerWaalsContact C-N 3.31Å; E182-G184 PolarHBondContact O-N 3.47Å; E182-A185 PolarHBondContact O-N 3.08Å; E182-R186 WeakPolarHBondContact O-CB 3.22Å; E182-R186 PolarHBondContact O-N 3.37Å
183	L	72.9	Confident	81.8	Confident	115 Å²	115	87.2 Å²	87.2	60%	0.602	43%	0.433	S	S	*	.	H	α-helix	trans	-62.5	-39.2	173.4	-88.7	151.3	0	0	0	111.3	R179 A187	R179-L183 VanDerWaalsContact O-CB 3.25Å; R179-L183 WeakPolarHBondContact O-CB 3.13Å; R179-L183 WeakPolarHBondContact O-CD1 2.86Å; R179-L183 PolarHBondContact O-N 2.98Å; L183-A187 WeakPolarHBondContact O-CA 3.05Å; L183-A187 WeakPolarHBondContact O-CB 3.45Å; L183-A187 PolarHBondContact O-N 3.31Å
184	G	70.8	Confident	82	Confident	34 Å²	34	86 Å²	86	35%	0.351	43%	0.427	S	S	.	.	H	α-helix	trans	-66.7	-38.5	176.4	0	0	0	0	0	112.7	E180 A181 E182 K188	E180-G184 WeakPolarHBondContact O-CA 3.3Å; E180-G184 PolarHBondContact O-N 3.39Å; A181-G184 PolarHBondContact O-N 3.14Å; E182-G184 VanDerWaalsContact C-N 3.31Å; E182-G184 PolarHBondContact O-N 3.47Å; G184-K188 WeakPolarHBondContact O-CG 3.45Å; G184-K188 PolarHBondContact O-N 2.78Å
185	A	70.8	Confident	82.3	Confident	54 Å²	54	82.7 Å²	82.7	45%	0.446	41%	0.413	S	S	.	.	H	α-helix	trans	-66	-50.5	173.1	0	0	0	0	0	110.8	A181 E182 A187 K188 E189	A181-A185 WeakPolarHBondContact O-CB 3.38Å; A181-A185 PolarHBondContact O-N 3.09Å; E182-A185 PolarHBondContact O-N 3.08Å; A185-A187 VanDerWaalsContact C-N 3.27Å; A185-A187 PolarHBondContact O-N 3.15Å; A185-K188 WeakPolarHBondContact O-CB 3.41Å; A185-K188 PolarHBondContact O-N 2.75Å; A185-E189 PolarHBondContact O-N 3.11Å
186	R	69.1	Low	82.8	Confident	182 Å²	182	85.4 Å²	85.4	69%	0.687	42%	0.418	S	S	*	.	H	α-helix	trans	-66.7	-27.9	178	-150.6	-177.8	88.2	158.8	9	113.2	E182 K188 E189	E182-R186 WeakPolarHBondContact O-CB 3.22Å; E182-R186 PolarHBondContact O-N 3.37Å; R186-K188 VanDerWaalsContact C-N 3.26Å; R186-E189 WeakPolarHBondContact CG-OE2 3.43Å; R186-E189 WeakPolarHBondContact O-CB 3.48Å; R186-E189 PolarHBondContact O-N 2.82Å
187	A	65	Low	83.2	Confident	54 Å²	54	80.1 Å²	80.1	45%	0.446	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-17.2	173.4	0	0	0	0	0	112.3	L183 A185 R265	L183-A187 WeakPolarHBondContact O-CA 3.05Å; L183-A187 WeakPolarHBondContact O-CB 3.45Å; L183-A187 PolarHBondContact O-N 3.31Å; A185-A187 VanDerWaalsContact C-N 3.27Å; A185-A187 PolarHBondContact O-N 3.15Å; A187-R265 PolarHBondContact O-NH1 3.31Å
188	K	70.7	Confident	83.4	Confident	155 Å²	155	72 Å²	72	67%	0.674	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-22.6	168.8	-70.9	173.2	-178.7	-176.1	0	111.9	G184 A185 R186 F190 H241	G184-K188 WeakPolarHBondContact O-CG 3.45Å; G184-K188 PolarHBondContact O-N 2.78Å; A185-K188 WeakPolarHBondContact O-CB 3.41Å; A185-K188 PolarHBondContact O-N 2.75Å; R186-K188 VanDerWaalsContact C-N 3.26Å; K188-F190 VanDerWaalsContact O-CD1 3.25Å; K188-F190 WeakPolarHBondContact O-CD1 3.37Å; K188-F190 PolarHBondContact O-N 3.17Å; K188-H241 PolarHBondContact O-CE1 3.09Å
189	E	81.3	Confident	83.4	Confident	110 Å²	110	68.7 Å²	68.7	51%	0.514	36%	0.356	S	S	.	.			trans	-67.7	124.3	171.3	-62.2	169.7	-170.8	0	0	109.6	A185 R186 H241	A185-E189 PolarHBondContact O-N 3.11Å; R186-E189 WeakPolarHBondContact CG-OE2 3.43Å; R186-E189 WeakPolarHBondContact O-CB 3.48Å; R186-E189 PolarHBondContact O-N 2.82Å; E189-H241 HydrophobicContact CB-CB 4.27Å
190	F	89	Confident	83.5	Confident	26 Å²	26	70.1 Å²	70.1	11%	0.114	37%	0.367	C	S	.	.			trans	-139.3	141	172.9	63.6	-88.2	0	0	0	109.6	K188 V193 H241 A244 V248 R265	K188-F190 VanDerWaalsContact O-CD1 3.25Å; K188-F190 WeakPolarHBondContact O-CD1 3.37Å; K188-F190 PolarHBondContact O-N 3.17Å; F190-V193 HydrophobicContact CD2-CG2 4.44Å; F190-V193 HydrophobicContact CE2-CG2 4.16Å; F190-H241 AromaticContact CD1-CE1 3.87Å; F190-H241 AromaticContact CE1-CE1 3.84Å; F190-H241 PolarHBondContact N-ND1 3.44Å; F190-H241 WeakPolarHBondContact O-CA 3.36Å; F190-H241 PolarHBondContact O-ND1 2.94Å; F190-A244 HydrophobicContact CD2-CB 3.94Å; F190-A244 HydrophobicContact CE2-CB 3.86Å; F190-A244 VanDerWaalsContact O-CB 3.29Å; F190-A244 WeakPolarHBondContact O-CB 3.34Å; F190-V248 HydrophobicContact CE2-CG2 3.74Å; F190-V248 HydrophobicContact CZ-CB 4.43Å; F190-V248 HydrophobicContact CZ-CG2 3.87Å; F190-R265 HydrophobicContact CB-CB 4.36Å; F190-R265 HydrophobicContact CB-CG 3.66Å; F190-R265 HydrophobicContact CD1-CB 3.85Å; F190-R265 HydrophobicContact CD1-CG 3.95Å; F190-R265 HydrophobicContact CD2-CB 3.89Å; F190-R265 HydrophobicContact CD2-CG 4.08Å; F190-R265 HydrophobicContact CE1-CB 4.13Å; F190-R265 HydrophobicContact CE2-CB 4.17Å; F190-R265 HydrophobicContact CG-CB 3.75Å; F190-R265 HydrophobicContact CG-CG 3.62Å; F190-R265 HydrophobicContact CZ-CB 4.29Å
191	T	92.5	Very high	83.8	Confident	50 Å²	50	70.5 Å²	70.5	31%	0.307	37%	0.372	S	S	.	.			trans	-105.4	-22.5	171.5	50.6	0	0	0	0	111.7	F238	T191-F238 VanDerWaalsContact CB-O 3.3Å; T191-F238 WeakPolarHBondContact CB-O 3.41Å; T191-F238 PolarHBondContact O-N 3.29Å
192	N	94.4	Very high	84.2	Confident	74 Å²	74	68.9 Å²	68.9	40%	0.396	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	119.9	-176.3	-62.8	2.2	0	0	0	110.1	V236 S237 A266	N192-V236 CarbonylContact C-O 3.57Å; N192-V236 WeakPolarHBondContact CA-O 3.34Å; N192-S237 WeakPolarHBondContact OD1-CB 3.24Å; N192-S237 PolarHBondContact OD1-OG 2.84Å; N192-A266 HydrophobicContact CB-CB 3.77Å; N192-A266 VanDerWaalsContact O-CB 3.32Å; N192-A266 WeakPolarHBondContact O-CB 3.31Å; N192-A266 PolarHBondContact O-N 3.12Å
193	V	96.4	Very high	84.9	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	135.5	179.3	-178.1	0	0	0	0	108.8	F190 I195 F235 V236 F238 A244 V248 V263 G264	F190-V193 HydrophobicContact CD2-CG2 4.44Å; F190-V193 HydrophobicContact CE2-CG2 4.16Å; V193-I195 HydrophobicContact CB-CD1 4.33Å; V193-I195 HydrophobicContact CG1-CD1 3.95Å; V193-I195 HydrophobicContact CG1-CG1 4.13Å; V193-F235 CarbonylContact O-C 3.41Å; V193-F235 VanDerWaalsContact O-CA 3.23Å; V193-F235 WeakPolarHBondContact O-CA 3.3Å; V193-V236 PolarHBondContact N-O 3.42Å; V193-V236 PolarHBondContact O-N 3.05Å; V193-F238 HydrophobicContact CB-CE2 4.46Å; V193-F238 HydrophobicContact CG2-CD2 3.91Å; V193-F238 HydrophobicContact CG2-CE2 3.83Å; V193-A244 HydrophobicContact CG2-CB 3.7Å; V193-V248 HydrophobicContact CG1-CG2 4.04Å; V193-V248 HydrophobicContact CG2-CG2 4.23Å; V193-V263 HydrophobicContact CG1-CG1 3.35Å; V193-G264 CarbonylContact C-O 3.55Å; V193-G264 WeakPolarHBondContact CA-O 3.34Å
194	Y	95.9	Very high	85.9	Confident	48 Å²	48	65 Å²	65	19%	0.188	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	129.8	170.8	170.3	-101.5	0	0	0	109	K196 F233 F235 Y262 V263 G264	Y194-K196 HydrophobicContact CE1-CB 3.7Å; Y194-K196 HydrophobicContact CE1-CD 4.37Å; Y194-K196 HydrophobicContact CE1-CG 4.49Å; Y194-K196 WeakPolarHBondContact OH-CD 3.47Å; Y194-F233 HydrophobicContact CD2-CD2 4.29Å; Y194-F233 HydrophobicContact CE2-CB 3.93Å; Y194-F233 AromaticContact CE2-CD2 3.45Å; Y194-F233 HydrophobicContact CE2-CD2 3.45Å; Y194-F233 VanDerWaalsContact CE2-CD2 3.45Å; Y194-F233 HydrophobicContact CE2-CE2 4.18Å; Y194-F233 AromaticContact CE2-CG 3.97Å; Y194-F233 HydrophobicContact CE2-CG 3.97Å; Y194-F235 HydrophobicContact CD2-CD1 4.08Å; Y194-F235 AromaticContact CD2-CE1 3.5Å; Y194-F235 HydrophobicContact CD2-CE1 3.5Å; Y194-F235 AromaticContact CD2-CZ 3.75Å; Y194-F235 HydrophobicContact CD2-CZ 3.75Å; Y194-F235 HydrophobicContact CE2-CE1 4.39Å; Y194-F235 HydrophobicContact CE2-CZ 4.21Å; Y194-F235 HydrophobicContact CG-CE1 4.28Å; Y194-Y262 AromaticContact CD1-CD1 3.86Å; Y194-Y262 HydrophobicContact CD1-CD1 3.86Å; Y194-Y262 AromaticContact CD1-CE1 3.8Å; Y194-Y262 HydrophobicContact CD1-CE1 3.8Å; Y194-Y262 AromaticContact CE1-CD1 3.94Å; Y194-Y262 HydrophobicContact CE1-CD1 3.94Å; Y194-Y262 HydrophobicContact CE1-CE1 4.13Å; Y194-V263 WeakPolarHBondContact O-CA 3.4Å; Y194-G264 PolarHBondContact N-O 2.99Å; Y194-G264 PolarHBondContact O-N 2.99Å
195	I	95.6	Very high	87	Confident	1 Å²	1	70.5 Å²	70.5	1%	0.005	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	132.3	-178.1	-50.8	86.9	0	0	0	107.9	V193 F198 L207 F211 F233 G234 V236 Y262 V263	V193-I195 HydrophobicContact CB-CD1 4.33Å; V193-I195 HydrophobicContact CG1-CD1 3.95Å; V193-I195 HydrophobicContact CG1-CG1 4.13Å; I195-F198 HydrophobicContact CB-CD1 4.31Å; I195-F198 HydrophobicContact CB-CE1 4.23Å; I195-F198 HydrophobicContact CG2-CD1 3.64Å; I195-F198 HydrophobicContact CG2-CE1 4.07Å; I195-L207 HydrophobicContact CG2-CD1 4.37Å; I195-F211 HydrophobicContact CB-CZ 4.45Å; I195-F211 HydrophobicContact CD1-CZ 4.49Å; I195-F211 HydrophobicContact CG1-CE1 4Å; I195-F211 HydrophobicContact CG1-CE2 3.9Å; I195-F211 HydrophobicContact CG1-CZ 3.55Å; I195-F211 HydrophobicContact CG2-CE2 4.07Å; I195-F211 HydrophobicContact CG2-CZ 3.95Å; I195-F233 CarbonylContact O-C 3.46Å; I195-F233 WeakPolarHBondContact O-CA 3.34Å; I195-F233 VanDerWaalsContact O-CB 3.26Å; I195-F233 WeakPolarHBondContact O-CB 3.38Å; I195-G234 PolarHBondContact N-O 3.29Å; I195-G234 PolarHBondContact O-N 2.96Å; I195-V236 HydrophobicContact CD1-CB 4.03Å; I195-V236 HydrophobicContact CD1-CG2 3.63Å; I195-Y262 CarbonylContact C-O 3.57Å; I195-Y262 VanDerWaalsContact CA-O 3.3Å; I195-Y262 WeakPolarHBondContact CA-O 3.12Å; I195-V263 HydrophobicContact CG1-CG1 4.33Å; I195-V263 HydrophobicContact CG2-CG2 4.18Å
196	K	94.6	Very high	88	Confident	108 Å²	108	74.1 Å²	74.1	47%	0.47	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	157.2	178.5	-171.4	-171.7	-175.7	-175.9	0	111	Y194 G232 F233 I261 Y262	Y194-K196 HydrophobicContact CE1-CB 3.7Å; Y194-K196 HydrophobicContact CE1-CD 4.37Å; Y194-K196 HydrophobicContact CE1-CG 4.49Å; Y194-K196 WeakPolarHBondContact OH-CD 3.47Å; K196-G232 CarbonylContact C-O 3.59Å; K196-G232 WeakPolarHBondContact CA-O 3.41Å; K196-F233 HydrophobicContact CB-CB 4.13Å; K196-F233 HydrophobicContact CG-CB 4.08Å; K196-I261 WeakPolarHBondContact O-CA 3.39Å; K196-Y262 PolarHBondContact N-O 3.45Å; K196-Y262 PolarHBondContact O-N 3.34Å
197	N	92.2	Very high	89.2	Confident	68 Å²	68	65.5 Å²	65.5	36%	0.364	32%	0.323	S	S	.	.			trans	75.2	29.5	168.8	-159.3	38.5	0	0	0	114.5	G232 Q260	N197-G232 PolarHBondContact N-O 3.31Å; N197-Q260 PolarHBondContact ND2-O 2.96Å
198	F	90.9	Very high	90.6	Very high	3 Å²	3	68.8 Å²	68.8	1%	0.013	33%	0.327	C	S	.	.	S	Bend	trans	-91	4.4	178.2	52.1	-121	0	0	0	114.3	I195 M202 L207 V222 F233 I261	I195-F198 HydrophobicContact CB-CD1 4.31Å; I195-F198 HydrophobicContact CB-CE1 4.23Å; I195-F198 HydrophobicContact CG2-CD1 3.64Å; I195-F198 HydrophobicContact CG2-CE1 4.07Å; F198-M202 HydrophobicContact CB-CG 3.86Å; F198-M202 HydrophobicContact CD2-CB 3.27Å; F198-M202 HydrophobicContact CD2-CG 3.43Å; F198-M202 VanDerWaalsContact CD2-CG 3.43Å; F198-M202 HydrophobicContact CE2-CB 3.48Å; F198-M202 VanDerWaalsContact CE2-CB 3.48Å; F198-M202 HydrophobicContact CE2-CG 4.17Å; F198-M202 HydrophobicContact CG-CB 4.06Å; F198-M202 HydrophobicContact CG-CG 3.82Å; F198-M202 HydrophobicContact CZ-CB 4.4Å; F198-L207 HydrophobicContact CD1-CD1 4.46Å; F198-L207 HydrophobicContact CE1-CD1 4.36Å; F198-V222 HydrophobicContact CE2-CG1 4.32Å; F198-V222 HydrophobicContact CZ-CG1 4.13Å; F198-V222 HydrophobicContact CZ-CG2 4.15Å; F198-F233 VanDerWaalsContact CZ-CA 3.46Å; F198-I261 HydrophobicContact CB-CG2 3.75Å
199	G	86.2	Confident	91.7	Very high	13 Å²	13	67.5 Å²	67.5	13%	0.134	33%	0.327	C	S	.	.			trans	91	178.2	-176.7	0	0	0	0	0	114
200	E	85.9	Confident	92.3	Very high	127 Å²	127	64.3 Å²	64.3	59%	0.593	31%	0.314	S	S	*	.	S	Bend	trans	-85.9	-20.9	179.7	-65.6	179	-162.1	0	0	112.1	M202 S230	E200-M202 PolarHBondContact O-N 2.82Å; E200-S230 VanDerWaalsContact O-CB 3.28Å; E200-S230 WeakPolarHBondContact O-CB 3.24Å
201	D	86.5	Confident	92.6	Very high	109 Å²	109	63.1 Å²	63.1	58%	0.583	31%	0.309	S	S	*	.	S	Bend	trans	-79.4	0.3	-175.1	-49.1	-45.8	0	0	0	114.4	R206	D201-R206 PolarHBondContact O-NH1 2.9Å
202	M	90	Very high	92.6	Very high	29 Å²	29	62.5 Å²	62.5	14%	0.143	31%	0.312	C	S	.	.			trans	-91.1	126.5	176.3	-73.1	-65.2	100.1	0	0	110.5	F198 E200 R206	F198-M202 HydrophobicContact CB-CG 3.86Å; F198-M202 HydrophobicContact CD2-CB 3.27Å; F198-M202 HydrophobicContact CD2-CG 3.43Å; F198-M202 VanDerWaalsContact CD2-CG 3.43Å; F198-M202 HydrophobicContact CE2-CB 3.48Å; F198-M202 VanDerWaalsContact CE2-CB 3.48Å; F198-M202 HydrophobicContact CE2-CG 4.17Å; F198-M202 HydrophobicContact CG-CB 4.06Å; F198-M202 HydrophobicContact CG-CG 3.82Å; F198-M202 HydrophobicContact CZ-CB 4.4Å; E200-M202 PolarHBondContact O-N 2.82Å; M202-R206 HydrophobicContact CE-CB 4.15Å; M202-R206 HydrophobicContact CE-CG 4.47Å; M202-R206 HydrophobicContact SD-CB 3.85Å
203	D	91.9	Very high	92.6	Very high	70 Å²	70	64.6 Å²	64.6	37%	0.374	32%	0.317	S	S	.	.			trans	-110.7	179.2	174.4	55.1	23.1	0	0	0	111.2	E205 R206 L207 V222	D203-E205 VanDerWaalsContact C-N 3.26Å; D203-E205 PolarHBondContact O-N 2.93Å; D203-E205 PolarHBondContact OD1-N 3.18Å; D203-R206 WeakPolarHBondContact OD1-CB 3.46Å; D203-R206 WeakPolarHBondContact OD1-CG 3.29Å; D203-R206 PolarHBondContact OD1-N 3.43Å; D203-L207 WeakPolarHBondContact O-CB 3.16Å; D203-L207 PolarHBondContact O-N 3.3Å; D203-L207 VanDerWaalsContact O-N 3.08Å; D203-V222 VanDerWaalsContact C-CG2 3.47Å; D203-V222 WeakPolarHBondContact O-CG2 3.37Å
204	D	94.1	Very high	92.6	Very high	51 Å²	51	65 Å²	65	27%	0.273	32%	0.319	S	S	.	.	H	α-helix	trans	-59.7	-37.6	-178.8	-68.9	-8.7	0	0	0	111.6	K208 K221 V222	D204-K208 VanDerWaalsContact O-CB 3.25Å; D204-K208 WeakPolarHBondContact O-CB 3.3Å; D204-K208 PolarHBondContact O-N 3.45Å; D204-K221 IonicContact OD2-NZ 3.16Å; D204-K221 PolarHBondContact OD2-NZ 2.95Å; D204-V222 WeakPolarHBondContact OD1-CA 3.3Å; D204-V222 VanDerWaalsContact OD1-CB 3.3Å; D204-V222 WeakPolarHBondContact OD1-CB 3.49Å; D204-V222 PolarHBondContact OD1-N 3.26Å
205	E	93.9	Very high	92.5	Very high	149 Å²	149	63.3 Å²	63.3	70%	0.696	32%	0.317	S	S	*	.	H	α-helix	trans	-70.9	-50.9	-177.6	-65.6	-175.7	176.1	0	0	111.7	D203 L207 K208 D209	D203-E205 VanDerWaalsContact C-N 3.26Å; D203-E205 PolarHBondContact O-N 2.93Å; D203-E205 PolarHBondContact OD1-N 3.18Å; E205-L207 VanDerWaalsContact C-N 3.3Å; E205-L207 PolarHBondContact O-N 2.76Å; E205-K208 WeakPolarHBondContact O-CB 3.44Å; E205-K208 PolarHBondContact O-N 2.93Å; E205-K208 VanDerWaalsContact O-N 3.1Å; E205-D209 PolarHBondContact O-N 3.42Å
206	R	92.3	Very high	92.4	Very high	130 Å²	130	66.5 Å²	66.5	49%	0.491	34%	0.337	S	S	.	.	H	α-helix	trans	-62.7	-38.4	177.3	-68.9	172	178.1	-167.2	-5.4	111.9	D201 M202 D203 K208 D209 L210	D201-R206 PolarHBondContact O-NH1 2.9Å; M202-R206 HydrophobicContact CE-CB 4.15Å; M202-R206 HydrophobicContact CE-CG 4.47Å; M202-R206 HydrophobicContact SD-CB 3.85Å; D203-R206 WeakPolarHBondContact OD1-CB 3.46Å; D203-R206 WeakPolarHBondContact OD1-CG 3.29Å; D203-R206 PolarHBondContact OD1-N 3.43Å; R206-K208 VanDerWaalsContact C-N 3.32Å; R206-D209 PolarHBondContact O-N 2.88Å; R206-L210 VanDerWaalsContact O-CB 3.22Å; R206-L210 WeakPolarHBondContact O-CB 3.43Å; R206-L210 PolarHBondContact O-N 3.48Å
207	L	93.8	Very high	92.4	Very high	1 Å²	1	63 Å²	63	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-65.8	-38.7	175.8	-171.2	67.4	0	0	0	111	I195 F198 D203 E205 F211 V220 V222 V236	I195-L207 HydrophobicContact CG2-CD1 4.37Å; F198-L207 HydrophobicContact CD1-CD1 4.46Å; F198-L207 HydrophobicContact CE1-CD1 4.36Å; D203-L207 WeakPolarHBondContact O-CB 3.16Å; D203-L207 PolarHBondContact O-N 3.3Å; D203-L207 VanDerWaalsContact O-N 3.08Å; E205-L207 VanDerWaalsContact C-N 3.3Å; E205-L207 PolarHBondContact O-N 2.76Å; L207-F211 HydrophobicContact CD1-CD2 3.65Å; L207-F211 HydrophobicContact CD1-CE2 3.64Å; L207-F211 HydrophobicContact CG-CD2 4.28Å; L207-F211 WeakPolarHBondContact O-CB 3.41Å; L207-F211 WeakPolarHBondContact O-CD2 3.45Å; L207-F211 PolarHBondContact O-N 2.82Å; L207-V220 HydrophobicContact CB-CG1 3.94Å; L207-V220 HydrophobicContact CD2-CG1 3.8Å; L207-V220 HydrophobicContact CG-CG1 3.88Å; L207-V222 HydrophobicContact CB-CG2 4.13Å; L207-V222 HydrophobicContact CD2-CG2 3.78Å; L207-V236 HydrophobicContact CD2-CG2 4.21Å; L207-V236 HydrophobicContact CG-CG2 4.18Å
208	K	94.9	Very high	92.4	Very high	123 Å²	123	65.5 Å²	65.5	54%	0.535	34%	0.342	S	S	.	.	H	α-helix	trans	-66	-43.3	176.5	-176.8	-179	179	-173.1	0	111.6	D204 E205 R206 G212 V220	D204-K208 VanDerWaalsContact O-CB 3.25Å; D204-K208 WeakPolarHBondContact O-CB 3.3Å; D204-K208 PolarHBondContact O-N 3.45Å; E205-K208 WeakPolarHBondContact O-CB 3.44Å; E205-K208 PolarHBondContact O-N 2.93Å; E205-K208 VanDerWaalsContact O-N 3.1Å; R206-K208 VanDerWaalsContact C-N 3.32Å; K208-G212 VanDerWaalsContact O-CA 3.26Å; K208-G212 WeakPolarHBondContact O-CA 3.38Å; K208-G212 PolarHBondContact O-N 2.81Å; K208-V220 HydrophobicContact CB-CB 4.17Å; K208-V220 HydrophobicContact CB-CG1 4.1Å; K208-V220 HydrophobicContact CB-CG2 3.96Å; K208-V220 HydrophobicContact CG-CG2 4.02Å
209	D	93.9	Very high	92.6	Very high	127 Å²	127	68.7 Å²	68.7	68%	0.679	36%	0.364	S	S	*	.	H	α-helix	trans	-65.2	-43.5	177.1	-70.5	-14.1	0	0	0	111.4	E205 R206 F211	E205-D209 PolarHBondContact O-N 3.42Å; R206-D209 PolarHBondContact O-N 2.88Å; D209-F211 VanDerWaalsContact C-N 3.34Å; D209-F211 PolarHBondContact O-N 3.47Å
210	L	93	Very high	93.1	Very high	44 Å²	44	69.2 Å²	69.2	23%	0.23	37%	0.365	C	S	.	.	H	α-helix	trans	-63.6	-38.4	-179.3	-175.6	64.7	0	0	0	112.8	R206 K213 M251 L256	R206-L210 VanDerWaalsContact O-CB 3.22Å; R206-L210 WeakPolarHBondContact O-CB 3.43Å; R206-L210 PolarHBondContact O-N 3.48Å; L210-K213 WeakPolarHBondContact O-CE 3.16Å; L210-M251 HydrophobicContact CD1-CE 3.79Å; L210-M251 HydrophobicContact CD2-CE 3.92Å; L210-M251 HydrophobicContact CG-CE 3.82Å; L210-L256 HydrophobicContact CD2-CD1 3.85Å
211	F	95.1	Very high	93.6	Very high	1 Å²	1	68 Å²	68	0%	0.004	36%	0.357	C	S	.	.	H	α-helix	trans	-98.6	-16.5	-177.8	-78.8	-94.4	0	0	0	114.1	I195 L207 D209 K213 F214 V236 F238 A247 M251 V263	I195-F211 HydrophobicContact CB-CZ 4.45Å; I195-F211 HydrophobicContact CD1-CZ 4.49Å; I195-F211 HydrophobicContact CG1-CE1 4Å; I195-F211 HydrophobicContact CG1-CE2 3.9Å; I195-F211 HydrophobicContact CG1-CZ 3.55Å; I195-F211 HydrophobicContact CG2-CE2 4.07Å; I195-F211 HydrophobicContact CG2-CZ 3.95Å; L207-F211 HydrophobicContact CD1-CD2 3.65Å; L207-F211 HydrophobicContact CD1-CE2 3.64Å; L207-F211 HydrophobicContact CG-CD2 4.28Å; L207-F211 WeakPolarHBondContact O-CB 3.41Å; L207-F211 WeakPolarHBondContact O-CD2 3.45Å; L207-F211 PolarHBondContact O-N 2.82Å; D209-F211 VanDerWaalsContact C-N 3.34Å; D209-F211 PolarHBondContact O-N 3.47Å; F211-K213 PolarHBondContact O-N 3.42Å; F211-F214 HydrophobicContact CB-CD2 4.4Å; F211-F214 AromaticContact CD1-CD2 3.99Å; F211-F214 HydrophobicContact CD1-CD2 3.99Å; F211-F214 HydrophobicContact CD1-CE2 4.1Å; F211-F214 HydrophobicContact CE1-CE2 4.48Å; F211-F214 HydrophobicContact CG-CD2 4.48Å; F211-F214 WeakPolarHBondContact O-CB 3.13Å; F211-F214 VanDerWaalsContact O-CD2 3.32Å; F211-F214 WeakPolarHBondContact O-CD2 3.44Å; F211-F214 PolarHBondContact O-N 2.84Å; F211-F214 VanDerWaalsContact O-N 3.08Å; F211-V236 HydrophobicContact CB-CG1 4.27Å; F211-V236 HydrophobicContact CB-CG2 4.04Å; F211-V236 HydrophobicContact CD2-CG2 4.44Å; F211-V236 HydrophobicContact CG-CG2 4.1Å; F211-F238 HydrophobicContact CB-CZ 4.19Å; F211-F238 HydrophobicContact CD1-CZ 4.3Å; F211-A247 HydrophobicContact CD1-CB 3.95Å; F211-A247 HydrophobicContact CE1-CB 4.17Å; F211-M251 HydrophobicContact CE1-CB 4.12Å; F211-M251 HydrophobicContact CE1-CG 4.01Å; F211-M251 HydrophobicContact CZ-CB 4.08Å; F211-M251 HydrophobicContact CZ-CG 4.15Å; F211-V263 HydrophobicContact CE1-CG1 3.9Å; F211-V263 HydrophobicContact CE1-CG2 4.44Å; F211-V263 HydrophobicContact CZ-CG1 4.23Å; F211-V263 HydrophobicContact CZ-CG2 4Å
212	G	93	Very high	94	Very high	36 Å²	36	62.9 Å²	62.9	37%	0.371	33%	0.33	S	S	.	.	H	α-helix	trans	-63.6	-25.1	179.7	0	0	0	0	0	113.3	K208 F214 G215	K208-G212 VanDerWaalsContact O-CA 3.26Å; K208-G212 WeakPolarHBondContact O-CA 3.38Å; K208-G212 PolarHBondContact O-N 2.81Å; G212-F214 PolarHBondContact O-N 2.98Å; G212-G215 PolarHBondContact O-N 3.01Å
213	K	95.1	Very high	94.3	Very high	118 Å²	118	64.8 Å²	64.8	51%	0.513	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-17.5	173.6	67.5	174.6	179.5	157.4	0	114.4	L210 F211 E250	L210-K213 WeakPolarHBondContact O-CE 3.16Å; F211-K213 PolarHBondContact O-N 3.42Å; K213-E250 IonicContact NZ-OE1 3.32Å; K213-E250 PolarHBondContact NZ-OE1 2.93Å; K213-E250 VanDerWaalsContact NZ-OE1 3.16Å
214	F	95.7	Very high	94.3	Very high	8 Å²	8	64.7 Å²	64.7	4%	0.035	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-27	179.4	-63.9	-69.2	0	0	0	112.9	F211 G212 F238 K246 A247 E250 M251	F211-F214 HydrophobicContact CB-CD2 4.4Å; F211-F214 AromaticContact CD1-CD2 3.99Å; F211-F214 HydrophobicContact CD1-CD2 3.99Å; F211-F214 HydrophobicContact CD1-CE2 4.1Å; F211-F214 HydrophobicContact CE1-CE2 4.48Å; F211-F214 HydrophobicContact CG-CD2 4.48Å; F211-F214 WeakPolarHBondContact O-CB 3.13Å; F211-F214 VanDerWaalsContact O-CD2 3.32Å; F211-F214 WeakPolarHBondContact O-CD2 3.44Å; F211-F214 PolarHBondContact O-N 2.84Å; F211-F214 VanDerWaalsContact O-N 3.08Å; G212-F214 PolarHBondContact O-N 2.98Å; F214-F238 HydrophobicContact CB-CE1 3.88Å; F214-F238 HydrophobicContact CB-CZ 3.96Å; F214-K246 HydrophobicContact CD1-CB 4.41Å; F214-K246 HydrophobicContact CD1-CD 4.2Å; F214-K246 HydrophobicContact CD1-CG 3.97Å; F214-K246 HydrophobicContact CE1-CG 4.47Å; F214-A247 HydrophobicContact CB-CB 4.01Å; F214-A247 HydrophobicContact CD1-CB 4.22Å; F214-A247 HydrophobicContact CD2-CB 3.61Å; F214-A247 HydrophobicContact CE2-CB 4.17Å; F214-A247 HydrophobicContact CG-CB 3.67Å; F214-E250 HydrophobicContact CE1-CB 3.69Å; F214-E250 HydrophobicContact CE1-CG 4.25Å; F214-E250 VanDerWaalsContact CE1-OE2 3.3Å; F214-E250 WeakPolarHBondContact CE1-OE2 3.26Å; F214-E250 HydrophobicContact CZ-CB 4.01Å; F214-M251 HydrophobicContact CE1-CG 4.45Å; F214-M251 HydrophobicContact CE2-CG 3.39Å; F214-M251 HydrophobicContact CE2-SD 3.98Å; F214-M251 HydrophobicContact CZ-CG 3.29Å; F214-M251 HydrophobicContact CZ-SD 3.69Å
215	G	93.4	Very high	94.2	Very high	14 Å²	14	65.5 Å²	65.5	14%	0.144	35%	0.346	C	S	.	.	S	Bend	trans	159.3	173.5	-178.7	0	0	0	0	0	112.2	G212 A217	G212-G215 PolarHBondContact O-N 3.01Å; G215-A217 PolarHBondContact O-N 3.43Å
216	P	94.5	Very high	94.1	Very high	67 Å²	67	68.5 Å²	68.5	44%	0.435	36%	0.36	S	S	.	.			trans	-61.8	122.2	179.4	25.3	-32.6	0	0	0	111.1	E239	P216-E239 HydrophobicContact CG-CB 4.01Å; P216-E239 WeakPolarHBondContact CG-OE2 3.23Å; P216-E239 PolarHBondContact O-N 3.43Å
217	A	93.3	Very high	93.9	Very high	35 Å²	35	66.5 Å²	66.5	29%	0.289	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	121.5	174.8	0	0	0	0	0	110.3	G215 S219 V220 V236 S237	G215-A217 PolarHBondContact O-N 3.43Å; A217-S219 VanDerWaalsContact C-N 3.35Å; A217-V220 HydrophobicContact CB-CG2 3.83Å; A217-V236 HydrophobicContact CB-CG1 4.01Å; A217-S237 CarbonylContact C-O 3.6Å; A217-S237 WeakPolarHBondContact CA-O 3.22Å
218	L	93.5	Very high	93.6	Very high	121 Å²	121	68.8 Å²	68.8	63%	0.634	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69	-33	171.7	-64.5	176.8	0	0	0	112.1	S237 E239	L218-S237 PolarHBondContact N-O 3.46Å; L218-E239 HydrophobicContact CD2-CB 4.43Å; L218-E239 HydrophobicContact CD2-CG 4.47Å; L218-E239 HydrophobicContact CG-CB 4.3Å
219	S	95	Very high	93.3	Very high	69 Å²	69	68.9 Å²	68.9	48%	0.483	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	139.4	-179.9	-175.6	0	0	0	0	110.9	A217 V236 S237	A217-S219 VanDerWaalsContact C-N 3.35Å; S219-V236 CarbonylContact O-C 3.57Å; S219-V236 WeakPolarHBondContact O-CA 3.32Å; S219-S237 PolarHBondContact N-O 3.06Å; S219-S237 PolarHBondContact O-N 3.36Å
220	V	96.7	Very high	93.2	Very high	24 Å²	24	63.5 Å²	63.5	15%	0.145	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	130.3	172.8	-178.3	0	0	0	0	107.7	L207 K208 A217 F235 V236	L207-V220 HydrophobicContact CB-CG1 3.94Å; L207-V220 HydrophobicContact CD2-CG1 3.8Å; L207-V220 HydrophobicContact CG-CG1 3.88Å; K208-V220 HydrophobicContact CB-CB 4.17Å; K208-V220 HydrophobicContact CB-CG1 4.1Å; K208-V220 HydrophobicContact CB-CG2 3.96Å; K208-V220 HydrophobicContact CG-CG2 4.02Å; A217-V220 HydrophobicContact CB-CG2 3.83Å; V220-F235 WeakPolarHBondContact CA-O 3.41Å; V220-V236 HydrophobicContact CG1-CG2 4.09Å; V220-V236 HydrophobicContact CG2-CG1 4.22Å; V220-V236 HydrophobicContact CG2-CG2 4.2Å
221	K	95.9	Very high	93.1	Very high	102 Å²	102	67.2 Å²	67.2	44%	0.443	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	119.1	179.3	-167.7	72.1	-161	158.9	0	112.3	D204 M223 G234 F235	D204-K221 IonicContact OD2-NZ 3.16Å; D204-K221 PolarHBondContact OD2-NZ 2.95Å; K221-M223 HydrophobicContact CG-SD 4.31Å; K221-G234 CarbonylContact O-C 3.58Å; K221-G234 WeakPolarHBondContact O-CA 3.5Å; K221-F235 PolarHBondContact N-O 3.15Å; K221-F235 PolarHBondContact O-N 3.49Å
222	V	96	Very high	93	Very high	2 Å²	2	67.8 Å²	67.8	1%	0.012	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	133.5	162.7	176	0	0	0	0	108.6	F198 D203 D204 L207 S230	F198-V222 HydrophobicContact CE2-CG1 4.32Å; F198-V222 HydrophobicContact CZ-CG1 4.13Å; F198-V222 HydrophobicContact CZ-CG2 4.15Å; D203-V222 VanDerWaalsContact C-CG2 3.47Å; D203-V222 WeakPolarHBondContact O-CG2 3.37Å; D204-V222 WeakPolarHBondContact OD1-CA 3.3Å; D204-V222 VanDerWaalsContact OD1-CB 3.3Å; D204-V222 WeakPolarHBondContact OD1-CB 3.49Å; D204-V222 PolarHBondContact OD1-N 3.26Å; L207-V222 HydrophobicContact CB-CG2 4.13Å; L207-V222 HydrophobicContact CD2-CG2 3.78Å; V222-S230 VanDerWaalsContact CG1-OG 3.22Å; V222-S230 WeakPolarHBondContact CG1-OG 3.47Å
223	M	94.6	Very high	93.1	Very high	68 Å²	68	68.1 Å²	68.1	34%	0.335	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	120.4	178.8	-62.2	-56.7	-57.1	0	0	109.5	K221 K231 F233 F235	K221-M223 HydrophobicContact CG-SD 4.31Å; M223-K231 VanDerWaalsContact O-CB 3.3Å; M223-K231 WeakPolarHBondContact O-CB 3.24Å; M223-K231 WeakPolarHBondContact O-CG 3.47Å; M223-K231 PolarHBondContact O-N 2.88Å; M223-F233 HydrophobicContact CB-CD1 4.4Å; M223-F233 HydrophobicContact CB-CD2 3.99Å; M223-F233 HydrophobicContact CB-CE1 4Å; M223-F233 HydrophobicContact CB-CE2 3.63Å; M223-F233 HydrophobicContact CB-CG 4.4Å; M223-F233 HydrophobicContact CB-CZ 3.6Å; M223-F233 HydrophobicContact CG-CD2 3.73Å; M223-F233 HydrophobicContact CG-CE2 3.3Å; M223-F233 HydrophobicContact CG-CZ 3.77Å; M223-F233 PolarHBondContact N-O 3.33Å; M223-F235 HydrophobicContact CG-CD2 4.1Å; M223-F235 HydrophobicContact CG-CE2 3.82Å; M223-F235 HydrophobicContact SD-CD2 4.21Å; M223-F235 HydrophobicContact SD-CE2 4.12Å
224	T	93.6	Very high	93.1	Very high	69 Å²	69	62.5 Å²	62.5	42%	0.423	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	160.3	177.1	55.9	0	0	0	0	111.6	G228 K229 K231	T224-G228 WeakPolarHBondContact CG2-O 3.29Å; T224-K229 CarbonylContact C-O 3.41Å; T224-K229 WeakPolarHBondContact CA-O 3.31Å; T224-K229 WeakPolarHBondContact CB-O 3.4Å; T224-K231 VanDerWaalsContact O-CD 3.32Å; T224-K231 WeakPolarHBondContact O-CD 3.3Å
225	D	90.9	Very high	93.2	Very high	67 Å²	67	65.7 Å²	65.7	36%	0.358	36%	0.363	S	S	.	.			trans	-81.6	-176.4	166.9	67.3	17.6	0	0	0	111.4	S227 G228 K229 K231	D225-S227 VanDerWaalsContact CG-OG 3.27Å; D225-S227 PolarHBondContact O-N 3.31Å; D225-S227 WeakPolarHBondContact OD1-CA 3.46Å; D225-S227 WeakPolarHBondContact OD1-CB 3.38Å; D225-S227 PolarHBondContact OD1-N 3.21Å; D225-S227 PolarHBondContact OD1-OG 2.72Å; D225-S227 PolarHBondContact OD2-OG 2.86Å; D225-G228 PolarHBondContact O-N 3.2Å; D225-G228 VanDerWaalsContact O-N 3.1Å; D225-G228 PolarHBondContact OD1-N 2.98Å; D225-G228 VanDerWaalsContact OD1-N 3.09Å; D225-K229 PolarHBondContact N-O 2.73Å; D225-K229 PolarHBondContact OD1-N 3.14Å; D225-K231 HydrophobicContact CB-CD 4.4Å; D225-K231 HydrophobicContact CB-CG 4.17Å
226	E	92.3	Very high	93.3	Very high	212 Å²	212	65 Å²	65	99%	0.991	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-22.1	179.5	-63.8	173.4	176	0	0	112.8	G228	E226-G228 VanDerWaalsContact C-N 3.32Å
227	S	88.6	Confident	93.4	Very high	89 Å²	89	63 Å²	63	62%	0.622	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-3.4	176.5	76.6	0	0	0	0	113.4	D225 K229	D225-S227 VanDerWaalsContact CG-OG 3.27Å; D225-S227 PolarHBondContact O-N 3.31Å; D225-S227 WeakPolarHBondContact OD1-CA 3.46Å; D225-S227 WeakPolarHBondContact OD1-CB 3.38Å; D225-S227 PolarHBondContact OD1-N 3.21Å; D225-S227 PolarHBondContact OD1-OG 2.72Å; D225-S227 PolarHBondContact OD2-OG 2.86Å; S227-K229 VanDerWaalsContact C-N 3.31Å
228	G	86.6	Confident	93.5	Very high	49 Å²	49	61.3 Å²	61.3	51%	0.505	33%	0.33	S	S	.	.	S	Bend	trans	83.9	0.2	-175.4	0	0	0	0	0	114.2	T224 D225 E226	T224-G228 WeakPolarHBondContact CG2-O 3.29Å; D225-G228 PolarHBondContact O-N 3.2Å; D225-G228 VanDerWaalsContact O-N 3.1Å; D225-G228 PolarHBondContact OD1-N 2.98Å; D225-G228 VanDerWaalsContact OD1-N 3.09Å; E226-G228 VanDerWaalsContact C-N 3.32Å
229	K	88	Confident	93.5	Very high	125 Å²	125	61.2 Å²	61.2	54%	0.543	33%	0.326	S	S	.	.			trans	-74.8	141.1	175.8	-79.7	-172.9	174.4	-168.4	0	111.1	T224 D225 S227 K231	T224-K229 CarbonylContact C-O 3.41Å; T224-K229 WeakPolarHBondContact CA-O 3.31Å; T224-K229 WeakPolarHBondContact CB-O 3.4Å; D225-K229 PolarHBondContact N-O 2.73Å; D225-K229 PolarHBondContact OD1-N 3.14Å; S227-K229 VanDerWaalsContact C-N 3.31Å; K229-K231 PolarHBondContact O-N 2.94Å
230	S	91.6	Very high	93.4	Very high	13 Å²	13	64 Å²	64	9%	0.091	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	131	176.7	179.9	0	0	0	0	111.1	E200 V222 G232	E200-S230 VanDerWaalsContact O-CB 3.28Å; E200-S230 WeakPolarHBondContact O-CB 3.24Å; V222-S230 VanDerWaalsContact CG1-OG 3.22Å; V222-S230 WeakPolarHBondContact CG1-OG 3.47Å; S230-G232 PolarHBondContact O-N 3.31Å; S230-G232 PolarHBondContact OG-N 3.18Å
231	K	92.4	Very high	93.2	Very high	123 Å²	123	65.4 Å²	65.4	54%	0.535	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	7.5	173.3	-60.1	175.6	70.7	163.5	0	112	M223 T224 D225 K229 F233	M223-K231 VanDerWaalsContact O-CB 3.3Å; M223-K231 WeakPolarHBondContact O-CB 3.24Å; M223-K231 WeakPolarHBondContact O-CG 3.47Å; M223-K231 PolarHBondContact O-N 2.88Å; T224-K231 VanDerWaalsContact O-CD 3.32Å; T224-K231 WeakPolarHBondContact O-CD 3.3Å; D225-K231 HydrophobicContact CB-CD 4.4Å; D225-K231 HydrophobicContact CB-CG 4.17Å; K229-K231 PolarHBondContact O-N 2.94Å; K231-F233 VanDerWaalsContact C-N 3.3Å; K231-F233 HydrophobicContact CB-CD1 3.75Å; K231-F233 HydrophobicContact CB-CE1 3.57Å; K231-F233 HydrophobicContact CD-CE1 4.17Å; K231-F233 HydrophobicContact CG-CE1 4.48Å; K231-F233 PolarHBondContact O-N 3.37Å
232	G	92.1	Very high	93.1	Very high	12 Å²	12	67 Å²	67	12%	0.124	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	70.4	22.8	179.7	0	0	0	0	0	114.1	K196 N197 S230	K196-G232 CarbonylContact C-O 3.59Å; K196-G232 WeakPolarHBondContact CA-O 3.41Å; N197-G232 PolarHBondContact N-O 3.31Å; S230-G232 PolarHBondContact O-N 3.31Å; S230-G232 PolarHBondContact OG-N 3.18Å
233	F	94.6	Very high	93.1	Very high	44 Å²	44	67.4 Å²	67.4	19%	0.193	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	157.1	172.7	75.8	-88.4	0	0	0	112.3	Y194 I195 K196 F198 M223 K231 F235	Y194-F233 HydrophobicContact CD2-CD2 4.29Å; Y194-F233 HydrophobicContact CE2-CB 3.93Å; Y194-F233 AromaticContact CE2-CD2 3.45Å; Y194-F233 HydrophobicContact CE2-CD2 3.45Å; Y194-F233 VanDerWaalsContact CE2-CD2 3.45Å; Y194-F233 HydrophobicContact CE2-CE2 4.18Å; Y194-F233 AromaticContact CE2-CG 3.97Å; Y194-F233 HydrophobicContact CE2-CG 3.97Å; I195-F233 CarbonylContact O-C 3.46Å; I195-F233 WeakPolarHBondContact O-CA 3.34Å; I195-F233 VanDerWaalsContact O-CB 3.26Å; I195-F233 WeakPolarHBondContact O-CB 3.38Å; K196-F233 HydrophobicContact CB-CB 4.13Å; K196-F233 HydrophobicContact CG-CB 4.08Å; F198-F233 VanDerWaalsContact CZ-CA 3.46Å; M223-F233 HydrophobicContact CB-CD1 4.4Å; M223-F233 HydrophobicContact CB-CD2 3.99Å; M223-F233 HydrophobicContact CB-CE1 4Å; M223-F233 HydrophobicContact CB-CE2 3.63Å; M223-F233 HydrophobicContact CB-CG 4.4Å; M223-F233 HydrophobicContact CB-CZ 3.6Å; M223-F233 HydrophobicContact CG-CD2 3.73Å; M223-F233 HydrophobicContact CG-CE2 3.3Å; M223-F233 HydrophobicContact CG-CZ 3.77Å; M223-F233 PolarHBondContact N-O 3.33Å; K231-F233 VanDerWaalsContact C-N 3.3Å; K231-F233 HydrophobicContact CB-CD1 3.75Å; K231-F233 HydrophobicContact CB-CE1 3.57Å; K231-F233 HydrophobicContact CD-CE1 4.17Å; K231-F233 HydrophobicContact CG-CE1 4.48Å; K231-F233 PolarHBondContact O-N 3.37Å; F233-F235 HydrophobicContact CD2-CE2 4.12Å; F233-F235 HydrophobicContact CD2-CZ 4.45Å; F233-F235 AromaticContact CE2-CE2 3.89Å; F233-F235 HydrophobicContact CE2-CE2 3.89Å; F233-F235 HydrophobicContact CE2-CZ 4.25Å
234	G	95.8	Very high	93.1	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	-179.2	-178.3	0	0	0	0	0	112.5	I195 K221	I195-G234 PolarHBondContact N-O 3.29Å; I195-G234 PolarHBondContact O-N 2.96Å; K221-G234 CarbonylContact O-C 3.58Å; K221-G234 WeakPolarHBondContact O-CA 3.5Å
235	F	97	Very high	93.2	Very high	74 Å²	74	63.8 Å²	63.8	33%	0.325	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	141.6	-179.4	-59.5	-88.9	0	0	0	110.5	V193 Y194 V220 K221 M223 F233 A266	V193-F235 CarbonylContact O-C 3.41Å; V193-F235 VanDerWaalsContact O-CA 3.23Å; V193-F235 WeakPolarHBondContact O-CA 3.3Å; Y194-F235 HydrophobicContact CD2-CD1 4.08Å; Y194-F235 AromaticContact CD2-CE1 3.5Å; Y194-F235 HydrophobicContact CD2-CE1 3.5Å; Y194-F235 AromaticContact CD2-CZ 3.75Å; Y194-F235 HydrophobicContact CD2-CZ 3.75Å; Y194-F235 HydrophobicContact CE2-CE1 4.39Å; Y194-F235 HydrophobicContact CE2-CZ 4.21Å; Y194-F235 HydrophobicContact CG-CE1 4.28Å; V220-F235 WeakPolarHBondContact CA-O 3.41Å; K221-F235 PolarHBondContact N-O 3.15Å; K221-F235 PolarHBondContact O-N 3.49Å; M223-F235 HydrophobicContact CG-CD2 4.1Å; M223-F235 HydrophobicContact CG-CE2 3.82Å; M223-F235 HydrophobicContact SD-CD2 4.21Å; M223-F235 HydrophobicContact SD-CE2 4.12Å; F233-F235 HydrophobicContact CD2-CE2 4.12Å; F233-F235 HydrophobicContact CD2-CZ 4.45Å; F233-F235 AromaticContact CE2-CE2 3.89Å; F233-F235 HydrophobicContact CE2-CE2 3.89Å; F233-F235 HydrophobicContact CE2-CZ 4.25Å; F235-A266 HydrophobicContact CD1-CB 4.02Å; F235-A266 HydrophobicContact CE1-CB 4.2Å
236	V	97	Very high	93.4	Very high	1 Å²	1	66 Å²	66	1%	0.006	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	121.5	171.1	176.8	0	0	0	0	107.7	N192 V193 I195 L207 F211 A217 S219 V220 F238	N192-V236 CarbonylContact C-O 3.57Å; N192-V236 WeakPolarHBondContact CA-O 3.34Å; V193-V236 PolarHBondContact N-O 3.42Å; V193-V236 PolarHBondContact O-N 3.05Å; I195-V236 HydrophobicContact CD1-CB 4.03Å; I195-V236 HydrophobicContact CD1-CG2 3.63Å; L207-V236 HydrophobicContact CD2-CG2 4.21Å; L207-V236 HydrophobicContact CG-CG2 4.18Å; F211-V236 HydrophobicContact CB-CG1 4.27Å; F211-V236 HydrophobicContact CB-CG2 4.04Å; F211-V236 HydrophobicContact CD2-CG2 4.44Å; F211-V236 HydrophobicContact CG-CG2 4.1Å; A217-V236 HydrophobicContact CB-CG1 4.01Å; S219-V236 CarbonylContact O-C 3.57Å; S219-V236 WeakPolarHBondContact O-CA 3.32Å; V220-V236 HydrophobicContact CG1-CG2 4.09Å; V220-V236 HydrophobicContact CG2-CG1 4.22Å; V220-V236 HydrophobicContact CG2-CG2 4.2Å; V236-F238 HydrophobicContact CB-CE2 4.21Å; V236-F238 HydrophobicContact CG1-CD2 3.92Å; V236-F238 HydrophobicContact CG1-CE1 4.18Å; V236-F238 HydrophobicContact CG1-CE2 3.48Å; V236-F238 VanDerWaalsContact CG1-CE2 3.48Å; V236-F238 HydrophobicContact CG1-CG 4.46Å; V236-F238 HydrophobicContact CG1-CZ 3.64Å
237	S	95.5	Very high	93.6	Very high	23 Å²	23	56 Å²	56	16%	0.161	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	110.4	172.9	179.3	0	0	0	0	108.3	N192 A217 L218 S219	N192-S237 WeakPolarHBondContact OD1-CB 3.24Å; N192-S237 PolarHBondContact OD1-OG 2.84Å; A217-S237 CarbonylContact C-O 3.6Å; A217-S237 WeakPolarHBondContact CA-O 3.22Å; L218-S237 PolarHBondContact N-O 3.46Å; S219-S237 PolarHBondContact N-O 3.06Å; S219-S237 PolarHBondContact O-N 3.36Å
238	F	96.5	Very high	94	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	162.4	172	-69.8	-82.5	0	0	0	111.5	T191 V193 F211 F214 V236 D243 A244 A247	T191-F238 VanDerWaalsContact CB-O 3.3Å; T191-F238 WeakPolarHBondContact CB-O 3.41Å; T191-F238 PolarHBondContact O-N 3.29Å; V193-F238 HydrophobicContact CB-CE2 4.46Å; V193-F238 HydrophobicContact CG2-CD2 3.91Å; V193-F238 HydrophobicContact CG2-CE2 3.83Å; F211-F238 HydrophobicContact CB-CZ 4.19Å; F211-F238 HydrophobicContact CD1-CZ 4.3Å; F214-F238 HydrophobicContact CB-CE1 3.88Å; F214-F238 HydrophobicContact CB-CZ 3.96Å; V236-F238 HydrophobicContact CB-CE2 4.21Å; V236-F238 HydrophobicContact CG1-CD2 3.92Å; V236-F238 HydrophobicContact CG1-CE1 4.18Å; V236-F238 HydrophobicContact CG1-CE2 3.48Å; V236-F238 VanDerWaalsContact CG1-CE2 3.48Å; V236-F238 HydrophobicContact CG1-CG 4.46Å; V236-F238 HydrophobicContact CG1-CZ 3.64Å; F238-D243 HydrophobicContact CB-CB 4.13Å; F238-D243 HydrophobicContact CD1-CB 3.74Å; F238-D243 HydrophobicContact CE1-CB 4.39Å; F238-D243 HydrophobicContact CG-CB 4.02Å; F238-A244 HydrophobicContact CB-CB 4.18Å; F238-A244 VanDerWaalsContact CD2-CA 3.44Å; F238-A244 HydrophobicContact CD2-CB 3.64Å; F238-A244 HydrophobicContact CE2-CB 4.44Å; F238-A244 HydrophobicContact CG-CB 4.21Å; F238-A247 HydrophobicContact CE2-CB 3.74Å; F238-A247 HydrophobicContact CZ-CB 3.77Å
239	E	93.1	Very high	94.4	Very high	120 Å²	120	55.5 Å²	55.5	56%	0.561	26%	0.259	S	S	*	.	S	Bend	trans	-73	-35.9	171.3	-168.5	174.4	174.6	0	0	111.8	P216 L218	P216-E239 HydrophobicContact CG-CB 4.01Å; P216-E239 WeakPolarHBondContact CG-OE2 3.23Å; P216-E239 PolarHBondContact O-N 3.43Å; L218-E239 HydrophobicContact CD2-CB 4.43Å; L218-E239 HydrophobicContact CD2-CG 4.47Å; L218-E239 HydrophobicContact CG-CB 4.3Å
240	R	92.4	Very high	94.7	Very high	126 Å²	126	53.4 Å²	53.4	48%	0.475	25%	0.251	S	S	.	.	S	Bend	trans	-121	150	-175.5	-53.1	180	-62.5	179.1	5.7	111.9	E242 D243 A244	R240-E242 VanDerWaalsContact C-N 3.31Å; R240-E242 PolarHBondContact O-N 2.86Å; R240-D243 WeakPolarHBondContact CB-OD2 3.28Å; R240-D243 IonicContact CZ-OD1 3.26Å; R240-D243 IonicContact CZ-OD2 3.48Å; R240-D243 IonicContact NE-OD1 2.76Å; R240-D243 IonicContact NE-OD2 2.69Å; R240-D243 PolarHBondContact NE-OD2 2.97Å; R240-D243 IonicContact NH2-OD1 2.86Å; R240-D243 PolarHBondContact NH2-OD1 2.93Å; R240-D243 IonicContact NH2-OD2 3.5Å; R240-D243 PolarHBondContact NH2-OD2 3.17Å; R240-D243 PolarHBondContact O-N 3.44Å; R240-A244 PolarHBondContact O-N 3.25Å
241	H	92.6	Very high	94.9	Very high	54 Å²	54	53 Å²	53	25%	0.25	25%	0.248	C	C	.	.	H	α-helix	trans	-62.8	-39	175.9	170.7	44.9	0	0	0	112.3	K188 E189 F190 D243 A244 Q245	K188-H241 PolarHBondContact O-CE1 3.09Å; E189-H241 HydrophobicContact CB-CB 4.27Å; F190-H241 AromaticContact CD1-CE1 3.87Å; F190-H241 AromaticContact CE1-CE1 3.84Å; F190-H241 PolarHBondContact N-ND1 3.44Å; F190-H241 WeakPolarHBondContact O-CA 3.36Å; F190-H241 PolarHBondContact O-ND1 2.94Å; H241-D243 VanDerWaalsContact C-N 3.31Å; H241-D243 PolarHBondContact O-N 3.08Å; H241-A244 PolarHBondContact O-N 3.34Å; H241-Q245 WeakPolarHBondContact O-CB 3.4Å; H241-Q245 PolarHBondContact O-N 2.95Å
242	E	93.6	Very high	95.1	Very high	137 Å²	137	50.9 Å²	50.9	64%	0.64	24%	0.242	S	C	*	.	H	α-helix	trans	-58.9	-42.1	-178.7	-63.8	171.4	-175	0	0	112	R240 Q245 K246	R240-E242 VanDerWaalsContact C-N 3.31Å; R240-E242 PolarHBondContact O-N 2.86Å; E242-Q245 PolarHBondContact O-N 3.34Å; E242-K246 WeakPolarHBondContact O-CB 3.25Å; E242-K246 PolarHBondContact O-N 2.91Å
243	D	95.8	Very high	95.1	Very high	10 Å²	10	52.1 Å²	52.1	5%	0.053	26%	0.255	C	S	.	.	H	α-helix	trans	-67.5	-42.6	179.3	-56.2	-34.7	0	0	0	111	F238 R240 H241 K246 A247	F238-D243 HydrophobicContact CB-CB 4.13Å; F238-D243 HydrophobicContact CD1-CB 3.74Å; F238-D243 HydrophobicContact CE1-CB 4.39Å; F238-D243 HydrophobicContact CG-CB 4.02Å; R240-D243 WeakPolarHBondContact CB-OD2 3.28Å; R240-D243 IonicContact CZ-OD1 3.26Å; R240-D243 IonicContact CZ-OD2 3.48Å; R240-D243 IonicContact NE-OD1 2.76Å; R240-D243 IonicContact NE-OD2 2.69Å; R240-D243 PolarHBondContact NE-OD2 2.97Å; R240-D243 IonicContact NH2-OD1 2.86Å; R240-D243 PolarHBondContact NH2-OD1 2.93Å; R240-D243 IonicContact NH2-OD2 3.5Å; R240-D243 PolarHBondContact NH2-OD2 3.17Å; R240-D243 PolarHBondContact O-N 3.44Å; H241-D243 VanDerWaalsContact C-N 3.31Å; H241-D243 PolarHBondContact O-N 3.08Å; D243-K246 PolarHBondContact O-N 2.99Å; D243-A247 WeakPolarHBondContact O-CB 3.48Å; D243-A247 PolarHBondContact O-N 2.98Å
244	A	95.6	Very high	95	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63.9	-40.7	175.1	0	0	0	0	0	112.5	F190 V193 F238 R240 H241 A247 V248	F190-A244 HydrophobicContact CD2-CB 3.94Å; F190-A244 HydrophobicContact CE2-CB 3.86Å; F190-A244 VanDerWaalsContact O-CB 3.29Å; F190-A244 WeakPolarHBondContact O-CB 3.34Å; V193-A244 HydrophobicContact CG2-CB 3.7Å; F238-A244 HydrophobicContact CB-CB 4.18Å; F238-A244 VanDerWaalsContact CD2-CA 3.44Å; F238-A244 HydrophobicContact CD2-CB 3.64Å; F238-A244 HydrophobicContact CE2-CB 4.44Å; F238-A244 HydrophobicContact CG-CB 4.21Å; R240-A244 PolarHBondContact O-N 3.25Å; H241-A244 PolarHBondContact O-N 3.34Å; A244-A247 PolarHBondContact O-N 2.97Å; A244-V248 WeakPolarHBondContact O-CG2 3.23Å; A244-V248 PolarHBondContact O-N 2.97Å
245	Q	94.5	Very high	94.7	Very high	60 Å²	60	60.3 Å²	60.3	28%	0.28	29%	0.293	S	S	.	.	H	α-helix	trans	-65.4	-46.7	177.3	-175.2	59.4	54.5	0	0	110.8	H241 E242 A247 V248 D249	H241-Q245 WeakPolarHBondContact O-CB 3.4Å; H241-Q245 PolarHBondContact O-N 2.95Å; E242-Q245 PolarHBondContact O-N 3.34Å; Q245-A247 VanDerWaalsContact C-N 3.31Å; Q245-A247 PolarHBondContact O-N 3.26Å; Q245-V248 PolarHBondContact O-N 3.23Å; Q245-V248 VanDerWaalsContact O-N 3.14Å; Q245-D249 VanDerWaalsContact NE2-CG 3.25Å; Q245-D249 PolarHBondContact NE2-OD1 2.92Å; Q245-D249 PolarHBondContact NE2-OD2 3.04Å; Q245-D249 PolarHBondContact O-N 3.43Å
246	K	95.9	Very high	94.1	Very high	115 Å²	115	59 Å²	59	50%	0.5	29%	0.289	S	S	.	.	H	α-helix	trans	-58.7	-42.3	175.5	-170	-177	177.8	-175.5	0	112	F214 E242 D243 V248 D249 E250	F214-K246 HydrophobicContact CD1-CB 4.41Å; F214-K246 HydrophobicContact CD1-CD 4.2Å; F214-K246 HydrophobicContact CD1-CG 3.97Å; F214-K246 HydrophobicContact CE1-CG 4.47Å; E242-K246 WeakPolarHBondContact O-CB 3.25Å; E242-K246 PolarHBondContact O-N 2.91Å; D243-K246 PolarHBondContact O-N 2.99Å; K246-V248 PolarHBondContact O-N 2.84Å; K246-D249 PolarHBondContact O-N 3.42Å; K246-E250 WeakPolarHBondContact O-CB 3.04Å; K246-E250 PolarHBondContact O-N 3.27Å
247	A	96.5	Very high	93.2	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-61.3	-42.3	175.7	0	0	0	0	0	112.5	F211 F214 F238 D243 A244 Q245 M251	F211-A247 HydrophobicContact CD1-CB 3.95Å; F211-A247 HydrophobicContact CE1-CB 4.17Å; F214-A247 HydrophobicContact CB-CB 4.01Å; F214-A247 HydrophobicContact CD1-CB 4.22Å; F214-A247 HydrophobicContact CD2-CB 3.61Å; F214-A247 HydrophobicContact CE2-CB 4.17Å; F214-A247 HydrophobicContact CG-CB 3.67Å; F238-A247 HydrophobicContact CE2-CB 3.74Å; F238-A247 HydrophobicContact CZ-CB 3.77Å; D243-A247 WeakPolarHBondContact O-CB 3.48Å; D243-A247 PolarHBondContact O-N 2.98Å; A244-A247 PolarHBondContact O-N 2.97Å; Q245-A247 VanDerWaalsContact C-N 3.31Å; Q245-A247 PolarHBondContact O-N 3.26Å; A247-M251 WeakPolarHBondContact O-CB 3.12Å; A247-M251 WeakPolarHBondContact O-CG 3.32Å; A247-M251 PolarHBondContact O-N 2.85Å
248	V	95.9	Very high	92.6	Very high	18 Å²	18	66 Å²	66	11%	0.109	34%	0.338	C	S	.	.	H	α-helix	trans	-63.8	-50	175.8	169.4	0	0	0	0	110.9	F190 V193 A244 Q245 K246 E250 N252 V263	F190-V248 HydrophobicContact CE2-CG2 3.74Å; F190-V248 HydrophobicContact CZ-CB 4.43Å; F190-V248 HydrophobicContact CZ-CG2 3.87Å; V193-V248 HydrophobicContact CG1-CG2 4.04Å; V193-V248 HydrophobicContact CG2-CG2 4.23Å; A244-V248 WeakPolarHBondContact O-CG2 3.23Å; A244-V248 PolarHBondContact O-N 2.97Å; Q245-V248 PolarHBondContact O-N 3.23Å; Q245-V248 VanDerWaalsContact O-N 3.14Å; K246-V248 PolarHBondContact O-N 2.84Å; V248-E250 VanDerWaalsContact C-N 3.35Å; V248-E250 PolarHBondContact O-N 3.02Å; V248-N252 WeakPolarHBondContact O-CB 3.34Å; V248-N252 PolarHBondContact O-N 2.98Å; V248-V263 HydrophobicContact CB-CG1 4.5Å; V248-V263 HydrophobicContact CG2-CG1 4.05Å
249	D	94.9	Very high	92.1	Very high	111 Å²	111	71 Å²	71	59%	0.594	36%	0.36	S	S	*	.	H	α-helix	trans	-66.2	-37.3	-175	-66.2	-26.3	0	0	0	112.2	Q245 K246	Q245-D249 VanDerWaalsContact NE2-CG 3.25Å; Q245-D249 PolarHBondContact NE2-OD1 2.92Å; Q245-D249 PolarHBondContact NE2-OD2 3.04Å; Q245-D249 PolarHBondContact O-N 3.43Å; K246-D249 PolarHBondContact O-N 3.42Å
250	E	95.5	Very high	92.1	Very high	80 Å²	80	71.6 Å²	71.6	37%	0.374	36%	0.363	S	S	.	.	H	α-helix	trans	-86.2	-30.7	-177.4	-152.6	-159.9	109.9	0	0	113.5	K213 F214 K246 V248 K254	K213-E250 IonicContact NZ-OE1 3.32Å; K213-E250 PolarHBondContact NZ-OE1 2.93Å; K213-E250 VanDerWaalsContact NZ-OE1 3.16Å; F214-E250 HydrophobicContact CE1-CB 3.69Å; F214-E250 HydrophobicContact CE1-CG 4.25Å; F214-E250 VanDerWaalsContact CE1-OE2 3.3Å; F214-E250 WeakPolarHBondContact CE1-OE2 3.26Å; F214-E250 HydrophobicContact CZ-CB 4.01Å; K246-E250 WeakPolarHBondContact O-CB 3.04Å; K246-E250 PolarHBondContact O-N 3.27Å; V248-E250 VanDerWaalsContact C-N 3.35Å; V248-E250 PolarHBondContact O-N 3.02Å; E250-K254 VanDerWaalsContact O-CD 3.22Å; E250-K254 WeakPolarHBondContact O-CD 3.41Å; E250-K254 WeakPolarHBondContact O-CE 3.32Å; E250-K254 PolarHBondContact O-NZ 2.75Å; E250-K254 IonicContact OE1-NZ 2.84Å; E250-K254 PolarHBondContact OE1-NZ 2.83Å
251	M	95.4	Very high	92.2	Very high	6 Å²	6	65.7 Å²	65.7	3%	0.03	34%	0.341	C	S	.	.	H	α-helix	trans	-102.4	-21.3	-173	-61.6	-62.6	-69.5	0	0	114.2	L210 F211 F214 A247 G253 K254 L256 I261 V263	L210-M251 HydrophobicContact CD1-CE 3.79Å; L210-M251 HydrophobicContact CD2-CE 3.92Å; L210-M251 HydrophobicContact CG-CE 3.82Å; F211-M251 HydrophobicContact CE1-CB 4.12Å; F211-M251 HydrophobicContact CE1-CG 4.01Å; F211-M251 HydrophobicContact CZ-CB 4.08Å; F211-M251 HydrophobicContact CZ-CG 4.15Å; F214-M251 HydrophobicContact CE1-CG 4.45Å; F214-M251 HydrophobicContact CE2-CG 3.39Å; F214-M251 HydrophobicContact CE2-SD 3.98Å; F214-M251 HydrophobicContact CZ-CG 3.29Å; F214-M251 HydrophobicContact CZ-SD 3.69Å; A247-M251 WeakPolarHBondContact O-CB 3.12Å; A247-M251 WeakPolarHBondContact O-CG 3.32Å; A247-M251 PolarHBondContact O-N 2.85Å; M251-G253 PolarHBondContact O-N 2.85Å; M251-K254 HydrophobicContact CE-CD 4.39Å; M251-K254 WeakPolarHBondContact O-CB 3.47Å; M251-K254 PolarHBondContact O-N 3.27Å; M251-K254 HydrophobicContact SD-CD 3.77Å; M251-L256 HydrophobicContact CE-CD1 4.42Å; M251-I261 HydrophobicContact CB-CD1 4Å; M251-I261 HydrophobicContact CE-CD1 3.94Å; M251-I261 VanDerWaalsContact O-CD1 3.24Å; M251-I261 WeakPolarHBondContact O-CD1 3.45Å; M251-I261 WeakPolarHBondContact O-CG1 3.22Å; M251-V263 HydrophobicContact CB-CB 4.37Å; M251-V263 HydrophobicContact CB-CG1 4.5Å; M251-V263 HydrophobicContact CB-CG2 3.68Å
252	N	95.9	Very high	92.4	Very high	78 Å²	78	68.9 Å²	68.9	42%	0.417	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	125.2	-179.7	-171.8	40.9	0	0	0	111.3	V248 K254 V263	V248-N252 WeakPolarHBondContact O-CB 3.34Å; V248-N252 PolarHBondContact O-N 2.98Å; N252-K254 VanDerWaalsContact C-N 3.32Å; N252-V263 HydrophobicContact CB-CB 3.97Å; N252-V263 WeakPolarHBondContact CB-O 3.34Å; N252-V263 PolarHBondContact OD1-N 2.85Å; N252-V263 PolarHBondContact OD1-O 2.85Å
253	G	92.8	Very high	92.5	Very high	37 Å²	37	62.4 Å²	62.4	38%	0.381	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.3	-2.4	-178.3	0	0	0	0	0	115	M251 I261	M251-G253 PolarHBondContact O-N 2.85Å; G253-I261 WeakPolarHBondContact CA-O 3.5Å; G253-I261 PolarHBondContact N-O 3.4Å
254	K	92.6	Very high	92.4	Very high	79 Å²	79	62.2 Å²	62.2	34%	0.343	32%	0.321	S	S	.	.			trans	-66	148.2	173.8	-81	-170.4	173.5	155.5	0	111.2	E250 M251 N252 Q260 I261	E250-K254 VanDerWaalsContact O-CD 3.22Å; E250-K254 WeakPolarHBondContact O-CD 3.41Å; E250-K254 WeakPolarHBondContact O-CE 3.32Å; E250-K254 PolarHBondContact O-NZ 2.75Å; E250-K254 IonicContact OE1-NZ 2.84Å; E250-K254 PolarHBondContact OE1-NZ 2.83Å; M251-K254 HydrophobicContact CE-CD 4.39Å; M251-K254 WeakPolarHBondContact O-CB 3.47Å; M251-K254 PolarHBondContact O-N 3.27Å; M251-K254 HydrophobicContact SD-CD 3.77Å; N252-K254 VanDerWaalsContact C-N 3.32Å; K254-Q260 CarbonylContact O-C 3.54Å; K254-Q260 WeakPolarHBondContact O-CA 3.04Å; K254-I261 HydrophobicContact CB-CG1 4.26Å; K254-I261 VanDerWaalsContact O-CG1 3.23Å; K254-I261 WeakPolarHBondContact O-CG1 3.48Å; K254-I261 PolarHBondContact O-N 3.03Å
255	E	89.8	Confident	92.3	Very high	138 Å²	138	66.3 Å²	66.3	65%	0.645	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.9	124.2	177.9	-160.3	174.4	153.6	0	0	110.5	G258 K259	E255-G258 WeakPolarHBondContact OE1-CA 3.3Å; E255-K259 CarbonylContact C-O 3.54Å; E255-K259 WeakPolarHBondContact CA-O 3.48Å
256	L	84.8	Confident	92.2	Very high	46 Å²	46	64.5 Å²	64.5	24%	0.241	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	124.6	171.7	-78.8	156.7	0	0	0	107.5	L210 M251 G258 K259 I261	L210-L256 HydrophobicContact CD2-CD1 3.85Å; M251-L256 HydrophobicContact CE-CD1 4.42Å; L256-G258 VanDerWaalsContact C-N 3.31Å; L256-G258 PolarHBondContact O-N 3.35Å; L256-K259 PolarHBondContact N-O 3.29Å; L256-K259 PolarHBondContact O-N 3.35Å; L256-I261 HydrophobicContact CB-CG2 4.02Å; L256-I261 HydrophobicContact CD1-CB 4.43Å; L256-I261 HydrophobicContact CD1-CD1 3.63Å; L256-I261 HydrophobicContact CD1-CG1 3.98Å; L256-I261 HydrophobicContact CD1-CG2 3.64Å; L256-I261 HydrophobicContact CG-CG2 4.37Å
257	N	78.3	Confident	91.9	Very high	110 Å²	110	62.6 Å²	62.6	59%	0.588	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	41.8	-179.8	-57.2	-13.9	0	0	0	113.7	K259	N257-K259 PolarHBondContact O-N 2.95Å
258	G	82.7	Confident	91.4	Very high	60 Å²	60	70.5 Å²	70.5	62%	0.619	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	7.3	-179.6	0	0	0	0	0	114.8	E255 L256	E255-G258 WeakPolarHBondContact OE1-CA 3.3Å; L256-G258 VanDerWaalsContact C-N 3.31Å; L256-G258 PolarHBondContact O-N 3.35Å
259	K	86.2	Confident	90.9	Very high	107 Å²	107	76.7 Å²	76.7	47%	0.465	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	138.2	-179.4	-67.5	-179.9	-177.5	174.3	0	110.3	E255 L256 N257 I261	E255-K259 CarbonylContact C-O 3.54Å; E255-K259 WeakPolarHBondContact CA-O 3.48Å; L256-K259 PolarHBondContact N-O 3.29Å; L256-K259 PolarHBondContact O-N 3.35Å; N257-K259 PolarHBondContact O-N 2.95Å; K259-I261 PolarHBondContact O-N 3.46Å
260	Q	92.4	Very high	90.4	Very high	132 Å²	132	76.5 Å²	76.5	62%	0.617	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	119.9	174.1	-68.4	-178	12.8	0	0	110.4	N197 K254	N197-Q260 PolarHBondContact ND2-O 2.96Å; K254-Q260 CarbonylContact O-C 3.54Å; K254-Q260 WeakPolarHBondContact O-CA 3.04Å
261	I	94.7	Very high	89.9	Confident	2 Å²	2	76.2 Å²	76.2	1%	0.01	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-75.3	141.8	175	56.5	155.6	0	0	0	111	K196 F198 M251 G253 K254 L256 K259 V263	K196-I261 WeakPolarHBondContact O-CA 3.39Å; F198-I261 HydrophobicContact CB-CG2 3.75Å; M251-I261 HydrophobicContact CB-CD1 4Å; M251-I261 HydrophobicContact CE-CD1 3.94Å; M251-I261 VanDerWaalsContact O-CD1 3.24Å; M251-I261 WeakPolarHBondContact O-CD1 3.45Å; M251-I261 WeakPolarHBondContact O-CG1 3.22Å; G253-I261 WeakPolarHBondContact CA-O 3.5Å; G253-I261 PolarHBondContact N-O 3.4Å; K254-I261 HydrophobicContact CB-CG1 4.26Å; K254-I261 VanDerWaalsContact O-CG1 3.23Å; K254-I261 WeakPolarHBondContact O-CG1 3.48Å; K254-I261 PolarHBondContact O-N 3.03Å; L256-I261 HydrophobicContact CB-CG2 4.02Å; L256-I261 HydrophobicContact CD1-CB 4.43Å; L256-I261 HydrophobicContact CD1-CD1 3.63Å; L256-I261 HydrophobicContact CD1-CG1 3.98Å; L256-I261 HydrophobicContact CD1-CG2 3.64Å; L256-I261 HydrophobicContact CG-CG2 4.37Å; K259-I261 PolarHBondContact O-N 3.46Å; I261-V263 HydrophobicContact CD1-CG2 3.66Å; I261-V263 HydrophobicContact CG1-CG2 4.31Å
262	Y	95.7	Very high	89.4	Confident	121 Å²	121	81.8 Å²	81.8	48%	0.475	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	127.5	169.1	175.2	-92.6	0	0	0	108.8	Y194 I195 K196	Y194-Y262 AromaticContact CD1-CD1 3.86Å; Y194-Y262 HydrophobicContact CD1-CD1 3.86Å; Y194-Y262 AromaticContact CD1-CE1 3.8Å; Y194-Y262 HydrophobicContact CD1-CE1 3.8Å; Y194-Y262 AromaticContact CE1-CD1 3.94Å; Y194-Y262 HydrophobicContact CE1-CD1 3.94Å; Y194-Y262 HydrophobicContact CE1-CE1 4.13Å; I195-Y262 CarbonylContact C-O 3.57Å; I195-Y262 VanDerWaalsContact CA-O 3.3Å; I195-Y262 WeakPolarHBondContact CA-O 3.12Å; K196-Y262 PolarHBondContact N-O 3.45Å; K196-Y262 PolarHBondContact O-N 3.34Å
263	V	96.3	Very high	88.9	Confident	1 Å²	1	83 Å²	83	1%	0.006	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	125.4	176.1	-169.7	0	0	0	0	107.9	V193 Y194 I195 F211 V248 M251 N252 I261	V193-V263 HydrophobicContact CG1-CG1 3.35Å; Y194-V263 WeakPolarHBondContact O-CA 3.4Å; I195-V263 HydrophobicContact CG1-CG1 4.33Å; I195-V263 HydrophobicContact CG2-CG2 4.18Å; F211-V263 HydrophobicContact CE1-CG1 3.9Å; F211-V263 HydrophobicContact CE1-CG2 4.44Å; F211-V263 HydrophobicContact CZ-CG1 4.23Å; F211-V263 HydrophobicContact CZ-CG2 4Å; V248-V263 HydrophobicContact CB-CG1 4.5Å; V248-V263 HydrophobicContact CG2-CG1 4.05Å; M251-V263 HydrophobicContact CB-CB 4.37Å; M251-V263 HydrophobicContact CB-CG1 4.5Å; M251-V263 HydrophobicContact CB-CG2 3.68Å; N252-V263 HydrophobicContact CB-CB 3.97Å; N252-V263 WeakPolarHBondContact CB-O 3.34Å; N252-V263 PolarHBondContact OD1-N 2.85Å; N252-V263 PolarHBondContact OD1-O 2.85Å; I261-V263 HydrophobicContact CD1-CG2 3.66Å; I261-V263 HydrophobicContact CG1-CG2 4.31Å
264	G	94.3	Very high	88.5	Confident	5 Å²	5	85.7 Å²	85.7	5%	0.052	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	172.2	180	0	0	0	0	0	111.9	V193 Y194 A266	V193-G264 CarbonylContact C-O 3.55Å; V193-G264 WeakPolarHBondContact CA-O 3.34Å; Y194-G264 PolarHBondContact N-O 2.99Å; Y194-G264 PolarHBondContact O-N 2.99Å; G264-A266 PolarHBondContact O-N 2.98Å
265	R	93.7	Very high	88.1	Confident	86 Å²	86	84.1 Å²	84.1	33%	0.325	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	133	173.9	171	-179.5	155.7	-172.3	-10.3	111	A187 F190 Q267 E271	A187-R265 PolarHBondContact O-NH1 3.31Å; F190-R265 HydrophobicContact CB-CB 4.36Å; F190-R265 HydrophobicContact CB-CG 3.66Å; F190-R265 HydrophobicContact CD1-CB 3.85Å; F190-R265 HydrophobicContact CD1-CG 3.95Å; F190-R265 HydrophobicContact CD2-CB 3.89Å; F190-R265 HydrophobicContact CD2-CG 4.08Å; F190-R265 HydrophobicContact CE1-CB 4.13Å; F190-R265 HydrophobicContact CE2-CB 4.17Å; F190-R265 HydrophobicContact CG-CB 3.75Å; F190-R265 HydrophobicContact CG-CG 3.62Å; F190-R265 HydrophobicContact CZ-CB 4.29Å; R265-Q267 PolarHBondContact O-N 3.15Å; R265-E271 IonicContact CZ-OE1 3.73Å; R265-E271 IonicContact NH2-OE1 2.98Å; R265-E271 PolarHBondContact NH2-OE1 3.34Å; R265-E271 VanDerWaalsContact NH2-OE1 3.16Å; R265-E271 IonicContact NH2-OE2 3.81Å; R265-E271 PolarHBondContact NH2-OE2 2.8Å
266	A	92.5	Very high	87.9	Confident	23 Å²	23	82.4 Å²	82.4	19%	0.19	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-66	120.1	170.1	0	0	0	0	0	110.2	N192 F235 G264	N192-A266 HydrophobicContact CB-CB 3.77Å; N192-A266 VanDerWaalsContact O-CB 3.32Å; N192-A266 WeakPolarHBondContact O-CB 3.31Å; N192-A266 PolarHBondContact O-N 3.12Å; F235-A266 HydrophobicContact CD1-CB 4.02Å; F235-A266 HydrophobicContact CE1-CB 4.2Å; G264-A266 PolarHBondContact O-N 2.98Å
267	Q	88.3	Confident	88.1	Confident	75 Å²	75	86.6 Å²	86.6	35%	0.35	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-93.9	142.9	177.8	-65.2	-179.4	-19.7	0	0	110.7	R265 R272 E275	R265-Q267 PolarHBondContact O-N 3.15Å; Q267-R272 HydrophobicContact CB-CB 4.29Å; Q267-E275 PolarHBondContact NE2-OE2 3.2Å
268	K	86.6	Confident	88.7	Confident	166 Å²	166	88.6 Å²	88.6	72%	0.722	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-67	150.7	170	-69.5	-175.5	179.2	-178.7	0	109.9	V270 E271 R272	K268-V270 VanDerWaalsContact C-N 3.25Å; K268-V270 PolarHBondContact O-N 3.01Å; K268-V270 VanDerWaalsContact O-N 3.17Å; K268-E271 HydrophobicContact CB-CB 4.43Å; K268-E271 WeakPolarHBondContact O-CB 3.45Å; K268-E271 PolarHBondContact O-N 3.03Å; K268-E271 VanDerWaalsContact O-N 3.1Å; K268-R272 PolarHBondContact O-N 2.9Å
269	K	86	Confident	88.9	Confident	148 Å²	148	90.3 Å²	90.3	64%	0.643	41%	0.414	S	S	*	.	H	α-helix	trans	-51.5	-42.8	-179.2	-173.5	176.7	179.6	-179.8	0	112.8	Q273	K269-Q273 WeakPolarHBondContact O-CB 3.43Å; K269-Q273 VanDerWaalsContact O-CG 3.29Å; K269-Q273 WeakPolarHBondContact O-CG 3.45Å; K269-Q273 PolarHBondContact O-N 3.06Å
270	V	83.2	Confident	89	Confident	106 Å²	106	91.6 Å²	91.6	64%	0.642	42%	0.42	S	S	*	.	H	α-helix	trans	-65.5	-48.9	178.7	-179.6	0	0	0	0	111.5	K268 R272 Q273 T274	K268-V270 VanDerWaalsContact C-N 3.25Å; K268-V270 PolarHBondContact O-N 3.01Å; K268-V270 VanDerWaalsContact O-N 3.17Å; V270-R272 VanDerWaalsContact C-N 3.33Å; V270-R272 PolarHBondContact O-N 2.79Å; V270-Q273 PolarHBondContact O-N 3.17Å; V270-T274 PolarHBondContact O-N 3.32Å; V270-T274 PolarHBondContact O-OG1 3.48Å; V270-T274 VanDerWaalsContact O-OG1 3.12Å
271	E	84.9	Confident	88.8	Confident	74 Å²	74	90.2 Å²	90.2	35%	0.346	41%	0.413	S	S	.	.	H	α-helix	trans	-56.3	-48	177.4	-178.9	-179.6	-173	0	0	111	R265 K268 Q273 T274 E275	R265-E271 IonicContact CZ-OE1 3.73Å; R265-E271 IonicContact NH2-OE1 2.98Å; R265-E271 PolarHBondContact NH2-OE1 3.34Å; R265-E271 VanDerWaalsContact NH2-OE1 3.16Å; R265-E271 IonicContact NH2-OE2 3.81Å; R265-E271 PolarHBondContact NH2-OE2 2.8Å; K268-E271 HydrophobicContact CB-CB 4.43Å; K268-E271 WeakPolarHBondContact O-CB 3.45Å; K268-E271 PolarHBondContact O-N 3.03Å; K268-E271 VanDerWaalsContact O-N 3.1Å; E271-Q273 PolarHBondContact O-N 2.83Å; E271-T274 PolarHBondContact O-N 2.89Å; E271-E275 PolarHBondContact O-N 2.9Å
272	R	85.8	Confident	88.5	Confident	124 Å²	124	95.5 Å²	95.5	47%	0.468	44%	0.438	S	S	.	.	H	α-helix	trans	-61	-43.1	177.7	-170.4	-176.2	72.7	179.4	3.6	112.3	Q267 K268 V270 E275 L276	Q267-R272 HydrophobicContact CB-CB 4.29Å; K268-R272 PolarHBondContact O-N 2.9Å; V270-R272 VanDerWaalsContact C-N 3.33Å; V270-R272 PolarHBondContact O-N 2.79Å; R272-E275 PolarHBondContact O-N 2.92Å; R272-L276 HydrophobicContact CG-CD1 3.94Å; R272-L276 WeakPolarHBondContact O-CB 3.25Å; R272-L276 WeakPolarHBondContact O-CD1 3.48Å; R272-L276 VanDerWaalsContact O-CG 3.27Å; R272-L276 WeakPolarHBondContact O-CG 3.23Å; R272-L276 PolarHBondContact O-N 3.26Å
273	Q	84.6	Confident	88.2	Confident	104 Å²	104	95.5 Å²	95.5	49%	0.486	44%	0.443	S	S	.	.	H	α-helix	trans	-64.8	-43.1	178.7	-79	176.9	-5.3	0	0	111.8	K269 V270 E271 L276 K277	K269-Q273 WeakPolarHBondContact O-CB 3.43Å; K269-Q273 VanDerWaalsContact O-CG 3.29Å; K269-Q273 WeakPolarHBondContact O-CG 3.45Å; K269-Q273 PolarHBondContact O-N 3.06Å; V270-Q273 PolarHBondContact O-N 3.17Å; E271-Q273 PolarHBondContact O-N 2.83Å; Q273-L276 PolarHBondContact O-N 3.05Å; Q273-K277 WeakPolarHBondContact O-CB 3.32Å; Q273-K277 PolarHBondContact O-N 3.19Å
274	T	84.7	Confident	87.8	Confident	92 Å²	92	99 Å²	99	56%	0.564	46%	0.458	S	S	*	.	H	α-helix	trans	-63.2	-43	176.3	-55.4	0	0	0	0	111.5	V270 E271 K277 R278	V270-T274 PolarHBondContact O-N 3.32Å; V270-T274 PolarHBondContact O-OG1 3.48Å; V270-T274 VanDerWaalsContact O-OG1 3.12Å; E271-T274 PolarHBondContact O-N 2.89Å; T274-K277 PolarHBondContact O-N 2.89Å; T274-R278 PolarHBondContact O-N 3.43Å
275	E	83.8	Confident	87.5	Confident	47 Å²	47	103.8 Å²	103.8	22%	0.22	48%	0.479	C	S	.	.	H	α-helix	trans	-65.4	-43.4	177.4	-164.3	-170.2	153.7	0	0	112	Q267 E271 R272 R278 K279	Q267-E275 PolarHBondContact NE2-OE2 3.2Å; E271-E275 PolarHBondContact O-N 2.9Å; R272-E275 PolarHBondContact O-N 2.92Å; E275-R278 PolarHBondContact O-N 3.03Å; E275-K279 PolarHBondContact O-N 3.38Å; E275-K279 WeakPolarHBondContact OE1-CE 3.46Å; E275-K279 IonicContact OE1-NZ 3.13Å; E275-K279 PolarHBondContact OE1-NZ 3.21Å
276	L	86.4	Confident	87.2	Confident	101 Å²	101	103.4 Å²	103.4	53%	0.529	48%	0.484	S	S	.	.	H	α-helix	trans	-61.4	-43.8	175.5	-78.2	165.9	0	0	0	111.6	R272 Q273 R278 K279 F280	R272-L276 HydrophobicContact CG-CD1 3.94Å; R272-L276 WeakPolarHBondContact O-CB 3.25Å; R272-L276 WeakPolarHBondContact O-CD1 3.48Å; R272-L276 VanDerWaalsContact O-CG 3.27Å; R272-L276 WeakPolarHBondContact O-CG 3.23Å; R272-L276 PolarHBondContact O-N 3.26Å; Q273-L276 PolarHBondContact O-N 3.05Å; L276-R278 VanDerWaalsContact C-N 3.35Å; L276-R278 PolarHBondContact O-N 3.31Å; L276-K279 PolarHBondContact O-N 3.43Å; L276-F280 WeakPolarHBondContact O-CB 3.07Å; L276-F280 PolarHBondContact O-N 3.27Å
277	K	88.9	Confident	86.8	Confident	135 Å²	135	108.1 Å²	108.1	59%	0.587	50%	0.497	S	S	*	.	H	α-helix	trans	-58.4	-47.8	175.3	-176.3	176.8	176.5	-179.7	0	110.7	Q273 T274 K279 F280 E281	Q273-K277 WeakPolarHBondContact O-CB 3.32Å; Q273-K277 PolarHBondContact O-N 3.19Å; T274-K277 PolarHBondContact O-N 2.89Å; K277-K279 PolarHBondContact O-N 3.28Å; K277-F280 PolarHBondContact O-N 2.91Å; K277-E281 WeakPolarHBondContact CE-OE1 3.36Å; K277-E281 WeakPolarHBondContact O-CB 3.34Å; K277-E281 WeakPolarHBondContact O-CG 3.39Å; K277-E281 PolarHBondContact O-N 3.43Å
278	R	90	Very high	86.7	Confident	151 Å²	151	106.2 Å²	106.2	57%	0.57	49%	0.489	S	S	*	.	H	α-helix	trans	-60.5	-44.7	176.7	-172.5	-176.2	68.6	-163.5	-1.1	112.4	T274 E275 L276 E281 Q282	T274-R278 PolarHBondContact O-N 3.43Å; E275-R278 PolarHBondContact O-N 3.03Å; L276-R278 VanDerWaalsContact C-N 3.35Å; L276-R278 PolarHBondContact O-N 3.31Å; R278-E281 PolarHBondContact O-N 2.96Å; R278-Q282 WeakPolarHBondContact O-CB 3.37Å; R278-Q282 PolarHBondContact O-N 3.43Å
279	K	88.2	Confident	86.7	Confident	97 Å²	97	102.2 Å²	102.2	42%	0.422	48%	0.478	S	S	.	.	H	α-helix	trans	-64.5	-38.9	177.2	-78	-178.8	-179.1	163.8	0	112	E275 L276 K277 Q282 M283	E275-K279 PolarHBondContact O-N 3.38Å; E275-K279 WeakPolarHBondContact OE1-CE 3.46Å; E275-K279 IonicContact OE1-NZ 3.13Å; E275-K279 PolarHBondContact OE1-NZ 3.21Å; L276-K279 PolarHBondContact O-N 3.43Å; K277-K279 PolarHBondContact O-N 3.28Å; K279-Q282 PolarHBondContact O-N 2.8Å; K279-M283 HydrophobicContact CB-CE 4.35Å; K279-M283 WeakPolarHBondContact O-CB 3.41Å; K279-M283 PolarHBondContact O-N 3.25Å
280	F	87.3	Confident	86.7	Confident	134 Å²	134	103.4 Å²	103.4	59%	0.588	48%	0.479	S	S	*	.	H	α-helix	trans	-68.3	-41.6	176.3	-173.3	-96.5	0	0	0	111.9	L276 K277 Q282 M283 K284	L276-F280 WeakPolarHBondContact O-CB 3.07Å; L276-F280 PolarHBondContact O-N 3.27Å; K277-F280 PolarHBondContact O-N 2.91Å; F280-Q282 VanDerWaalsContact C-N 3.35Å; F280-M283 PolarHBondContact O-N 3.28Å; F280-K284 VanDerWaalsContact O-CB 3.27Å; F280-K284 WeakPolarHBondContact O-CB 3.47Å; F280-K284 PolarHBondContact O-N 3.47Å
281	E	89.5	Confident	86.8	Confident	102 Å²	102	102.8 Å²	102.8	48%	0.477	47%	0.466	S	S	.	.	H	α-helix	trans	-61.7	-42.4	173	-75.7	172	179.9	0	0	111.4	K277 R278 K284 Q285	K277-E281 WeakPolarHBondContact CE-OE1 3.36Å; K277-E281 WeakPolarHBondContact O-CB 3.34Å; K277-E281 WeakPolarHBondContact O-CG 3.39Å; K277-E281 PolarHBondContact O-N 3.43Å; R278-E281 PolarHBondContact O-N 2.96Å; E281-K284 WeakPolarHBondContact O-CB 3.45Å; E281-K284 PolarHBondContact O-N 2.8Å; E281-Q285 WeakPolarHBondContact O-CB 3.37Å; E281-Q285 PolarHBondContact O-N 2.95Å
282	Q	88.7	Confident	86.8	Confident	114 Å²	114	105.9 Å²	105.9	53%	0.533	48%	0.48	S	S	.	.	H	α-helix	trans	-64.5	-48.9	175.3	-172.5	174.5	15.8	0	0	111.9	R278 K279 F280 K284 Q285 D286	R278-Q282 WeakPolarHBondContact O-CB 3.37Å; R278-Q282 PolarHBondContact O-N 3.43Å; K279-Q282 PolarHBondContact O-N 2.8Å; F280-Q282 VanDerWaalsContact C-N 3.35Å; Q282-K284 VanDerWaalsContact C-N 3.26Å; Q282-K284 PolarHBondContact O-N 3.43Å; Q282-Q285 CarbonylContact O-C 3.56Å; Q282-Q285 WeakPolarHBondContact O-CA 3.38Å; Q282-Q285 WeakPolarHBondContact O-CB 3.48Å; Q282-Q285 PolarHBondContact O-N 2.97Å; Q282-D286 WeakPolarHBondContact O-CB 3.47Å; Q282-D286 VanDerWaalsContact O-CG 3.28Å; Q282-D286 PolarHBondContact O-N 2.68Å
283	M	88.7	Confident	87	Confident	120 Å²	120	101.3 Å²	101.3	59%	0.591	47%	0.471	S	S	*	.	H	α-helix	trans	-60.8	-36	174.5	-82.7	-174	-85.9	0	0	112.3	K279 F280 R287	K279-M283 HydrophobicContact CB-CE 4.35Å; K279-M283 WeakPolarHBondContact O-CB 3.41Å; K279-M283 PolarHBondContact O-N 3.25Å; F280-M283 PolarHBondContact O-N 3.28Å; M283-R287 VanDerWaalsContact O-CB 3.32Å; M283-R287 WeakPolarHBondContact O-CB 3.16Å; M283-R287 PolarHBondContact O-N 2.87Å
284	K	88.1	Confident	87.5	Confident	74 Å²	74	96.9 Å²	96.9	32%	0.322	45%	0.451	S	S	.	.	H	α-helix	trans	-62	-49.1	172.4	-175.3	179.5	178.3	177.9	0	109.5	F280 E281 Q282 R287 I288	F280-K284 VanDerWaalsContact O-CB 3.27Å; F280-K284 WeakPolarHBondContact O-CB 3.47Å; F280-K284 PolarHBondContact O-N 3.47Å; E281-K284 WeakPolarHBondContact O-CB 3.45Å; E281-K284 PolarHBondContact O-N 2.8Å; Q282-K284 VanDerWaalsContact C-N 3.26Å; Q282-K284 PolarHBondContact O-N 3.43Å; K284-R287 WeakPolarHBondContact O-CB 3.45Å; K284-R287 PolarHBondContact O-N 3.49Å; K284-I288 WeakPolarHBondContact O-CG1 3.44Å; K284-I288 PolarHBondContact O-N 3Å
285	Q	87.6	Confident	88	Confident	106 Å²	106	94 Å²	94	50%	0.495	43%	0.433	S	S	.	.	H	α-helix	trans	-61.1	-46.1	179.6	-169.5	59.3	27.3	0	0	112.7	E281 Q282 R287 I288 T289	E281-Q285 WeakPolarHBondContact O-CB 3.37Å; E281-Q285 PolarHBondContact O-N 2.95Å; Q282-Q285 CarbonylContact O-C 3.56Å; Q282-Q285 WeakPolarHBondContact O-CA 3.38Å; Q282-Q285 WeakPolarHBondContact O-CB 3.48Å; Q282-Q285 PolarHBondContact O-N 2.97Å; Q285-R287 VanDerWaalsContact C-N 3.28Å; Q285-R287 PolarHBondContact O-N 2.81Å; Q285-I288 WeakPolarHBondContact O-CA 3.26Å; Q285-I288 WeakPolarHBondContact O-CB 3.49Å; Q285-I288 PolarHBondContact O-N 3.16Å; Q285-T289 PolarHBondContact O-N 3.45Å; Q285-T289 PolarHBondContact O-OG1 3.38Å
286	D	88	Confident	88.6	Confident	78 Å²	78	91.8 Å²	91.8	42%	0.417	42%	0.422	S	S	.	.	H	α-helix	trans	-61.7	-39.5	176.9	-68.2	-16.9	0	0	0	110.6	Q282 I288 T289 R290	Q282-D286 WeakPolarHBondContact O-CB 3.47Å; Q282-D286 VanDerWaalsContact O-CG 3.28Å; Q282-D286 PolarHBondContact O-N 2.68Å; D286-I288 VanDerWaalsContact C-N 3.33Å; D286-I288 PolarHBondContact O-N 2.92Å; D286-T289 PolarHBondContact O-N 3.14Å; D286-R290 VanDerWaalsContact O-CB 3.23Å; D286-R290 WeakPolarHBondContact O-CB 3.21Å; D286-R290 PolarHBondContact O-N 3.39Å
287	R	84.4	Confident	89.1	Confident	123 Å²	123	88.4 Å²	88.4	46%	0.464	40%	0.402	S	S	.	.	H	α-helix	trans	-67.2	-29.7	173.4	-165.7	178.2	73.9	-122.4	6.3	112.8	M283 K284 Q285 Y291 R370	M283-R287 VanDerWaalsContact O-CB 3.32Å; M283-R287 WeakPolarHBondContact O-CB 3.16Å; M283-R287 PolarHBondContact O-N 2.87Å; K284-R287 WeakPolarHBondContact O-CB 3.45Å; K284-R287 PolarHBondContact O-N 3.49Å; Q285-R287 VanDerWaalsContact C-N 3.28Å; Q285-R287 PolarHBondContact O-N 2.81Å; R287-Y291 HydrophobicContact CG-CD2 4.01Å; R287-Y291 HydrophobicContact CG-CE2 3.83Å; R287-Y291 VanDerWaalsContact O-CD2 3.23Å; R287-Y291 WeakPolarHBondContact O-CD2 3.4Å; R287-R370 PolarHBondContact O-NH2 3.25Å
288	I	84.8	Confident	89.5	Confident	35 Å²	35	82 Å²	82	18%	0.179	37%	0.374	C	S	.	.	H	α-helix	trans	-66.2	-55.6	172	-39.4	-160.7	0	0	0	109.9	K284 Q285 D286 R290 Y291 Q292 R370	K284-I288 WeakPolarHBondContact O-CG1 3.44Å; K284-I288 PolarHBondContact O-N 3Å; Q285-I288 WeakPolarHBondContact O-CA 3.26Å; Q285-I288 WeakPolarHBondContact O-CB 3.49Å; Q285-I288 PolarHBondContact O-N 3.16Å; D286-I288 VanDerWaalsContact C-N 3.33Å; D286-I288 PolarHBondContact O-N 2.92Å; I288-R290 VanDerWaalsContact C-N 3.3Å; I288-R290 PolarHBondContact O-N 2.96Å; I288-Y291 PolarHBondContact O-N 3.44Å; I288-Q292 PolarHBondContact O-N 2.82Å; I288-Q292 VanDerWaalsContact O-N 3.15Å; I288-R370 VanDerWaalsContact CG1-CZ 3.41Å; I288-R370 VanDerWaalsContact CG1-NH2 3.34Å
289	T	86.5	Confident	89.8	Confident	82 Å²	82	79.9 Å²	79.9	50%	0.503	37%	0.37	S	S	.	.	H	α-helix	trans	-62.7	-40.1	-173.6	-47.1	0	0	0	0	110.9	Q285 D286 Y291 Q292	Q285-T289 PolarHBondContact O-N 3.45Å; Q285-T289 PolarHBondContact O-OG1 3.38Å; D286-T289 PolarHBondContact O-N 3.14Å; T289-Y291 VanDerWaalsContact C-N 3.3Å; T289-Y291 PolarHBondContact O-N 3.5Å; T289-Q292 PolarHBondContact O-N 3.47Å
290	R	85.6	Confident	90.2	Very high	173 Å²	173	78.5 Å²	78.5	65%	0.653	37%	0.367	S	S	*	.	H	α-helix	trans	-60.8	-33.8	-179.7	-173.4	179.7	-62.7	165.8	1.6	114.1	D286 I288 V294	D286-R290 VanDerWaalsContact O-CB 3.23Å; D286-R290 WeakPolarHBondContact O-CB 3.21Å; D286-R290 PolarHBondContact O-N 3.39Å; I288-R290 VanDerWaalsContact C-N 3.3Å; I288-R290 PolarHBondContact O-N 2.96Å; R290-V294 VanDerWaalsContact O-CG2 3.23Å; R290-V294 WeakPolarHBondContact O-CG2 3.29Å
291	Y	85.9	Confident	90.6	Very high	93 Å²	93	72.2 Å²	72.2	37%	0.365	34%	0.339	S	S	.	.	H	α-helix	trans	-104.2	-4.4	-174.9	-65.6	-56.8	0	0	0	113.7	R287 I288 T289 G293 V294 N295 C339	R287-Y291 HydrophobicContact CG-CD2 4.01Å; R287-Y291 HydrophobicContact CG-CE2 3.83Å; R287-Y291 VanDerWaalsContact O-CD2 3.23Å; R287-Y291 WeakPolarHBondContact O-CD2 3.4Å; I288-Y291 PolarHBondContact O-N 3.44Å; T289-Y291 VanDerWaalsContact C-N 3.3Å; T289-Y291 PolarHBondContact O-N 3.5Å; Y291-G293 PolarHBondContact O-N 2.86Å; Y291-V294 PolarHBondContact O-N 2.92Å; Y291-N295 HydrophobicContact CD1-CB 4.43Å; Y291-N295 PolarHBondContact O-N 3.06Å; Y291-C339 VanDerWaalsContact CD1-SG 3.55Å
292	Q	85.8	Confident	90.8	Very high	139 Å²	139	68.8 Å²	68.8	65%	0.65	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	123.2	-178.7	-170.6	170.6	18.3	0	0	110.2	I288 T289 V294	I288-Q292 PolarHBondContact O-N 2.82Å; I288-Q292 VanDerWaalsContact O-N 3.15Å; T289-Q292 PolarHBondContact O-N 3.47Å; Q292-V294 PolarHBondContact O-N 3.06Å; Q292-V294 VanDerWaalsContact O-N 3.15Å
293	G	89.3	Confident	90.9	Very high	27 Å²	27	68 Å²	68	28%	0.278	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.1	-11	178.7	0	0	0	0	0	115.8	Y291 A346	Y291-G293 PolarHBondContact O-N 2.86Å; G293-A346 WeakPolarHBondContact O-CB 3.44Å
294	V	94.7	Very high	91	Very high	12 Å²	12	64.8 Å²	64.8	7%	0.073	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	-21.3	-177.7	-61.2	0	0	0	0	114.2	R290 Y291 Q292 C339 F340 P343	R290-V294 VanDerWaalsContact O-CG2 3.23Å; R290-V294 WeakPolarHBondContact O-CG2 3.29Å; Y291-V294 PolarHBondContact O-N 2.92Å; Q292-V294 PolarHBondContact O-N 3.06Å; Q292-V294 VanDerWaalsContact O-N 3.15Å; V294-C339 VanDerWaalsContact CG2-SG 3.58Å; V294-C339 WeakPolarHBondContact O-CA 3.41Å; V294-F340 PolarHBondContact O-N 2.89Å; V294-P343 HydrophobicContact CG1-CB 4.47Å; V294-P343 HydrophobicContact CG1-CG 3.82Å
295	N	96.1	Very high	91.3	Very high	32 Å²	32	61.5 Å²	61.5	17%	0.171	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	127	-178	-167.3	27.7	0	0	0	110.6	Y291 A368	Y291-N295 HydrophobicContact CD1-CB 4.43Å; Y291-N295 PolarHBondContact O-N 3.06Å; N295-A368 HydrophobicContact CB-CB 4.09Å; N295-A368 WeakPolarHBondContact O-CB 3.33Å; N295-A368 PolarHBondContact O-N 3.28Å
296	L	96.6	Very high	91.6	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	140.5	-179.8	-55.4	-169.8	0	0	0	110.5	F314 F337 V338 F340 A346 A349 V350 V365 A366 L367	L296-F314 HydrophobicContact CD1-CD1 4.44Å; L296-F314 HydrophobicContact CD1-CE1 4.19Å; L296-F337 WeakPolarHBondContact O-CA 3.26Å; L296-F337 WeakPolarHBondContact O-CD1 3.47Å; L296-V338 HydrophobicContact CB-CB 4.46Å; L296-V338 WeakPolarHBondContact CB-O 3.43Å; L296-V338 PolarHBondContact N-O 3.17Å; L296-V338 PolarHBondContact O-N 3.42Å; L296-F340 HydrophobicContact CD1-CD2 4.03Å; L296-F340 HydrophobicContact CD1-CE2 3.64Å; L296-F340 HydrophobicContact CG-CD2 4.29Å; L296-F340 HydrophobicContact CG-CE2 4.33Å; L296-A346 HydrophobicContact CD2-CB 3.93Å; L296-A346 HydrophobicContact CG-CB 4.43Å; L296-A349 HydrophobicContact CD1-CB 3.71Å; L296-V350 HydrophobicContact CD1-CG2 4.06Å; L296-V350 HydrophobicContact CD2-CG2 3.44Å; L296-V350 VanDerWaalsContact CD2-CG2 3.44Å; L296-V350 HydrophobicContact CG-CG2 4.36Å; L296-V365 HydrophobicContact CB-CG1 4.38Å; L296-V365 HydrophobicContact CD1-CG1 3.93Å; L296-A366 CarbonylContact C-O 3.4Å; L296-A366 WeakPolarHBondContact CA-O 3.4Å; L296-L367 HydrophobicContact CD2-CD2 3.82Å
297	Y	96.6	Very high	92	Very high	29 Å²	29	59.6 Å²	59.6	11%	0.114	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	120.7	165.7	176.4	-105.8	0	0	0	108.6	K299 F335 F337 Y364 V365 A366	Y297-K299 HydrophobicContact CD1-CB 4.32Å; Y297-K299 HydrophobicContact CE1-CB 3.54Å; Y297-K299 HydrophobicContact CE1-CD 4.04Å; Y297-K299 HydrophobicContact CE1-CG 4.21Å; Y297-K299 WeakPolarHBondContact OH-CD 3.42Å; Y297-F335 HydrophobicContact CD2-CD2 4.17Å; Y297-F335 HydrophobicContact CE2-CB 3.93Å; Y297-F335 AromaticContact CE2-CD2 3.37Å; Y297-F335 HydrophobicContact CE2-CD2 3.37Å; Y297-F335 HydrophobicContact CE2-CE2 4.03Å; Y297-F335 AromaticContact CE2-CG 3.84Å; Y297-F335 HydrophobicContact CE2-CG 3.84Å; Y297-F337 HydrophobicContact CD2-CD1 4.48Å; Y297-F337 AromaticContact CD2-CE1 3.78Å; Y297-F337 HydrophobicContact CD2-CE1 3.78Å; Y297-F337 AromaticContact CD2-CZ 3.9Å; Y297-F337 HydrophobicContact CD2-CZ 3.9Å; Y297-F337 HydrophobicContact CE2-CZ 4.45Å; Y297-Y364 HydrophobicContact CD1-CD1 4.1Å; Y297-Y364 HydrophobicContact CD1-CE1 4.01Å; Y297-Y364 HydrophobicContact CE1-CD1 4.17Å; Y297-Y364 HydrophobicContact CE1-CE1 4.23Å; Y297-V365 WeakPolarHBondContact O-CA 3.42Å; Y297-A366 PolarHBondContact N-O 2.97Å; Y297-A366 PolarHBondContact O-N 3.19Å
298	V	97.3	Very high	92.5	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	117.5	179.1	-172.4	0	0	0	0	108.1	L301 L310 F314 F335 G336 V338 L363 Y364 V365	V298-L301 HydrophobicContact CG1-CD2 3.64Å; V298-L301 HydrophobicContact CG1-CG 4.36Å; V298-L310 HydrophobicContact CB-CD1 4.42Å; V298-L310 HydrophobicContact CG1-CD1 4.17Å; V298-L310 HydrophobicContact CG2-CD1 4.46Å; V298-F314 HydrophobicContact CB-CZ 4.4Å; V298-F314 HydrophobicContact CG1-CE2 4.09Å; V298-F314 HydrophobicContact CG1-CZ 3.96Å; V298-F314 HydrophobicContact CG2-CE1 4.1Å; V298-F314 HydrophobicContact CG2-CE2 3.98Å; V298-F314 HydrophobicContact CG2-CZ 3.5Å; V298-F335 CarbonylContact O-C 3.43Å; V298-F335 WeakPolarHBondContact O-CA 3.43Å; V298-F335 VanDerWaalsContact O-CB 3.29Å; V298-F335 WeakPolarHBondContact O-CB 3.5Å; V298-G336 PolarHBondContact N-O 3.22Å; V298-G336 PolarHBondContact O-N 3.21Å; V298-V338 HydrophobicContact CG2-CG2 4.03Å; V298-L363 HydrophobicContact CG1-CD1 4.33Å; V298-L363 HydrophobicContact CG1-CD2 4.36Å; V298-Y364 CarbonylContact C-O 3.52Å; V298-Y364 WeakPolarHBondContact CA-O 3.35Å; V298-V365 HydrophobicContact CG1-CG2 4.27Å; V298-V365 HydrophobicContact CG2-CG1 4.44Å
299	K	96.7	Very high	93	Very high	108 Å²	108	64.4 Å²	64.4	47%	0.47	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	163.8	-179.7	-173.9	-174.2	-179.5	-169	0	110.4	Y297 L301 G334 F335 Y364	Y297-K299 HydrophobicContact CD1-CB 4.32Å; Y297-K299 HydrophobicContact CE1-CB 3.54Å; Y297-K299 HydrophobicContact CE1-CD 4.04Å; Y297-K299 HydrophobicContact CE1-CG 4.21Å; Y297-K299 WeakPolarHBondContact OH-CD 3.42Å; K299-L301 VanDerWaalsContact C-N 3.32Å; K299-G334 CarbonylContact C-O 3.43Å; K299-F335 HydrophobicContact CB-CB 4.2Å; K299-F335 HydrophobicContact CG-CB 4.29Å; K299-Y364 HydrophobicContact CB-CD1 4.09Å; K299-Y364 PolarHBondContact N-O 3.29Å; K299-Y364 PolarHBondContact O-N 3.5Å
300	N	95.5	Very high	93.5	Very high	68 Å²	68	60.6 Å²	60.6	36%	0.364	30%	0.299	S	S	.	.	S	Bend	trans	69.1	35.3	-178.3	-155.8	35.3	0	0	0	111.6	G334 K361 P362	N300-G334 PolarHBondContact N-O 3.32Å; N300-K361 WeakPolarHBondContact O-CB 3.3Å; N300-P362 WeakPolarHBondContact CB-O 3.34Å; N300-P362 PolarHBondContact ND2-O 3.4Å
301	L	95.7	Very high	94	Very high	1 Å²	1	57 Å²	57	1%	0.005	29%	0.286	C	S	.	.			trans	-64.4	139.9	171	-62	176.6	0	0	0	109.2	V298 K299 I305 L310 V325 G334 K361 L363	V298-L301 HydrophobicContact CG1-CD2 3.64Å; V298-L301 HydrophobicContact CG1-CG 4.36Å; K299-L301 VanDerWaalsContact C-N 3.32Å; L301-I305 HydrophobicContact CD2-CD1 4.23Å; L301-I305 HydrophobicContact CD2-CG2 4.28Å; L301-L310 HydrophobicContact CD2-CD1 3.97Å; L301-V325 HydrophobicContact CD1-CG1 4.13Å; L301-V325 HydrophobicContact CD1-CG2 4.02Å; L301-G334 PolarHBondContact N-O 3.36Å; L301-K361 PolarHBondContact O-NZ 3.28Å; L301-L363 HydrophobicContact CD2-CD2 3.79Å
302	D	93.6	Very high	94.5	Very high	31 Å²	31	60 Å²	60	17%	0.166	30%	0.301	C	S	.	.			trans	-64.8	147.7	165.4	-166.5	-77.4	0	0	0	109.7	G304 I305 A359 T360	D302-G304 PolarHBondContact O-N 3.37Å; D302-G304 PolarHBondContact OD1-N 2.75Å; D302-I305 HydrophobicContact CB-CD1 3.93Å; D302-I305 HydrophobicContact CB-CG1 4.05Å; D302-I305 WeakPolarHBondContact O-CB 3.38Å; D302-I305 PolarHBondContact O-N 3.34Å; D302-A359 HydrophobicContact CB-CB 3.9Å; D302-T360 PolarHBondContact OD2-OG1 3.02Å
303	D	90.9	Very high	95	Very high	97 Å²	97	55.7 Å²	55.7	52%	0.519	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-23.3	-171.9	-63.5	19	0	0	0	111.4	K361	D303-K361 IonicContact OD1-NZ 2.65Å; D303-K361 PolarHBondContact OD1-NZ 2.84Å
304	G	90.9	Very high	95.4	Very high	52 Å²	52	54.4 Å²	54.4	54%	0.536	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	6.8	174.4	0	0	0	0	0	115.5	D302	D302-G304 PolarHBondContact O-N 3.37Å; D302-G304 PolarHBondContact OD1-N 2.75Å
305	I	93.6	Very high	95.5	Very high	5 Å²	5	56.8 Å²	56.8	3%	0.026	29%	0.285	C	S	.	.			trans	-91.5	116.5	174.3	-61.7	174.1	0	0	0	109.4	L301 D302 R309 L310 V358	L301-I305 HydrophobicContact CD2-CD1 4.23Å; L301-I305 HydrophobicContact CD2-CG2 4.28Å; D302-I305 HydrophobicContact CB-CD1 3.93Å; D302-I305 HydrophobicContact CB-CG1 4.05Å; D302-I305 WeakPolarHBondContact O-CB 3.38Å; D302-I305 PolarHBondContact O-N 3.34Å; I305-R309 HydrophobicContact CG2-CB 4.27Å; I305-R309 HydrophobicContact CG2-CG 4.44Å; I305-L310 HydrophobicContact CG2-CB 4.09Å; I305-V358 HydrophobicContact CD1-CB 4.49Å; I305-V358 HydrophobicContact CD1-CG1 3.8Å
306	D	94.7	Very high	95.6	Very high	80 Å²	80	59.6 Å²	59.6	43%	0.428	31%	0.305	S	S	.	.			trans	-100.6	-176.9	173.7	62.2	6.9	0	0	0	112.2	E308 R309 L310	D306-E308 VanDerWaalsContact C-N 3.27Å; D306-E308 PolarHBondContact O-N 2.92Å; D306-E308 PolarHBondContact OD1-N 2.92Å; D306-R309 PolarHBondContact O-N 2.88Å; D306-R309 VanDerWaalsContact OD1-CB 3.23Å; D306-R309 WeakPolarHBondContact OD1-CB 3.41Å; D306-R309 PolarHBondContact OD1-N 3.42Å; D306-L310 VanDerWaalsContact O-CB 3.22Å; D306-L310 WeakPolarHBondContact O-CB 3.3Å; D306-L310 PolarHBondContact O-N 3.22Å
307	D	96.5	Very high	95.5	Very high	65 Å²	65	60.4 Å²	60.4	35%	0.348	31%	0.308	S	S	.	.	H	α-helix	trans	-59.1	-37.1	-179.7	-68.4	3.8	0	0	0	112.2	R311 K324 V325	D307-R311 VanDerWaalsContact O-CB 3.29Å; D307-R311 WeakPolarHBondContact O-CB 3.46Å; D307-R311 PolarHBondContact O-N 3.22Å; D307-K324 WeakPolarHBondContact OD1-CA 3.49Å; D307-V325 WeakPolarHBondContact OD1-CB 3.41Å; D307-V325 PolarHBondContact OD1-N 2.8Å
308	E	95.8	Very high	95.4	Very high	153 Å²	153	60 Å²	60	72%	0.715	31%	0.312	S	S	*	.	H	α-helix	trans	-71.9	-47.5	-178.7	-69.3	-171.1	-176.6	0	0	111.8	D306 R311 K312	D306-E308 VanDerWaalsContact C-N 3.27Å; D306-E308 PolarHBondContact O-N 2.92Å; D306-E308 PolarHBondContact OD1-N 2.92Å; E308-R311 WeakPolarHBondContact O-CB 3.34Å; E308-R311 PolarHBondContact O-N 2.84Å; E308-K312 WeakPolarHBondContact O-CB 3.4Å; E308-K312 PolarHBondContact O-N 3.47Å
309	R	94.6	Very high	95.4	Very high	105 Å²	105	64.3 Å²	64.3	40%	0.396	34%	0.339	S	S	.	.	H	α-helix	trans	-66	-41.4	176.7	-171.4	165	-175.2	-177.9	1.7	111.1	I305 D306 R311 K312 E313	I305-R309 HydrophobicContact CG2-CB 4.27Å; I305-R309 HydrophobicContact CG2-CG 4.44Å; D306-R309 PolarHBondContact O-N 2.88Å; D306-R309 VanDerWaalsContact OD1-CB 3.23Å; D306-R309 WeakPolarHBondContact OD1-CB 3.41Å; D306-R309 PolarHBondContact OD1-N 3.42Å; R309-R311 VanDerWaalsContact C-N 3.33Å; R309-R311 PolarHBondContact O-N 3.31Å; R309-K312 PolarHBondContact O-N 2.84Å; R309-E313 WeakPolarHBondContact O-CG 3.37Å; R309-E313 PolarHBondContact O-N 2.94Å
310	L	96.4	Very high	95.4	Very high	2 Å²	2	60.1 Å²	60.1	1%	0.01	32%	0.322	C	S	.	.	H	α-helix	trans	-58	-46.1	173.4	-178	65.2	0	0	0	111.1	V298 L301 I305 D306 K312 E313 F314 V325 V338	V298-L310 HydrophobicContact CB-CD1 4.42Å; V298-L310 HydrophobicContact CG1-CD1 4.17Å; V298-L310 HydrophobicContact CG2-CD1 4.46Å; L301-L310 HydrophobicContact CD2-CD1 3.97Å; I305-L310 HydrophobicContact CG2-CB 4.09Å; D306-L310 VanDerWaalsContact O-CB 3.22Å; D306-L310 WeakPolarHBondContact O-CB 3.3Å; D306-L310 PolarHBondContact O-N 3.22Å; L310-K312 VanDerWaalsContact C-N 3.34Å; L310-K312 PolarHBondContact O-N 3.32Å; L310-E313 PolarHBondContact O-N 3.39Å; L310-F314 HydrophobicContact CD1-CD2 3.85Å; L310-F314 HydrophobicContact CD1-CE2 3.65Å; L310-F314 WeakPolarHBondContact O-CD2 3.23Å; L310-F314 PolarHBondContact O-N 2.85Å; L310-V325 HydrophobicContact CB-CG2 4.23Å; L310-V325 HydrophobicContact CD2-CG2 3.86Å; L310-V338 HydrophobicContact CD1-CG2 4.04Å; L310-V338 HydrophobicContact CD2-CG2 3.83Å; L310-V338 HydrophobicContact CG-CG2 3.75Å
311	R	97.6	Very high	95.4	Very high	99 Å²	99	61 Å²	61	37%	0.374	33%	0.33	S	S	.	.	H	α-helix	trans	-60.4	-43	175.3	-178.2	-179.3	-66.3	-85.4	1.3	111.9	D307 E308 R309 F314 S315 I320 A323	D307-R311 VanDerWaalsContact O-CB 3.29Å; D307-R311 WeakPolarHBondContact O-CB 3.46Å; D307-R311 PolarHBondContact O-N 3.22Å; E308-R311 WeakPolarHBondContact O-CB 3.34Å; E308-R311 PolarHBondContact O-N 2.84Å; R309-R311 VanDerWaalsContact C-N 3.33Å; R309-R311 PolarHBondContact O-N 3.31Å; R311-F314 PolarHBondContact O-N 2.89Å; R311-S315 WeakPolarHBondContact O-CB 3.1Å; R311-S315 PolarHBondContact O-N 3.33Å; R311-I320 HydrophobicContact CB-CD1 4.46Å; R311-I320 HydrophobicContact CG-CD1 3.89Å; R311-I320 PolarHBondContact NH1-O 3.28Å; R311-I320 VanDerWaalsContact NH1-O 3.11Å; R311-I320 VanDerWaalsContact O-CD1 3.24Å; R311-I320 WeakPolarHBondContact O-CD1 3.43Å; R311-A323 HydrophobicContact CB-CB 3.91Å
312	K	96.4	Very high	95.3	Very high	155 Å²	155	63.5 Å²	63.5	67%	0.674	35%	0.347	S	S	*	.	H	α-helix	trans	-64.7	-40.4	-179.3	-174.3	178.9	178.9	179.3	0	112.7	E308 R309 L310 F314 S315	E308-K312 WeakPolarHBondContact O-CB 3.4Å; E308-K312 PolarHBondContact O-N 3.47Å; R309-K312 PolarHBondContact O-N 2.84Å; L310-K312 VanDerWaalsContact C-N 3.34Å; L310-K312 PolarHBondContact O-N 3.32Å; K312-F314 VanDerWaalsContact C-N 3.29Å; K312-F314 PolarHBondContact O-N 3.13Å; K312-S315 PolarHBondContact O-OG 3.25Å; K312-S315 VanDerWaalsContact O-OG 3.11Å
313	E	95.9	Very high	95.5	Very high	48 Å²	48	62.3 Å²	62.3	22%	0.224	34%	0.342	C	S	.	.	H	α-helix	trans	-68.2	-29.5	178.4	-67.2	-63.7	157.6	0	0	112.5	R309 L310 M353 V358	R309-E313 WeakPolarHBondContact O-CG 3.37Å; R309-E313 PolarHBondContact O-N 2.94Å; L310-E313 PolarHBondContact O-N 3.39Å; E313-M353 HydrophobicContact CB-CE 4.04Å; E313-V358 HydrophobicContact CG-CG1 4Å
314	F	97.3	Very high	95.8	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-98.2	-13.7	-178	-79.9	-98	0	0	0	114.5	L296 V298 L310 R311 K312 P316 F317 I320 V338 F340 A349 M353 L363 V365	L296-F314 HydrophobicContact CD1-CD1 4.44Å; L296-F314 HydrophobicContact CD1-CE1 4.19Å; V298-F314 HydrophobicContact CB-CZ 4.4Å; V298-F314 HydrophobicContact CG1-CE2 4.09Å; V298-F314 HydrophobicContact CG1-CZ 3.96Å; V298-F314 HydrophobicContact CG2-CE1 4.1Å; V298-F314 HydrophobicContact CG2-CE2 3.98Å; V298-F314 HydrophobicContact CG2-CZ 3.5Å; L310-F314 HydrophobicContact CD1-CD2 3.85Å; L310-F314 HydrophobicContact CD1-CE2 3.65Å; L310-F314 WeakPolarHBondContact O-CD2 3.23Å; L310-F314 PolarHBondContact O-N 2.85Å; R311-F314 PolarHBondContact O-N 2.89Å; K312-F314 VanDerWaalsContact C-N 3.29Å; K312-F314 PolarHBondContact O-N 3.13Å; F314-P316 VanDerWaalsContact C-N 3.32Å; F314-F317 HydrophobicContact CD1-CD2 4.48Å; F314-F317 WeakPolarHBondContact O-CD2 3.41Å; F314-F317 PolarHBondContact O-N 3.47Å; F314-I320 HydrophobicContact CB-CD1 3.76Å; F314-V338 HydrophobicContact CB-CG1 3.97Å; F314-V338 HydrophobicContact CB-CG2 4.49Å; F314-V338 HydrophobicContact CD1-CB 4.46Å; F314-V338 HydrophobicContact CD1-CG1 4.27Å; F314-V338 HydrophobicContact CD1-CG2 4.38Å; F314-V338 HydrophobicContact CD2-CG2 4.11Å; F314-V338 HydrophobicContact CE2-CG2 4.44Å; F314-V338 HydrophobicContact CG-CB 4.5Å; F314-V338 HydrophobicContact CG-CG1 4.17Å; F314-V338 HydrophobicContact CG-CG2 4.07Å; F314-F340 HydrophobicContact CB-CZ 4.11Å; F314-F340 HydrophobicContact CD1-CE2 4.22Å; F314-F340 HydrophobicContact CD1-CZ 4.18Å; F314-F340 WeakPolarHBondContact O-CZ 3.36Å; F314-A349 HydrophobicContact CD1-CB 4.16Å; F314-A349 HydrophobicContact CE1-CB 4.42Å; F314-M353 HydrophobicContact CD1-CG 4.34Å; F314-M353 HydrophobicContact CD2-CE 4.2Å; F314-M353 HydrophobicContact CE1-CB 3.98Å; F314-M353 HydrophobicContact CE1-CG 3.97Å; F314-M353 HydrophobicContact CE2-CE 3.91Å; F314-M353 HydrophobicContact CZ-CB 4.05Å; F314-M353 HydrophobicContact CZ-CE 4.15Å; F314-M353 HydrophobicContact CZ-CG 4.24Å; F314-L363 HydrophobicContact CE2-CD1 4.27Å; F314-L363 HydrophobicContact CZ-CD1 4.45Å; F314-V365 HydrophobicContact CE1-CG1 4.03Å; F314-V365 HydrophobicContact CE1-CG2 4.33Å; F314-V365 HydrophobicContact CZ-CG1 4.3Å; F314-V365 HydrophobicContact CZ-CG2 3.87Å
315	S	96.9	Very high	96.1	Very high	63 Å²	63	61 Å²	61	44%	0.441	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-60.4	-28.5	-178.5	66.1	0	0	0	0	115	R311 K312 F317 G318	R311-S315 WeakPolarHBondContact O-CB 3.1Å; R311-S315 PolarHBondContact O-N 3.33Å; K312-S315 PolarHBondContact O-OG 3.25Å; K312-S315 VanDerWaalsContact O-OG 3.11Å; S315-F317 PolarHBondContact O-N 2.8Å; S315-F317 VanDerWaalsContact O-N 3.14Å; S315-G318 PolarHBondContact O-N 2.76Å
316	P	97.2	Very high	96.2	Very high	91 Å²	91	64 Å²	64	59%	0.591	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-64.6	-15.3	176.2	-24.4	36.6	0	0	0	114.7	F314	F314-P316 VanDerWaalsContact C-N 3.32Å
317	F	96.1	Very high	96.1	Very high	16 Å²	16	65.3 Å²	65.3	7%	0.07	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-94.3	-9.6	-176	-53.5	-71.9	0	0	0	114	F314 S315 F340 E345 K348 A349 E352 M353	F314-F317 HydrophobicContact CD1-CD2 4.48Å; F314-F317 WeakPolarHBondContact O-CD2 3.41Å; F314-F317 PolarHBondContact O-N 3.47Å; S315-F317 PolarHBondContact O-N 2.8Å; S315-F317 VanDerWaalsContact O-N 3.14Å; F317-F340 HydrophobicContact CB-CE1 4.09Å; F317-F340 HydrophobicContact CB-CZ 3.94Å; F317-E345 WeakPolarHBondContact O-CB 3.16Å; F317-K348 HydrophobicContact CD1-CD 4.45Å; F317-K348 HydrophobicContact CD1-CG 4.28Å; F317-A349 HydrophobicContact CB-CB 3.67Å; F317-A349 HydrophobicContact CD2-CB 4.04Å; F317-A349 HydrophobicContact CG-CB 3.8Å; F317-E352 HydrophobicContact CD1-CB 4.32Å; F317-E352 HydrophobicContact CE1-CB 3.51Å; F317-E352 HydrophobicContact CE1-CG 4.09Å; F317-E352 WeakPolarHBondContact CE1-OE2 3.47Å; F317-E352 HydrophobicContact CZ-CB 4.03Å; F317-M353 HydrophobicContact CD2-CG 4Å; F317-M353 HydrophobicContact CE1-CG 4.42Å; F317-M353 HydrophobicContact CE2-CE 4.38Å; F317-M353 HydrophobicContact CE2-CG 3.23Å; F317-M353 HydrophobicContact CE2-SD 3.43Å; F317-M353 WeakPolarHBondContact CE2-SD 3.42Å; F317-M353 HydrophobicContact CZ-CG 3.48Å; F317-M353 VanDerWaalsContact CZ-CG 3.48Å; F317-M353 HydrophobicContact CZ-SD 3.53Å; F317-M353 VanDerWaalsContact CZ-SD 3.53Å
318	G	95	Very high	95.8	Very high	20 Å²	20	68.2 Å²	68.2	21%	0.206	35%	0.348	C	S	.	.	S	Bend	trans	153.5	-174	179.5	0	0	0	0	0	114.8	S315 I320 E345	S315-G318 PolarHBondContact O-N 2.76Å; G318-I320 PolarHBondContact O-N 2.86Å; G318-E345 VanDerWaalsContact CA-CD 3.46Å; G318-E345 WeakPolarHBondContact CA-OE1 3.36Å
319	T	96.5	Very high	95.4	Very high	92 Å²	92	65.3 Å²	65.3	56%	0.564	36%	0.359	S	S	*	.			trans	-78.8	110.4	-178.8	-55	0	0	0	0	111.3	T321 F340 S341 E345	T319-T321 PolarHBondContact O-N 2.64Å; T319-F340 CarbonylContact O-C 3.58Å; T319-F340 WeakPolarHBondContact O-CA 3.47Å; T319-S341 PolarHBondContact O-N 2.62Å; T319-E345 PolarHBondContact N-OE1 2.95Å
320	I	96.7	Very high	95.1	Very high	20 Å²	20	63.4 Å²	63.4	10%	0.103	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	114.8	179.7	-60.8	172.8	0	0	0	110.9	R311 F314 G318 S322 A323 V338 C339 F340	R311-I320 HydrophobicContact CB-CD1 4.46Å; R311-I320 HydrophobicContact CG-CD1 3.89Å; R311-I320 PolarHBondContact NH1-O 3.28Å; R311-I320 VanDerWaalsContact NH1-O 3.11Å; R311-I320 VanDerWaalsContact O-CD1 3.24Å; R311-I320 WeakPolarHBondContact O-CD1 3.43Å; F314-I320 HydrophobicContact CB-CD1 3.76Å; G318-I320 PolarHBondContact O-N 2.86Å; I320-S322 WeakPolarHBondContact CG2-O 3.42Å; I320-A323 HydrophobicContact CG2-CB 4.01Å; I320-V338 HydrophobicContact CD1-CG1 4.07Å; I320-V338 HydrophobicContact CG1-CG1 4.07Å; I320-V338 HydrophobicContact CG2-CG1 4.09Å; I320-C339 CarbonylContact C-O 3.56Å; I320-C339 WeakPolarHBondContact CA-O 3.41Å; I320-F340 HydrophobicContact CG1-CD1 4.24Å; I320-F340 HydrophobicContact CG1-CE1 3.8Å; I320-F340 HydrophobicContact CG1-CZ 4.24Å
321	T	95	Very high	94.7	Very high	86 Å²	86	72 Å²	72	53%	0.528	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	-30.9	174.7	58.2	0	0	0	0	112.4	T319 C339	T319-T321 PolarHBondContact O-N 2.64Å; T321-C339 PolarHBondContact N-O 2.88Å; T321-C339 WeakPolarHBondContact OG1-CB 3.39Å; T321-C339 PolarHBondContact OG1-O 3.07Å; T321-C339 VanDerWaalsContact OG1-O 3.07Å; T321-C339 PolarHBondContact OG1-SG 3.16Å
322	S	94.6	Very high	94.5	Very high	53 Å²	53	68 Å²	68	37%	0.371	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	136.2	176.5	-179.3	0	0	0	0	110.5	I320 V338 C339	I320-S322 WeakPolarHBondContact CG2-O 3.42Å; S322-V338 CarbonylContact O-C 3.57Å; S322-V338 WeakPolarHBondContact O-CA 3.42Å; S322-C339 PolarHBondContact N-O 3.49Å; S322-C339 PolarHBondContact O-N 3.1Å
323	A	97.2	Very high	94.4	Very high	7 Å²	7	65 Å²	65	6%	0.058	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	128.7	168.5	0	0	0	0	0	107.7	R311 I320 F337 V338	R311-A323 HydrophobicContact CB-CB 3.91Å; I320-A323 HydrophobicContact CG2-CB 4.01Å; A323-F337 CarbonylContact C-O 3.48Å; A323-F337 VanDerWaalsContact CA-O 3.3Å; A323-F337 WeakPolarHBondContact CA-O 3.38Å; A323-V338 HydrophobicContact CB-CG2 4.44Å
324	K	97	Very high	94.3	Very high	119 Å²	119	63.4 Å²	63.4	52%	0.517	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	124.4	-177.2	-174.4	167.7	-175	170.5	0	112.1	D307 G336 F337	D307-K324 WeakPolarHBondContact OD1-CA 3.49Å; K324-G336 CarbonylContact O-C 3.47Å; K324-G336 WeakPolarHBondContact O-CA 3.48Å; K324-F337 PolarHBondContact N-O 2.92Å; K324-F337 PolarHBondContact O-N 2.94Å
325	V	96.9	Very high	94.2	Very high	3 Å²	3	65.3 Å²	65.3	2%	0.018	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	135.4	169.9	-178.2	0	0	0	0	108.6	L301 D307 L310 M327 S332	L301-V325 HydrophobicContact CD1-CG1 4.13Å; L301-V325 HydrophobicContact CD1-CG2 4.02Å; D307-V325 WeakPolarHBondContact OD1-CB 3.41Å; D307-V325 PolarHBondContact OD1-N 2.8Å; L310-V325 HydrophobicContact CB-CG2 4.23Å; L310-V325 HydrophobicContact CD2-CG2 3.86Å; V325-M327 HydrophobicContact CG1-SD 3.95Å; V325-M327 PolarHBondContact O-N 2.82Å; V325-S332 WeakPolarHBondContact CG1-OG 3.18Å
326	M	95.3	Very high	94.2	Very high	67 Å²	67	62.3 Å²	62.3	33%	0.33	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	115.7	-180	-62.4	-63.7	-101.2	0	0	109.1	K333 F335 F337	M326-K333 HydrophobicContact CB-CD 4.22Å; M326-K333 VanDerWaalsContact O-CB 3.3Å; M326-K333 WeakPolarHBondContact O-CB 3.5Å; M326-K333 WeakPolarHBondContact O-CG 3.47Å; M326-K333 PolarHBondContact O-N 3.43Å; M326-F335 HydrophobicContact CB-CD2 4.13Å; M326-F335 HydrophobicContact CB-CE1 4.19Å; M326-F335 HydrophobicContact CB-CE2 3.76Å; M326-F335 HydrophobicContact CB-CZ 3.77Å; M326-F335 WeakPolarHBondContact CB-O 3.41Å; M326-F335 HydrophobicContact CG-CD2 3.84Å; M326-F335 HydrophobicContact CG-CE2 3.41Å; M326-F335 VanDerWaalsContact CG-CE2 3.41Å; M326-F335 HydrophobicContact CG-CZ 3.9Å; M326-F335 PolarHBondContact N-O 3.26Å; M326-F337 HydrophobicContact CE-CE2 4.09Å; M326-F337 HydrophobicContact CG-CD2 4.2Å; M326-F337 HydrophobicContact CG-CE2 4.01Å; M326-F337 HydrophobicContact SD-CD2 4.34Å; M326-F337 HydrophobicContact SD-CE2 4.29Å
327	M	93.1	Very high	94.2	Very high	107 Å²	107	60.6 Å²	60.6	53%	0.527	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	146.8	-177.7	-53.7	-66.4	-91.1	0	0	110.5	V325 G330 R331 S332	V325-M327 HydrophobicContact CG1-SD 3.95Å; V325-M327 PolarHBondContact O-N 2.82Å; M327-G330 WeakPolarHBondContact CE-O 3.47Å; M327-R331 CarbonylContact C-O 3.58Å; M327-R331 WeakPolarHBondContact CA-O 3.13Å; M327-S332 VanDerWaalsContact SD-CA 3.53Å
328	E	90	Very high	94.3	Very high	126 Å²	126	59.8 Å²	59.8	59%	0.589	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.8	117.2	174.3	-178.4	161.5	-124.6	0	0	108.5	G330 R331 K333	E328-G330 PolarHBondContact O-N 3.28Å; E328-R331 PolarHBondContact N-O 2.9Å; E328-R331 PolarHBondContact O-N 2.94Å; E328-K333 HydrophobicContact CB-CD 3.96Å; E328-K333 HydrophobicContact CB-CG 3.61Å; E328-K333 IonicContact OE1-NZ 2.69Å; E328-K333 PolarHBondContact OE1-NZ 3.29Å; E328-K333 VanDerWaalsContact OE1-NZ 3.13Å; E328-K333 IonicContact OE2-NZ 2.91Å; E328-K333 PolarHBondContact OE2-NZ 3.39Å
329	G	87.5	Confident	94.3	Very high	92 Å²	92	59 Å²	59	95%	0.948	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	29.5	-176.1	0	0	0	0	0	114.3	R331	G329-R331 VanDerWaalsContact C-N 3.27Å; G329-R331 PolarHBondContact O-N 3.09Å
330	G	87.7	Confident	94.4	Very high	65 Å²	65	54.8 Å²	54.8	67%	0.67	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.3	-5.3	-176.5	0	0	0	0	0	115.1	M327 E328	M327-G330 WeakPolarHBondContact CE-O 3.47Å; E328-G330 PolarHBondContact O-N 3.28Å
331	R	88.8	Confident	94.3	Very high	184 Å²	184	57 Å²	57	69%	0.694	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98	142.1	172.7	-174.6	180	-78.1	171.6	-5.1	110.3	M327 E328 G329 K333	M327-R331 CarbonylContact C-O 3.58Å; M327-R331 WeakPolarHBondContact CA-O 3.13Å; E328-R331 PolarHBondContact N-O 2.9Å; E328-R331 PolarHBondContact O-N 2.94Å; G329-R331 VanDerWaalsContact C-N 3.27Å; G329-R331 PolarHBondContact O-N 3.09Å; R331-K333 PolarHBondContact O-N 2.62Å
332	S	93.1	Very high	94.3	Very high	14 Å²	14	54.2 Å²	54.2	10%	0.098	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	133.8	172.8	180	0	0	0	0	111.1	V325 M327 G334	V325-S332 WeakPolarHBondContact CG1-OG 3.18Å; M327-S332 VanDerWaalsContact SD-CA 3.53Å; S332-G334 PolarHBondContact O-N 3.21Å; S332-G334 PolarHBondContact OG-N 2.84Å; S332-G334 VanDerWaalsContact OG-N 3.08Å
333	K	94.2	Very high	94.3	Very high	93 Å²	93	54.3 Å²	54.3	40%	0.404	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	2.7	169.3	-62.5	177.8	75.6	91.1	0	112.1	M326 E328 R331 F335	M326-K333 HydrophobicContact CB-CD 4.22Å; M326-K333 VanDerWaalsContact O-CB 3.3Å; M326-K333 WeakPolarHBondContact O-CB 3.5Å; M326-K333 WeakPolarHBondContact O-CG 3.47Å; M326-K333 PolarHBondContact O-N 3.43Å; E328-K333 HydrophobicContact CB-CD 3.96Å; E328-K333 HydrophobicContact CB-CG 3.61Å; E328-K333 IonicContact OE1-NZ 2.69Å; E328-K333 PolarHBondContact OE1-NZ 3.29Å; E328-K333 VanDerWaalsContact OE1-NZ 3.13Å; E328-K333 IonicContact OE2-NZ 2.91Å; E328-K333 PolarHBondContact OE2-NZ 3.39Å; R331-K333 PolarHBondContact O-N 2.62Å; K333-F335 VanDerWaalsContact C-N 3.31Å; K333-F335 HydrophobicContact CB-CD1 3.76Å; K333-F335 HydrophobicContact CB-CE1 3.56Å; K333-F335 HydrophobicContact CD-CE1 3.92Å; K333-F335 HydrophobicContact CD-CZ 4.29Å; K333-F335 HydrophobicContact CG-CE1 4.38Å; K333-F335 PolarHBondContact O-N 3.31Å
334	G	93.8	Very high	94.2	Very high	14 Å²	14	60.5 Å²	60.5	14%	0.144	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	75.9	15.2	-179.9	0	0	0	0	0	114.2	K299 N300 L301 S332	K299-G334 CarbonylContact C-O 3.43Å; N300-G334 PolarHBondContact N-O 3.32Å; L301-G334 PolarHBondContact N-O 3.36Å; S332-G334 PolarHBondContact O-N 3.21Å; S332-G334 PolarHBondContact OG-N 2.84Å; S332-G334 VanDerWaalsContact OG-N 3.08Å
335	F	96.2	Very high	94.1	Very high	40 Å²	40	56.7 Å²	56.7	18%	0.175	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	158.2	174	74.9	-87.8	0	0	0	112.5	Y297 V298 K299 M326 K333 F337	Y297-F335 HydrophobicContact CD2-CD2 4.17Å; Y297-F335 HydrophobicContact CE2-CB 3.93Å; Y297-F335 AromaticContact CE2-CD2 3.37Å; Y297-F335 HydrophobicContact CE2-CD2 3.37Å; Y297-F335 HydrophobicContact CE2-CE2 4.03Å; Y297-F335 AromaticContact CE2-CG 3.84Å; Y297-F335 HydrophobicContact CE2-CG 3.84Å; V298-F335 CarbonylContact O-C 3.43Å; V298-F335 WeakPolarHBondContact O-CA 3.43Å; V298-F335 VanDerWaalsContact O-CB 3.29Å; V298-F335 WeakPolarHBondContact O-CB 3.5Å; K299-F335 HydrophobicContact CB-CB 4.2Å; K299-F335 HydrophobicContact CG-CB 4.29Å; M326-F335 HydrophobicContact CB-CD2 4.13Å; M326-F335 HydrophobicContact CB-CE1 4.19Å; M326-F335 HydrophobicContact CB-CE2 3.76Å; M326-F335 HydrophobicContact CB-CZ 3.77Å; M326-F335 WeakPolarHBondContact CB-O 3.41Å; M326-F335 HydrophobicContact CG-CD2 3.84Å; M326-F335 HydrophobicContact CG-CE2 3.41Å; M326-F335 VanDerWaalsContact CG-CE2 3.41Å; M326-F335 HydrophobicContact CG-CZ 3.9Å; M326-F335 PolarHBondContact N-O 3.26Å; K333-F335 VanDerWaalsContact C-N 3.31Å; K333-F335 HydrophobicContact CB-CD1 3.76Å; K333-F335 HydrophobicContact CB-CE1 3.56Å; K333-F335 HydrophobicContact CD-CE1 3.92Å; K333-F335 HydrophobicContact CD-CZ 4.29Å; K333-F335 HydrophobicContact CG-CE1 4.38Å; K333-F335 PolarHBondContact O-N 3.31Å; F335-F337 HydrophobicContact CD2-CE2 4.24Å; F335-F337 AromaticContact CE2-CE2 3.96Å; F335-F337 HydrophobicContact CE2-CE2 3.96Å; F335-F337 HydrophobicContact CE2-CZ 4.36Å
336	G	96.7	Very high	94.1	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	-175.9	179.2	0	0	0	0	0	112.1	V298 K324	V298-G336 PolarHBondContact N-O 3.22Å; V298-G336 PolarHBondContact O-N 3.21Å; K324-G336 CarbonylContact O-C 3.47Å; K324-G336 WeakPolarHBondContact O-CA 3.48Å
337	F	97.3	Very high	94.1	Very high	54 Å²	54	56.9 Å²	56.9	24%	0.237	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	140	178	-64.2	-86.9	0	0	0	111	L296 Y297 A323 K324 M326 F335 A368	L296-F337 WeakPolarHBondContact O-CA 3.26Å; L296-F337 WeakPolarHBondContact O-CD1 3.47Å; Y297-F337 HydrophobicContact CD2-CD1 4.48Å; Y297-F337 AromaticContact CD2-CE1 3.78Å; Y297-F337 HydrophobicContact CD2-CE1 3.78Å; Y297-F337 AromaticContact CD2-CZ 3.9Å; Y297-F337 HydrophobicContact CD2-CZ 3.9Å; Y297-F337 HydrophobicContact CE2-CZ 4.45Å; A323-F337 CarbonylContact C-O 3.48Å; A323-F337 VanDerWaalsContact CA-O 3.3Å; A323-F337 WeakPolarHBondContact CA-O 3.38Å; K324-F337 PolarHBondContact N-O 2.92Å; K324-F337 PolarHBondContact O-N 2.94Å; M326-F337 HydrophobicContact CE-CE2 4.09Å; M326-F337 HydrophobicContact CG-CD2 4.2Å; M326-F337 HydrophobicContact CG-CE2 4.01Å; M326-F337 HydrophobicContact SD-CD2 4.34Å; M326-F337 HydrophobicContact SD-CE2 4.29Å; F335-F337 HydrophobicContact CD2-CE2 4.24Å; F335-F337 AromaticContact CE2-CE2 3.96Å; F335-F337 HydrophobicContact CE2-CE2 3.96Å; F335-F337 HydrophobicContact CE2-CZ 4.36Å; F337-A368 HydrophobicContact CD1-CB 3.99Å; F337-A368 HydrophobicContact CE1-CB 3.97Å
338	V	97.6	Very high	94.3	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	116	173.8	-178	0	0	0	0	108.2	L296 V298 L310 F314 I320 S322 A323 F340	L296-V338 HydrophobicContact CB-CB 4.46Å; L296-V338 WeakPolarHBondContact CB-O 3.43Å; L296-V338 PolarHBondContact N-O 3.17Å; L296-V338 PolarHBondContact O-N 3.42Å; V298-V338 HydrophobicContact CG2-CG2 4.03Å; L310-V338 HydrophobicContact CD1-CG2 4.04Å; L310-V338 HydrophobicContact CD2-CG2 3.83Å; L310-V338 HydrophobicContact CG-CG2 3.75Å; F314-V338 HydrophobicContact CB-CG1 3.97Å; F314-V338 HydrophobicContact CB-CG2 4.49Å; F314-V338 HydrophobicContact CD1-CB 4.46Å; F314-V338 HydrophobicContact CD1-CG1 4.27Å; F314-V338 HydrophobicContact CD1-CG2 4.38Å; F314-V338 HydrophobicContact CD2-CG2 4.11Å; F314-V338 HydrophobicContact CE2-CG2 4.44Å; F314-V338 HydrophobicContact CG-CB 4.5Å; F314-V338 HydrophobicContact CG-CG1 4.17Å; F314-V338 HydrophobicContact CG-CG2 4.07Å; I320-V338 HydrophobicContact CD1-CG1 4.07Å; I320-V338 HydrophobicContact CG1-CG1 4.07Å; I320-V338 HydrophobicContact CG2-CG1 4.09Å; S322-V338 CarbonylContact O-C 3.57Å; S322-V338 WeakPolarHBondContact O-CA 3.42Å; A323-V338 HydrophobicContact CB-CG2 4.44Å; V338-F340 HydrophobicContact CG1-CD2 4.29Å; V338-F340 HydrophobicContact CG1-CE2 3.76Å; V338-F340 HydrophobicContact CG1-CZ 4.09Å
339	C	96.1	Very high	94.6	Very high	3 Å²	3	50.7 Å²	50.7	2%	0.02	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	123.4	176.4	-168	0	0	0	0	109.9	Y291 V294 I320 T321 S322	Y291-C339 VanDerWaalsContact CD1-SG 3.55Å; V294-C339 VanDerWaalsContact CG2-SG 3.58Å; V294-C339 WeakPolarHBondContact O-CA 3.41Å; I320-C339 CarbonylContact C-O 3.56Å; I320-C339 WeakPolarHBondContact CA-O 3.41Å; T321-C339 PolarHBondContact N-O 2.88Å; T321-C339 WeakPolarHBondContact OG1-CB 3.39Å; T321-C339 PolarHBondContact OG1-O 3.07Å; T321-C339 VanDerWaalsContact OG1-O 3.07Å; T321-C339 PolarHBondContact OG1-SG 3.16Å; S322-C339 PolarHBondContact N-O 3.49Å; S322-C339 PolarHBondContact O-N 3.1Å
340	F	97.3	Very high	95.1	Very high	3 Å²	3	47.9 Å²	47.9	1%	0.013	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	172	172.2	-75.5	-81.6	0	0	0	111.6	V294 L296 F314 F317 T319 I320 V338 E345 A346 A349	V294-F340 PolarHBondContact O-N 2.89Å; L296-F340 HydrophobicContact CD1-CD2 4.03Å; L296-F340 HydrophobicContact CD1-CE2 3.64Å; L296-F340 HydrophobicContact CG-CD2 4.29Å; L296-F340 HydrophobicContact CG-CE2 4.33Å; F314-F340 HydrophobicContact CB-CZ 4.11Å; F314-F340 HydrophobicContact CD1-CE2 4.22Å; F314-F340 HydrophobicContact CD1-CZ 4.18Å; F314-F340 WeakPolarHBondContact O-CZ 3.36Å; F317-F340 HydrophobicContact CB-CE1 4.09Å; F317-F340 HydrophobicContact CB-CZ 3.94Å; T319-F340 CarbonylContact O-C 3.58Å; T319-F340 WeakPolarHBondContact O-CA 3.47Å; I320-F340 HydrophobicContact CG1-CD1 4.24Å; I320-F340 HydrophobicContact CG1-CE1 3.8Å; I320-F340 HydrophobicContact CG1-CZ 4.24Å; V338-F340 HydrophobicContact CG1-CD2 4.29Å; V338-F340 HydrophobicContact CG1-CE2 3.76Å; V338-F340 HydrophobicContact CG1-CZ 4.09Å; F340-E345 HydrophobicContact CB-CB 3.97Å; F340-E345 HydrophobicContact CD1-CB 3.81Å; F340-E345 HydrophobicContact CG-CB 3.99Å; F340-A346 HydrophobicContact CB-CB 4.18Å; F340-A346 HydrophobicContact CD2-CB 4Å; F340-A346 HydrophobicContact CG-CB 4.42Å; F340-A349 HydrophobicContact CD2-CB 4.48Å; F340-A349 HydrophobicContact CE2-CB 3.56Å; F340-A349 HydrophobicContact CZ-CB 3.75Å
341	S	94.9	Very high	95.4	Very high	66 Å²	66	50 Å²	50	46%	0.462	26%	0.257	S	S	.	.	S	Bend	trans	-81.1	-25.9	175.5	75.5	0	0	0	0	112.2	T319 E345	T319-S341 PolarHBondContact O-N 2.62Å; S341-E345 PolarHBondContact N-OE2 3Å; S341-E345 PolarHBondContact OG-OE2 3.22Å
342	S	94.7	Very high	95.8	Very high	28 Å²	28	46.1 Å²	46.1	20%	0.196	25%	0.247	C	C	.	.	S	Bend	trans	-137.1	150.6	-178.3	66.8	0	0	0	0	112.9	E344 E345 A346	S342-E344 WeakPolarHBondContact CB-OE2 3.37Å; S342-E344 PolarHBondContact O-N 3.01Å; S342-E345 PolarHBondContact N-OE2 3.01Å; S342-E345 VanDerWaalsContact N-OE2 3.17Å; S342-E345 PolarHBondContact O-N 2.65Å; S342-E345 WeakPolarHBondContact OG-CB 3.2Å; S342-E345 WeakPolarHBondContact OG-CG 3.45Å; S342-E345 PolarHBondContact OG-N 2.76Å; S342-E345 PolarHBondContact OG-OE2 3.31Å; S342-A346 PolarHBondContact O-N 3.49Å
343	P	94.7	Very high	95.9	Very high	56 Å²	56	45.5 Å²	45.5	36%	0.364	24%	0.243	S	C	.	.	H	α-helix	trans	-63.6	-28.4	176.7	-23.8	34.2	0	0	0	113.4	V294 A346 T347	V294-P343 HydrophobicContact CG1-CB 4.47Å; V294-P343 HydrophobicContact CG1-CG 3.82Å; P343-A346 PolarHBondContact O-N 3.35Å; P343-T347 WeakPolarHBondContact O-CB 3.43Å; P343-T347 PolarHBondContact O-N 2.82Å; P343-T347 PolarHBondContact O-OG1 2.79Å
344	E	94.7	Very high	96	Very high	136 Å²	136	44.8 Å²	44.8	64%	0.636	24%	0.243	S	C	*	.	H	α-helix	trans	-67	-47.3	179	-62.7	73.5	-159.2	0	0	110.8	S342 A346 T347 K348	S342-E344 WeakPolarHBondContact CB-OE2 3.37Å; S342-E344 PolarHBondContact O-N 3.01Å; E344-A346 VanDerWaalsContact C-N 3.33Å; E344-A346 PolarHBondContact O-N 3.39Å; E344-T347 PolarHBondContact O-N 2.82Å; E344-K348 PolarHBondContact O-N 2.88Å
345	E	96.6	Very high	96.1	Very high	39 Å²	39	46.4 Å²	46.4	18%	0.182	26%	0.26	C	S	.	.	H	α-helix	trans	-59.2	-44.3	173.1	-71.3	170.8	146	0	0	111.3	F317 G318 T319 F340 S341 S342 T347 K348 A349	F317-E345 WeakPolarHBondContact O-CB 3.16Å; G318-E345 VanDerWaalsContact CA-CD 3.46Å; G318-E345 WeakPolarHBondContact CA-OE1 3.36Å; T319-E345 PolarHBondContact N-OE1 2.95Å; F340-E345 HydrophobicContact CB-CB 3.97Å; F340-E345 HydrophobicContact CD1-CB 3.81Å; F340-E345 HydrophobicContact CG-CB 3.99Å; S341-E345 PolarHBondContact N-OE2 3Å; S341-E345 PolarHBondContact OG-OE2 3.22Å; S342-E345 PolarHBondContact N-OE2 3.01Å; S342-E345 VanDerWaalsContact N-OE2 3.17Å; S342-E345 PolarHBondContact O-N 2.65Å; S342-E345 WeakPolarHBondContact OG-CB 3.2Å; S342-E345 WeakPolarHBondContact OG-CG 3.45Å; S342-E345 PolarHBondContact OG-N 2.76Å; S342-E345 PolarHBondContact OG-OE2 3.31Å; E345-T347 PolarHBondContact O-N 2.9Å; E345-K348 PolarHBondContact O-N 2.74Å; E345-A349 PolarHBondContact O-N 3.24Å
346	A	96.6	Very high	96	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.2	-42.4	177.6	0	0	0	0	0	112.1	G293 L296 F340 S342 P343 E344 A349 V350	G293-A346 WeakPolarHBondContact O-CB 3.44Å; L296-A346 HydrophobicContact CD2-CB 3.93Å; L296-A346 HydrophobicContact CG-CB 4.43Å; F340-A346 HydrophobicContact CB-CB 4.18Å; F340-A346 HydrophobicContact CD2-CB 4Å; F340-A346 HydrophobicContact CG-CB 4.42Å; S342-A346 PolarHBondContact O-N 3.49Å; P343-A346 PolarHBondContact O-N 3.35Å; E344-A346 VanDerWaalsContact C-N 3.33Å; E344-A346 PolarHBondContact O-N 3.39Å; A346-A349 PolarHBondContact O-N 2.99Å; A346-V350 WeakPolarHBondContact O-CG2 3.42Å; A346-V350 PolarHBondContact O-N 3.23Å
347	T	95	Very high	95.9	Very high	75 Å²	75	55.9 Å²	55.9	46%	0.46	30%	0.302	S	S	.	.	H	α-helix	trans	-65.4	-43.7	178.4	-57.5	0	0	0	0	111.1	P343 E344 E345 A349 V350 T351	P343-T347 WeakPolarHBondContact O-CB 3.43Å; P343-T347 PolarHBondContact O-N 2.82Å; P343-T347 PolarHBondContact O-OG1 2.79Å; E344-T347 PolarHBondContact O-N 2.82Å; E345-T347 PolarHBondContact O-N 2.9Å; T347-A349 VanDerWaalsContact C-N 3.34Å; T347-A349 PolarHBondContact O-N 3.04Å; T347-V350 PolarHBondContact O-N 3.29Å; T347-T351 PolarHBondContact O-N 2.92Å; T347-T351 PolarHBondContact O-OG1 3.1Å
348	K	96.2	Very high	95.7	Very high	102 Å²	102	53.6 Å²	53.6	44%	0.443	29%	0.293	S	S	.	.	H	α-helix	trans	-57.6	-47.7	175	-173.2	-174.6	177.7	-172.1	0	111.4	F317 E344 E345 V350 T351 E352	F317-K348 HydrophobicContact CD1-CD 4.45Å; F317-K348 HydrophobicContact CD1-CG 4.28Å; E344-K348 PolarHBondContact O-N 2.88Å; E345-K348 PolarHBondContact O-N 2.74Å; K348-V350 VanDerWaalsContact C-N 3.34Å; K348-V350 PolarHBondContact O-N 3.45Å; K348-T351 PolarHBondContact O-N 2.96Å; K348-E352 WeakPolarHBondContact CE-OE1 3.33Å; K348-E352 WeakPolarHBondContact CG-OE1 3.47Å; K348-E352 PolarHBondContact O-N 2.92Å
349	A	97.3	Very high	95.3	Very high	0 Å²	0	56 Å²	56	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-60.5	-40.8	176.6	0	0	0	0	0	112.5	L296 F314 F317 F340 E345 A346 T347 M353	L296-A349 HydrophobicContact CD1-CB 3.71Å; F314-A349 HydrophobicContact CD1-CB 4.16Å; F314-A349 HydrophobicContact CE1-CB 4.42Å; F317-A349 HydrophobicContact CB-CB 3.67Å; F317-A349 HydrophobicContact CD2-CB 4.04Å; F317-A349 HydrophobicContact CG-CB 3.8Å; F340-A349 HydrophobicContact CD2-CB 4.48Å; F340-A349 HydrophobicContact CE2-CB 3.56Å; F340-A349 HydrophobicContact CZ-CB 3.75Å; E345-A349 PolarHBondContact O-N 3.24Å; A346-A349 PolarHBondContact O-N 2.99Å; T347-A349 VanDerWaalsContact C-N 3.34Å; T347-A349 PolarHBondContact O-N 3.04Å; A349-M353 WeakPolarHBondContact O-CB 3.13Å; A349-M353 PolarHBondContact O-N 3.36Å
350	V	96.9	Very high	95.1	Very high	34 Å²	34	61 Å²	61	21%	0.206	34%	0.344	C	S	.	.	H	α-helix	trans	-61.3	-44.9	175.1	171.4	0	0	0	0	111.1	L296 A346 T347 K348 N354 V365	L296-V350 HydrophobicContact CD1-CG2 4.06Å; L296-V350 HydrophobicContact CD2-CG2 3.44Å; L296-V350 VanDerWaalsContact CD2-CG2 3.44Å; L296-V350 HydrophobicContact CG-CG2 4.36Å; A346-V350 WeakPolarHBondContact O-CG2 3.42Å; A346-V350 PolarHBondContact O-N 3.23Å; T347-V350 PolarHBondContact O-N 3.29Å; K348-V350 VanDerWaalsContact C-N 3.34Å; K348-V350 PolarHBondContact O-N 3.45Å; V350-N354 WeakPolarHBondContact O-CB 3.37Å; V350-N354 PolarHBondContact O-N 2.91Å; V350-V365 HydrophobicContact CG2-CG1 4.08Å
351	T	95.7	Very high	94.9	Very high	109 Å²	109	63.5 Å²	63.5	67%	0.669	35%	0.354	S	S	*	.	H	α-helix	trans	-64.8	-40.9	-178.9	-58.3	0	0	0	0	112.7	T347 K348	T347-T351 PolarHBondContact O-N 2.92Å; T347-T351 PolarHBondContact O-OG1 3.1Å; K348-T351 PolarHBondContact O-N 2.96Å
352	E	95.7	Very high	95	Very high	103 Å²	103	63.4 Å²	63.4	48%	0.481	35%	0.352	S	S	.	.	H	α-helix	trans	-90.7	-31	-173.7	-67.2	-171.7	-132.7	0	0	113.9	F317 K348	F317-E352 HydrophobicContact CD1-CB 4.32Å; F317-E352 HydrophobicContact CE1-CB 3.51Å; F317-E352 HydrophobicContact CE1-CG 4.09Å; F317-E352 WeakPolarHBondContact CE1-OE2 3.47Å; F317-E352 HydrophobicContact CZ-CB 4.03Å; K348-E352 WeakPolarHBondContact CE-OE1 3.33Å; K348-E352 WeakPolarHBondContact CG-OE1 3.47Å; K348-E352 PolarHBondContact O-N 2.92Å
353	M	96.6	Very high	95.1	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-95.4	-19.4	-175.9	-65.3	-66.8	-77.9	0	0	114	E313 F314 F317 A349 G355 R356 V358 L363 V365	E313-M353 HydrophobicContact CB-CE 4.04Å; F314-M353 HydrophobicContact CD1-CG 4.34Å; F314-M353 HydrophobicContact CD2-CE 4.2Å; F314-M353 HydrophobicContact CE1-CB 3.98Å; F314-M353 HydrophobicContact CE1-CG 3.97Å; F314-M353 HydrophobicContact CE2-CE 3.91Å; F314-M353 HydrophobicContact CZ-CB 4.05Å; F314-M353 HydrophobicContact CZ-CE 4.15Å; F314-M353 HydrophobicContact CZ-CG 4.24Å; F317-M353 HydrophobicContact CD2-CG 4Å; F317-M353 HydrophobicContact CE1-CG 4.42Å; F317-M353 HydrophobicContact CE2-CE 4.38Å; F317-M353 HydrophobicContact CE2-CG 3.23Å; F317-M353 HydrophobicContact CE2-SD 3.43Å; F317-M353 WeakPolarHBondContact CE2-SD 3.42Å; F317-M353 HydrophobicContact CZ-CG 3.48Å; F317-M353 VanDerWaalsContact CZ-CG 3.48Å; F317-M353 HydrophobicContact CZ-SD 3.53Å; F317-M353 VanDerWaalsContact CZ-SD 3.53Å; A349-M353 WeakPolarHBondContact O-CB 3.13Å; A349-M353 PolarHBondContact O-N 3.36Å; M353-G355 PolarHBondContact O-N 3.09Å; M353-R356 WeakPolarHBondContact O-CB 3.25Å; M353-R356 PolarHBondContact O-N 3.47Å; M353-R356 VanDerWaalsContact O-N 3.1Å; M353-R356 WeakPolarHBondContact SD-CD 3.41Å; M353-R356 PolarHBondContact SD-NH1 2.94Å; M353-V358 HydrophobicContact CE-CG2 4.29Å; M353-L363 HydrophobicContact CE-CD1 3.89Å; M353-V365 HydrophobicContact CB-CG2 3.86Å
354	N	96.2	Very high	95.2	Very high	79 Å²	79	65.5 Å²	65.5	42%	0.422	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	120.8	177.7	-172	44	0	0	0	110.6	V350 R356 V365	V350-N354 WeakPolarHBondContact O-CB 3.37Å; V350-N354 PolarHBondContact O-N 2.91Å; N354-R356 VanDerWaalsContact C-N 3.32Å; N354-V365 HydrophobicContact CB-CB 4.1Å; N354-V365 PolarHBondContact OD1-N 3.4Å; N354-V365 PolarHBondContact OD1-O 3.17Å
355	G	94.9	Very high	95.3	Very high	48 Å²	48	59.1 Å²	59.1	50%	0.495	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	86	-7.6	-174.3	0	0	0	0	0	114.8	M353 I357 L363	M353-G355 PolarHBondContact O-N 3.09Å; G355-I357 PolarHBondContact O-N 3.25Å; G355-L363 WeakPolarHBondContact CA-O 3.46Å; G355-L363 PolarHBondContact N-O 3.38Å
356	R	95.3	Very high	95.3	Very high	119 Å²	119	58.3 Å²	58.3	45%	0.449	32%	0.32	S	S	.	.			trans	-68.7	132.5	-179.7	-166.7	179	-174.9	-153.3	-2.9	110.5	M353 N354 V358 L363	M353-R356 WeakPolarHBondContact O-CB 3.25Å; M353-R356 PolarHBondContact O-N 3.47Å; M353-R356 VanDerWaalsContact O-N 3.1Å; M353-R356 WeakPolarHBondContact SD-CD 3.41Å; M353-R356 PolarHBondContact SD-NH1 2.94Å; N354-R356 VanDerWaalsContact C-N 3.32Å; R356-V358 PolarHBondContact O-N 3.35Å; R356-L363 PolarHBondContact O-N 2.8Å
357	I	94.1	Very high	95.2	Very high	119 Å²	119	62.5 Å²	62.5	61%	0.61	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	119.7	176	-58.8	173.6	0	0	0	108.9	G355 P362	G355-I357 PolarHBondContact O-N 3.25Å; I357-P362 HydrophobicContact CG1-CB 4.18Å
358	V	92	Very high	95.1	Very high	6 Å²	6	60.2 Å²	60.2	4%	0.036	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	124.9	173.5	179	0	0	0	0	107.8	I305 E313 M353 R356 T360 K361 L363	I305-V358 HydrophobicContact CD1-CB 4.49Å; I305-V358 HydrophobicContact CD1-CG1 3.8Å; E313-V358 HydrophobicContact CG-CG1 4Å; M353-V358 HydrophobicContact CE-CG2 4.29Å; R356-V358 PolarHBondContact O-N 3.35Å; V358-T360 PolarHBondContact O-N 3.19Å; V358-T360 VanDerWaalsContact O-N 3.11Å; V358-K361 PolarHBondContact N-O 3.23Å; V358-K361 PolarHBondContact O-N 3.33Å; V358-L363 HydrophobicContact CB-CD1 4.11Å; V358-L363 HydrophobicContact CB-CD2 4.33Å; V358-L363 HydrophobicContact CB-CG 4.12Å; V358-L363 HydrophobicContact CG2-CD1 3.52Å; V358-L363 HydrophobicContact CG2-CG 3.89Å
359	A	89.9	Confident	94.7	Very high	52 Å²	52	60.9 Å²	60.9	43%	0.43	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	-107.8	-164.5	0	0	0	0	0	111.3	D302	D302-A359 HydrophobicContact CB-CB 3.9Å
360	T	91.7	Very high	94.2	Very high	108 Å²	108	63.6 Å²	63.6	66%	0.663	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.9	-8.9	-175.8	70.2	0	0	0	0	114.1	D302 V358	D302-T360 PolarHBondContact OD2-OG1 3.02Å; V358-T360 PolarHBondContact O-N 3.19Å; V358-T360 VanDerWaalsContact O-N 3.11Å
361	K	93.5	Very high	93.7	Very high	55 Å²	55	70.6 Å²	70.6	24%	0.239	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	139.4	-168.4	-58.3	-176.3	-165.4	169.5	0	111.7	N300 L301 D303 V358	N300-K361 WeakPolarHBondContact O-CB 3.3Å; L301-K361 PolarHBondContact O-NZ 3.28Å; D303-K361 IonicContact OD1-NZ 2.65Å; D303-K361 PolarHBondContact OD1-NZ 2.84Å; V358-K361 PolarHBondContact N-O 3.23Å; V358-K361 PolarHBondContact O-N 3.33Å
362	P	95.9	Very high	93.2	Very high	64 Å²	64	71.1 Å²	71.1	42%	0.416	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	126.7	170.7	28.9	-32.8	0	0	0	110.5	N300 I357	N300-P362 WeakPolarHBondContact CB-O 3.34Å; N300-P362 PolarHBondContact ND2-O 3.4Å; I357-P362 HydrophobicContact CG1-CB 4.18Å
363	L	97.3	Very high	92.7	Very high	7 Å²	7	70.7 Å²	70.7	4%	0.037	37%	0.366	C	S	.	.			trans	-71.4	144.8	179.5	-62.6	-173.9	0	0	0	111.7	V298 L301 F314 M353 G355 R356 V358 V365	V298-L363 HydrophobicContact CG1-CD1 4.33Å; V298-L363 HydrophobicContact CG1-CD2 4.36Å; L301-L363 HydrophobicContact CD2-CD2 3.79Å; F314-L363 HydrophobicContact CE2-CD1 4.27Å; F314-L363 HydrophobicContact CZ-CD1 4.45Å; M353-L363 HydrophobicContact CE-CD1 3.89Å; G355-L363 WeakPolarHBondContact CA-O 3.46Å; G355-L363 PolarHBondContact N-O 3.38Å; R356-L363 PolarHBondContact O-N 2.8Å; V358-L363 HydrophobicContact CB-CD1 4.11Å; V358-L363 HydrophobicContact CB-CD2 4.33Å; V358-L363 HydrophobicContact CB-CG 4.12Å; V358-L363 HydrophobicContact CG2-CD1 3.52Å; V358-L363 HydrophobicContact CG2-CG 3.89Å; L363-V365 HydrophobicContact CB-CG2 4.12Å
364	Y	96.9	Very high	92.1	Very high	120 Å²	120	76.3 Å²	76.3	47%	0.471	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	120.2	162.2	173.6	-91.4	0	0	0	108.5	Y297 V298 K299 A366	Y297-Y364 HydrophobicContact CD1-CD1 4.1Å; Y297-Y364 HydrophobicContact CD1-CE1 4.01Å; Y297-Y364 HydrophobicContact CE1-CD1 4.17Å; Y297-Y364 HydrophobicContact CE1-CE1 4.23Å; V298-Y364 CarbonylContact C-O 3.52Å; V298-Y364 WeakPolarHBondContact CA-O 3.35Å; K299-Y364 HydrophobicContact CB-CD1 4.09Å; K299-Y364 PolarHBondContact N-O 3.29Å; K299-Y364 PolarHBondContact O-N 3.5Å; Y364-A366 HydrophobicContact CE1-CB 3.85Å
365	V	97.5	Very high	91.5	Very high	2 Å²	2	77.2 Å²	77.2	1%	0.012	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	125.1	-177.4	-171.5	0	0	0	0	109.2	L296 Y297 V298 F314 V350 M353 N354 L363	L296-V365 HydrophobicContact CB-CG1 4.38Å; L296-V365 HydrophobicContact CD1-CG1 3.93Å; Y297-V365 WeakPolarHBondContact O-CA 3.42Å; V298-V365 HydrophobicContact CG1-CG2 4.27Å; V298-V365 HydrophobicContact CG2-CG1 4.44Å; F314-V365 HydrophobicContact CE1-CG1 4.03Å; F314-V365 HydrophobicContact CE1-CG2 4.33Å; F314-V365 HydrophobicContact CZ-CG1 4.3Å; F314-V365 HydrophobicContact CZ-CG2 3.87Å; V350-V365 HydrophobicContact CG2-CG1 4.08Å; M353-V365 HydrophobicContact CB-CG2 3.86Å; N354-V365 HydrophobicContact CB-CB 4.1Å; N354-V365 PolarHBondContact OD1-N 3.4Å; N354-V365 PolarHBondContact OD1-O 3.17Å; L363-V365 HydrophobicContact CB-CG2 4.12Å
366	A	95.8	Very high	91	Very high	23 Å²	23	77 Å²	77	19%	0.19	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	164.6	177.4	0	0	0	0	0	110.7	L296 Y297 Y364 A368	L296-A366 CarbonylContact C-O 3.4Å; L296-A366 WeakPolarHBondContact CA-O 3.4Å; Y297-A366 PolarHBondContact N-O 2.97Å; Y297-A366 PolarHBondContact O-N 3.19Å; Y364-A366 HydrophobicContact CE1-CB 3.85Å; A366-A368 PolarHBondContact O-N 2.72Å
367	L	94.2	Very high	90.4	Very high	87 Å²	87	77.1 Å²	77.1	46%	0.455	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	132.7	169.2	-67.4	176	0	0	0	110	L296 Q369	L296-L367 HydrophobicContact CD2-CD2 3.82Å; L367-Q369 PolarHBondContact O-N 3.08Å
368	A	92.6	Very high	89.9	Confident	28 Å²	28	76.1 Å²	76.1	23%	0.231	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-67.9	118.4	-177.4	0	0	0	0	0	110.6	N295 F337 A366	N295-A368 HydrophobicContact CB-CB 4.09Å; N295-A368 WeakPolarHBondContact O-CB 3.33Å; N295-A368 PolarHBondContact O-N 3.28Å; F337-A368 HydrophobicContact CD1-CB 3.99Å; F337-A368 HydrophobicContact CE1-CB 3.97Å; A366-A368 PolarHBondContact O-N 2.72Å
369	Q	89.4	Confident	89.5	Confident	115 Å²	115	79.1 Å²	79.1	54%	0.537	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-90.9	139.8	171.6	-65.4	179.7	-9.8	0	0	110.1	L367 R374	L367-Q369 PolarHBondContact O-N 3.08Å; Q369-R374 HydrophobicContact CB-CB 4.33Å
370	R	86.4	Confident	89.2	Confident	58 Å²	58	81 Å²	81	22%	0.219	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-70.9	149.8	176.3	-71.5	172.6	157.4	-134.8	-11.7	110.8	R287 I288 E372 E373 R374	R287-R370 PolarHBondContact O-NH2 3.25Å; I288-R370 VanDerWaalsContact CG1-CZ 3.41Å; I288-R370 VanDerWaalsContact CG1-NH2 3.34Å; R370-E372 VanDerWaalsContact C-N 3.27Å; R370-E372 PolarHBondContact O-N 3.07Å; R370-E373 HydrophobicContact CB-CB 4.3Å; R370-E373 HydrophobicContact CB-CG 4.29Å; R370-E373 PolarHBondContact O-N 2.96Å; R370-R374 WeakPolarHBondContact O-CB 3.37Å; R370-R374 PolarHBondContact O-N 3.48Å
371	K	85.9	Confident	88.9	Confident	181 Å²	181	80.7 Å²	80.7	79%	0.787	40%	0.396	S	S	*	.	H	α-helix	trans	-52.6	-46.2	179.3	-173	-179.2	177.7	-175.1	0	111.9	R374 Q375	K371-R374 PolarHBondContact O-N 3.42Å; K371-Q375 VanDerWaalsContact O-CB 3.3Å; K371-Q375 WeakPolarHBondContact O-CB 3.32Å; K371-Q375 PolarHBondContact O-N 2.86Å
372	E	85.3	Confident	88.3	Confident	120 Å²	120	82.7 Å²	82.7	56%	0.561	40%	0.403	S	S	*	.	H	α-helix	trans	-63.8	-49.9	179.8	-65.5	153.9	-172.8	0	0	111.9	R370 R374 Q375 A376	R370-E372 VanDerWaalsContact C-N 3.27Å; R370-E372 PolarHBondContact O-N 3.07Å; E372-R374 VanDerWaalsContact C-N 3.34Å; E372-R374 PolarHBondContact O-N 3.47Å; E372-Q375 PolarHBondContact O-N 3Å; E372-A376 WeakPolarHBondContact O-CB 3.36Å; E372-A376 PolarHBondContact O-N 2.88Å
373	E	84.3	Confident	87.5	Confident	93 Å²	93	85.2 Å²	85.2	44%	0.435	41%	0.411	S	S	.	.	H	α-helix	trans	-63.4	-41.5	177.2	-71.7	172.9	-176.4	0	0	111.5	R370 A376 H377	R370-E373 HydrophobicContact CB-CB 4.3Å; R370-E373 HydrophobicContact CB-CG 4.29Å; R370-E373 PolarHBondContact O-N 2.96Å; E373-A376 PolarHBondContact O-N 2.82Å; E373-H377 WeakPolarHBondContact O-CB 3.39Å; E373-H377 PolarHBondContact O-N 3.24Å; E373-H377 PolarHBondContact O-ND1 2.68Å
374	R	85.7	Confident	86.7	Confident	118 Å²	118	91.5 Å²	91.5	45%	0.445	44%	0.44	S	S	.	.	H	α-helix	trans	-63.9	-43.1	177.8	-171.1	-177.4	-167.5	177	6.8	111	Q369 R370 K371 E372 H377 L378	Q369-R374 HydrophobicContact CB-CB 4.33Å; R370-R374 WeakPolarHBondContact O-CB 3.37Å; R370-R374 PolarHBondContact O-N 3.48Å; K371-R374 PolarHBondContact O-N 3.42Å; E372-R374 VanDerWaalsContact C-N 3.34Å; E372-R374 PolarHBondContact O-N 3.47Å; R374-H377 PolarHBondContact O-N 2.94Å; R374-L378 HydrophobicContact CG-CD1 3.99Å; R374-L378 WeakPolarHBondContact O-CB 3.17Å; R374-L378 WeakPolarHBondContact O-CD1 3.22Å; R374-L378 VanDerWaalsContact O-CG 3.28Å; R374-L378 WeakPolarHBondContact O-CG 3.36Å; R374-L378 PolarHBondContact O-N 2.74Å
375	Q	83.4	Confident	85.8	Confident	98 Å²	98	93.1 Å²	93.1	46%	0.458	45%	0.445	S	S	.	.	H	α-helix	trans	-62.6	-47.1	175.5	-173	173.6	7.4	0	0	110.3	K371 E372 H377 L378 T379	K371-Q375 VanDerWaalsContact O-CB 3.3Å; K371-Q375 WeakPolarHBondContact O-CB 3.32Å; K371-Q375 PolarHBondContact O-N 2.86Å; E372-Q375 PolarHBondContact O-N 3Å; Q375-H377 VanDerWaalsContact C-N 3.35Å; Q375-H377 PolarHBondContact O-N 2.79Å; Q375-L378 PolarHBondContact O-N 2.61Å; Q375-T379 WeakPolarHBondContact O-CB 3.33Å; Q375-T379 PolarHBondContact O-N 3.08Å; Q375-T379 PolarHBondContact O-OG1 3.44Å
376	A	84.3	Confident	84.6	Confident	45 Å²	45	96.5 Å²	96.5	37%	0.372	46%	0.462	S	S	.	.	H	α-helix	trans	-60.4	-41.5	176.1	0	0	0	0	0	112.7	E372 E373 T379 N380	E372-A376 WeakPolarHBondContact O-CB 3.36Å; E372-A376 PolarHBondContact O-N 2.88Å; E373-A376 PolarHBondContact O-N 2.82Å; A376-T379 PolarHBondContact O-N 3.37Å; A376-N380 VanDerWaalsContact O-CB 3.3Å; A376-N380 WeakPolarHBondContact O-CB 3.39Å; A376-N380 VanDerWaalsContact O-CG 3.32Å; A376-N380 PolarHBondContact O-N 2.75Å; A376-N380 PolarHBondContact O-ND2 3.49Å
377	H	82.1	Confident	83	Confident	121 Å²	121	98.5 Å²	98.5	56%	0.56	48%	0.478	S	S	*	.	H	α-helix	trans	-63.8	-43.3	174.9	-80.3	81.5	0	0	0	111.8	E373 R374 Q375 N380 Q381	E373-H377 WeakPolarHBondContact O-CB 3.39Å; E373-H377 PolarHBondContact O-N 3.24Å; E373-H377 PolarHBondContact O-ND1 2.68Å; R374-H377 PolarHBondContact O-N 2.94Å; Q375-H377 VanDerWaalsContact C-N 3.35Å; Q375-H377 PolarHBondContact O-N 2.79Å; H377-N380 PolarHBondContact O-N 2.9Å; H377-Q381 VanDerWaalsContact O-CB 3.3Å; H377-Q381 WeakPolarHBondContact O-CB 3.25Å; H377-Q381 PolarHBondContact O-N 2.79Å
378	L	83.3	Confident	81.4	Confident	98 Å²	98	98.2 Å²	98.2	51%	0.513	48%	0.483	S	S	.	.	H	α-helix	trans	-64.2	-44.8	176.4	-76.8	161.1	0	0	0	111.7	R374 Q375 Q381 Y382	R374-L378 HydrophobicContact CG-CD1 3.99Å; R374-L378 WeakPolarHBondContact O-CB 3.17Å; R374-L378 WeakPolarHBondContact O-CD1 3.22Å; R374-L378 VanDerWaalsContact O-CG 3.28Å; R374-L378 WeakPolarHBondContact O-CG 3.36Å; R374-L378 PolarHBondContact O-N 2.74Å; Q375-L378 PolarHBondContact O-N 2.61Å; L378-Q381 PolarHBondContact O-N 3.44Å; L378-Y382 WeakPolarHBondContact O-CB 3.35Å; L378-Y382 PolarHBondContact O-N 3.44Å
379	T	85	Confident	79.8	Confident	69 Å²	69	101.4 Å²	101.4	42%	0.423	50%	0.5	S	S	.	.	H	α-helix	trans	-62.6	-45	176.5	-58.4	0	0	0	0	111.2	Q375 A376 Q381 Y382 M383	Q375-T379 WeakPolarHBondContact O-CB 3.33Å; Q375-T379 PolarHBondContact O-N 3.08Å; Q375-T379 PolarHBondContact O-OG1 3.44Å; A376-T379 PolarHBondContact O-N 3.37Å; T379-Q381 VanDerWaalsContact C-N 3.35Å; T379-Q381 PolarHBondContact O-N 3.2Å; T379-Y382 WeakPolarHBondContact O-CB 3.05Å; T379-Y382 PolarHBondContact O-N 2.96Å; T379-M383 HydrophobicContact CG2-SD 4.38Å; T379-M383 WeakPolarHBondContact O-CB 3.49Å; T379-M383 WeakPolarHBondContact O-CG 3.43Å; T379-M383 PolarHBondContact O-N 3.28Å
380	N	83.7	Confident	78	Confident	92 Å²	92	102.8 Å²	102.8	49%	0.492	50%	0.5	S	S	.	.	H	α-helix	trans	-63	-40.9	175.4	-79.9	-29.7	0	0	0	112	A376 H377 Y382 M383 Q384	A376-N380 VanDerWaalsContact O-CB 3.3Å; A376-N380 WeakPolarHBondContact O-CB 3.39Å; A376-N380 VanDerWaalsContact O-CG 3.32Å; A376-N380 PolarHBondContact O-N 2.75Å; A376-N380 PolarHBondContact O-ND2 3.49Å; H377-N380 PolarHBondContact O-N 2.9Å; N380-Y382 VanDerWaalsContact C-N 3.33Å; N380-Y382 PolarHBondContact O-N 2.9Å; N380-M383 PolarHBondContact O-N 3.1Å; N380-Q384 WeakPolarHBondContact O-CB 3.2Å; N380-Q384 VanDerWaalsContact O-CG 3.28Å; N380-Q384 WeakPolarHBondContact O-CG 3.34Å; N380-Q384 PolarHBondContact O-N 2.88Å
381	Q	83.7	Confident	76.1	Confident	100 Å²	100	103.6 Å²	103.6	47%	0.467	52%	0.519	S	S	.	.	H	α-helix	trans	-65.8	-37.8	177.1	-164.9	177.5	41.1	0	0	111.6	H377 L378 T379 R385	H377-Q381 VanDerWaalsContact O-CB 3.3Å; H377-Q381 WeakPolarHBondContact O-CB 3.25Å; H377-Q381 PolarHBondContact O-N 2.79Å; L378-Q381 PolarHBondContact O-N 3.44Å; T379-Q381 VanDerWaalsContact C-N 3.35Å; T379-Q381 PolarHBondContact O-N 3.2Å; Q381-R385 WeakPolarHBondContact O-CG 3.32Å; Q381-R385 PolarHBondContact O-N 3.23Å; Q381-R385 VanDerWaalsContact O-N 3.09Å
382	Y	80.8	Confident	74.1	Confident	98 Å²	98	100.5 Å²	100.5	38%	0.384	52%	0.515	S	S	.	.	H	α-helix	trans	-64.7	-47.2	173.5	-176.9	-97	0	0	0	111.8	L378 T379 N380 Q384 R385 M386 Q534	L378-Y382 WeakPolarHBondContact O-CB 3.35Å; L378-Y382 PolarHBondContact O-N 3.44Å; T379-Y382 WeakPolarHBondContact O-CB 3.05Å; T379-Y382 PolarHBondContact O-N 2.96Å; N380-Y382 VanDerWaalsContact C-N 3.33Å; N380-Y382 PolarHBondContact O-N 2.9Å; Y382-Q384 PolarHBondContact O-N 3.46Å; Y382-R385 PolarHBondContact O-N 3.4Å; Y382-M386 HydrophobicContact CD1-CG 4.48Å; Y382-M386 HydrophobicContact CE1-CG 4.19Å; Y382-M386 PolarHBondContact O-N 3.15Å; Y382-Q534 HydrophobicContact CE2-CG 3.99Å; Y382-Q534 PolarHBondContact OH-OE1 3.19Å
383	M	81.1	Confident	72.1	Confident	116 Å²	116	100.6 Å²	100.6	57%	0.571	53%	0.526	S	S	*	.	H	α-helix	trans	-61.3	-41	176.3	-76.8	-178.9	59.2	0	0	112.6	T379 N380 M386 A387	T379-M383 HydrophobicContact CG2-SD 4.38Å; T379-M383 WeakPolarHBondContact O-CB 3.49Å; T379-M383 WeakPolarHBondContact O-CG 3.43Å; T379-M383 PolarHBondContact O-N 3.28Å; N380-M383 PolarHBondContact O-N 3.1Å; M383-M386 PolarHBondContact O-N 2.87Å; M383-A387 PolarHBondContact O-N 3.15Å
384	Q	79.1	Confident	69.9	Low	139 Å²	139	103.4 Å²	103.4	65%	0.65	54%	0.544	S	S	*	.	H	α-helix	trans	-64.7	-41.7	176.6	-76.2	176.1	-2	0	0	112	N380 Y382 M386 A387 S388	N380-Q384 WeakPolarHBondContact O-CB 3.2Å; N380-Q384 VanDerWaalsContact O-CG 3.28Å; N380-Q384 WeakPolarHBondContact O-CG 3.34Å; N380-Q384 PolarHBondContact O-N 2.88Å; Y382-Q384 PolarHBondContact O-N 3.46Å; Q384-M386 VanDerWaalsContact C-N 3.32Å; Q384-M386 PolarHBondContact O-N 3.44Å; Q384-A387 PolarHBondContact O-N 3.39Å; Q384-S388 PolarHBondContact O-N 3.05Å; Q384-S388 VanDerWaalsContact O-N 3.13Å; Q384-S388 PolarHBondContact O-OG 2.82Å
385	R	78.4	Confident	68.1	Low	154 Å²	154	103.1 Å²	103.1	58%	0.581	56%	0.558	S	S	*	*	H	α-helix	trans	-61.8	-40	173.8	-76.7	-172.9	-168.7	-178.9	5.1	112	Q381 Y382 S388 V389	Q381-R385 WeakPolarHBondContact O-CG 3.32Å; Q381-R385 PolarHBondContact O-N 3.23Å; Q381-R385 VanDerWaalsContact O-N 3.09Å; Y382-R385 PolarHBondContact O-N 3.4Å; R385-S388 PolarHBondContact O-OG 2.78Å; R385-V389 WeakPolarHBondContact O-CG2 3.5Å
386	M	71.4	Confident	66	Low	74 Å²	74	105.1 Å²	105.1	37%	0.365	58%	0.576	S	S	.	*	H	α-helix	trans	-65.6	-40.2	175.4	-80.7	-79.6	99.6	0	0	112.5	Y382 M383 Q384 S388 V389 Q534	Y382-M386 HydrophobicContact CD1-CG 4.48Å; Y382-M386 HydrophobicContact CE1-CG 4.19Å; Y382-M386 PolarHBondContact O-N 3.15Å; M383-M386 PolarHBondContact O-N 2.87Å; Q384-M386 VanDerWaalsContact C-N 3.32Å; Q384-M386 PolarHBondContact O-N 3.44Å; M386-S388 PolarHBondContact O-N 2.86Å; M386-V389 PolarHBondContact O-N 2.78Å; M386-Q534 HydrophobicContact CE-CB 4.32Å; M386-Q534 HydrophobicContact CE-CG 4.15Å; M386-Q534 VanDerWaalsContact CG-OE1 3.29Å; M386-Q534 PolarHBondContact SD-OE1 3Å
387	A	63.1	Low	64	Low	64 Å²	64	110.4 Å²	110.4	53%	0.529	60%	0.597	S	S	.	*	H	α-helix	trans	-64.9	-37.6	178.7	0	0	0	0	0	112.8	M383 Q384 V389 R390	M383-A387 PolarHBondContact O-N 3.15Å; Q384-A387 PolarHBondContact O-N 3.39Å; A387-V389 PolarHBondContact O-N 3.4Å; A387-R390 PolarHBondContact O-N 2.89Å
388	S	61.3	Low	62	Low	81 Å²	81	111.3 Å²	111.3	57%	0.566	61%	0.606	S	S	*	*	H	α-helix	trans	-66.1	-21.4	176.4	47.2	0	0	0	0	114.2	Q384 R385 M386	Q384-S388 PolarHBondContact O-N 3.05Å; Q384-S388 VanDerWaalsContact O-N 3.13Å; Q384-S388 PolarHBondContact O-OG 2.82Å; R385-S388 PolarHBondContact O-OG 2.78Å; M386-S388 PolarHBondContact O-N 2.86Å
389	V	58.7	Low	60	Low	96 Å²	96	112 Å²	112	58%	0.582	62%	0.616	S	S	*	*	H	α-helix	trans	-81	-22.3	177.4	179	0	0	0	0	111.9	R385 M386 A387	R385-V389 WeakPolarHBondContact O-CG2 3.5Å; M386-V389 PolarHBondContact O-N 2.78Å; A387-V389 PolarHBondContact O-N 3.4Å
390	R	50.6	Low	57.9	Low	143 Å²	143	119.3 Å²	119.3	54%	0.54	64%	0.637	S	S	.	*	S	Bend	trans	-87.9	-7.3	175.3	-81.9	-159.7	-163.8	135	41.2	115.3	A387 V392 S548	A387-R390 PolarHBondContact O-N 2.89Å; R390-V392 PolarHBondContact O-N 3.42Å; R390-S548 VanDerWaalsContact CZ-CA 3.4Å; R390-S548 PolarHBondContact NE-OG 2.86Å; R390-S548 PolarHBondContact NH2-OG 3.15Å
391	A	48.1	Very low	56	Low	76 Å²	76	124 Å²	124	63%	0.628	66%	0.656	S	S	*	*			trans	-90.4	11.5	-172.2	0	0	0	0	0	114.7	P393	A391-P393 VanDerWaalsContact O-CD 3.27Å; A391-P393 WeakPolarHBondContact O-CD 3.34Å
392	V	42.9	Very low	53.8	Low	116 Å²	116	125.2 Å²	125.2	70%	0.703	67%	0.673	S	S	*	*			trans	-77.5	111.9	167.6	-94.7	0	0	0	0	109.3	R390 N394	R390-V392 PolarHBondContact O-N 3.42Å; V392-N394 PolarHBondContact O-N 2.96Å
393	P	43.2	Very low	52.3	Low	121 Å²	121	125.2 Å²	125.2	79%	0.786	69%	0.693	S	S	*	*			trans	-82.3	110.2	179.3	6.8	11.7	0	0	0	108.8	A391	A391-P393 VanDerWaalsContact O-CD 3.27Å; A391-P393 WeakPolarHBondContact O-CD 3.34Å
394	N	39.4	Very low	50.7	Low	152 Å²	152	125.6 Å²	125.6	81%	0.813	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-73.8	132.1	165.1	-104.8	32.1	0	0	0	109.2	V392	V392-N394 PolarHBondContact O-N 2.96Å
395	P	46.1	Very low	48.9	Very low	112 Å²	112	124.4 Å²	124.4	73%	0.727	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-70.4	136.8	179.3	28.2	-31.4	0	0	0	110.9	I397	P395-I397 PolarHBondContact O-N 2.83Å
396	V	39.7	Very low	47.2	Very low	140 Å²	140	123.1 Å²	123.1	85%	0.848	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-60	120.3	-179.9	179.6	0	0	0	0	110.4
397	I	43.3	Very low	45.6	Very low	157 Å²	157	122.7 Å²	122.7	81%	0.805	74%	0.738	S	S	*	*			trans	-118.4	124.3	165.6	-67	178.7	0	0	0	108.8	P395	P395-I397 PolarHBondContact O-N 2.83Å
398	N	40.3	Very low	44.5	Very low	140 Å²	140	129.8 Å²	129.8	75%	0.749	75%	0.753	S	S	*	*			trans	-73.3	130.5	-174	-148.6	49.9	0	0	0	111.2
399	P	39.9	Very low	43.4	Very low	113 Å²	113	134.2 Å²	134.2	73%	0.734	76%	0.762	S	S	*	*			trans	-104.5	105.2	178.2	33.9	-24	0	0	0	111.9
400	Y	41.4	Very low	42.4	Very low	221 Å²	221	137.7 Å²	137.7	87%	0.867	77%	0.774	S	S	*	*			trans	-148.1	96.1	155.7	-100.7	-83.2	0	0	0	108.5
401	Q	43.1	Very low	41.8	Very low	190 Å²	190	135.7 Å²	135.7	89%	0.888	79%	0.788	S	S	*	*			trans	166	135.2	136.5	-96.2	-171.7	-42.2	0	0	111.1
402	P	39.4	Very low	41.4	Very low	126 Å²	126	137 Å²	137	82%	0.818	80%	0.799	S	S	*	*			trans	-104.8	139.6	-178.9	37	-27.6	0	0	0	112.8
403	A	48.3	Very low	41.4	Very low	98 Å²	98	139 Å²	139	81%	0.81	80%	0.804	S	S	*	*			trans	-173.6	156.8	158.7	0	0	0	0	0	110.8
404	P	46.8	Very low	41.3	Very low	124 Å²	124	138.2 Å²	138.2	81%	0.805	80%	0.799	S	S	*	*				-115.8	-177.2	-118.6	44.2	-33.8	0	0	0	113.9
405	P	41.2	Very low	41.4	Very low	115 Å²	115	139 Å²	139	75%	0.747	80%	0.798	S	S	*	*			trans	-92.2	159.6	-144	38.4	-38.1	0	0	0	114
406	S	43.7	Very low	40.9	Very low	127 Å²	127	139.2 Å²	139.2	89%	0.888	80%	0.797	S	S	*	*			trans	174.5	136	137.2	-80.5	0	0	0	0	113
407	G	37.6	Very low	41	Very low	65 Å²	65	142.2 Å²	142.2	67%	0.67	80%	0.802	S	S	*	*			trans	107.3	84	134.9	0	0	0	0	0	119.6
408	Y	40	Very low	40.6	Very low	213 Å²	213	142 Å²	142	84%	0.835	80%	0.802	S	S	*	*				37.8	128.5	120.7	-78.1	-73.4	0	0	0	118.6
409	F	38.6	Very low	40.4	Very low	174 Å²	174	147.5 Å²	147.5	76%	0.763	81%	0.812	S	S	*	*				174.9	168.6	56.7	-138.4	-82.9	0	0	0	109.4
410	M	37.3	Very low	40.1	Very low	168 Å²	168	146.7 Å²	146.7	83%	0.828	82%	0.815	S	S	*	*			trans	-60.7	155	-167.1	-62.3	165.1	116.7	0	0	118.7
411	A	36.6	Very low	40	Very low	102 Å²	102	140.7 Å²	140.7	84%	0.843	81%	0.812	S	S	*	*			trans	-99	141.3	165.1	0	0	0	0	0	112
412	A	40.1	Very low	39.8	Very low	102 Å²	102	141 Å²	141	84%	0.843	81%	0.806	S	S	*	*			trans	-106.4	137	167.4	0	0	0	0	0	110.8
413	I	44.3	Very low	40	Very low	160 Å²	160	143.8 Å²	143.8	82%	0.821	80%	0.802	S	S	*	*			trans	-69.9	169.9	167.6	-14.2	175.8	0	0	0	107.7
414	P	41.1	Very low	39.7	Very low	104 Å²	104	144.2 Å²	144.2	68%	0.675	80%	0.796	S	S	*	*			cis	-155.5	-168.3	18.8	40	-14.3	0	0	0	119.4
415	Q	39.6	Very low	39.8	Very low	169 Å²	169	143.5 Å²	143.5	79%	0.79	79%	0.791	S	S	*	*			trans	102.5	101.9	142.4	-90.2	-176.2	-44.1	0	0	121.8
416	T	36.7	Very low	39.8	Very low	116 Å²	116	143 Å²	143	71%	0.712	79%	0.791	S	S	*	*				24	128.9	127.2	71.5	0	0	0	0	121.1
417	Q	40.9	Very low	39.8	Very low	202 Å²	202	146 Å²	146	94%	0.944	79%	0.791	S	S	*	*				-171.5	156.9	117.7	-106.6	178.8	13	0	0	112.6
418	N	35	Very low	40	Very low	154 Å²	154	150.6 Å²	150.6	82%	0.824	80%	0.798	S	S	*	*			trans	-118.3	134.1	-157.9	-174.3	14.2	0	0	0	109.2
419	R	36.9	Very low	40	Very low	254 Å²	254	145.1 Å²	145.1	96%	0.958	80%	0.797	S	S	*	*			trans	-170.2	145.3	147	-123.1	-179.3	162.4	135.5	-2.7	114.8
420	A	34.4	Very low	40.2	Very low	96 Å²	96	145.1 Å²	145.1	79%	0.793	80%	0.799	S	S	*	*			trans	-97.4	160.3	-168.7	0	0	0	0	0	115.1
421	A	39	Very low	40.4	Very low	96 Å²	96	145.3 Å²	145.3	79%	0.793	80%	0.803	S	S	*	*			trans	-174.3	155.6	153.4	0	0	0	0	0	108.4
422	Y	38.6	Very low	40.5	Very low	195 Å²	195	151.8 Å²	151.8	77%	0.765	81%	0.806	S	S	*	*			cis	-178.5	128.3	-30.7	-138.7	-117	0	0	0	103.6
423	Y	42.2	Very low	40.5	Very low	186 Å²	186	152.9 Å²	152.9	73%	0.729	80%	0.804	S	S	*	*			trans	89	152.2	146.4	-84.3	-113.9	0	0	0	124
424	P	42.2	Very low	40.4	Very low	106 Å²	106	151 Å²	151	69%	0.688	81%	0.805	S	S	*	*				-135.9	-132.5	-129	31.7	-1.4	0	0	0	113.9
425	P	49.2	Very low	40.5	Very low	109 Å²	109	152.3 Å²	152.3	71%	0.708	81%	0.814	S	S	*	*				-121.9	171.6	-106	39.6	-20.9	0	0	0	115.4
426	S	41.9	Very low	40.2	Very low	105 Å²	105	154.7 Å²	154.7	73%	0.734	82%	0.816	S	S	*	*			trans	158.8	129.7	138	48.7	0	0	0	0	113.4
427	Q	43.9	Very low	40.2	Very low	190 Å²	190	161.3 Å²	161.3	89%	0.888	83%	0.828	S	S	*	*				164.3	146.3	113.3	-82.6	-166.3	49.1	0	0	112.7
428	I	40.8	Very low	40.1	Very low	161 Å²	161	156.9 Å²	156.9	83%	0.826	81%	0.814	S	S	*	*			trans	-93.8	145.6	-161.9	-74.9	161	0	0	0	111
429	A	40.9	Very low	40.3	Very low	99 Å²	99	154.1 Å²	154.1	82%	0.818	81%	0.813	S	S	*	*			trans	-175.3	140.7	132	0	0	0	0	0	112.8
430	Q	42.4	Very low	40.5	Very low	173 Å²	173	151.8 Å²	151.8	81%	0.808	81%	0.813	S	S	*	*			trans	-88.5	156.2	-171.9	-58.4	175.8	-29.9	0	0	112.5
431	L	41.4	Very low	40.6	Very low	173 Å²	173	151 Å²	151	91%	0.906	81%	0.814	S	S	*	*				161.3	143.7	121.4	-83.4	154	0	0	0	112.9
432	R	38.1	Very low	40.8	Very low	237 Å²	237	151 Å²	151	89%	0.894	81%	0.814	S	S	*	*			trans	-67.8	157.7	-171.9	-76.4	171.4	154.6	160.8	-6.3	115.5
433	P	41	Very low	40.9	Very low	126 Å²	126	153.2 Å²	153.2	82%	0.818	82%	0.821	S	S	*	*			trans	-107.9	140.3	157.5	33.2	-21.7	0	0	0	113.9
434	S	42.1	Very low	41.1	Very low	119 Å²	119	150.4 Å²	150.4	83%	0.832	83%	0.825	S	S	*	*			trans	-105.5	145.5	160.6	-68.6	0	0	0	0	109.5
435	P	43.8	Very low	41.6	Very low	132 Å²	132	154.4 Å²	154.4	86%	0.857	84%	0.835	S	S	*	*			trans	-98.9	135.9	-173.6	34.7	-29.4	0	0	0	113.9
436	R	33.4	Very low	41.5	Very low	220 Å²	220	154.7 Å²	154.7	83%	0.83	84%	0.836	S	S	*	*			trans	-148.4	116.3	162.8	-170.9	-179.6	-170.8	-179.9	2.5	109.2
437	W	36.2	Very low	41.9	Very low	255 Å²	255	159.7 Å²	159.7	97%	0.966	85%	0.845	S	S	*	*			trans	-122.7	122.9	162.3	-83.4	101.5	0	0	0	109.9
438	T	40	Very low	42	Very low	108 Å²	108	157.9 Å²	157.9	66%	0.663	84%	0.837	S	S	*	*			trans	-91.5	157.6	169.1	40.7	0	0	0	0	110.4
439	A	39.1	Very low	42.2	Very low	97 Å²	97	156.8 Å²	156.8	80%	0.802	83%	0.833	S	S	*	*			trans	-63.7	149.4	-175	0	0	0	0	0	116.7
440	Q	39.7	Very low	42.8	Very low	204 Å²	204	160.9 Å²	160.9	95%	0.953	84%	0.837	S	S	*	*			trans	-152.8	139.2	147.3	-75.8	-177.9	-21.1	0	0	104.5
441	G	37.8	Very low	42.8	Very low	79 Å²	79	158.6 Å²	158.6	81%	0.814	84%	0.838	S	S	*	*			cis	147.1	119.2	9.7	0	0	0	0	0	106.2
442	A	42.8	Very low	43.1	Very low	96 Å²	96	154.1 Å²	154.1	79%	0.793	83%	0.833	S	S	*	*			trans	-161.8	101.1	167	0	0	0	0	0	113.4
443	R	40.9	Very low	43.4	Very low	243 Å²	243	146.9 Å²	146.9	92%	0.917	82%	0.824	S	S	*	*			trans	56.5	129.2	140.1	-60.2	-174.7	176	-163.1	-1.8	122.4
444	P	45.4	Very low	43.7	Very low	126 Å²	126	148.3 Å²	148.3	82%	0.818	82%	0.823	S	S	*	*			trans	-114.4	151.2	149.8	34.9	-22.3	0	0	0	113.2
445	H	54	Low	44	Very low	191 Å²	191	154.1 Å²	154.1	88%	0.884	83%	0.826	S	S	*	*			trans	-89.3	146.8	172.7	-71.5	-80.8	0	0	0	112
446	P	47	Very low	44.1	Very low	114 Å²	114	153.5 Å²	153.5	74%	0.74	82%	0.822	S	S	*	*			trans	-113.8	147.2	164.5	36.3	-24.5	0	0	0	112.7
447	F	49.1	Very low	44.5	Very low	210 Å²	210	147.7 Å²	147.7	92%	0.921	82%	0.822	S	S	*	*			trans	-143.5	154.6	157.3	-122.6	-89.3	0	0	0	111.2
448	Q	46.5	Very low	45.1	Very low	152 Å²	152	140.4 Å²	140.4	71%	0.71	82%	0.816	S	S	*	*			trans	-89.6	162	-147.1	-97.8	160.8	-66.3	0	0	118.9
449	N	45.1	Very low	45.5	Very low	138 Å²	138	140.6 Å²	140.6	74%	0.738	82%	0.819	S	S	*	*			trans	80.9	110	140.1	-74.5	5.7	0	0	0	122.7
450	M	53.5	Low	46	Very low	185 Å²	185	147 Å²	147	91%	0.911	82%	0.822	S	S	*	*				175.7	131.5	119.8	-103.2	-77	-173.8	0	0	110.6
451	P	41.7	Very low	46.5	Very low	126 Å²	126	142.3 Å²	142.3	82%	0.818	81%	0.809	S	S	*	*			trans	-121.6	154	171.4	37.7	-24.7	0	0	0	114.9
452	G	47.1	Very low	46.9	Very low	78 Å²	78	144.5 Å²	144.5	80%	0.804	81%	0.809	S	S	*	*			trans	127.8	134.2	168.9	0	0	0	0	0	111.5
453	A	45.9	Very low	47.2	Very low	85 Å²	85	149.2 Å²	149.2	70%	0.702	81%	0.812	S	S	*	*			cis	-163.6	141.8	8	0	0	0	0	0	109.7
454	I	47	Very low	47.3	Very low	157 Å²	157	142.2 Å²	142.2	81%	0.805	80%	0.8	S	S	*	*			trans	54.4	108.3	131.6	-52	164.5	0	0	0	118.9
455	R	47.6	Very low	47	Very low	240 Å²	240	142.4 Å²	142.4	91%	0.906	80%	0.799	S	S	*	*				179.8	139.6	115.5	-100.3	179.8	158.1	-161.3	-9	113.6
456	P	45.4	Very low	46.7	Very low	119 Å²	119	142.7 Å²	142.7	77%	0.773	80%	0.803	S	S	*	*			trans	-110.7	166.8	-175.8	40.8	-31.7	0	0	0	115.2
457	A	42.9	Very low	46.5	Very low	99 Å²	99	148.2 Å²	148.2	82%	0.818	81%	0.809	S	S	*	*			trans	68	118.8	141.5	0	0	0	0	0	121.7
458	A	49.1	Very low	46.6	Very low	101 Å²	101	143.2 Å²	143.2	84%	0.835	80%	0.798	S	S	*	*			trans	-163.5	128.6	131.1	0	0	0	0	0	110.9
459	P	48.3	Very low	46.5	Very low	112 Å²	112	140.3 Å²	140.3	73%	0.727	80%	0.8	S	S	*	*			trans	-122.5	164.9	169.9	38.5	-26.3	0	0	0	114.4
460	R	50.1	Low	46.3	Very low	233 Å²	233	139 Å²	139	88%	0.879	80%	0.801	S	S	*	*			trans	88.3	164.7	161.6	-58.1	-178.5	178.8	-120.6	-0.1	117.7
461	P	49.5	Very low	46	Very low	105 Å²	105	135.7 Å²	135.7	68%	0.682	80%	0.797	S	S	*	*			cis	-133.1	179.2	-15.7	20.2	4.8	0	0	0	114.3
462	P	46.1	Very low	46.1	Very low	124 Å²	124	138.5 Å²	138.5	81%	0.805	80%	0.799	S	S	*	*			trans	-94.4	156.3	172	36.6	-29.8	0	0	0	113.3
463	F	49.3	Very low	45.8	Very low	196 Å²	196	141.5 Å²	141.5	86%	0.86	80%	0.802	S	S	*	*			trans	-123.6	140.5	178.2	-109.8	-87.6	0	0	0	114.1
464	S	42.7	Very low	45.8	Very low	95 Å²	95	142.7 Å²	142.7	66%	0.664	80%	0.802	S	S	*	*			trans	-19.9	133.7	170.3	-53.3	0	0	0	0	119.4
465	T	39.8	Very low	45.2	Very low	131 Å²	131	146 Å²	146	80%	0.804	81%	0.805	S	S	*	*				62.6	111.1	77.1	-37.9	0	0	0	0	115.7
466	M	47.3	Very low	45	Very low	196 Å²	196	141.1 Å²	141.1	97%	0.966	80%	0.801	S	S	*	*			trans	-150.1	142.9	139	-80.4	-144	164.1	0	0	110.7
467	R	43.4	Very low	44.7	Very low	230 Å²	230	143.5 Å²	143.5	87%	0.868	80%	0.804	S	S	*	*			trans	-129	-170	-174.3	-137	-173.5	143.2	-163.1	-3.9	105.2
468	P	50.7	Low	44.6	Very low	105 Å²	105	143.5 Å²	143.5	68%	0.682	80%	0.798	S	S	*	*			cis	-141.1	-164.5	-17.9	37.5	-15.8	0	0	0	114.4
469	A	43.2	Very low	44.1	Very low	91 Å²	91	144.5 Å²	144.5	75%	0.752	79%	0.794	S	S	*	*			trans	106.7	139.1	150.1	0	0	0	0	0	116.7
470	S	41.9	Very low	43.7	Very low	110 Å²	110	146.4 Å²	146.4	77%	0.769	79%	0.793	S	S	*	*			cis	177.5	142.8	-10.3	50	0	0	0	0	109.3
471	S	47.3	Very low	43.1	Very low	117 Å²	117	145.3 Å²	145.3	82%	0.818	79%	0.789	S	S	*	*			trans	152.7	93.6	150.1	59.7	0	0	0	0	110
472	Q	42.8	Very low	42.4	Very low	185 Å²	185	146.9 Å²	146.9	86%	0.864	80%	0.796	S	S	*	*				46.9	123.6	86.6	-67.7	-169.4	0.8	0	0	114
473	V	42.2	Very low	42	Very low	141 Å²	141	145.5 Å²	145.5	86%	0.855	80%	0.795	S	S	*	*				-160.3	165.2	71.6	-103.2	0	0	0	0	114.7
474	P	44.5	Very low	41.3	Very low	110 Å²	110	143.5 Å²	143.5	71%	0.714	79%	0.794	S	S	*	*			trans	-130.1	172.3	-154.1	43.6	-28.3	0	0	0	120.1
475	R	36.1	Very low	41	Very low	227 Å²	227	144.8 Å²	144.8	86%	0.857	80%	0.798	S	S	*	*			trans	55.6	137.4	140.7	-91.6	-177.3	173.8	165.2	-1.7	124.3
476	V	43.2	Very low	40.7	Very low	137 Å²	137	142.9 Å²	142.9	83%	0.83	79%	0.79	S	S	*	*				-168	116.1	120.9	-167.5	0	0	0	0	109.1
477	M	39	Very low	40.4	Very low	169 Å²	169	139.3 Å²	139.3	83%	0.833	78%	0.779	S	S	*	*				50	143.3	94.2	-78.8	179.1	147.9	0	0	116.5
478	S	40.1	Very low	40.2	Very low	99 Å²	99	136.2 Å²	136.2	69%	0.692	77%	0.774	S	S	*	*			cis	-176.2	156.3	3.9	41.1	0	0	0	0	110.6
479	T	38.7	Very low	39.7	Very low	122 Å²	122	136.9 Å²	136.9	75%	0.748	78%	0.777	S	S	*	*			trans	4.7	152.5	148.6	58.5	0	0	0	0	120.8
480	Q	39.6	Very low	39.5	Very low	152 Å²	152	141.6 Å²	141.6	71%	0.71	79%	0.785	S	S	*	*			cis	177.4	153.4	38.6	-137.4	172.6	-6.5	0	0	111.7
481	R	37.9	Very low	39.3	Very low	210 Å²	210	139.9 Å²	139.9	79%	0.792	79%	0.785	S	S	*	*			trans	65.8	116.5	142.7	-86.2	174	179.2	-177.6	0.4	126.4
482	V	34.4	Very low	39.2	Very low	137 Å²	137	140.2 Å²	140.2	83%	0.83	79%	0.785	S	S	*	*				50.9	121.1	119.3	-168.2	0	0	0	0	121.8
483	A	38.2	Very low	38.8	Very low	96 Å²	96	142.7 Å²	142.7	79%	0.793	79%	0.786	S	S	*	*				173.5	150.9	116.6	0	0	0	0	0	114.1
484	N	35.6	Very low	38.9	Very low	154 Å²	154	141 Å²	141	82%	0.824	78%	0.777	S	S	*	*			trans	-50.5	161.8	-179.9	-77.5	-23.5	0	0	0	116.6
485	T	36	Very low	38.6	Very low	122 Å²	122	140.7 Å²	140.7	75%	0.748	78%	0.784	S	S	*	*				157.7	111.9	107.9	-56.2	0	0	0	0	112.5
486	S	33.2	Very low	38.6	Very low	91 Å²	91	134.8 Å²	134.8	64%	0.636	78%	0.784	S	S	*	*			trans	30.6	155.4	144.1	66	0	0	0	0	125.6
487	T	40.2	Very low	38.3	Very low	120 Å²	120	133.2 Å²	133.2	74%	0.736	79%	0.785	S	S	*	*			trans	87.6	149.9	155.9	72.1	0	0	0	0	116.8
488	Q	40.3	Very low	38.2	Very low	165 Å²	165	130.1 Å²	130.1	77%	0.771	79%	0.787	S	S	*	*			cis	-170.5	162.7	-31.8	-104.4	-173.4	60.1	0	0	103.6
489	T	39.6	Very low	38.1	Very low	120 Å²	120	130.2 Å²	130.2	74%	0.736	79%	0.794	S	S	*	*			trans	90.5	113.6	155.9	78.7	0	0	0	0	121.7
490	M	38.4	Very low	38	Very low	190 Å²	190	129.3 Å²	129.3	94%	0.936	80%	0.798	S	S	*	*				56.8	125.2	121.5	-60.3	-73.1	-108.4	0	0	122.4
491	G	38.5	Very low	38	Very low	74 Å²	74	126 Å²	126	76%	0.763	80%	0.798	S	S	*	*				115.3	150.7	128.4	0	0	0	0	0	118.1
492	P	44.3	Very low	38	Very low	124 Å²	124	121.9 Å²	121.9	81%	0.805	80%	0.796	S	S	*	*			trans	-124.9	159.8	-133	37.9	-23.3	0	0	0	117.2
493	R	34.7	Very low	38.3	Very low	237 Å²	237	121.5 Å²	121.5	89%	0.894	80%	0.796	S	S	*	*			trans	46	170.8	149.7	-91.4	-179.2	94.1	176.3	4.5	119.6
494	P	44.7	Very low	38.3	Very low	104 Å²	104	121.2 Å²	121.2	68%	0.675	79%	0.794	S	S	*	*			cis	-131.7	175.2	-43.7	35.8	-19	0	0	0	111.4
495	A	38.3	Very low	38.3	Very low	104 Å²	104	120.2 Å²	120.2	86%	0.86	79%	0.793	S	S	*	*			trans	161.1	151.2	133.9	0	0	0	0	0	112.9
496	A	36.7	Very low	38.3	Very low	103 Å²	103	125.9 Å²	125.9	85%	0.851	80%	0.801	S	S	*	*			trans	-43.3	145	-174.8	0	0	0	0	0	118.9
497	A	37.1	Very low	38.4	Very low	104 Å²	104	127.4 Å²	127.4	86%	0.86	81%	0.807	S	S	*	*			trans	-165.1	137.8	132.2	0	0	0	0	0	110.4
498	A	35.6	Very low	38.1	Very low	104 Å²	104	128.2 Å²	128.2	86%	0.86	81%	0.811	S	S	*	*			trans	-72.7	143.2	179	0	0	0	0	0	112.4
499	A	38	Very low	38	Very low	102 Å²	102	124.8 Å²	124.8	84%	0.843	80%	0.803	S	S	*	*			trans	-167.3	137.7	150.3	0	0	0	0	0	110.7
500	A	36.5	Very low	37.6	Very low	102 Å²	102	128.2 Å²	128.2	84%	0.843	81%	0.811	S	S	*	*			trans	-61	145.6	174.1	0	0	0	0	0	112.8
501	A	39	Very low	37.2	Very low	84 Å²	84	129.4 Å²	129.4	69%	0.694	81%	0.806	S	S	*	*			trans	172.5	125.6	137.5	0	0	0	0	0	112.4
502	T	39.3	Very low	37	Very low	122 Å²	122	135.4 Å²	135.4	75%	0.748	81%	0.811	S	S	*	*			trans	56.3	122.5	143.9	61.4	0	0	0	0	120.5	A504	T502-A504 PolarHBondContact O-N 3.45Å
503	P	39.4	Very low	36.4	Very low	129 Å²	129	140.9 Å²	140.9	84%	0.838	82%	0.818	S	S	*	*			trans	-77.1	107.1	161.6	30.7	-26.7	0	0	0	109.4	V505	P503-V505 PolarHBondContact O-N 3.23Å
504	A	38.5	Very low	36.4	Very low	91 Å²	91	134.2 Å²	134.2	75%	0.752	81%	0.813	S	S	*	*			trans	-61.6	126.9	168	0	0	0	0	0	110.5	T502 R506	T502-A504 PolarHBondContact O-N 3.45Å; A504-R506 PolarHBondContact O-N 2.95Å
505	V	36.5	Very low	35.8	Very low	133 Å²	133	134.4 Å²	134.4	81%	0.806	82%	0.824	S	S	*	*			trans	-63.4	109.5	173.1	175.5	0	0	0	0	108.6	P503 T507	P503-V505 PolarHBondContact O-N 3.23Å; V505-T507 PolarHBondContact O-N 3.35Å
506	R	35.1	Very low	35.6	Very low	240 Å²	240	133 Å²	133	91%	0.906	82%	0.819	S	S	*	*			trans	-72.1	107.4	167.3	-87.9	-176	174.8	176.8	-1.2	109.2	A504 V508	A504-R506 PolarHBondContact O-N 2.95Å; R506-V508 PolarHBondContact O-N 3.14Å
507	T	35	Very low	35.5	Very low	124 Å²	124	135 Å²	135	76%	0.761	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-59.7	121.4	164.1	46.8	0	0	0	0	110.1	V505	V505-T507 PolarHBondContact O-N 3.35Å
508	V	35.1	Very low	35.2	Very low	136 Å²	136	141.7 Å²	141.7	82%	0.824	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-77.6	124.3	171.3	-161.5	0	0	0	0	107.8	R506	R506-V508 PolarHBondContact O-N 3.14Å
509	P	37.2	Very low	35.1	Very low	94 Å²	94	144.1 Å²	144.1	61%	0.61	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-72.3	130.7	175	-11.2	26.5	0	0	0	110.5	Y511	P509-Y511 PolarHBondContact O-N 2.84Å
510	Q	31.1	Very low	35.1	Very low	192 Å²	192	144.3 Å²	144.3	90%	0.897	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-62.1	119.2	167.8	-75	171.7	-72.7	0	0	110.2	K512	Q510-K512 PolarHBondContact O-N 3.35Å
511	Y	30	Very low	34.8	Very low	214 Å²	214	148.8 Å²	148.8	84%	0.839	82%	0.818	S	S	*	*			trans	-83.9	109.9	163	-73.2	-85.3	0	0	0	109.2	P509	P509-Y511 PolarHBondContact O-N 2.84Å
512	K	35.6	Very low	34.6	Very low	201 Å²	201	153.5 Å²	153.5	87%	0.874	83%	0.826	S	S	*	*			trans	-72	121.3	164.5	-83	177.7	173.1	176.8	0	108.7	Q510 A514	Q510-K512 PolarHBondContact O-N 3.35Å; K512-A514 PolarHBondContact O-N 3.44Å
513	Y	31.3	Very low	34.3	Very low	239 Å²	239	156.3 Å²	156.3	94%	0.937	83%	0.83	S	S	*	*			trans	-71.3	112.9	163.7	-97.6	-94.4	0	0	0	109.1
514	A	35.4	Very low	34	Very low	96 Å²	96	157.8 Å²	157.8	79%	0.793	83%	0.83	S	S	*	*			trans	-90.2	131.7	164.2	0	0	0	0	0	109	K512	K512-A514 PolarHBondContact O-N 3.44Å
515	A	31.9	Very low	33.8	Very low	109 Å²	109	161.1 Å²	161.1	90%	0.901	84%	0.835	S	S	*	*			trans	-77.1	139.4	174.5	0	0	0	0	0	110.9
516	G	34.4	Very low	33.6	Very low	74 Å²	74	159.6 Å²	159.6	76%	0.763	84%	0.837	S	S	*	*			trans	114	89.5	157.7	0	0	0	0	0	115.7
517	V	34.5	Very low	33.6	Very low	145 Å²	145	157 Å²	157	88%	0.879	84%	0.835	S	S	*	*			trans	-140.5	112.2	144.1	-171.8	0	0	0	0	108.3
518	R	29.5	Very low	33.5	Very low	244 Å²	244	156.6 Å²	156.6	92%	0.921	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-97.1	118.3	178.1	-157	-179.8	-168.6	-177.1	2.7	105.8
519	N	34	Very low	33.3	Very low	155 Å²	155	159 Å²	159	83%	0.829	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-88.9	123.9	178.9	-138.8	33.3	0	0	0	109.4
520	P	37.6	Very low	33	Very low	107 Å²	107	161.1 Å²	161.1	70%	0.695	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-86.8	136.3	176.4	31.5	-28.8	0	0	0	111.7
521	Q	29.6	Very low	32.8	Very low	195 Å²	195	158.5 Å²	158.5	91%	0.911	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-65.5	130.7	168.3	-80	169.3	-59.6	0	0	110.5
522	Q	36.4	Very low	33.1	Very low	183 Å²	183	157 Å²	157	86%	0.855	85%	0.847	S	S	*	*			trans	-110.9	126.6	163.3	-79.5	-177.1	-10.2	0	0	109.5
523	H	31.6	Very low	32.8	Very low	181 Å²	181	156.9 Å²	156.9	84%	0.838	85%	0.85	S	S	*	*			trans	-69.5	139	170	-78.7	-102.6	0	0	0	110.8
524	L	34.9	Very low	33	Very low	161 Å²	161	148.6 Å²	148.6	84%	0.843	82%	0.82	S	S	*	*			trans	-150.2	114.2	156.2	-106.8	130.8	0	0	0	112
525	N	33.5	Very low	33.1	Very low	161 Å²	161	149 Å²	149	86%	0.861	82%	0.815	S	S	*	*			trans	19.2	128.7	155.9	-75.7	6.8	0	0	0	121.8
526	A	32.7	Very low	33.5	Very low	101 Å²	101	146 Å²	146	84%	0.835	79%	0.79	S	S	*	*			trans	-72.5	138.3	166.2	0	0	0	0	0	112.6
527	Q	35.2	Very low	33.8	Very low	185 Å²	185	145.1 Å²	145.1	86%	0.864	77%	0.769	S	S	*	*			trans	-133	154.9	160.3	-95.6	-158.5	-12.1	0	0	109.2
528	P	32.5	Very low	34.1	Very low	116 Å²	116	145.9 Å²	145.9	75%	0.753	76%	0.763	S	S	*	*			trans	-76	137.2	-149.7	28.2	-33	0	0	0	114	V530	P528-V530 PolarHBondContact O-N 3.13Å
529	Q	30.1	Very low	34.9	Very low	186 Å²	186	136.6 Å²	136.6	87%	0.869	73%	0.734	S	S	*	*			trans	-68.5	114.7	177.2	-87.6	179.6	-62.6	0	0	111.8
530	V	30.3	Very low	35	Very low	139 Å²	139	139 Å²	139	84%	0.842	74%	0.74	S	S	*	*			trans	-78.7	117.9	151.5	-109.8	0	0	0	0	108	P528 M532	P528-V530 PolarHBondContact O-N 3.13Å; V530-M532 PolarHBondContact O-N 2.94Å
531	T	28.5	Very low	35.5	Very low	137 Å²	137	137.9 Å²	137.9	84%	0.84	75%	0.747	S	S	*	*			trans	-71	110.9	174.3	35.1	0	0	0	0	109.8
532	M	35.2	Very low	36.4	Very low	181 Å²	181	132.6 Å²	132.6	89%	0.892	72%	0.723	S	S	*	*			trans	-110	121.4	164.3	-88.5	-158	168.1	0	0	109.8	V530	V530-M532 PolarHBondContact O-N 2.94Å
533	Q	30.5	Very low	37.3	Very low	200 Å²	200	130.9 Å²	130.9	94%	0.935	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-60.8	135	175	-71.2	165.9	-5.3	0	0	110.6
534	Q	35.8	Very low	38.5	Very low	64 Å²	64	124.5 Å²	124.5	30%	0.299	69%	0.689	S	S	.	*	P	Polyproline II helix	trans	-94	147.2	172.4	-76.6	-172.2	15.6	0	0	110.9	Y382 M386 A536	Y382-Q534 HydrophobicContact CE2-CG 3.99Å; Y382-Q534 PolarHBondContact OH-OE1 3.19Å; M386-Q534 HydrophobicContact CE-CB 4.32Å; M386-Q534 HydrophobicContact CE-CG 4.15Å; M386-Q534 VanDerWaalsContact CG-OE1 3.29Å; M386-Q534 PolarHBondContact SD-OE1 3Å; Q534-A536 PolarHBondContact O-N 3.34Å
535	P	36.9	Very low	39.8	Very low	106 Å²	106	117.7 Å²	117.7	69%	0.688	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-76.9	123.4	-168	30.2	-31.5	0	0	0	111
536	A	40.3	Very low	41.5	Very low	45 Å²	45	113 Å²	113	37%	0.372	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-77.4	131.8	166.3	0	0	0	0	0	109.4	Q534 H538 P544	Q534-A536 PolarHBondContact O-N 3.34Å; A536-H538 PolarHBondContact O-N 2.89Å; A536-H538 PolarHBondContact O-ND1 3.37Å; A536-P544 HydrophobicContact CB-CB 3.85Å; A536-P544 HydrophobicContact CB-CG 4.29Å
537	V	40.5	Very low	43.1	Very low	55 Å²	55	111.2 Å²	111.2	33%	0.333	62%	0.616	S	S	.	*			trans	-72.4	101.3	176	-156.3	0	0	0	0	107.7	E598	V537-E598 HydrophobicContact CG2-CG 4.23Å
538	H	39.8	Very low	44.7	Very low	161 Å²	161	104.3 Å²	104.3	75%	0.745	59%	0.588	S	S	*	*			trans	-88.7	110.9	177.9	-73.5	77.3	0	0	0	109.1	A536	A536-H538 PolarHBondContact O-N 2.89Å; A536-H538 PolarHBondContact O-ND1 3.37Å
539	V	47.2	Very low	46.6	Very low	50 Å²	50	102.2 Å²	102.2	30%	0.303	57%	0.569	S	S	.	*			trans	-97.9	124.9	158.2	-176.9	0	0	0	0	105.4	G541 Q542	V539-G541 PolarHBondContact O-N 3.28Å; V539-Q542 PolarHBondContact O-N 2.9Å
540	Q	37.1	Very low	48.7	Very low	206 Å²	206	93.8 Å²	93.8	96%	0.963	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	113.5	-178.1	-95.7	179.7	-23.2	0	0	110.5
541	G	47.1	Very low	50.8	Low	82 Å²	82	90.6 Å²	90.6	85%	0.845	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.6	1.8	173	0	0	0	0	0	117.9	V539	V539-G541 PolarHBondContact O-N 3.28Å
542	Q	48.9	Very low	53.2	Low	85 Å²	85	88.7 Å²	88.7	40%	0.397	51%	0.51	S	S	.	.	S	Bend	trans	-136.1	146.3	178.7	-85.3	-175.3	-21.4	0	0	113.6	V539 R565	V539-Q542 PolarHBondContact O-N 2.9Å; Q542-R565 VanDerWaalsContact OE1-CD 3.27Å
543	E	54.2	Low	55.2	Low	147 Å²	147	80.7 Å²	80.7	69%	0.687	47%	0.473	S	S	*	.			trans	-55.8	139.9	175.7	-82.3	-164	142.9	0	0	111.9	L545 R565	E543-L545 PolarHBondContact O-N 3.27Å; E543-R565 PolarHBondContact O-NH1 3.13Å; E543-R565 PolarHBondContact O-NH2 3.34Å
544	P	57.7	Low	57.5	Low	46 Å²	46	74.8 Å²	74.8	30%	0.299	45%	0.452	S	S	.	.			trans	-63.7	123.7	-174.7	24.7	-32.7	0	0	0	112.2	A536 T546 M549	A536-P544 HydrophobicContact CB-CB 3.85Å; A536-P544 HydrophobicContact CB-CG 4.29Å; P544-T546 PolarHBondContact O-N 3Å; P544-T546 VanDerWaalsContact O-N 3.15Å; P544-M549 VanDerWaalsContact O-SD 3.39Å
545	L	63	Low	59.4	Low	19 Å²	19	76.5 Å²	76.5	10%	0.099	47%	0.469	C	S	.	.			trans	-77.3	103.3	175.6	-128.6	91	0	0	0	108.5	E543 L550 M561 L562 R565	E543-L545 PolarHBondContact O-N 3.27Å; L545-L550 HydrophobicContact CD2-CD1 3.81Å; L545-L550 HydrophobicContact CD2-CD2 4.02Å; L545-L550 HydrophobicContact CD2-CG 3.83Å; L545-M561 HydrophobicContact CD1-CB 4.31Å; L545-M561 HydrophobicContact CD2-CB 4.21Å; L545-L562 HydrophobicContact CD2-CD2 4.31Å; L545-R565 HydrophobicContact CD1-CG 4.11Å; L545-R565 VanDerWaalsContact CD1-NH1 3.29Å; L545-R565 HydrophobicContact CD2-CG 4.49Å
546	T	67.5	Low	61.4	Low	61 Å²	61	79.6 Å²	79.6	37%	0.374	47%	0.474	S	S	.	.			trans	-90.4	151.6	174.3	60.6	0	0	0	0	110.4	P544 S548 M549 L550	P544-T546 PolarHBondContact O-N 3Å; P544-T546 VanDerWaalsContact O-N 3.15Å; T546-S548 PolarHBondContact O-N 3.08Å; T546-S548 WeakPolarHBondContact OG1-CB 3.45Å; T546-M549 PolarHBondContact O-N 3.32Å; T546-M549 WeakPolarHBondContact OG1-CG 3.44Å; T546-M549 PolarHBondContact OG1-N 3.4Å; T546-L550 PolarHBondContact O-N 3.36Å
547	A	67.8	Low	63.4	Low	64 Å²	64	82.4 Å²	82.4	53%	0.529	48%	0.479	S	S	.	.	H	α-helix	trans	-55.2	-18.3	170.1	0	0	0	0	0	112.8	A551 L594	A547-A551 WeakPolarHBondContact O-CB 3.17Å; A547-A551 PolarHBondContact O-N 3.37Å; A547-L594 HydrophobicContact CB-CD1 4.47Å
548	S	67.7	Low	65.5	Low	41 Å²	41	81.6 Å²	81.6	29%	0.287	47%	0.472	S	S	.	.	H	α-helix	trans	-64.4	-52.1	169.6	-158.3	0	0	0	0	113.8	R390 T546 L550 A551 S552	R390-S548 VanDerWaalsContact CZ-CA 3.4Å; R390-S548 PolarHBondContact NE-OG 2.86Å; R390-S548 PolarHBondContact NH2-OG 3.15Å; T546-S548 PolarHBondContact O-N 3.08Å; T546-S548 WeakPolarHBondContact OG1-CB 3.45Å; S548-L550 VanDerWaalsContact C-N 3.31Å; S548-L550 PolarHBondContact O-N 3.26Å; S548-A551 PolarHBondContact O-N 3.1Å; S548-S552 PolarHBondContact O-N 2.98Å; S548-S552 PolarHBondContact O-OG 2.7Å
549	M	73.6	Confident	67.7	Low	72 Å²	72	76.8 Å²	76.8	36%	0.355	45%	0.449	S	S	.	.	H	α-helix	trans	-68.3	-36.5	-172.5	-67	169.5	76.8	0	0	110.6	P544 T546 S552	P544-M549 VanDerWaalsContact O-SD 3.39Å; T546-M549 PolarHBondContact O-N 3.32Å; T546-M549 WeakPolarHBondContact OG1-CG 3.44Å; T546-M549 PolarHBondContact OG1-N 3.4Å; M549-S552 PolarHBondContact O-OG 3.35Å
550	L	74.4	Confident	69.6	Low	8 Å²	8	80 Å²	80	4%	0.042	46%	0.461	C	S	.	.	H	α-helix	trans	-65.6	-41.7	173.2	-79.5	164.1	0	0	0	112.6	L545 T546 S548 S552 A553 Q558 M561 L562 L594	L545-L550 HydrophobicContact CD2-CD1 3.81Å; L545-L550 HydrophobicContact CD2-CD2 4.02Å; L545-L550 HydrophobicContact CD2-CG 3.83Å; T546-L550 PolarHBondContact O-N 3.36Å; S548-L550 VanDerWaalsContact C-N 3.31Å; S548-L550 PolarHBondContact O-N 3.26Å; L550-S552 PolarHBondContact O-N 2.86Å; L550-A553 PolarHBondContact O-N 3.25Å; L550-Q558 HydrophobicContact CD2-CB 4.14Å; L550-Q558 HydrophobicContact CD2-CG 4.42Å; L550-Q558 VanDerWaalsContact O-CD 3.26Å; L550-Q558 WeakPolarHBondContact O-CG 3.41Å; L550-Q558 PolarHBondContact O-NE2 2.69Å; L550-Q558 VanDerWaalsContact O-NE2 3.11Å; L550-M561 HydrophobicContact CD2-CB 4.38Å; L550-M561 HydrophobicContact CD2-CE 3.94Å; L550-L562 HydrophobicContact CD1-CD2 3.99Å; L550-L562 HydrophobicContact CD1-CG 4.41Å; L550-L562 HydrophobicContact CD2-CD1 4.1Å; L550-L562 HydrophobicContact CD2-CD2 4.29Å; L550-L562 HydrophobicContact CD2-CG 3.82Å; L550-L594 HydrophobicContact CD1-CD1 3.74Å; L550-L594 HydrophobicContact CD1-CD2 3.52Å; L550-L594 HydrophobicContact CD1-CG 3.78Å
551	A	73.9	Confident	71.9	Confident	72 Å²	72	72.1 Å²	72.1	60%	0.595	42%	0.424	S	S	*	.	H	α-helix	trans	-68.2	-23.3	-177.4	0	0	0	0	0	113.5	A547 S548	A547-A551 WeakPolarHBondContact O-CB 3.17Å; A547-A551 PolarHBondContact O-N 3.37Å; S548-A551 PolarHBondContact O-N 3.1Å
552	S	77.4	Confident	73.9	Confident	97 Å²	97	68.2 Å²	68.2	68%	0.678	38%	0.384	S	S	*	.	H	α-helix	trans	-86.7	-14.6	179	46.4	0	0	0	0	114.8	S548 M549 L550	S548-S552 PolarHBondContact O-N 2.98Å; S548-S552 PolarHBondContact O-OG 2.7Å; M549-S552 PolarHBondContact O-OG 3.35Å; L550-S552 PolarHBondContact O-N 2.86Å
553	A	78.7	Confident	75.9	Confident	13 Å²	13	64.6 Å²	64.6	11%	0.107	37%	0.37	C	S	.	.	S	Bend	trans	-91.9	151.5	-176.5	0	0	0	0	0	112.3	L550 E557 Q558 M561	L550-A553 PolarHBondContact O-N 3.25Å; A553-E557 HydrophobicContact CB-CB 4.21Å; A553-E557 HydrophobicContact CB-CG 4.34Å; A553-Q558 HydrophobicContact CB-CG 4.03Å; A553-Q558 WeakPolarHBondContact O-CG 3.39Å; A553-Q558 PolarHBondContact O-NE2 3.4Å; A553-M561 HydrophobicContact CB-CE 3.29Å
554	P	78.9	Confident	77.7	Confident	76 Å²	76	62.1 Å²	62.1	49%	0.494	36%	0.359	S	S	.	.			trans	-59.7	153.1	169.5	-20.6	33.3	0	0	0	112.4	Q556 E557 Q558	P554-Q556 PolarHBondContact O-N 3.48Å; P554-E557 WeakPolarHBondContact CD-OE2 3.29Å; P554-E557 PolarHBondContact O-N 2.76Å; P554-Q558 WeakPolarHBondContact O-CG 3.32Å; P554-Q558 PolarHBondContact O-N 2.75Å
555	P	75.9	Confident	79.1	Confident	101 Å²	101	61.2 Å²	61.2	66%	0.656	35%	0.349	S	S	*	.	H	α-helix	trans	-54.3	-34.5	-173	-27.8	34.6	0	0	0	115.3	K559	P555-K559 WeakPolarHBondContact O-CG 3.33Å; P555-K559 PolarHBondContact O-N 3.35Å
556	Q	77.1	Confident	80.5	Confident	171 Å²	171	60.3 Å²	60.3	80%	0.799	34%	0.344	S	S	*	.	H	α-helix	trans	-71.7	-38.9	179.2	-164.8	167.5	-0.7	0	0	112	P554 K559 Q560	P554-Q556 PolarHBondContact O-N 3.48Å; Q556-K559 PolarHBondContact O-N 2.89Å; Q556-Q560 PolarHBondContact O-N 2.78Å; Q556-Q560 VanDerWaalsContact O-N 3.17Å
557	E	84.1	Confident	81.7	Confident	103 Å²	103	61.1 Å²	61.1	48%	0.481	34%	0.343	S	S	.	.	H	α-helix	trans	-73	-32.7	176.2	-164.1	171.3	-151	0	0	111.2	A553 P554 K559 Q560 M561	A553-E557 HydrophobicContact CB-CB 4.21Å; A553-E557 HydrophobicContact CB-CG 4.34Å; P554-E557 WeakPolarHBondContact CD-OE2 3.29Å; P554-E557 PolarHBondContact O-N 2.76Å; E557-K559 VanDerWaalsContact C-N 3.35Å; E557-K559 PolarHBondContact O-N 2.95Å; E557-Q560 PolarHBondContact O-N 2.79Å; E557-M561 WeakPolarHBondContact O-CG 3.41Å; E557-M561 PolarHBondContact O-N 3.32Å
558	Q	84.5	Confident	82.9	Confident	38 Å²	38	61 Å²	61	18%	0.178	34%	0.337	C	S	.	.	H	α-helix	trans	-57.5	-46	170.9	-67.6	179.3	17.2	0	0	112.2	L550 A553 P554 L562 N590	L550-Q558 HydrophobicContact CD2-CB 4.14Å; L550-Q558 HydrophobicContact CD2-CG 4.42Å; L550-Q558 VanDerWaalsContact O-CD 3.26Å; L550-Q558 WeakPolarHBondContact O-CG 3.41Å; L550-Q558 PolarHBondContact O-NE2 2.69Å; L550-Q558 VanDerWaalsContact O-NE2 3.11Å; A553-Q558 HydrophobicContact CB-CG 4.03Å; A553-Q558 WeakPolarHBondContact O-CG 3.39Å; A553-Q558 PolarHBondContact O-NE2 3.4Å; P554-Q558 WeakPolarHBondContact O-CG 3.32Å; P554-Q558 PolarHBondContact O-N 2.75Å; Q558-L562 WeakPolarHBondContact O-CG 3.4Å; Q558-L562 PolarHBondContact O-N 2.79Å; Q558-L562 VanDerWaalsContact O-N 3.08Å; Q558-N590 PolarHBondContact OE1-ND2 3.22Å
559	K	85.8	Confident	84	Confident	60 Å²	60	61.9 Å²	61.9	26%	0.261	34%	0.338	S	S	.	.	H	α-helix	trans	-66.6	-38.3	177.8	-67.5	-61.9	-172.1	-177.1	0	111.7	P555 Q556 E557 L562 G563 L586 I588 N590	P555-K559 WeakPolarHBondContact O-CG 3.33Å; P555-K559 PolarHBondContact O-N 3.35Å; Q556-K559 PolarHBondContact O-N 2.89Å; E557-K559 VanDerWaalsContact C-N 3.35Å; E557-K559 PolarHBondContact O-N 2.95Å; K559-L562 PolarHBondContact O-N 2.74Å; K559-G563 PolarHBondContact O-N 2.93Å; K559-L586 HydrophobicContact CB-CD2 4.5Å; K559-L586 HydrophobicContact CD-CD2 4.31Å; K559-L586 WeakPolarHBondContact CD-O 3.16Å; K559-L586 WeakPolarHBondContact CE-O 3.3Å; K559-L586 PolarHBondContact NZ-O 2.8Å; K559-L586 VanDerWaalsContact O-CD2 3.29Å; K559-L586 WeakPolarHBondContact O-CD2 3.39Å; K559-I588 PolarHBondContact NZ-O 3.16Å; K559-N590 WeakPolarHBondContact CE-OD1 3.41Å; K559-N590 PolarHBondContact NZ-OD1 2.61Å
560	Q	86.5	Confident	84.9	Confident	119 Å²	119	58.4 Å²	58.4	56%	0.556	32%	0.321	S	S	*	.	H	α-helix	trans	-61.9	-49.9	175.3	-175.3	170.6	-3.3	0	0	111.7	Q556 E557 L562 G563 E564	Q556-Q560 PolarHBondContact O-N 2.78Å; Q556-Q560 VanDerWaalsContact O-N 3.17Å; E557-Q560 PolarHBondContact O-N 2.79Å; Q560-L562 VanDerWaalsContact C-N 3.31Å; Q560-L562 PolarHBondContact O-N 3.11Å; Q560-G563 PolarHBondContact O-N 2.87Å; Q560-G563 VanDerWaalsContact O-N 3.09Å; Q560-E564 PolarHBondContact O-N 2.9Å
561	M	86	Confident	85.8	Confident	39 Å²	39	62.5 Å²	62.5	19%	0.192	34%	0.34	C	S	.	.	H	α-helix	trans	-59.5	-39.3	177.6	-71.5	-171.7	-71.3	0	0	112.9	L545 L550 A553 E557 R565	L545-M561 HydrophobicContact CD1-CB 4.31Å; L545-M561 HydrophobicContact CD2-CB 4.21Å; L550-M561 HydrophobicContact CD2-CB 4.38Å; L550-M561 HydrophobicContact CD2-CE 3.94Å; A553-M561 HydrophobicContact CB-CE 3.29Å; E557-M561 WeakPolarHBondContact O-CG 3.41Å; E557-M561 PolarHBondContact O-N 3.32Å; M561-R565 WeakPolarHBondContact O-CG 3.48Å
562	L	89.1	Confident	86.6	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-69.1	-39.1	174.9	-73.5	167	0	0	0	111.7	L545 L550 Q558 K559 Q560 R565 L566 L586 N590 L593 L594 L597	L545-L562 HydrophobicContact CD2-CD2 4.31Å; L550-L562 HydrophobicContact CD1-CD2 3.99Å; L550-L562 HydrophobicContact CD1-CG 4.41Å; L550-L562 HydrophobicContact CD2-CD1 4.1Å; L550-L562 HydrophobicContact CD2-CD2 4.29Å; L550-L562 HydrophobicContact CD2-CG 3.82Å; Q558-L562 WeakPolarHBondContact O-CG 3.4Å; Q558-L562 PolarHBondContact O-N 2.79Å; Q558-L562 VanDerWaalsContact O-N 3.08Å; K559-L562 PolarHBondContact O-N 2.74Å; Q560-L562 VanDerWaalsContact C-N 3.31Å; Q560-L562 PolarHBondContact O-N 3.11Å; L562-R565 PolarHBondContact O-N 2.82Å; L562-L566 WeakPolarHBondContact O-CB 3.32Å; L562-L566 WeakPolarHBondContact O-CG 3.32Å; L562-L566 PolarHBondContact O-N 3.3Å; L562-L586 HydrophobicContact CB-CD2 3.99Å; L562-N590 HydrophobicContact CD1-CB 3.98Å; L562-L593 HydrophobicContact CB-CD1 4.46Å; L562-L593 HydrophobicContact CD1-CB 4.14Å; L562-L593 HydrophobicContact CD1-CD1 3.74Å; L562-L593 HydrophobicContact CD2-CB 4.2Å; L562-L594 HydrophobicContact CD2-CD2 4.37Å; L562-L594 HydrophobicContact CD2-CG 4.46Å; L562-L597 HydrophobicContact CD2-CD1 3.95Å
563	G	90.3	Very high	87.3	Confident	10 Å²	10	61.4 Å²	61.4	10%	0.103	33%	0.327	C	S	.	.	H	α-helix	trans	-62.7	-43.7	179.3	0	0	0	0	0	112.4	K559 Q560 R565 L566 F567	K559-G563 PolarHBondContact O-N 2.93Å; Q560-G563 PolarHBondContact O-N 2.87Å; Q560-G563 VanDerWaalsContact O-N 3.09Å; G563-R565 PolarHBondContact O-N 2.96Å; G563-L566 PolarHBondContact O-N 2.93Å; G563-F567 VanDerWaalsContact O-CB 3.25Å; G563-F567 WeakPolarHBondContact O-CB 3.38Å; G563-F567 PolarHBondContact O-N 2.87Å
564	E	91.2	Very high	87.8	Confident	95 Å²	95	63.4 Å²	63.4	44%	0.444	33%	0.334	S	S	.	.	H	α-helix	trans	-62.7	-26	176.9	-72.8	-179.2	-179.1	0	0	113.2	Q560 P568	Q560-E564 PolarHBondContact O-N 2.9Å; E564-P568 WeakPolarHBondContact O-CD 3.32Å; E564-P568 WeakPolarHBondContact O-CG 3.24Å
565	R	88.4	Confident	88.4	Confident	26 Å²	26	64.2 Å²	64.2	10%	0.098	34%	0.34	C	S	.	.	H	α-helix	trans	-88.3	-37.2	176.4	-62.9	-65.5	156.7	96.1	2.2	113.5	Q542 E543 L545 M561 L562 G563 L597	Q542-R565 VanDerWaalsContact OE1-CD 3.27Å; E543-R565 PolarHBondContact O-NH1 3.13Å; E543-R565 PolarHBondContact O-NH2 3.34Å; L545-R565 HydrophobicContact CD1-CG 4.11Å; L545-R565 VanDerWaalsContact CD1-NH1 3.29Å; L545-R565 HydrophobicContact CD2-CG 4.49Å; M561-R565 WeakPolarHBondContact O-CG 3.48Å; L562-R565 PolarHBondContact O-N 2.82Å; G563-R565 PolarHBondContact O-N 2.96Å; R565-L597 HydrophobicContact CB-CD1 4.03Å; R565-L597 HydrophobicContact CB-CD2 3.86Å
566	L	91.3	Very high	89	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-73.6	-40.7	179.8	-75.2	164.2	0	0	0	111.6	L562 G563 L569 I570 T582 L586 L593 M596 L597 L603	L562-L566 WeakPolarHBondContact O-CB 3.32Å; L562-L566 WeakPolarHBondContact O-CG 3.32Å; L562-L566 PolarHBondContact O-N 3.3Å; G563-L566 PolarHBondContact O-N 2.93Å; L566-L569 PolarHBondContact O-N 2.9Å; L566-I570 HydrophobicContact CB-CD1 3.89Å; L566-I570 WeakPolarHBondContact O-CD1 3.45Å; L566-I570 VanDerWaalsContact O-CG1 3.25Å; L566-I570 WeakPolarHBondContact O-CG1 3.44Å; L566-I570 PolarHBondContact O-N 3.31Å; L566-T582 HydrophobicContact CB-CG2 4.27Å; L566-L586 HydrophobicContact CD1-CD2 4.37Å; L566-L593 HydrophobicContact CD1-CD2 3.66Å; L566-M596 HydrophobicContact CD1-CE 4.42Å; L566-M596 HydrophobicContact CD2-CE 3.72Å; L566-L597 HydrophobicContact CD2-CD2 3.81Å; L566-L597 HydrophobicContact CD2-CG 4.2Å; L566-L597 HydrophobicContact CG-CD2 4.07Å; L566-L603 HydrophobicContact CD2-CD1 3.79Å
567	F	93.6	Very high	89.6	Confident	79 Å²	79	59 Å²	59	35%	0.346	32%	0.316	S	S	.	.	H	α-helix	trans	-57.2	-48.2	-172.4	-176.8	-88.7	0	0	0	113.6	G563 L569 I570 Q571 A578 T582	G563-F567 VanDerWaalsContact O-CB 3.25Å; G563-F567 WeakPolarHBondContact O-CB 3.38Å; G563-F567 PolarHBondContact O-N 2.87Å; F567-L569 VanDerWaalsContact C-N 3.32Å; F567-L569 PolarHBondContact O-N 3.06Å; F567-I570 PolarHBondContact O-N 3.41Å; F567-Q571 HydrophobicContact CE1-CB 4.45Å; F567-Q571 VanDerWaalsContact O-CB 3.24Å; F567-Q571 WeakPolarHBondContact O-CB 2.89Å; F567-Q571 PolarHBondContact O-N 3.14Å; F567-A578 HydrophobicContact CE2-CB 4.03Å; F567-A578 HydrophobicContact CZ-CB 4.32Å; F567-T582 HydrophobicContact CB-CG2 4.18Å
568	P	91.6	Very high	90	Very high	62 Å²	62	54.2 Å²	54.2	40%	0.403	29%	0.294	S	S	.	.	H	α-helix	trans	-62.5	-38	178.7	-22.5	34.3	0	0	0	113	E564 Q571 A572	E564-P568 WeakPolarHBondContact O-CD 3.32Å; E564-P568 WeakPolarHBondContact O-CG 3.24Å; P568-Q571 PolarHBondContact O-N 3.32Å; P568-A572 PolarHBondContact O-N 2.76Å; P568-A572 VanDerWaalsContact O-N 3.15Å
569	L	92.2	Very high	90.3	Very high	58 Å²	58	54.6 Å²	54.6	30%	0.304	31%	0.309	S	S	.	.	H	α-helix	trans	-67.9	-42.2	178.8	-62	176.2	0	0	0	111.4	L566 F567 A572 M573 L597 L603	L566-L569 PolarHBondContact O-N 2.9Å; F567-L569 VanDerWaalsContact C-N 3.32Å; F567-L569 PolarHBondContact O-N 3.06Å; L569-A572 PolarHBondContact O-N 2.86Å; L569-M573 WeakPolarHBondContact O-CG 3.37Å; L569-L597 HydrophobicContact CD1-CD2 3.78Å; L569-L603 HydrophobicContact CB-CD2 3.73Å; L569-L603 HydrophobicContact CD1-CD2 3.91Å; L569-L603 HydrophobicContact CG-CD2 4.46Å
570	I	92.6	Very high	90.5	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-69.9	-38.8	177.4	-63.3	161.5	0	0	0	110.4	L566 F567 A572 M573 H574 A578 I581 T582 L585 L603 V607	L566-I570 HydrophobicContact CB-CD1 3.89Å; L566-I570 WeakPolarHBondContact O-CD1 3.45Å; L566-I570 VanDerWaalsContact O-CG1 3.25Å; L566-I570 WeakPolarHBondContact O-CG1 3.44Å; L566-I570 PolarHBondContact O-N 3.31Å; F567-I570 PolarHBondContact O-N 3.41Å; I570-A572 VanDerWaalsContact C-N 3.26Å; I570-A572 PolarHBondContact O-N 3.33Å; I570-M573 WeakPolarHBondContact O-CA 3.35Å; I570-M573 PolarHBondContact O-N 3.15Å; I570-H574 PolarHBondContact O-N 2.91Å; I570-A578 HydrophobicContact CG2-CB 4.25Å; I570-I581 HydrophobicContact CD1-CG2 4.29Å; I570-I581 HydrophobicContact CG2-CB 3.85Å; I570-I581 HydrophobicContact CG2-CD1 4.25Å; I570-I581 HydrophobicContact CG2-CG2 3.66Å; I570-T582 HydrophobicContact CD1-CG2 4.34Å; I570-T582 VanDerWaalsContact CD1-OG1 3.3Å; I570-T582 WeakPolarHBondContact CD1-OG1 3.38Å; I570-L585 HydrophobicContact CD1-CD1 3.6Å; I570-L585 HydrophobicContact CG1-CD1 4.34Å; I570-L603 HydrophobicContact CG1-CD1 4.44Å; I570-V607 HydrophobicContact CG1-CG2 4.05Å
571	Q	93.3	Very high	90.8	Very high	94 Å²	94	52.1 Å²	52.1	44%	0.439	30%	0.296	S	S	.	.	H	α-helix	trans	-61.9	-35.4	178.2	-172.2	177	16.6	0	0	112.1	F567 P568 M573 P575 A578	F567-Q571 HydrophobicContact CE1-CB 4.45Å; F567-Q571 VanDerWaalsContact O-CB 3.24Å; F567-Q571 WeakPolarHBondContact O-CB 2.89Å; F567-Q571 PolarHBondContact O-N 3.14Å; P568-Q571 PolarHBondContact O-N 3.32Å; Q571-M573 PolarHBondContact O-N 3.46Å; Q571-P575 WeakPolarHBondContact O-CG 3.33Å; Q571-A578 HydrophobicContact CB-CB 4Å; Q571-A578 HydrophobicContact CG-CB 4.37Å
572	A	90.9	Very high	91.1	Very high	89 Å²	89	50.6 Å²	50.6	74%	0.736	29%	0.289	S	S	*	.	H	α-helix	trans	-64.9	-23.6	172.9	0	0	0	0	0	113.3	P568 L569 I570	P568-A572 PolarHBondContact O-N 2.76Å; P568-A572 VanDerWaalsContact O-N 3.15Å; L569-A572 PolarHBondContact O-N 2.86Å; I570-A572 VanDerWaalsContact C-N 3.26Å; I570-A572 PolarHBondContact O-N 3.33Å
573	M	91.3	Very high	91.2	Very high	57 Å²	57	52.4 Å²	52.4	28%	0.281	31%	0.307	S	S	.	.	H	α-helix	trans	-96.6	-45.6	-178.9	-60.4	176.8	61.7	0	0	112.8	L569 I570 Q571 R604 V607	L569-M573 WeakPolarHBondContact O-CG 3.37Å; I570-M573 WeakPolarHBondContact O-CA 3.35Å; I570-M573 PolarHBondContact O-N 3.15Å; Q571-M573 PolarHBondContact O-N 3.46Å; M573-R604 HydrophobicContact CE-CB 3.72Å; M573-R604 HydrophobicContact CE-CG 3.58Å; M573-V607 HydrophobicContact CE-CB 4.22Å; M573-V607 HydrophobicContact CE-CG1 4.12Å; M573-V607 HydrophobicContact SD-CG2 4.49Å
574	H	89.6	Confident	91.3	Very high	54 Å²	54	54.9 Å²	54.9	25%	0.25	32%	0.317	C	S	.	.			trans	-137.5	83.4	-178	-77.3	-73	0	0	0	111.1	I570 T576 L577 A578 I581	I570-H574 PolarHBondContact O-N 2.91Å; H574-T576 VanDerWaalsContact C-N 3.3Å; H574-T576 PolarHBondContact O-N 3.42Å; H574-L577 PolarHBondContact O-N 3.48Å; H574-A578 WeakPolarHBondContact O-CA 3.49Å; H574-A578 WeakPolarHBondContact O-CB 3.27Å; H574-A578 PolarHBondContact O-N 2.71Å; H574-I581 HydrophobicContact CB-CD1 3.73Å
575	P	90.5	Very high	91.3	Very high	94 Å²	94	50.5 Å²	50.5	61%	0.61	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-36.9	-174.2	-21.3	29.7	0	0	0	113.6	Q571	Q571-P575 WeakPolarHBondContact O-CG 3.33Å
576	T	89.4	Confident	91.5	Very high	129 Å²	129	51 Å²	51	79%	0.791	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-26.4	-174.4	50.1	0	0	0	0	113.7	H574	H574-T576 VanDerWaalsContact C-N 3.3Å; H574-T576 PolarHBondContact O-N 3.42Å
577	L	90.4	Very high	91.4	Very high	32 Å²	32	59.2 Å²	59.2	17%	0.168	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.7	2.6	-175.3	-64.3	177.4	0	0	0	113	H574 G579 K580 I581	H574-L577 PolarHBondContact O-N 3.48Å; L577-G579 VanDerWaalsContact C-N 3.32Å; L577-G579 PolarHBondContact O-N 3.04Å; L577-K580 PolarHBondContact O-N 2.95Å; L577-I581 HydrophobicContact CB-CD1 3.63Å; L577-I581 HydrophobicContact CB-CG1 4.07Å; L577-I581 WeakPolarHBondContact O-CG1 3.48Å; L577-I581 PolarHBondContact O-N 3.5Å
578	A	91.6	Very high	91	Very high	3 Å²	3	57.2 Å²	57.2	3%	0.025	33%	0.332	C	S	.	.	H	α-helix	trans	-51.4	-46.6	-170.9	0	0	0	0	0	113.6	F567 I570 Q571 H574 K580 I581 T582	F567-A578 HydrophobicContact CE2-CB 4.03Å; F567-A578 HydrophobicContact CZ-CB 4.32Å; I570-A578 HydrophobicContact CG2-CB 4.25Å; Q571-A578 HydrophobicContact CB-CB 4Å; Q571-A578 HydrophobicContact CG-CB 4.37Å; H574-A578 WeakPolarHBondContact O-CA 3.49Å; H574-A578 WeakPolarHBondContact O-CB 3.27Å; H574-A578 PolarHBondContact O-N 2.71Å; A578-K580 PolarHBondContact O-N 3.37Å; A578-I581 PolarHBondContact O-N 3.01Å; A578-T582 VanDerWaalsContact O-CB 3.31Å; A578-T582 WeakPolarHBondContact O-CB 3.47Å; A578-T582 PolarHBondContact O-N 2.64Å; A578-T582 PolarHBondContact O-OG1 3.38Å
579	G	90.4	Very high	90.8	Very high	46 Å²	46	60.1 Å²	60.1	47%	0.474	34%	0.344	S	S	.	.	H	α-helix	trans	-62.6	-42.8	178.9	0	0	0	0	0	113.2	L577 G583	L577-G579 VanDerWaalsContact C-N 3.32Å; L577-G579 PolarHBondContact O-N 3.04Å; G579-G583 PolarHBondContact O-N 3.25Å
580	K	90.8	Very high	90.4	Very high	127 Å²	127	59.1 Å²	59.1	55%	0.552	34%	0.339	S	S	*	.	H	α-helix	trans	-68.8	-43.9	178.9	-67.8	-174.4	180	-178.6	0	111.6	L577 A578 G583 M584 L614	L577-K580 PolarHBondContact O-N 2.95Å; A578-K580 PolarHBondContact O-N 3.37Å; K580-G583 PolarHBondContact O-N 2.95Å; K580-M584 WeakPolarHBondContact O-CG 3.45Å; K580-M584 PolarHBondContact O-N 2.88Å; K580-L614 HydrophobicContact CB-CD1 3.91Å; K580-L614 HydrophobicContact CB-CD2 4.14Å; K580-L614 HydrophobicContact CD-CD2 4.08Å
581	I	92.7	Very high	89.9	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-63.2	-45.3	178.2	-64.6	165	0	0	0	110	I570 H574 L577 A578 G583 M584 L585 V607 A610 V611 L614	I570-I581 HydrophobicContact CD1-CG2 4.29Å; I570-I581 HydrophobicContact CG2-CB 3.85Å; I570-I581 HydrophobicContact CG2-CD1 4.25Å; I570-I581 HydrophobicContact CG2-CG2 3.66Å; H574-I581 HydrophobicContact CB-CD1 3.73Å; L577-I581 HydrophobicContact CB-CD1 3.63Å; L577-I581 HydrophobicContact CB-CG1 4.07Å; L577-I581 WeakPolarHBondContact O-CG1 3.48Å; L577-I581 PolarHBondContact O-N 3.5Å; A578-I581 PolarHBondContact O-N 3.01Å; I581-G583 PolarHBondContact O-N 3.04Å; I581-M584 PolarHBondContact O-N 2.9Å; I581-L585 HydrophobicContact CG2-CD1 3.85Å; I581-L585 HydrophobicContact CG2-CG 4.36Å; I581-L585 WeakPolarHBondContact O-CG 3.3Å; I581-L585 PolarHBondContact O-N 3.39Å; I581-V607 HydrophobicContact CD1-CG1 4.4Å; I581-V607 HydrophobicContact CG2-CG1 4.32Å; I581-V607 HydrophobicContact CG2-CG2 4.14Å; I581-A610 HydrophobicContact CG2-CB 4.07Å; I581-V611 HydrophobicContact CD1-CG2 3.67Å; I581-V611 HydrophobicContact CG1-CG2 4.38Å; I581-L614 HydrophobicContact CG1-CD1 3.75Å
582	T	93	Very high	89.5	Confident	8 Å²	8	62.7 Å²	62.7	5%	0.049	37%	0.366	C	S	.	.	H	α-helix	trans	-61.1	-45.4	177	-51.9	0	0	0	0	110.8	L566 F567 I570 A578 M584 L585 L586	L566-T582 HydrophobicContact CB-CG2 4.27Å; F567-T582 HydrophobicContact CB-CG2 4.18Å; I570-T582 HydrophobicContact CD1-CG2 4.34Å; I570-T582 VanDerWaalsContact CD1-OG1 3.3Å; I570-T582 WeakPolarHBondContact CD1-OG1 3.38Å; A578-T582 VanDerWaalsContact O-CB 3.31Å; A578-T582 WeakPolarHBondContact O-CB 3.47Å; A578-T582 PolarHBondContact O-N 2.64Å; A578-T582 PolarHBondContact O-OG1 3.38Å; T582-M584 VanDerWaalsContact C-N 3.35Å; T582-M584 PolarHBondContact O-N 3.38Å; T582-L585 PolarHBondContact O-N 3.15Å; T582-L586 HydrophobicContact CG2-CD1 4.19Å; T582-L586 HydrophobicContact CG2-CG 4.43Å; T582-L586 VanDerWaalsContact O-CG 3.29Å; T582-L586 WeakPolarHBondContact O-CG 3.3Å; T582-L586 PolarHBondContact O-N 3.45Å
583	G	91.1	Very high	89.3	Confident	37 Å²	37	58.4 Å²	58.4	38%	0.381	33%	0.331	S	S	.	.	H	α-helix	trans	-57.5	-44.5	175.8	0	0	0	0	0	113	G579 K580 I581 L586	G579-G583 PolarHBondContact O-N 3.25Å; K580-G583 PolarHBondContact O-N 2.95Å; I581-G583 PolarHBondContact O-N 3.04Å; G583-L586 PolarHBondContact O-N 3.01Å
584	M	90.8	Very high	89	Confident	62 Å²	62	57.4 Å²	57.4	31%	0.305	33%	0.327	S	S	.	.	H	α-helix	trans	-65.5	-43	176.3	-71.8	179.5	67.4	0	0	112.7	K580 I581 T582 L586 E587 A610 V613 L614	K580-M584 WeakPolarHBondContact O-CG 3.45Å; K580-M584 PolarHBondContact O-N 2.88Å; I581-M584 PolarHBondContact O-N 2.9Å; T582-M584 VanDerWaalsContact C-N 3.35Å; T582-M584 PolarHBondContact O-N 3.38Å; M584-L586 VanDerWaalsContact C-N 3.28Å; M584-L586 PolarHBondContact O-N 2.96Å; M584-E587 WeakPolarHBondContact O-CB 3.32Å; M584-E587 PolarHBondContact O-N 2.88Å; M584-A610 HydrophobicContact CE-CB 4.44Å; M584-V613 HydrophobicContact CE-CB 3.95Å; M584-V613 HydrophobicContact CE-CG1 3.67Å; M584-L614 HydrophobicContact SD-CD1 4.07Å; M584-L614 HydrophobicContact SD-CD2 3.87Å; M584-L614 HydrophobicContact SD-CG 3.69Å
585	L	91.9	Very high	88.7	Confident	3 Å²	3	58.7 Å²	58.7	2%	0.016	33%	0.332	C	S	.	.	H	α-helix	trans	-66.3	-33.2	179.3	-70.8	172.1	0	0	0	111.6	I570 I581 T582 E587 I588 L593 M596 L603 K606 V607	I570-L585 HydrophobicContact CD1-CD1 3.6Å; I570-L585 HydrophobicContact CG1-CD1 4.34Å; I581-L585 HydrophobicContact CG2-CD1 3.85Å; I581-L585 HydrophobicContact CG2-CG 4.36Å; I581-L585 WeakPolarHBondContact O-CG 3.3Å; I581-L585 PolarHBondContact O-N 3.39Å; T582-L585 PolarHBondContact O-N 3.15Å; L585-E587 PolarHBondContact O-N 3.42Å; L585-E587 VanDerWaalsContact O-N 3.14Å; L585-I588 HydrophobicContact CD2-CD1 3.63Å; L585-I588 VanDerWaalsContact O-CB 3.23Å; L585-I588 WeakPolarHBondContact O-CB 3.42Å; L585-I588 VanDerWaalsContact O-CG1 3.32Å; L585-I588 WeakPolarHBondContact O-CG1 3.39Å; L585-I588 PolarHBondContact O-N 2.64Å; L585-L593 HydrophobicContact CB-CD2 4.34Å; L585-L593 VanDerWaalsContact O-CD2 3.28Å; L585-L593 WeakPolarHBondContact O-CD2 3.37Å; L585-M596 HydrophobicContact CB-CE 4.44Å; L585-M596 HydrophobicContact CD1-CE 4.21Å; L585-M596 HydrophobicContact CD2-CE 4.17Å; L585-M596 HydrophobicContact CD2-SD 4.28Å; L585-L603 HydrophobicContact CD1-CD1 4.42Å; L585-K606 HydrophobicContact CD2-CB 3.94Å; L585-V607 HydrophobicContact CD1-CG2 4.15Å
586	L	92.2	Very high	88.6	Confident	38 Å²	38	54.2 Å²	54.2	20%	0.199	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-13.7	176.4	-74.7	173.5	0	0	0	113.7	K559 L562 L566 T582 G583 M584 I588 L593	K559-L586 HydrophobicContact CB-CD2 4.5Å; K559-L586 HydrophobicContact CD-CD2 4.31Å; K559-L586 WeakPolarHBondContact CD-O 3.16Å; K559-L586 WeakPolarHBondContact CE-O 3.3Å; K559-L586 PolarHBondContact NZ-O 2.8Å; K559-L586 VanDerWaalsContact O-CD2 3.29Å; K559-L586 WeakPolarHBondContact O-CD2 3.39Å; L562-L586 HydrophobicContact CB-CD2 3.99Å; L566-L586 HydrophobicContact CD1-CD2 4.37Å; T582-L586 HydrophobicContact CG2-CD1 4.19Å; T582-L586 HydrophobicContact CG2-CG 4.43Å; T582-L586 VanDerWaalsContact O-CG 3.29Å; T582-L586 WeakPolarHBondContact O-CG 3.3Å; T582-L586 PolarHBondContact O-N 3.45Å; G583-L586 PolarHBondContact O-N 3.01Å; M584-L586 VanDerWaalsContact C-N 3.28Å; M584-L586 PolarHBondContact O-N 2.96Å; L586-I588 VanDerWaalsContact C-N 3.26Å; L586-L593 HydrophobicContact CD2-CD1 4.27Å
587	E	88.8	Confident	88.4	Confident	172 Å²	172	49.4 Å²	49.4	80%	0.804	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-12.8	171.2	-60.2	-169.9	172.7	0	0	113.2	M584 L585	M584-E587 WeakPolarHBondContact O-CB 3.32Å; M584-E587 PolarHBondContact O-N 2.88Å; L585-E587 PolarHBondContact O-N 3.42Å; L585-E587 VanDerWaalsContact O-N 3.14Å
588	I	87.1	Confident	88.1	Confident	36 Å²	36	53.4 Å²	53.4	19%	0.185	29%	0.291	C	S	.	.	S	Bend	trans	-78.2	156	178.7	-54.3	174.6	0	0	0	110.6	K559 L585 L586 E592 L593 K606	K559-I588 PolarHBondContact NZ-O 3.16Å; L585-I588 HydrophobicContact CD2-CD1 3.63Å; L585-I588 VanDerWaalsContact O-CB 3.23Å; L585-I588 WeakPolarHBondContact O-CB 3.42Å; L585-I588 VanDerWaalsContact O-CG1 3.32Å; L585-I588 WeakPolarHBondContact O-CG1 3.39Å; L585-I588 PolarHBondContact O-N 2.64Å; L586-I588 VanDerWaalsContact C-N 3.26Å; I588-E592 HydrophobicContact CG2-CB 3.83Å; I588-E592 HydrophobicContact CG2-CG 3.97Å; I588-E592 VanDerWaalsContact CG2-OE2 3.26Å; I588-E592 WeakPolarHBondContact CG2-OE2 3.49Å; I588-L593 HydrophobicContact CB-CD2 4.36Å; I588-L593 HydrophobicContact CB-CG 4.44Å; I588-K606 HydrophobicContact CD1-CD 4.36Å
589	D	85.9	Confident	87.8	Confident	124 Å²	124	54.7 Å²	54.7	66%	0.663	30%	0.299	S	S	*	.			trans	-56.2	140.5	175.1	-89.9	-51.5	0	0	0	113.2	S591 E592 L593	D589-S591 PolarHBondContact O-N 2.98Å; D589-S591 VanDerWaalsContact O-N 3.14Å; D589-E592 PolarHBondContact O-N 3.48Å; D589-E592 VanDerWaalsContact O-N 3.08Å; D589-L593 PolarHBondContact O-N 3.05Å; D589-L593 VanDerWaalsContact O-N 3.09Å
590	N	84.7	Confident	87.6	Confident	37 Å²	37	57.3 Å²	57.3	20%	0.198	31%	0.308	C	S	.	.	H	α-helix	trans	-62.4	-26.6	-174.8	-67.8	-5.4	0	0	0	113.6	Q558 K559 L562 L594	Q558-N590 PolarHBondContact OE1-ND2 3.22Å; K559-N590 WeakPolarHBondContact CE-OD1 3.41Å; K559-N590 PolarHBondContact NZ-OD1 2.61Å; L562-N590 HydrophobicContact CD1-CB 3.98Å; N590-L594 WeakPolarHBondContact O-CG 3.49Å; N590-L594 PolarHBondContact O-N 2.88Å; N590-L594 VanDerWaalsContact O-N 3.08Å
591	S	81.4	Confident	87.4	Confident	92 Å²	92	59 Å²	59	64%	0.643	32%	0.318	S	S	*	.	H	α-helix	trans	-70	-37.5	176.5	56.2	0	0	0	0	112.6	D589 H595	D589-S591 PolarHBondContact O-N 2.98Å; D589-S591 VanDerWaalsContact O-N 3.14Å; S591-H595 PolarHBondContact O-N 2.89Å
592	E	84.8	Confident	87.2	Confident	76 Å²	76	60.5 Å²	60.5	36%	0.355	33%	0.328	S	S	.	.	H	α-helix	trans	-73.6	-39.2	175.6	-170.5	171.7	178.6	0	0	110.5	I588 D589 L594 H595 M596 K606	I588-E592 HydrophobicContact CG2-CB 3.83Å; I588-E592 HydrophobicContact CG2-CG 3.97Å; I588-E592 VanDerWaalsContact CG2-OE2 3.26Å; I588-E592 WeakPolarHBondContact CG2-OE2 3.49Å; D589-E592 PolarHBondContact O-N 3.48Å; D589-E592 VanDerWaalsContact O-N 3.08Å; E592-L594 VanDerWaalsContact C-N 3.32Å; E592-L594 PolarHBondContact O-N 3.41Å; E592-H595 WeakPolarHBondContact O-CB 3.4Å; E592-H595 PolarHBondContact O-N 3.17Å; E592-H595 VanDerWaalsContact O-N 3.1Å; E592-M596 WeakPolarHBondContact O-CG 3.45Å; E592-M596 PolarHBondContact O-N 3.39Å; E592-K606 VanDerWaalsContact OE1-CE 3.26Å; E592-K606 WeakPolarHBondContact OE1-CE 3.42Å; E592-K606 IonicContact OE1-NZ 3.62Å
593	L	87.1	Confident	87.2	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-58.5	-42.4	173.9	-70.8	177.3	0	0	0	112.8	L562 L566 L585 L586 I588 D589 M596 L597	L562-L593 HydrophobicContact CB-CD1 4.46Å; L562-L593 HydrophobicContact CD1-CB 4.14Å; L562-L593 HydrophobicContact CD1-CD1 3.74Å; L562-L593 HydrophobicContact CD2-CB 4.2Å; L566-L593 HydrophobicContact CD1-CD2 3.66Å; L585-L593 HydrophobicContact CB-CD2 4.34Å; L585-L593 VanDerWaalsContact O-CD2 3.28Å; L585-L593 WeakPolarHBondContact O-CD2 3.37Å; L586-L593 HydrophobicContact CD2-CD1 4.27Å; I588-L593 HydrophobicContact CB-CD2 4.36Å; I588-L593 HydrophobicContact CB-CG 4.44Å; D589-L593 PolarHBondContact O-N 3.05Å; D589-L593 VanDerWaalsContact O-N 3.09Å; L593-M596 HydrophobicContact CD2-CE 3.36Å; L593-M596 HydrophobicContact CD2-SD 4.47Å; L593-M596 PolarHBondContact O-N 3.37Å; L593-L597 PolarHBondContact O-N 2.96Å; L593-L597 VanDerWaalsContact O-N 3.15Å
594	L	85.1	Confident	87.2	Confident	36 Å²	36	66.1 Å²	66.1	19%	0.188	34%	0.338	C	S	.	.	H	α-helix	trans	-62	-42.5	173.7	-82.1	173.1	0	0	0	112.2	A547 L550 L562 N590 E592 M596 L597 E598	A547-L594 HydrophobicContact CB-CD1 4.47Å; L550-L594 HydrophobicContact CD1-CD1 3.74Å; L550-L594 HydrophobicContact CD1-CD2 3.52Å; L550-L594 HydrophobicContact CD1-CG 3.78Å; L562-L594 HydrophobicContact CD2-CD2 4.37Å; L562-L594 HydrophobicContact CD2-CG 4.46Å; N590-L594 WeakPolarHBondContact O-CG 3.49Å; N590-L594 PolarHBondContact O-N 2.88Å; N590-L594 VanDerWaalsContact O-N 3.08Å; E592-L594 VanDerWaalsContact C-N 3.32Å; E592-L594 PolarHBondContact O-N 3.41Å; L594-M596 VanDerWaalsContact C-N 3.29Å; L594-M596 PolarHBondContact O-N 2.95Å; L594-L597 PolarHBondContact O-N 3.2Å; L594-L597 VanDerWaalsContact O-N 3.16Å; L594-E598 PolarHBondContact O-N 3.3Å
595	H	84.1	Confident	87.2	Confident	80 Å²	80	66.9 Å²	66.9	37%	0.37	35%	0.349	S	S	.	.	H	α-helix	trans	-62.7	-36.8	176.9	-170.5	51.6	0	0	0	112.4	S591 E592 L597 E598 S599	S591-H595 PolarHBondContact O-N 2.89Å; E592-H595 WeakPolarHBondContact O-CB 3.4Å; E592-H595 PolarHBondContact O-N 3.17Å; E592-H595 VanDerWaalsContact O-N 3.1Å; H595-L597 VanDerWaalsContact C-N 3.34Å; H595-E598 PolarHBondContact O-N 3.44Å; H595-S599 WeakPolarHBondContact O-CB 2.98Å; H595-S599 PolarHBondContact O-N 3.23Å
596	M	86.5	Confident	87.1	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.005	36%	0.358	C	S	.	.	H	α-helix	trans	-65.6	-35.3	174.8	-64.4	-176.5	-21.1	0	0	112.6	L566 L585 E592 L593 L594 E598 S599 L603 K606	L566-M596 HydrophobicContact CD1-CE 4.42Å; L566-M596 HydrophobicContact CD2-CE 3.72Å; L585-M596 HydrophobicContact CB-CE 4.44Å; L585-M596 HydrophobicContact CD1-CE 4.21Å; L585-M596 HydrophobicContact CD2-CE 4.17Å; L585-M596 HydrophobicContact CD2-SD 4.28Å; E592-M596 WeakPolarHBondContact O-CG 3.45Å; E592-M596 PolarHBondContact O-N 3.39Å; L593-M596 HydrophobicContact CD2-CE 3.36Å; L593-M596 HydrophobicContact CD2-SD 4.47Å; L593-M596 PolarHBondContact O-N 3.37Å; L594-M596 VanDerWaalsContact C-N 3.29Å; L594-M596 PolarHBondContact O-N 2.95Å; M596-E598 VanDerWaalsContact C-N 3.27Å; M596-E598 PolarHBondContact O-N 2.97Å; M596-S599 CarbonylContact O-C 3.59Å; M596-S599 PolarHBondContact O-N 2.98Å; M596-S599 VanDerWaalsContact O-O 3.07Å; M596-L603 HydrophobicContact CB-CB 4.21Å; M596-L603 HydrophobicContact CB-CD1 4.19Å; M596-L603 HydrophobicContact CE-CD1 3.9Å; M596-K606 HydrophobicContact SD-CB 3.77Å; M596-K606 HydrophobicContact SD-CG 3.77Å
597	L	87	Confident	87.2	Confident	28 Å²	28	67.3 Å²	67.3	15%	0.147	35%	0.349	C	S	.	.	H	α-helix	trans	-68.2	-28.8	175.4	-71	172.2	0	0	0	112.3	L562 R565 L566 L569 L593 L594 H595	L562-L597 HydrophobicContact CD2-CD1 3.95Å; R565-L597 HydrophobicContact CB-CD1 4.03Å; R565-L597 HydrophobicContact CB-CD2 3.86Å; L566-L597 HydrophobicContact CD2-CD2 3.81Å; L566-L597 HydrophobicContact CD2-CG 4.2Å; L566-L597 HydrophobicContact CG-CD2 4.07Å; L569-L597 HydrophobicContact CD1-CD2 3.78Å; L593-L597 PolarHBondContact O-N 2.96Å; L593-L597 VanDerWaalsContact O-N 3.15Å; L594-L597 PolarHBondContact O-N 3.2Å; L594-L597 VanDerWaalsContact O-N 3.16Å; H595-L597 VanDerWaalsContact C-N 3.34Å
598	E	84	Confident	87.3	Confident	116 Å²	116	63.1 Å²	63.1	54%	0.542	33%	0.332	S	S	.	.	H	α-helix	trans	-85	-25.6	176.5	-67.7	176.9	174.2	0	0	113.3	V537 L594 H595 M596	V537-E598 HydrophobicContact CG2-CG 4.23Å; L594-E598 PolarHBondContact O-N 3.3Å; H595-E598 PolarHBondContact O-N 3.44Å; M596-E598 VanDerWaalsContact C-N 3.27Å; M596-E598 PolarHBondContact O-N 2.97Å
599	S	84.9	Confident	87.5	Confident	29 Å²	29	66.5 Å²	66.5	20%	0.203	35%	0.347	C	S	.	.			trans	-121.5	103.8	-176.5	-178.5	0	0	0	0	112	H595 M596 E601 S602 L603	H595-S599 WeakPolarHBondContact O-CB 2.98Å; H595-S599 PolarHBondContact O-N 3.23Å; M596-S599 CarbonylContact O-C 3.59Å; M596-S599 PolarHBondContact O-N 2.98Å; M596-S599 VanDerWaalsContact O-O 3.07Å; S599-E601 PolarHBondContact O-N 2.82Å; S599-S602 PolarHBondContact O-N 2.92Å; S599-S602 VanDerWaalsContact O-N 3.09Å; S599-S602 PolarHBondContact OG-N 3.38Å; S599-L603 PolarHBondContact O-N 3.11Å
600	P	86.2	Confident	87.8	Confident	102 Å²	102	61 Å²	61	66%	0.662	32%	0.319	S	S	*	.	H	α-helix	trans	-56.9	-33	176.3	-24.7	33.1	0	0	0	113.6	R604	P600-R604 WeakPolarHBondContact O-CB 3.5Å; P600-R604 PolarHBondContact O-N 3.44Å
601	E	86.6	Confident	88.2	Confident	163 Å²	163	59.8 Å²	59.8	76%	0.762	31%	0.313	S	S	*	.	H	α-helix	trans	-67.8	-43.8	177.3	-63.7	174.8	177.6	0	0	111.4	S599 R604 S605	S599-E601 PolarHBondContact O-N 2.82Å; E601-R604 PolarHBondContact O-N 3.15Å; E601-S605 PolarHBondContact O-N 2.97Å
602	S	88.4	Confident	88.6	Confident	31 Å²	31	58 Å²	58	22%	0.217	30%	0.304	C	S	.	.	H	α-helix	trans	-64.5	-42.9	176.9	-169.2	0	0	0	0	111.3	S599 K606	S599-S602 PolarHBondContact O-N 2.92Å; S599-S602 VanDerWaalsContact O-N 3.09Å; S599-S602 PolarHBondContact OG-N 3.38Å; S602-K606 PolarHBondContact O-N 3.01Å; S602-K606 VanDerWaalsContact O-N 3.15Å
603	L	92.1	Very high	88.8	Confident	7 Å²	7	58.2 Å²	58.2	4%	0.037	31%	0.31	C	S	.	.	H	α-helix	trans	-60.9	-48	175.4	-179.1	62.2	0	0	0	110.9	L566 L569 I570 L585 M596 S599 S605 K606 V607	L566-L603 HydrophobicContact CD2-CD1 3.79Å; L569-L603 HydrophobicContact CB-CD2 3.73Å; L569-L603 HydrophobicContact CD1-CD2 3.91Å; L569-L603 HydrophobicContact CG-CD2 4.46Å; I570-L603 HydrophobicContact CG1-CD1 4.44Å; L585-L603 HydrophobicContact CD1-CD1 4.42Å; M596-L603 HydrophobicContact CB-CB 4.21Å; M596-L603 HydrophobicContact CB-CD1 4.19Å; M596-L603 HydrophobicContact CE-CD1 3.9Å; S599-L603 PolarHBondContact O-N 3.11Å; L603-S605 PolarHBondContact O-N 3.12Å; L603-K606 PolarHBondContact O-N 2.83Å; L603-V607 HydrophobicContact CD1-CG2 4.08Å; L603-V607 HydrophobicContact CG-CG2 4.26Å; L603-V607 WeakPolarHBondContact O-CB 3.18Å; L603-V607 VanDerWaalsContact O-CG2 3.26Å; L603-V607 WeakPolarHBondContact O-CG2 3.31Å; L603-V607 PolarHBondContact O-N 3.05Å
604	R	91.3	Very high	89	Confident	156 Å²	156	59.2 Å²	59.2	59%	0.589	32%	0.315	S	S	*	.	H	α-helix	trans	-59.7	-46.8	179.9	-176.4	173.1	-67.9	-176.3	-1.2	112.2	M573 P600 E601 K606 V607 D608	M573-R604 HydrophobicContact CE-CB 3.72Å; M573-R604 HydrophobicContact CE-CG 3.58Å; P600-R604 WeakPolarHBondContact O-CB 3.5Å; P600-R604 PolarHBondContact O-N 3.44Å; E601-R604 PolarHBondContact O-N 3.15Å; R604-K606 VanDerWaalsContact C-N 3.28Å; R604-K606 PolarHBondContact O-N 3.35Å; R604-V607 PolarHBondContact O-N 3.4Å; R604-D608 VanDerWaalsContact O-CG 3.28Å; R604-D608 PolarHBondContact O-N 3.12Å
605	S	91.4	Very high	89.1	Confident	78 Å²	78	63.1 Å²	63.1	55%	0.545	33%	0.332	S	S	.	.	H	α-helix	trans	-59	-38.8	177.2	-175.6	0	0	0	0	112.8	E601 L603 E609	E601-S605 PolarHBondContact O-N 2.97Å; L603-S605 PolarHBondContact O-N 3.12Å; S605-E609 PolarHBondContact O-N 2.9Å
606	K	90.7	Very high	89.2	Confident	49 Å²	49	62.3 Å²	62.3	21%	0.213	34%	0.339	C	S	.	.	H	α-helix	trans	-76.3	-34.3	179.7	-81.2	-73.7	176.2	-165.9	0	112.9	L585 I588 E592 M596 S602 L603 R604 E609 A610	L585-K606 HydrophobicContact CD2-CB 3.94Å; I588-K606 HydrophobicContact CD1-CD 4.36Å; E592-K606 VanDerWaalsContact OE1-CE 3.26Å; E592-K606 WeakPolarHBondContact OE1-CE 3.42Å; E592-K606 IonicContact OE1-NZ 3.62Å; M596-K606 HydrophobicContact SD-CB 3.77Å; M596-K606 HydrophobicContact SD-CG 3.77Å; S602-K606 PolarHBondContact O-N 3.01Å; S602-K606 VanDerWaalsContact O-N 3.15Å; L603-K606 PolarHBondContact O-N 2.83Å; R604-K606 VanDerWaalsContact C-N 3.28Å; R604-K606 PolarHBondContact O-N 3.35Å; K606-E609 IonicContact NZ-OE2 2.8Å; K606-E609 PolarHBondContact NZ-OE2 2.92Å; K606-E609 PolarHBondContact O-N 3.2Å; K606-A610 PolarHBondContact O-N 3.42Å
607	V	93.3	Very high	89.3	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-62.9	-44.8	171.8	168.6	0	0	0	0	110.5	I570 M573 I581 L585 L603 R604 E609 A610 V611	I570-V607 HydrophobicContact CG1-CG2 4.05Å; M573-V607 HydrophobicContact CE-CB 4.22Å; M573-V607 HydrophobicContact CE-CG1 4.12Å; M573-V607 HydrophobicContact SD-CG2 4.49Å; I581-V607 HydrophobicContact CD1-CG1 4.4Å; I581-V607 HydrophobicContact CG2-CG1 4.32Å; I581-V607 HydrophobicContact CG2-CG2 4.14Å; L585-V607 HydrophobicContact CD1-CG2 4.15Å; L603-V607 HydrophobicContact CD1-CG2 4.08Å; L603-V607 HydrophobicContact CG-CG2 4.26Å; L603-V607 WeakPolarHBondContact O-CB 3.18Å; L603-V607 VanDerWaalsContact O-CG2 3.26Å; L603-V607 WeakPolarHBondContact O-CG2 3.31Å; L603-V607 PolarHBondContact O-N 3.05Å; R604-V607 PolarHBondContact O-N 3.4Å; V607-E609 VanDerWaalsContact C-N 3.33Å; V607-E609 PolarHBondContact O-N 3.4Å; V607-A610 PolarHBondContact O-N 2.85Å; V607-V611 HydrophobicContact CG1-CG2 4.42Å; V607-V611 VanDerWaalsContact O-CG2 3.3Å; V607-V611 WeakPolarHBondContact O-CG2 3.43Å; V607-V611 PolarHBondContact O-N 3.04Å
608	D	91.1	Very high	89.2	Confident	85 Å²	85	70 Å²	70	46%	0.455	38%	0.375	S	S	.	.	H	α-helix	trans	-62.1	-40.5	177.4	-67.4	-22.4	0	0	0	111.8	R604 V611 A612	R604-D608 VanDerWaalsContact O-CG 3.28Å; R604-D608 PolarHBondContact O-N 3.12Å; D608-V611 PolarHBondContact O-N 3.23Å; D608-A612 PolarHBondContact O-N 2.86Å
609	E	91.4	Very high	89.3	Confident	107 Å²	107	67.5 Å²	67.5	50%	0.5	37%	0.374	S	S	.	.	H	α-helix	trans	-60.3	-46.8	173.7	-171.1	-179.6	-177.8	0	0	111.3	S605 K606 V607 V611 A612 V613	S605-E609 PolarHBondContact O-N 2.9Å; K606-E609 IonicContact NZ-OE2 2.8Å; K606-E609 PolarHBondContact NZ-OE2 2.92Å; K606-E609 PolarHBondContact O-N 3.2Å; V607-E609 VanDerWaalsContact C-N 3.33Å; V607-E609 PolarHBondContact O-N 3.4Å; E609-V611 PolarHBondContact O-N 3.31Å; E609-A612 PolarHBondContact O-N 3.04Å; E609-V613 WeakPolarHBondContact O-CG2 3.5Å; E609-V613 PolarHBondContact O-N 3.42Å; E609-V613 VanDerWaalsContact O-N 3.17Å
610	A	92.3	Very high	89.2	Confident	7 Å²	7	72.9 Å²	72.9	6%	0.058	39%	0.393	C	S	.	.	H	α-helix	trans	-64.2	-38.8	177.9	0	0	0	0	0	112.6	I581 M584 K606 V607 V613 L614	I581-A610 HydrophobicContact CG2-CB 4.07Å; M584-A610 HydrophobicContact CE-CB 4.44Å; K606-A610 PolarHBondContact O-N 3.42Å; V607-A610 PolarHBondContact O-N 2.85Å; A610-V613 PolarHBondContact O-N 3.4Å; A610-L614 WeakPolarHBondContact O-CG 3.45Å; A610-L614 PolarHBondContact O-N 3.36Å
611	V	92.2	Very high	89	Confident	13 Å²	13	72.5 Å²	72.5	8%	0.079	38%	0.383	C	S	.	.	H	α-helix	trans	-62.2	-44.8	175.4	169.6	0	0	0	0	111	I581 V607 D608 E609 V613 L614 Q615	I581-V611 HydrophobicContact CD1-CG2 3.67Å; I581-V611 HydrophobicContact CG1-CG2 4.38Å; V607-V611 HydrophobicContact CG1-CG2 4.42Å; V607-V611 VanDerWaalsContact O-CG2 3.3Å; V607-V611 WeakPolarHBondContact O-CG2 3.43Å; V607-V611 PolarHBondContact O-N 3.04Å; D608-V611 PolarHBondContact O-N 3.23Å; E609-V611 PolarHBondContact O-N 3.31Å; V611-V613 VanDerWaalsContact C-N 3.3Å; V611-V613 PolarHBondContact O-N 3.02Å; V611-L614 PolarHBondContact O-N 3.21Å; V611-Q615 HydrophobicContact CG1-CG 4.34Å; V611-Q615 WeakPolarHBondContact O-CG 3.24Å; V611-Q615 PolarHBondContact O-N 3.09Å
612	A	90.2	Very high	88.7	Confident	55 Å²	55	67.6 Å²	67.6	46%	0.455	37%	0.37	S	S	.	.	H	α-helix	trans	-60.4	-40.6	178	0	0	0	0	0	112.1	D608 E609 A616	D608-A612 PolarHBondContact O-N 2.86Å; E609-A612 PolarHBondContact O-N 3.04Å; A612-A616 WeakPolarHBondContact O-CB 3.38Å; A612-A616 PolarHBondContact O-N 2.91Å
613	V	89.9	Confident	88.3	Confident	79 Å²	79	68.9 Å²	68.9	48%	0.479	38%	0.382	S	S	.	.	H	α-helix	trans	-65.5	-44.2	176	174.6	0	0	0	0	111.5	M584 E609 A610 V611 Q615 A616 H617	M584-V613 HydrophobicContact CE-CB 3.95Å; M584-V613 HydrophobicContact CE-CG1 3.67Å; E609-V613 WeakPolarHBondContact O-CG2 3.5Å; E609-V613 PolarHBondContact O-N 3.42Å; E609-V613 VanDerWaalsContact O-N 3.17Å; A610-V613 PolarHBondContact O-N 3.4Å; V611-V613 VanDerWaalsContact C-N 3.3Å; V611-V613 PolarHBondContact O-N 3.02Å; V613-Q615 PolarHBondContact O-N 3.11Å; V613-A616 PolarHBondContact O-N 2.84Å; V613-H617 PolarHBondContact O-N 3.05Å
614	L	89.7	Confident	87.4	Confident	22 Å²	22	73.9 Å²	73.9	12%	0.115	41%	0.406	C	S	.	.	H	α-helix	trans	-63.3	-41.2	177.8	-77.2	169.1	0	0	0	112.3	K580 I581 M584 A610 V611 H617 Q618	K580-L614 HydrophobicContact CB-CD1 3.91Å; K580-L614 HydrophobicContact CB-CD2 4.14Å; K580-L614 HydrophobicContact CD-CD2 4.08Å; I581-L614 HydrophobicContact CG1-CD1 3.75Å; M584-L614 HydrophobicContact SD-CD1 4.07Å; M584-L614 HydrophobicContact SD-CD2 3.87Å; M584-L614 HydrophobicContact SD-CG 3.69Å; A610-L614 WeakPolarHBondContact O-CG 3.45Å; A610-L614 PolarHBondContact O-N 3.36Å; V611-L614 PolarHBondContact O-N 3.21Å; L614-H617 PolarHBondContact O-N 2.79Å; L614-Q618 WeakPolarHBondContact O-CG 3.27Å; L614-Q618 PolarHBondContact O-N 3.18Å
615	Q	89.1	Confident	86.6	Confident	117 Å²	117	73.8 Å²	73.8	55%	0.547	41%	0.41	S	S	.	.	H	α-helix	trans	-63.8	-42.6	175.7	-73.2	176.1	-3.7	0	0	111.6	V611 V613 H617 Q618 A619	V611-Q615 HydrophobicContact CG1-CG 4.34Å; V611-Q615 WeakPolarHBondContact O-CG 3.24Å; V611-Q615 PolarHBondContact O-N 3.09Å; V613-Q615 PolarHBondContact O-N 3.11Å; Q615-H617 VanDerWaalsContact C-N 3.32Å; Q615-H617 PolarHBondContact O-N 2.87Å; Q615-Q618 PolarHBondContact O-N 3.13Å; Q615-A619 WeakPolarHBondContact O-CB 3.38Å; Q615-A619 PolarHBondContact O-N 3.13Å
616	A	86	Confident	85.8	Confident	63 Å²	63	72.7 Å²	72.7	52%	0.521	41%	0.405	S	S	.	.	H	α-helix	trans	-62.7	-38.5	176.4	0	0	0	0	0	112.4	A612 V613 K620	A612-A616 WeakPolarHBondContact O-CB 3.38Å; A612-A616 PolarHBondContact O-N 2.91Å; V613-A616 PolarHBondContact O-N 2.84Å; A616-K620 WeakPolarHBondContact O-CB 3.39Å; A616-K620 PolarHBondContact O-N 2.92Å; A616-K620 VanDerWaalsContact O-N 3.13Å
617	H	86.7	Confident	84.9	Confident	108 Å²	108	74.5 Å²	74.5	50%	0.5	42%	0.42	S	S	.	.	H	α-helix	trans	-66.7	-45.3	175.6	-167.6	-83.1	0	0	0	112	V613 L614 Q615 A619 K620 E621	V613-H617 PolarHBondContact O-N 3.05Å; L614-H617 PolarHBondContact O-N 2.79Å; Q615-H617 VanDerWaalsContact C-N 3.32Å; Q615-H617 PolarHBondContact O-N 2.87Å; H617-A619 VanDerWaalsContact C-N 3.34Å; H617-A619 PolarHBondContact O-N 3.5Å; H617-K620 WeakPolarHBondContact O-CB 3.26Å; H617-K620 PolarHBondContact O-N 2.75Å; H617-K620 VanDerWaalsContact O-N 3.15Å; H617-E621 VanDerWaalsContact CE1-CD 3.41Å; H617-E621 IonicContact CE1-OE1 2.82Å; H617-E621 IonicContact CE1-OE2 3.62Å; H617-E621 IonicContact ND1-OE2 3.68Å; H617-E621 PolarHBondContact ND1-OE2 2.82Å; H617-E621 PolarHBondContact O-N 2.82Å
618	Q	86.2	Confident	83.5	Confident	84 Å²	84	79.8 Å²	79.8	39%	0.393	45%	0.448	S	S	.	.	H	α-helix	trans	-62	-41.2	177.6	-72.5	174.3	19.9	0	0	112	L614 Q615 K620 E621 A622	L614-Q618 WeakPolarHBondContact O-CG 3.27Å; L614-Q618 PolarHBondContact O-N 3.18Å; Q615-Q618 PolarHBondContact O-N 3.13Å; Q618-K620 VanDerWaalsContact C-N 3.29Å; Q618-K620 PolarHBondContact O-N 3.15Å; Q618-E621 PolarHBondContact O-N 2.79Å; Q618-A622 VanDerWaalsContact O-CB 3.32Å; Q618-A622 WeakPolarHBondContact O-CB 3.3Å; Q618-A622 PolarHBondContact O-N 3.28Å
619	A	84.9	Confident	82	Confident	63 Å²	63	80.3 Å²	80.3	52%	0.521	46%	0.459	S	S	.	.	H	α-helix	trans	-61.6	-38.6	175	0	0	0	0	0	111.8	Q615 H617 A623	Q615-A619 WeakPolarHBondContact O-CB 3.38Å; Q615-A619 PolarHBondContact O-N 3.13Å; H617-A619 VanDerWaalsContact C-N 3.34Å; H617-A619 PolarHBondContact O-N 3.5Å; A619-A623 WeakPolarHBondContact O-CB 3.18Å; A619-A623 PolarHBondContact O-N 3.05Å
620	K	83	Confident	80.5	Confident	141 Å²	141	79.4 Å²	79.4	61%	0.613	47%	0.47	S	S	*	.	H	α-helix	trans	-70.1	-42.1	177.5	-165.9	179.6	178.7	-172.6	0	112.5	A616 H617 Q618 A623 Q624	A616-K620 WeakPolarHBondContact O-CB 3.39Å; A616-K620 PolarHBondContact O-N 2.92Å; A616-K620 VanDerWaalsContact O-N 3.13Å; H617-K620 WeakPolarHBondContact O-CB 3.26Å; H617-K620 PolarHBondContact O-N 2.75Å; H617-K620 VanDerWaalsContact O-N 3.15Å; Q618-K620 VanDerWaalsContact C-N 3.29Å; Q618-K620 PolarHBondContact O-N 3.15Å; K620-A623 PolarHBondContact O-N 3.48Å; K620-Q624 PolarHBondContact O-N 2.87Å
621	E	82	Confident	78.7	Confident	95 Å²	95	83.3 Å²	83.3	44%	0.444	49%	0.493	S	S	.	.	H	α-helix	trans	-64.9	-40.3	174.1	-82.3	-176.4	133.8	0	0	112.2	H617 Q618 Q624 K625	H617-E621 VanDerWaalsContact CE1-CD 3.41Å; H617-E621 IonicContact CE1-OE1 2.82Å; H617-E621 IonicContact CE1-OE2 3.62Å; H617-E621 IonicContact ND1-OE2 3.68Å; H617-E621 PolarHBondContact ND1-OE2 2.82Å; H617-E621 PolarHBondContact O-N 2.82Å; Q618-E621 PolarHBondContact O-N 2.79Å; E621-Q624 PolarHBondContact O-N 3.24Å; E621-K625 WeakPolarHBondContact O-CB 3.47Å; E621-K625 PolarHBondContact O-N 2.89Å
622	A	80.7	Confident	76.2	Confident	60 Å²	60	85.8 Å²	85.8	50%	0.496	52%	0.521	S	S	.	.	H	α-helix	trans	-62.8	-42.6	175.3	0	0	0	0	0	111.3	Q618 K625 A626	Q618-A622 VanDerWaalsContact O-CB 3.32Å; Q618-A622 WeakPolarHBondContact O-CB 3.3Å; Q618-A622 PolarHBondContact O-N 3.28Å; A622-K625 PolarHBondContact O-N 3.25Å; A622-A626 WeakPolarHBondContact O-CB 3.35Å; A622-A626 PolarHBondContact O-N 3.17Å
623	A	80	Confident	74.1	Confident	57 Å²	57	88.9 Å²	88.9	47%	0.471	53%	0.534	S	S	.	.	H	α-helix	trans	-62.9	-42.1	174.4	0	0	0	0	0	112.1	A619 K620 A626 V627	A619-A623 WeakPolarHBondContact O-CB 3.18Å; A619-A623 PolarHBondContact O-N 3.05Å; K620-A623 PolarHBondContact O-N 3.48Å; A623-A626 PolarHBondContact O-N 2.57Å; A623-V627 VanDerWaalsContact O-CG2 3.26Å; A623-V627 WeakPolarHBondContact O-CG2 3.26Å; A623-V627 PolarHBondContact O-N 2.71Å
624	Q	74.5	Confident	71.7	Confident	113 Å²	113	91 Å²	91	53%	0.528	55%	0.549	S	S	.	.	H	α-helix	trans	-66	-40.4	175.9	-91.1	172	-47	0	0	112.9	K620 E621 V627 N628	K620-Q624 PolarHBondContact O-N 2.87Å; E621-Q624 PolarHBondContact O-N 3.24Å; Q624-V627 PolarHBondContact O-N 3.44Å; Q624-N628 WeakPolarHBondContact O-CB 3.4Å; Q624-N628 VanDerWaalsContact O-CG 3.32Å; Q624-N628 PolarHBondContact O-N 2.91Å
625	K	74.2	Confident	69.6	Low	154 Å²	154	96.5 Å²	96.5	67%	0.67	58%	0.584	S	S	*	*	H	α-helix	trans	-64.4	-42.3	174.5	-78.5	-176.6	178.1	-179.6	0	111.8	E621 A622 V627 N628 S629	E621-K625 WeakPolarHBondContact O-CB 3.47Å; E621-K625 PolarHBondContact O-N 2.89Å; A622-K625 PolarHBondContact O-N 3.25Å; K625-V627 VanDerWaalsContact C-N 3.33Å; K625-V627 PolarHBondContact O-N 3.15Å; K625-N628 PolarHBondContact O-N 3.11Å; K625-S629 PolarHBondContact O-N 2.95Å; K625-S629 PolarHBondContact O-OG 3.13Å
626	A	74.7	Confident	67.5	Low	55 Å²	55	101 Å²	101	46%	0.455	62%	0.619	S	S	.	*	H	α-helix	trans	-60.7	-42	176.6	0	0	0	0	0	112	A622 A623 S629 A630	A622-A626 WeakPolarHBondContact O-CB 3.35Å; A622-A626 PolarHBondContact O-N 3.17Å; A623-A626 PolarHBondContact O-N 2.57Å; A626-S629 WeakPolarHBondContact CA-OG 3.35Å; A626-S629 PolarHBondContact O-OG 2.98Å; A626-A630 WeakPolarHBondContact O-CB 3.43Å; A626-A630 PolarHBondContact O-N 3.13Å; A626-A630 VanDerWaalsContact O-N 3.11Å
627	V	71.1	Confident	66.6	Low	86 Å²	86	103 Å²	103	52%	0.521	62%	0.624	S	S	.	*	H	α-helix	trans	-64.4	-45.8	174.9	173.8	0	0	0	0	110.9	A623 Q624 K625 S629 A630 T631	A623-V627 VanDerWaalsContact O-CG2 3.26Å; A623-V627 WeakPolarHBondContact O-CG2 3.26Å; A623-V627 PolarHBondContact O-N 2.71Å; Q624-V627 PolarHBondContact O-N 3.44Å; K625-V627 VanDerWaalsContact C-N 3.33Å; K625-V627 PolarHBondContact O-N 3.15Å; V627-S629 PolarHBondContact O-N 3.46Å; V627-A630 PolarHBondContact O-N 3.42Å; V627-A630 VanDerWaalsContact O-N 3.15Å; V627-T631 PolarHBondContact O-N 2.9Å; V627-T631 VanDerWaalsContact O-N 3.13Å; V627-T631 PolarHBondContact O-OG1 2.91Å; V627-T631 VanDerWaalsContact O-OG1 3.13Å
628	N	63.1	Low	65.5	Low	112 Å²	112	102.7 Å²	102.7	60%	0.599	63%	0.631	S	S	*	*	H	α-helix	trans	-66.1	-35.8	-179.9	-73	-0.5	0	0	0	113.2	Q624 K625 A630 T631	Q624-N628 WeakPolarHBondContact O-CB 3.4Å; Q624-N628 VanDerWaalsContact O-CG 3.32Å; Q624-N628 PolarHBondContact O-N 2.91Å; K625-N628 PolarHBondContact O-N 3.11Å; N628-A630 VanDerWaalsContact C-N 3.33Å; N628-T631 PolarHBondContact O-N 3.21Å; N628-T631 PolarHBondContact O-OG1 3.45Å
629	S	61	Low	64.4	Low	96 Å²	96	103.7 Å²	103.7	67%	0.671	64%	0.644	S	S	*	*	H	α-helix	trans	-70.8	-26.5	173.6	48.1	0	0	0	0	113.4	K625 A626 V627	K625-S629 PolarHBondContact O-N 2.95Å; K625-S629 PolarHBondContact O-OG 3.13Å; A626-S629 WeakPolarHBondContact CA-OG 3.35Å; A626-S629 PolarHBondContact O-OG 2.98Å; V627-S629 PolarHBondContact O-N 3.46Å
630	A	58.9	Low	63.1	Low	88 Å²	88	106.1 Å²	106.1	73%	0.727	65%	0.651	S	S	*	*	H	α-helix	trans	-80.6	-21.3	176.1	0	0	0	0	0	112.9	A626 V627 N628	A626-A630 WeakPolarHBondContact O-CB 3.43Å; A626-A630 PolarHBondContact O-N 3.13Å; A626-A630 VanDerWaalsContact O-N 3.11Å; V627-A630 PolarHBondContact O-N 3.42Å; V627-A630 VanDerWaalsContact O-N 3.15Å; N628-A630 VanDerWaalsContact C-N 3.33Å
631	T	55.7	Low	61.9	Low	89 Å²	89	103.9 Å²	103.9	55%	0.546	65%	0.653	S	S	.	*	S	Bend	trans	-94.1	-3.2	-178.1	49.6	0	0	0	0	115.3	V627 N628 V633	V627-T631 PolarHBondContact O-N 2.9Å; V627-T631 VanDerWaalsContact O-N 3.13Å; V627-T631 PolarHBondContact O-OG1 2.91Å; V627-T631 VanDerWaalsContact O-OG1 3.13Å; N628-T631 PolarHBondContact O-N 3.21Å; N628-T631 PolarHBondContact O-OG1 3.45Å; T631-V633 WeakPolarHBondContact O-CG2 3.41Å; T631-V633 PolarHBondContact O-N 3.15Å; T631-V633 VanDerWaalsContact O-N 3.15Å
632	G	39.7	Very low	60.6	Low	65 Å²	65	104.5 Å²	104.5	67%	0.67	67%	0.667	S	S	*	*			trans	41.7	57.3	163.8	0	0	0	0	0	116.3
633	V	46	Very low	59.1	Low	119 Å²	119	107.7 Å²	107.7	72%	0.721	68%	0.68	S	S	*	*			trans	-123.5	116.8	167.1	-170.5	0	0	0	0	108.4	T631 T635	T631-V633 WeakPolarHBondContact O-CG2 3.41Å; T631-V633 PolarHBondContact O-N 3.15Å; T631-V633 VanDerWaalsContact O-N 3.15Å; V633-T635 PolarHBondContact O-N 3.38Å
634	P	38.4	Very low	57.5	Low	123 Å²	123	111.6 Å²	111.6	80%	0.799	70%	0.696	S	S	*	*			trans	-77.3	114.8	174.2	29.8	-28.3	0	0	0	109
635	T	45.3	Very low	56.1	Low	138 Å²	138	111.5 Å²	111.5	85%	0.847	71%	0.71	S	S	*	*			trans	-84.3	121.5	168.1	15.1	0	0	0	0	109.9	V633	V633-T635 PolarHBondContact O-N 3.38Å
636	V	45.4	Very low	54.5	Low	213 Å²	213	107.6 Å²	107.6	100%	1.291	71%	0.713	S	S	*	*			trans	-62.1	0	161.8	178.5	0	0	0	0	110.3

Retrieved 636 of 636 residues in 2825.3 ms (Link to these results)

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