A0A077Z2B5_TRITR Loading...

rRNA adenine N(6)-methyltransferase

Specifically dimethylates two adjacent adenosines in the loop of a conserved hairpin near the 3'-end of 18S rRNA in the 40S particle. Involved in the pre-rRNA processing steps leading to small-subunit rRNA production independently of its RNA-modifying catalytic activity. Part of the small subunit (SSU) processome, first precursor of the small eukaryotic ribosomal subunit. During the assembly of the SSU processome in the nucleolus, many ribosome biogenesis factors, an RNA chaperone and ribosomal proteins associate with the nascent pre-rRNA and work in concert to generate RNA folding, modifications, rearrangements and cleavage as well as targeted degradation of pre-ribosomal RNA by the RNA exosome.

AlphaFold DB , UniProt , Accession A0A077Z2B5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 268 aa.

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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	33.7	Very low	63.8	Low	214 Å²	214	108.5 Å²	108.5	100%	1.054	56%	0.561	S	S	*	*				0	-27.1	0	-94.2	-177.8	-173.3	0	0	116.2	S4	M1-S4 PolarHBondContact O-OG 3.19Å
2	K	32.8	Very low	66.6	Low	194 Å²	194	105 Å²	105	84%	0.843	55%	0.553	S	S	*	*			trans	-71.4	-29.5	-173	-76.4	-177.7	178.1	176.6	0	116.5
3	K	33.5	Very low	69	Low	188 Å²	188	97.2 Å²	97.2	82%	0.817	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-70.5	-32.3	-178.5	-79.3	-174.8	177	179.4	0	113.7	V5	K3-V5 PolarHBondContact O-N 3.45Å
4	S	37.6	Very low	71.1	Confident	78 Å²	78	90.6 Å²	90.6	55%	0.545	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-72.9	-11.7	-174.3	21	0	0	0	0	114.2	M1 R163	M1-S4 PolarHBondContact O-OG 3.19Å; S4-R163 PolarHBondContact O-NH1 3.48Å
5	V	54.4	Low	72.9	Confident	40 Å²	40	84.6 Å²	84.6	24%	0.242	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-101.1	-15.9	-174.9	-164.1	0	0	0	0	112.4	K3 H141 V143 R163	K3-V5 PolarHBondContact O-N 3.45Å; V5-H141 HydrophobicContact CG1-CB 4.15Å; V5-V143 HydrophobicContact CB-CG1 4.46Å; V5-V143 HydrophobicContact CG1-CB 4.05Å; V5-V143 HydrophobicContact CG1-CG1 4.08Å; V5-V143 HydrophobicContact CG1-CG2 3.86Å; V5-R163 VanDerWaalsContact O-CD 3.29Å; V5-R163 WeakPolarHBondContact O-CD 3.34Å
6	M	65.7	Low	74.5	Confident	104 Å²	104	79.4 Å²	79.4	51%	0.512	42%	0.418	S	S	.	.	S	Bend	trans	-78.9	162.9	173.5	-76.8	175.7	52.4	0	0	111.9	V8 V143 R163	M6-V8 PolarHBondContact O-N 2.98Å; M6-V143 HydrophobicContact CG-CG1 4.37Å; M6-R163 PolarHBondContact O-NH1 2.91Å
7	V	74.2	Confident	75.9	Confident	46 Å²	46	75.1 Å²	75.1	28%	0.279	40%	0.395	S	S	.	.			trans	-59.1	122.3	172.7	-176.3	0	0	0	0	109.2	L9 V79 V81 V107	V7-L9 HydrophobicContact CG1-CD2 3.46Å; V7-L9 VanDerWaalsContact CG1-CD2 3.46Å; V7-L9 HydrophobicContact CG1-CG 3.71Å; V7-V79 HydrophobicContact CG1-CG1 3.86Å; V7-V81 HydrophobicContact CG2-CG1 4.03Å; V7-V107 HydrophobicContact CB-CG2 4.36Å; V7-V107 HydrophobicContact CG2-CB 3.37Å; V7-V107 HydrophobicContact CG2-CG1 3.84Å; V7-V107 HydrophobicContact CG2-CG2 3.27Å
8	V	85.3	Confident	77.1	Confident	77 Å²	77	71.2 Å²	71.2	47%	0.467	38%	0.375	S	S	.	.			trans	-107.6	96	171.4	-178.5	0	0	0	0	108	M6 R104	M6-V8 PolarHBondContact O-N 2.98Å; V8-R104 PolarHBondContact O-NH1 2.94Å; V8-R104 VanDerWaalsContact O-NH1 3.08Å; V8-R104 PolarHBondContact O-NH2 2.88Å
9	L	93.6	Very high	78	Confident	38 Å²	38	68.8 Å²	68.8	20%	0.199	37%	0.369	C	S	.	.			trans	-79	142	177.5	-62.4	178.6	0	0	0	111.2	V7 V15 L29 R32 V79	V7-L9 HydrophobicContact CG1-CD2 3.46Å; V7-L9 VanDerWaalsContact CG1-CD2 3.46Å; V7-L9 HydrophobicContact CG1-CG 3.71Å; L9-V15 HydrophobicContact CD1-CG2 4.47Å; L9-V15 HydrophobicContact CD2-CG2 3.66Å; L9-L29 HydrophobicContact CD1-CD2 3.83Å; L9-R32 HydrophobicContact CB-CB 4.37Å; L9-R32 HydrophobicContact CD1-CB 3.92Å; L9-V79 HydrophobicContact CD2-CB 4.15Å; L9-V79 HydrophobicContact CD2-CG1 4.02Å; L9-V79 HydrophobicContact CD2-CG2 4.12Å
10	K	95.3	Very high	78.9	Confident	111 Å²	111	65.9 Å²	65.9	48%	0.483	35%	0.354	S	S	.	.			trans	-100.6	151.6	164.3	-56.4	175.8	178.4	-179.8	0	108.9	S12 D13 R32	K10-S12 PolarHBondContact O-N 3.3Å; K10-S12 VanDerWaalsContact O-N 3.13Å; K10-D13 PolarHBondContact N-OD2 3.19Å; K10-D13 WeakPolarHBondContact O-CB 3.39Å; K10-D13 PolarHBondContact O-N 3.12Å; K10-R32 CarbonylContact C-O 3.52Å
11	S	95.8	Very high	79.5	Confident	104 Å²	104	63.7 Å²	63.7	73%	0.727	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-20.9	175	53.1	0	0	0	0	113.5	S33 R34	S11-S33 CarbonylContact O-C 3.55Å; S11-R34 WeakPolarHBondContact O-CA 3.42Å; S11-R34 WeakPolarHBondContact O-CB 3.39Å; S11-R34 PolarHBondContact O-N 3.02Å
12	S	97.5	Very high	82.3	Confident	66 Å²	66	55.9 Å²	55.9	46%	0.462	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-14.9	176	58.9	0	0	0	0	114.4	K10 R34	K10-S12 PolarHBondContact O-N 3.3Å; K10-S12 VanDerWaalsContact O-N 3.13Å; S12-R34 PolarHBondContact O-NE 3.03Å
13	D	98	Very high	85.3	Confident	3 Å²	3	46.7 Å²	46.7	2%	0.016	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-70.1	140.5	-169.4	-70.4	-18.1	0	0	0	112	K10 S33 R34 K35 D78 R104	K10-D13 PolarHBondContact N-OD2 3.19Å; K10-D13 WeakPolarHBondContact O-CB 3.39Å; K10-D13 PolarHBondContact O-N 3.12Å; D13-S33 WeakPolarHBondContact O-CB 3.47Å; D13-R34 WeakPolarHBondContact O-CB 3.49Å; D13-R34 PolarHBondContact O-N 3.11Å; D13-K35 PolarHBondContact O-N 3.21Å; D13-D78 WeakPolarHBondContact CA-OD2 3.46Å; D13-D78 HydrophobicContact CB-CB 3.99Å; D13-R104 IonicContact OD1-NH2 3.66Å; D13-R104 IonicContact OD2-CZ 3.43Å; D13-R104 IonicContact OD2-NH2 2.93Å; D13-R104 PolarHBondContact OD2-NH2 2.69Å
14	T	98.4	Very high	88.2	Confident	6 Å²	6	42.2 Å²	42.2	4%	0.037	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	124.3	156.2	-64.3	0	0	0	0	109.2	R34 K35 I37 F77 D78 V79	T14-R34 PolarHBondContact OG1-NH2 3.39Å; T14-K35 CarbonylContact C-O 3.58Å; T14-K35 WeakPolarHBondContact CA-O 3.39Å; T14-K35 HydrophobicContact CG2-CB 4.48Å; T14-I37 HydrophobicContact CG2-CD1 3.69Å; T14-I37 HydrophobicContact CG2-CG1 4.12Å; T14-F77 HydrophobicContact CG2-CB 4.37Å; T14-D78 PolarHBondContact N-OD2 3.14Å; T14-D78 PolarHBondContact O-N 2.8Å; T14-V79 PolarHBondContact O-N 2.97Å
15	V	98.4	Very high	90.9	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	127.5	177.4	-176.3	0	0	0	0	110.1	L9 L29 K35 V36 I37 V79 V81	L9-V15 HydrophobicContact CD1-CG2 4.47Å; L9-V15 HydrophobicContact CD2-CG2 3.66Å; V15-L29 HydrophobicContact CG1-CD1 4.05Å; V15-L29 HydrophobicContact CG1-CD2 4.34Å; V15-K35 PolarHBondContact N-O 3.32Å; V15-V36 HydrophobicContact CB-CG2 4.34Å; V15-V36 CarbonylContact O-C 3.46Å; V15-V36 WeakPolarHBondContact O-CA 3.44Å; V15-I37 PolarHBondContact O-N 3.23Å; V15-V79 CarbonylContact C-O 3.6Å; V15-V79 VanDerWaalsContact CA-O 3.3Å; V15-V79 WeakPolarHBondContact CA-O 3.27Å; V15-V79 HydrophobicContact CG2-CB 4.46Å; V15-V81 HydrophobicContact CG1-CG2 3.97Å
16	F	98.2	Very high	92.9	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.009	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	108.9	168.6	-174.8	-129.2	0	0	0	109.8	V18 I37 C39 V69 W74 P75 F77 V79 C80 V81	F16-V18 HydrophobicContact CD1-CG2 3.77Å; F16-V18 HydrophobicContact CE1-CG2 3.39Å; F16-V18 HydrophobicContact CG-CG2 4.46Å; F16-V18 HydrophobicContact CZ-CG2 3.81Å; F16-I37 CarbonylContact C-O 3.58Å; F16-I37 WeakPolarHBondContact CA-O 3.31Å; F16-I37 HydrophobicContact CD2-CB 4.27Å; F16-I37 HydrophobicContact CD2-CG2 4.28Å; F16-I37 VanDerWaalsContact CD2-O 3.32Å; F16-I37 WeakPolarHBondContact CD2-O 3.4Å; F16-C39 HydrophobicContact CE2-CB 3.81Å; F16-C39 HydrophobicContact CZ-CB 3.85Å; F16-V69 HydrophobicContact CE1-CG2 4.22Å; F16-V69 HydrophobicContact CZ-CG2 4.06Å; F16-W74 AromaticContact CE1-CD2 3.93Å; F16-W74 HydrophobicContact CE1-CD2 3.93Å; F16-W74 AromaticContact CE1-CE2 3.99Å; F16-W74 HydrophobicContact CE1-CE3 4.32Å; F16-W74 HydrophobicContact CE1-CG 4.16Å; F16-W74 HydrophobicContact CE1-CZ2 4.48Å; F16-W74 HydrophobicContact CZ-CD2 4.49Å; F16-W74 HydrophobicContact CZ-CG 4.31Å; F16-P75 HydrophobicContact CD2-CG 4.3Å; F16-F77 HydrophobicContact CB-CB 3.64Å; F16-F77 HydrophobicContact CB-CD1 3.54Å; F16-F77 HydrophobicContact CB-CD2 4.03Å; F16-F77 HydrophobicContact CB-CE1 4.19Å; F16-F77 HydrophobicContact CB-CG 3.45Å; F16-F77 VanDerWaalsContact CB-CG 3.45Å; F16-F77 AromaticContact CD1-CD1 3.99Å; F16-F77 HydrophobicContact CD1-CD1 3.99Å; F16-F77 AromaticContact CD1-CE1 3.81Å; F16-F77 HydrophobicContact CD1-CE1 3.81Å; F16-F77 HydrophobicContact CD1-CZ 4.26Å; F16-F77 AromaticContact CG-CD1 3.89Å; F16-F77 HydrophobicContact CG-CD1 3.89Å; F16-F77 HydrophobicContact CG-CE1 4.2Å; F16-F77 HydrophobicContact CG-CG 4.3Å; F16-V79 PolarHBondContact N-O 2.71Å; F16-C80 CarbonylContact O-C 3.58Å; F16-C80 VanDerWaalsContact O-CA 3.29Å; F16-C80 WeakPolarHBondContact O-CA 3.33Å; F16-V81 PolarHBondContact O-N 2.66Å
17	E	97.8	Very high	94.3	Very high	6 Å²	6	37 Å²	37	3%	0.028	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	125.8	177	178.6	172.8	-149.7	0	0	110.1	P20 L25 T26 L29 V36 I37 A38 C39 V81	E17-P20 HydrophobicContact CG-CB 4.17Å; E17-L25 WeakPolarHBondContact OE1-CB 3.33Å; E17-T26 VanDerWaalsContact CD-OG1 3.23Å; E17-T26 PolarHBondContact OE1-N 3.24Å; E17-T26 PolarHBondContact OE1-OG1 3.4Å; E17-T26 VanDerWaalsContact OE2-CA 3.25Å; E17-T26 WeakPolarHBondContact OE2-CA 3.41Å; E17-T26 WeakPolarHBondContact OE2-CB 3.36Å; E17-T26 WeakPolarHBondContact OE2-CG2 3.14Å; E17-T26 PolarHBondContact OE2-OG1 3.33Å; E17-L29 HydrophobicContact CB-CD1 4.15Å; E17-L29 HydrophobicContact CG-CD1 4.32Å; E17-V36 HydrophobicContact CB-CG1 4.12Å; E17-I37 PolarHBondContact N-O 3.39Å; E17-A38 CarbonylContact O-C 3.52Å; E17-A38 VanDerWaalsContact O-CA 3.28Å; E17-A38 WeakPolarHBondContact O-CA 3.44Å; E17-C39 PolarHBondContact O-N 2.98Å; E17-V81 CarbonylContact C-O 3.57Å; E17-V81 VanDerWaalsContact CA-O 3.32Å; E17-V81 WeakPolarHBondContact CA-O 3.32Å; E17-V81 HydrophobicContact CB-CG2 3.87Å; E17-V81 HydrophobicContact CG-CG2 4Å
18	V	96.8	Very high	95.4	Very high	4 Å²	4	41 Å²	41	2%	0.024	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	121.9	178	-170	0	0	0	0	110.5	F16 C39 V69 V81 A82 N83 L84 F92	F16-V18 HydrophobicContact CD1-CG2 3.77Å; F16-V18 HydrophobicContact CE1-CG2 3.39Å; F16-V18 HydrophobicContact CG-CG2 4.46Å; F16-V18 HydrophobicContact CZ-CG2 3.81Å; V18-C39 HydrophobicContact CG1-CB 4.48Å; V18-V69 HydrophobicContact CB-CG2 4.41Å; V18-V69 HydrophobicContact CG1-CB 3.7Å; V18-V69 HydrophobicContact CG1-CG1 3.85Å; V18-V69 HydrophobicContact CG1-CG2 3.55Å; V18-V69 HydrophobicContact CG2-CG2 3.94Å; V18-V81 PolarHBondContact N-O 3.09Å; V18-A82 HydrophobicContact CB-CB 3.87Å; V18-A82 HydrophobicContact CG2-CB 4.42Å; V18-A82 WeakPolarHBondContact O-CA 3.29Å; V18-N83 PolarHBondContact O-N 3.31Å; V18-L84 HydrophobicContact CB-CD2 3.86Å; V18-L84 HydrophobicContact CG1-CD2 3.28Å; V18-F92 HydrophobicContact CB-CE2 4.44Å; V18-F92 HydrophobicContact CG1-CE2 4.38Å; V18-F92 HydrophobicContact CG2-CE2 3.94Å; V18-F92 HydrophobicContact CG2-CZ 4.09Å
19	G	94.7	Very high	95.9	Very high	26 Å²	26	37.7 Å²	37.7	27%	0.268	22%	0.217	S	C	.	.			trans	71.5	62.1	-171.5	0	0	0	0	0	111.7	G21 C39	G19-G21 PolarHBondContact O-N 2.69Å; G19-C39 PolarHBondContact N-O 3.4Å
20	P	95.6	Very high	96.1	Very high	10 Å²	10	36 Å²	36	7%	0.065	21%	0.208	C	C	.	.			trans	-63.6	-22.6	176.8	30.8	-39.7	0	0	0	112.9	E17 T22 G23 T26 A38 C39 E40 L49	E17-P20 HydrophobicContact CG-CB 4.17Å; P20-T22 PolarHBondContact O-N 3.13Å; P20-G23 PolarHBondContact O-N 2.83Å; P20-T26 WeakPolarHBondContact CB-OG1 3.43Å; P20-A38 HydrophobicContact CB-CB 4.18Å; P20-A38 HydrophobicContact CG-CB 4.03Å; P20-C39 VanDerWaalsContact CD-O 3.26Å; P20-C39 WeakPolarHBondContact CD-O 3.03Å; P20-E40 WeakPolarHBondContact CD-OE2 3.01Å; P20-E40 HydrophobicContact CG-CB 3.83Å; P20-E40 HydrophobicContact CG-CG 4.32Å; P20-L49 HydrophobicContact CB-CD2 3.81Å; P20-L49 HydrophobicContact CG-CD2 3.82Å
21	G	92.9	Very high	96.1	Very high	21 Å²	21	36.4 Å²	36.4	22%	0.216	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	-129.1	-174.8	0	0	0	0	0	111.1	G19 G23 E40	G19-G21 PolarHBondContact O-N 2.69Å; G21-G23 PolarHBondContact O-N 3.24Å; G21-E40 PolarHBondContact N-OE2 3.31Å
22	T	92.8	Very high	96.1	Very high	50 Å²	50	39.7 Å²	39.7	31%	0.307	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	2	177.8	61.9	0	0	0	0	114.1	P20 N24 L45 E48 R52	P20-T22 PolarHBondContact O-N 3.13Å; T22-N24 PolarHBondContact OG1-ND2 2.83Å; T22-L45 HydrophobicContact CG2-CD2 4.15Å; T22-E48 WeakPolarHBondContact CB-OE1 3.32Å; T22-E48 VanDerWaalsContact CG2-OE1 3.27Å; T22-E48 WeakPolarHBondContact CG2-OE1 3.37Å; T22-R52 WeakPolarHBondContact O-CD 3.3Å; T22-R52 PolarHBondContact O-NH1 2.62Å
23	G	94.9	Very high	96	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.187	C	C	.	.	S	Bend	trans	91	11.9	174	0	0	0	0	0	116.8	P20 G21 L25 T26 V27 L49	P20-G23 PolarHBondContact O-N 2.83Å; G21-G23 PolarHBondContact O-N 3.24Å; G23-L25 VanDerWaalsContact C-N 3.29Å; G23-L25 PolarHBondContact O-N 2.88Å; G23-T26 WeakPolarHBondContact CA-OG1 3.39Å; G23-T26 PolarHBondContact O-N 3.3Å; G23-V27 PolarHBondContact O-N 3.3Å; G23-V27 VanDerWaalsContact O-N 3.1Å; G23-L49 VanDerWaalsContact CA-CD1 3.48Å
24	N	93.7	Very high	96	Very high	95 Å²	95	43 Å²	43	51%	0.508	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-36.7	-176.8	-73.3	-29.3	0	0	0	113.4	T22 R52	T22-N24 PolarHBondContact OG1-ND2 2.83Å; N24-R52 PolarHBondContact OD1-NH1 3.23Å; N24-R52 PolarHBondContact OD1-NH2 3.25Å
25	L	94.2	Very high	96	Very high	84 Å²	84	46.1 Å²	46.1	44%	0.44	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-41.8	174.3	-179.9	61.6	0	0	0	110.3	E17 G23 V27 K28 L29 V81	E17-L25 WeakPolarHBondContact OE1-CB 3.33Å; G23-L25 VanDerWaalsContact C-N 3.29Å; G23-L25 PolarHBondContact O-N 2.88Å; L25-V27 VanDerWaalsContact C-N 3.33Å; L25-V27 PolarHBondContact O-N 3.35Å; L25-K28 WeakPolarHBondContact O-CA 3.34Å; L25-K28 WeakPolarHBondContact O-CB 3.46Å; L25-K28 PolarHBondContact O-N 2.79Å; L25-L29 HydrophobicContact CD1-CD2 4.33Å; L25-L29 HydrophobicContact CD1-CG 4.26Å; L25-L29 HydrophobicContact CD2-CD1 4.39Å; L25-L29 HydrophobicContact CG-CD1 3.94Å; L25-L29 HydrophobicContact CG-CD2 4.43Å; L25-L29 HydrophobicContact CG-CG 4.02Å; L25-L29 WeakPolarHBondContact O-CG 3.48Å; L25-L29 PolarHBondContact O-N 3.43Å; L25-V81 HydrophobicContact CD2-CB 4.45Å; L25-V81 HydrophobicContact CD2-CG2 4.16Å
26	T	96.5	Very high	96	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-46.9	-50.5	178.9	-42.2	0	0	0	0	113.3	E17 P20 G23 K28 L29 L30 V36 L49 L62	E17-T26 VanDerWaalsContact CD-OG1 3.23Å; E17-T26 PolarHBondContact OE1-N 3.24Å; E17-T26 PolarHBondContact OE1-OG1 3.4Å; E17-T26 VanDerWaalsContact OE2-CA 3.25Å; E17-T26 WeakPolarHBondContact OE2-CA 3.41Å; E17-T26 WeakPolarHBondContact OE2-CB 3.36Å; E17-T26 WeakPolarHBondContact OE2-CG2 3.14Å; E17-T26 PolarHBondContact OE2-OG1 3.33Å; P20-T26 WeakPolarHBondContact CB-OG1 3.43Å; G23-T26 WeakPolarHBondContact CA-OG1 3.39Å; G23-T26 PolarHBondContact O-N 3.3Å; T26-K28 VanDerWaalsContact C-N 3.29Å; T26-K28 PolarHBondContact O-N 2.65Å; T26-L29 WeakPolarHBondContact O-CB 3.49Å; T26-L29 PolarHBondContact O-N 3.31Å; T26-L29 VanDerWaalsContact O-N 3.12Å; T26-L30 HydrophobicContact CG2-CD1 3.91Å; T26-L30 HydrophobicContact CG2-CG 4.46Å; T26-L30 VanDerWaalsContact O-CG 3.31Å; T26-L30 WeakPolarHBondContact O-CG 3.4Å; T26-L30 PolarHBondContact O-N 3.08Å; T26-V36 HydrophobicContact CG2-CG1 4.21Å; T26-L49 HydrophobicContact CG2-CD1 4.06Å; T26-L49 HydrophobicContact CG2-CD2 4.43Å; T26-L62 HydrophobicContact CG2-CD1 3.63Å; T26-L62 HydrophobicContact CG2-CD2 4.26Å
27	V	96.3	Very high	96	Very high	27 Å²	27	46.3 Å²	46.3	16%	0.164	23%	0.225	C	C	.	.	H	α-helix	trans	-60.2	-38.3	179.8	-63.5	0	0	0	0	112.5	G23 L25 L30 E31 R52 V53 M58	G23-V27 PolarHBondContact O-N 3.3Å; G23-V27 VanDerWaalsContact O-N 3.1Å; L25-V27 VanDerWaalsContact C-N 3.33Å; L25-V27 PolarHBondContact O-N 3.35Å; V27-L30 PolarHBondContact O-N 3.03Å; V27-E31 WeakPolarHBondContact O-CG 3.5Å; V27-E31 PolarHBondContact O-N 2.84Å; V27-R52 HydrophobicContact CG1-CG 4.48Å; V27-V53 HydrophobicContact CG1-CG1 4.38Å; V27-M58 HydrophobicContact CB-SD 4.37Å
28	K	95.8	Very high	96	Very high	130 Å²	130	46 Å²	46	57%	0.565	22%	0.224	S	C	*	.	H	α-helix	trans	-72.4	-31	177.6	-61.3	-177.7	-179.9	-179.4	0	112.6	L25 T26	L25-K28 WeakPolarHBondContact O-CA 3.34Å; L25-K28 WeakPolarHBondContact O-CB 3.46Å; L25-K28 PolarHBondContact O-N 2.79Å; T26-K28 VanDerWaalsContact C-N 3.29Å; T26-K28 PolarHBondContact O-N 2.65Å
29	L	96.8	Very high	96.1	Very high	9 Å²	9	46 Å²	46	5%	0.047	22%	0.224	C	C	.	.	H	α-helix	trans	-69.8	-42.7	173.6	-62.4	171.5	0	0	0	110.4	L9 V15 E17 L25 T26 E31 R32 S33 V36 V81	L9-L29 HydrophobicContact CD1-CD2 3.83Å; V15-L29 HydrophobicContact CG1-CD1 4.05Å; V15-L29 HydrophobicContact CG1-CD2 4.34Å; E17-L29 HydrophobicContact CB-CD1 4.15Å; E17-L29 HydrophobicContact CG-CD1 4.32Å; L25-L29 HydrophobicContact CD1-CD2 4.33Å; L25-L29 HydrophobicContact CD1-CG 4.26Å; L25-L29 HydrophobicContact CD2-CD1 4.39Å; L25-L29 HydrophobicContact CG-CD1 3.94Å; L25-L29 HydrophobicContact CG-CD2 4.43Å; L25-L29 HydrophobicContact CG-CG 4.02Å; L25-L29 WeakPolarHBondContact O-CG 3.48Å; L25-L29 PolarHBondContact O-N 3.43Å; T26-L29 WeakPolarHBondContact O-CB 3.49Å; T26-L29 PolarHBondContact O-N 3.31Å; T26-L29 VanDerWaalsContact O-N 3.12Å; L29-E31 PolarHBondContact O-N 2.87Å; L29-R32 PolarHBondContact O-N 3.07Å; L29-S33 WeakPolarHBondContact O-CB 3.38Å; L29-S33 PolarHBondContact O-N 2.79Å; L29-S33 PolarHBondContact O-OG 2.62Å; L29-V36 HydrophobicContact CB-CG2 3.67Å; L29-V36 HydrophobicContact CD1-CG1 4.38Å; L29-V81 HydrophobicContact CD1-CG2 3.65Å; L29-V81 HydrophobicContact CD2-CG2 4.49Å
30	L	97	Very high	96.2	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-61.7	-30.9	179	-72.9	162.9	0	0	0	112.2	T26 V27 R32 V36 V53 M58 K61 L62	T26-L30 HydrophobicContact CG2-CD1 3.91Å; T26-L30 HydrophobicContact CG2-CG 4.46Å; T26-L30 VanDerWaalsContact O-CG 3.31Å; T26-L30 WeakPolarHBondContact O-CG 3.4Å; T26-L30 PolarHBondContact O-N 3.08Å; V27-L30 PolarHBondContact O-N 3.03Å; L30-R32 VanDerWaalsContact C-N 3.27Å; L30-R32 PolarHBondContact O-N 2.7Å; L30-V36 HydrophobicContact CD2-CB 3.83Å; L30-V36 HydrophobicContact CD2-CG2 3.66Å; L30-V36 HydrophobicContact CG-CB 4.2Å; L30-V36 HydrophobicContact CG-CG2 3.78Å; L30-V53 HydrophobicContact CD1-CG1 4Å; L30-M58 HydrophobicContact CB-CB 4.08Å; L30-M58 HydrophobicContact CB-CG 4.12Å; L30-M58 HydrophobicContact CB-SD 3.84Å; L30-M58 HydrophobicContact CD1-CB 4.01Å; L30-M58 HydrophobicContact CD1-SD 4.4Å; L30-M58 HydrophobicContact CG-CB 4.47Å; L30-K61 HydrophobicContact CD2-CB 3.6Å; L30-K61 WeakPolarHBondContact O-CE 3.43Å; L30-K61 PolarHBondContact O-NZ 3.35Å; L30-L62 HydrophobicContact CD1-CB 4.09Å; L30-L62 HydrophobicContact CD1-CD1 4.38Å; L30-L62 HydrophobicContact CD1-CD2 4.39Å; L30-L62 HydrophobicContact CD2-CB 3.95Å
31	E	95.5	Very high	96.1	Very high	121 Å²	121	50.2 Å²	50.2	57%	0.565	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-26.8	173.5	-71.4	169.5	179.6	0	0	113.8	V27 L29 M58	V27-E31 WeakPolarHBondContact O-CG 3.5Å; V27-E31 PolarHBondContact O-N 2.84Å; L29-E31 PolarHBondContact O-N 2.87Å; E31-M58 HydrophobicContact CG-CE 3.4Å
32	R	95.8	Very high	96.3	Very high	173 Å²	173	51.2 Å²	51.2	65%	0.653	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.8	-11.4	-165	-62.9	-174.9	-178.5	-152.2	-2.2	115.4	L9 K10 L29 L30	L9-R32 HydrophobicContact CB-CB 4.37Å; L9-R32 HydrophobicContact CD1-CB 3.92Å; K10-R32 CarbonylContact C-O 3.52Å; L29-R32 PolarHBondContact O-N 3.07Å; L30-R32 VanDerWaalsContact C-N 3.27Å; L30-R32 PolarHBondContact O-N 2.7Å
33	S	96.8	Very high	96.4	Very high	2 Å²	2	56.3 Å²	56.3	1%	0.014	25%	0.253	C	S	.	.	S	Bend	trans	-117	168.9	-176.2	61.6	0	0	0	0	111.4	S11 D13 L29 V36 K61	S11-S33 CarbonylContact O-C 3.55Å; D13-S33 WeakPolarHBondContact O-CB 3.47Å; L29-S33 WeakPolarHBondContact O-CB 3.38Å; L29-S33 PolarHBondContact O-N 2.79Å; L29-S33 PolarHBondContact O-OG 2.62Å; S33-V36 WeakPolarHBondContact OG-CG2 3.49Å; S33-K61 WeakPolarHBondContact O-CE 3.44Å; S33-K61 PolarHBondContact O-NZ 3.27Å
34	R	97.6	Very high	96.5	Very high	137 Å²	137	65.3 Å²	65.3	52%	0.517	29%	0.287	S	S	.	.	S	Bend	trans	-72	-47.6	174	-179.5	-178.2	65	175.8	-4.1	110.7	S11 S12 D13 T14 K61	S11-R34 WeakPolarHBondContact O-CA 3.42Å; S11-R34 WeakPolarHBondContact O-CB 3.39Å; S11-R34 PolarHBondContact O-N 3.02Å; S12-R34 PolarHBondContact O-NE 3.03Å; D13-R34 WeakPolarHBondContact O-CB 3.49Å; D13-R34 PolarHBondContact O-N 3.11Å; T14-R34 PolarHBondContact OG1-NH2 3.39Å; R34-K61 WeakPolarHBondContact O-CE 3.49Å
35	K	98.2	Very high	96.6	Very high	70 Å²	70	62.9 Å²	62.9	30%	0.304	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	142.5	-173.2	-173.4	175.3	-178.9	179.2	0	109.5	D13 T14 V15 I37 K61 E63	D13-K35 PolarHBondContact O-N 3.21Å; T14-K35 CarbonylContact C-O 3.58Å; T14-K35 WeakPolarHBondContact CA-O 3.39Å; T14-K35 HydrophobicContact CG2-CB 4.48Å; V15-K35 PolarHBondContact N-O 3.32Å; K35-I37 HydrophobicContact CD-CG1 4.32Å; K35-I37 HydrophobicContact CG-CG1 4.35Å; K35-K61 CarbonylContact C-O 3.55Å; K35-K61 WeakPolarHBondContact CA-O 3.25Å; K35-K61 WeakPolarHBondContact CG-O 3.22Å; K35-E63 WeakPolarHBondContact CE-OE2 3.34Å; K35-E63 IonicContact NZ-OE2 3.23Å; K35-E63 PolarHBondContact NZ-OE2 2.57Å
36	V	98.5	Very high	96.8	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	128.4	168.3	-177.4	0	0	0	0	108	V15 E17 T26 L29 L30 S33 K61 L62 E63	V15-V36 HydrophobicContact CB-CG2 4.34Å; V15-V36 CarbonylContact O-C 3.46Å; V15-V36 WeakPolarHBondContact O-CA 3.44Å; E17-V36 HydrophobicContact CB-CG1 4.12Å; T26-V36 HydrophobicContact CG2-CG1 4.21Å; L29-V36 HydrophobicContact CB-CG2 3.67Å; L29-V36 HydrophobicContact CD1-CG1 4.38Å; L30-V36 HydrophobicContact CD2-CB 3.83Å; L30-V36 HydrophobicContact CD2-CG2 3.66Å; L30-V36 HydrophobicContact CG-CB 4.2Å; L30-V36 HydrophobicContact CG-CG2 3.78Å; S33-V36 WeakPolarHBondContact OG-CG2 3.49Å; V36-K61 PolarHBondContact N-O 2.83Å; V36-L62 HydrophobicContact CB-CD1 4.09Å; V36-L62 HydrophobicContact CG1-CD1 4.13Å; V36-L62 WeakPolarHBondContact O-CA 3.43Å; V36-E63 PolarHBondContact O-N 2.88Å
37	I	98.5	Very high	96.8	Very high	7 Å²	7	62.7 Å²	62.7	4%	0.036	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	111.5	171.1	-53.8	169.5	0	0	0	106.7	T14 V15 F16 E17 K35 E63 V65 P75	T14-I37 HydrophobicContact CG2-CD1 3.69Å; T14-I37 HydrophobicContact CG2-CG1 4.12Å; V15-I37 PolarHBondContact O-N 3.23Å; F16-I37 CarbonylContact C-O 3.58Å; F16-I37 WeakPolarHBondContact CA-O 3.31Å; F16-I37 HydrophobicContact CD2-CB 4.27Å; F16-I37 HydrophobicContact CD2-CG2 4.28Å; F16-I37 VanDerWaalsContact CD2-O 3.32Å; F16-I37 WeakPolarHBondContact CD2-O 3.4Å; E17-I37 PolarHBondContact N-O 3.39Å; K35-I37 HydrophobicContact CD-CG1 4.32Å; K35-I37 HydrophobicContact CG-CG1 4.35Å; I37-E63 CarbonylContact C-O 3.54Å; I37-E63 WeakPolarHBondContact CA-O 3.44Å; I37-E63 HydrophobicContact CG1-CB 4.21Å; I37-E63 HydrophobicContact CG2-CB 4.34Å; I37-E63 HydrophobicContact CG2-CG 4.32Å; I37-V65 HydrophobicContact CG2-CG2 3.77Å; I37-P75 HydrophobicContact CB-CG 4.37Å; I37-P75 HydrophobicContact CD1-CB 3.76Å; I37-P75 HydrophobicContact CD1-CG 3.55Å; I37-P75 HydrophobicContact CG2-CG 4.02Å
38	A	97.9	Very high	96.8	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	122	-173.7	0	0	0	0	0	110.9	E17 P20 L49 L62 E63 I64 V65	E17-A38 CarbonylContact O-C 3.52Å; E17-A38 VanDerWaalsContact O-CA 3.28Å; E17-A38 WeakPolarHBondContact O-CA 3.44Å; P20-A38 HydrophobicContact CB-CB 4.18Å; P20-A38 HydrophobicContact CG-CB 4.03Å; A38-L49 HydrophobicContact CB-CD2 4.24Å; A38-L62 HydrophobicContact CB-CD1 4.08Å; A38-E63 PolarHBondContact N-O 2.74Å; A38-I64 CarbonylContact O-C 3.47Å; A38-I64 WeakPolarHBondContact O-CA 3.37Å; A38-V65 PolarHBondContact O-N 3.3Å
39	C	97.8	Very high	96.9	Very high	3 Å²	3	59.7 Å²	59.7	2%	0.02	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	119.4	175.4	-172.6	0	0	0	0	110.1	F16 E17 V18 G19 P20 V65 V69	F16-C39 HydrophobicContact CE2-CB 3.81Å; F16-C39 HydrophobicContact CZ-CB 3.85Å; E17-C39 PolarHBondContact O-N 2.98Å; V18-C39 HydrophobicContact CG1-CB 4.48Å; G19-C39 PolarHBondContact N-O 3.4Å; P20-C39 VanDerWaalsContact CD-O 3.26Å; P20-C39 WeakPolarHBondContact CD-O 3.03Å; C39-V65 WeakPolarHBondContact CA-O 3.41Å; C39-V69 HydrophobicContact CB-CG2 4.39Å
40	E	96.4	Very high	96.9	Very high	14 Å²	14	62.3 Å²	62.3	7%	0.065	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	134.4	-177.6	-178.8	51.2	-103.6	0	0	110.9	P20 G21 D42 L45 V46 V65 P66 G67	P20-E40 WeakPolarHBondContact CD-OE2 3.01Å; P20-E40 HydrophobicContact CG-CB 3.83Å; P20-E40 HydrophobicContact CG-CG 4.32Å; G21-E40 PolarHBondContact N-OE2 3.31Å; E40-D42 PolarHBondContact OE1-N 2.79Å; E40-L45 HydrophobicContact CG-CB 4.06Å; E40-V46 HydrophobicContact CB-CG2 3.77Å; E40-V46 HydrophobicContact CG-CG2 3.89Å; E40-V65 PolarHBondContact N-O 3.01Å; E40-P66 CarbonylContact O-C 3.6Å; E40-P66 WeakPolarHBondContact O-CA 3.28Å; E40-G67 PolarHBondContact O-N 3.34Å
41	I	95.2	Very high	96.9	Very high	110 Å²	110	69.8 Å²	69.8	56%	0.564	32%	0.317	S	S	*	.	S	Bend	trans	-87.3	-30.9	-179.2	-164.6	171	0	0	0	111.8	Y43 D68	I41-Y43 PolarHBondContact O-N 3.34Å; I41-D68 HydrophobicContact CD1-CB 4.29Å
42	D	95.3	Very high	96.9	Very high	42 Å²	42	69 Å²	69	23%	0.225	31%	0.309	C	S	.	.			trans	-86.8	106.4	178.6	-168.2	-24.7	0	0	0	111.3	E40 R44 L45 V46	E40-D42 PolarHBondContact OE1-N 2.79Å; D42-R44 PolarHBondContact O-N 2.87Å; D42-R44 VanDerWaalsContact O-N 3.11Å; D42-R44 VanDerWaalsContact OD1-CB 3.26Å; D42-R44 WeakPolarHBondContact OD1-CB 3.36Å; D42-R44 WeakPolarHBondContact OD1-CG 3.3Å; D42-R44 IonicContact OD1-CZ 3.51Å; D42-R44 PolarHBondContact OD1-N 3.49Å; D42-R44 IonicContact OD1-NE 3.3Å; D42-R44 PolarHBondContact OD1-NE 3.21Å; D42-R44 IonicContact OD1-NH2 3.43Å; D42-R44 IonicContact OD2-CZ 2.62Å; D42-R44 IonicContact OD2-NE 3.73Å; D42-R44 PolarHBondContact OD2-NE 3.32Å; D42-R44 IonicContact OD2-NH2 3.7Å; D42-R44 PolarHBondContact OD2-NH2 2.8Å; D42-L45 HydrophobicContact CB-CB 4.28Å; D42-L45 HydrophobicContact CB-CD1 3.94Å; D42-L45 HydrophobicContact CB-CG 4.07Å; D42-L45 PolarHBondContact O-N 2.8Å; D42-V46 PolarHBondContact O-N 2.88Å; D42-V46 VanDerWaalsContact O-N 3.1Å
43	Y	96.3	Very high	97	Very high	158 Å²	158	61 Å²	61	62%	0.62	28%	0.279	S	S	*	.	H	α-helix	trans	-57.6	-24.9	178.5	-76.3	-88.9	0	0	0	114.1	I41 V46 A47 P66	I41-Y43 PolarHBondContact O-N 3.34Å; Y43-V46 WeakPolarHBondContact O-CB 3.42Å; Y43-V46 PolarHBondContact O-N 2.82Å; Y43-A47 PolarHBondContact O-N 3.12Å; Y43-P66 HydrophobicContact CD1-CB 4.01Å; Y43-P66 HydrophobicContact CE1-CB 3.39Å; Y43-P66 HydrophobicContact CE1-CG 4.14Å
44	R	97	Very high	96.9	Very high	188 Å²	188	66 Å²	66	71%	0.709	30%	0.303	S	S	*	.	H	α-helix	trans	-70.1	-40.6	176.1	-57.5	171.7	-63.5	168.7	3	110.8	D42 V46 A47 E48	D42-R44 PolarHBondContact O-N 2.87Å; D42-R44 VanDerWaalsContact O-N 3.11Å; D42-R44 VanDerWaalsContact OD1-CB 3.26Å; D42-R44 WeakPolarHBondContact OD1-CB 3.36Å; D42-R44 WeakPolarHBondContact OD1-CG 3.3Å; D42-R44 IonicContact OD1-CZ 3.51Å; D42-R44 PolarHBondContact OD1-N 3.49Å; D42-R44 IonicContact OD1-NE 3.3Å; D42-R44 PolarHBondContact OD1-NE 3.21Å; D42-R44 IonicContact OD1-NH2 3.43Å; D42-R44 IonicContact OD2-CZ 2.62Å; D42-R44 IonicContact OD2-NE 3.73Å; D42-R44 PolarHBondContact OD2-NE 3.32Å; D42-R44 IonicContact OD2-NH2 3.7Å; D42-R44 PolarHBondContact OD2-NH2 2.8Å; R44-V46 VanDerWaalsContact C-N 3.35Å; R44-A47 PolarHBondContact O-N 3.3Å; R44-E48 PolarHBondContact O-N 2.9Å
45	L	96.1	Very high	96.8	Very high	44 Å²	44	65 Å²	65	23%	0.23	32%	0.316	C	S	.	.	H	α-helix	trans	-71	-32.2	176.7	-63.9	176.9	0	0	0	111.6	T22 E40 D42 A47 E48 L49	T22-L45 HydrophobicContact CG2-CD2 4.15Å; E40-L45 HydrophobicContact CG-CB 4.06Å; D42-L45 HydrophobicContact CB-CB 4.28Å; D42-L45 HydrophobicContact CB-CD1 3.94Å; D42-L45 HydrophobicContact CB-CG 4.07Å; D42-L45 PolarHBondContact O-N 2.8Å; L45-A47 VanDerWaalsContact C-N 3.35Å; L45-A47 PolarHBondContact O-N 2.91Å; L45-E48 PolarHBondContact O-N 3.29Å; L45-L49 VanDerWaalsContact O-CB 3.26Å; L45-L49 WeakPolarHBondContact O-CB 3.34Å; L45-L49 PolarHBondContact O-N 3.46Å
46	V	97.2	Very high	96.7	Very high	19 Å²	19	64.6 Å²	64.6	12%	0.115	32%	0.319	C	S	.	.	H	α-helix	trans	-57.2	-48.4	169.7	170.1	0	0	0	0	111	E40 D42 Y43 R44 L49 T50 I64 P66	E40-V46 HydrophobicContact CB-CG2 3.77Å; E40-V46 HydrophobicContact CG-CG2 3.89Å; D42-V46 PolarHBondContact O-N 2.88Å; D42-V46 VanDerWaalsContact O-N 3.1Å; Y43-V46 WeakPolarHBondContact O-CB 3.42Å; Y43-V46 PolarHBondContact O-N 2.82Å; R44-V46 VanDerWaalsContact C-N 3.35Å; V46-L49 PolarHBondContact O-N 3.25Å; V46-T50 WeakPolarHBondContact O-CB 3.39Å; V46-T50 PolarHBondContact O-N 3.1Å; V46-T50 PolarHBondContact O-OG1 2.96Å; V46-I64 HydrophobicContact CB-CG2 4.35Å; V46-I64 HydrophobicContact CG1-CG2 3.84Å; V46-I64 HydrophobicContact CG2-CG2 3.93Å; V46-P66 HydrophobicContact CG1-CG 4.29Å; V46-P66 HydrophobicContact CG2-CB 4.36Å; V46-P66 HydrophobicContact CG2-CG 4.41Å
47	A	96.9	Very high	96.5	Very high	61 Å²	61	69.8 Å²	69.8	50%	0.504	36%	0.355	S	S	.	.	H	α-helix	trans	-64.3	-42.5	178.7	0	0	0	0	0	111.9	Y43 R44 L45 T50 K51	Y43-A47 PolarHBondContact O-N 3.12Å; R44-A47 PolarHBondContact O-N 3.3Å; L45-A47 VanDerWaalsContact C-N 3.35Å; L45-A47 PolarHBondContact O-N 2.91Å; A47-T50 PolarHBondContact O-N 3.38Å; A47-K51 WeakPolarHBondContact O-CB 3.45Å; A47-K51 PolarHBondContact O-N 3.28Å
48	E	96.8	Very high	96.3	Very high	94 Å²	94	71.4 Å²	71.4	44%	0.439	36%	0.363	S	S	.	.	H	α-helix	trans	-61.8	-46.4	176.5	-171	-177.6	151.9	0	0	112	T22 R44 L45 T50 K51 R52	T22-E48 WeakPolarHBondContact CB-OE1 3.32Å; T22-E48 VanDerWaalsContact CG2-OE1 3.27Å; T22-E48 WeakPolarHBondContact CG2-OE1 3.37Å; R44-E48 PolarHBondContact O-N 2.9Å; L45-E48 PolarHBondContact O-N 3.29Å; E48-T50 PolarHBondContact O-N 2.72Å; E48-K51 PolarHBondContact O-N 3Å; E48-R52 WeakPolarHBondContact O-CB 3.27Å; E48-R52 PolarHBondContact O-N 3.08Å
49	L	97.1	Very high	96.3	Very high	0 Å²	0	75.9 Å²	75.9	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-62.6	-42.7	177.6	178	60.1	0	0	0	111.7	P20 G23 T26 A38 L45 V46 R52 V53 L62 I64	P20-L49 HydrophobicContact CB-CD2 3.81Å; P20-L49 HydrophobicContact CG-CD2 3.82Å; G23-L49 VanDerWaalsContact CA-CD1 3.48Å; T26-L49 HydrophobicContact CG2-CD1 4.06Å; T26-L49 HydrophobicContact CG2-CD2 4.43Å; A38-L49 HydrophobicContact CB-CD2 4.24Å; L45-L49 VanDerWaalsContact O-CB 3.26Å; L45-L49 WeakPolarHBondContact O-CB 3.34Å; L45-L49 PolarHBondContact O-N 3.46Å; V46-L49 PolarHBondContact O-N 3.25Å; L49-R52 WeakPolarHBondContact O-CB 3.43Å; L49-R52 PolarHBondContact O-N 3.34Å; L49-V53 PolarHBondContact O-N 3.49Å; L49-L62 HydrophobicContact CD1-CD2 4.25Å; L49-L62 HydrophobicContact CD2-CD2 4.22Å; L49-L62 HydrophobicContact CG-CD2 3.95Å; L49-I64 HydrophobicContact CB-CD1 4.24Å; L49-I64 HydrophobicContact CD2-CD1 3.85Å; L49-I64 HydrophobicContact CD2-CG1 4.12Å; L49-I64 HydrophobicContact CG-CD1 3.89Å
50	T	97	Very high	96.2	Very high	64 Å²	64	80.5 Å²	80.5	39%	0.393	42%	0.423	S	S	.	.	H	α-helix	trans	-58.8	-49.5	176.2	-56.6	0	0	0	0	110.3	V46 A47 E48 R52 V53 Q54 I64	V46-T50 WeakPolarHBondContact O-CB 3.39Å; V46-T50 PolarHBondContact O-N 3.1Å; V46-T50 PolarHBondContact O-OG1 2.96Å; A47-T50 PolarHBondContact O-N 3.38Å; E48-T50 PolarHBondContact O-N 2.72Å; T50-R52 VanDerWaalsContact C-N 3.27Å; T50-R52 PolarHBondContact O-N 2.99Å; T50-V53 PolarHBondContact O-N 3.27Å; T50-Q54 WeakPolarHBondContact O-CB 3.3Å; T50-Q54 PolarHBondContact O-N 3.5Å; T50-Q54 VanDerWaalsContact O-N 3.08Å; T50-I64 VanDerWaalsContact OG1-CD1 3.3Å; T50-I64 WeakPolarHBondContact OG1-CD1 3.5Å
51	K	97	Very high	96.3	Very high	159 Å²	159	82.9 Å²	82.9	69%	0.691	43%	0.432	S	S	*	.	H	α-helix	trans	-61.1	-36.7	177.8	-173.3	175.1	-177.4	176.3	0	112	A47 E48 V53 Q54	A47-K51 WeakPolarHBondContact O-CB 3.45Å; A47-K51 PolarHBondContact O-N 3.28Å; E48-K51 PolarHBondContact O-N 3Å; K51-V53 VanDerWaalsContact C-N 3.32Å; K51-V53 PolarHBondContact O-N 2.79Å; K51-Q54 WeakPolarHBondContact O-CB 3.26Å; K51-Q54 PolarHBondContact O-N 3.32Å
52	R	96.5	Very high	96.5	Very high	104 Å²	104	78.7 Å²	78.7	39%	0.392	41%	0.411	S	S	.	.	H	α-helix	trans	-63.6	-34.4	-178.7	-175.7	172.3	-175.1	156.7	2.1	113.4	T22 N24 V27 E48 L49 T50	T22-R52 WeakPolarHBondContact O-CD 3.3Å; T22-R52 PolarHBondContact O-NH1 2.62Å; N24-R52 PolarHBondContact OD1-NH1 3.23Å; N24-R52 PolarHBondContact OD1-NH2 3.25Å; V27-R52 HydrophobicContact CG1-CG 4.48Å; E48-R52 WeakPolarHBondContact O-CB 3.27Å; E48-R52 PolarHBondContact O-N 3.08Å; L49-R52 WeakPolarHBondContact O-CB 3.43Å; L49-R52 PolarHBondContact O-N 3.34Å; T50-R52 VanDerWaalsContact C-N 3.27Å; T50-R52 PolarHBondContact O-N 2.99Å
53	V	96.3	Very high	96.6	Very high	4 Å²	4	80.3 Å²	80.3	2%	0.024	42%	0.418	C	S	.	.	H	α-helix	trans	-99.2	-4.5	178.4	-58.1	0	0	0	0	113.1	V27 L30 L49 T50 K51 T56 Q59 L62	V27-V53 HydrophobicContact CG1-CG1 4.38Å; L30-V53 HydrophobicContact CD1-CG1 4Å; L49-V53 PolarHBondContact O-N 3.49Å; T50-V53 PolarHBondContact O-N 3.27Å; K51-V53 VanDerWaalsContact C-N 3.32Å; K51-V53 PolarHBondContact O-N 2.79Å; V53-T56 WeakPolarHBondContact O-CB 3.48Å; V53-T56 WeakPolarHBondContact O-CG2 3.3Å; V53-T56 PolarHBondContact O-N 2.93Å; V53-T56 PolarHBondContact O-OG1 3.2Å; V53-Q59 WeakPolarHBondContact O-CB 3.46Å; V53-L62 HydrophobicContact CB-CD2 4.48Å; V53-L62 HydrophobicContact CG1-CD2 4.08Å; V53-L62 HydrophobicContact CG2-CD2 3.66Å
54	Q	95.9	Very high	96.7	Very high	108 Å²	108	74.5 Å²	74.5	51%	0.505	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	139	-176.9	-170.8	175.9	-7.3	0	0	111.4	T50 K51 T56	T50-Q54 WeakPolarHBondContact O-CB 3.3Å; T50-Q54 PolarHBondContact O-N 3.5Å; T50-Q54 VanDerWaalsContact O-N 3.08Å; K51-Q54 WeakPolarHBondContact O-CB 3.26Å; K51-Q54 PolarHBondContact O-N 3.32Å; Q54-T56 PolarHBondContact O-N 3.45Å
55	C	94.9	Very high	96.7	Very high	117 Å²	117	67.2 Å²	67.2	79%	0.791	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	23.6	-178.1	-57.3	0	0	0	0	114
56	T	95.8	Very high	96.7	Very high	60 Å²	60	67.6 Å²	67.6	37%	0.368	38%	0.378	S	S	.	.	S	Bend	trans	-112.9	160.2	171.6	76.2	0	0	0	0	110.8	V53 Q54 M58 Q59	V53-T56 WeakPolarHBondContact O-CB 3.48Å; V53-T56 WeakPolarHBondContact O-CG2 3.3Å; V53-T56 PolarHBondContact O-N 2.93Å; V53-T56 PolarHBondContact O-OG1 3.2Å; Q54-T56 PolarHBondContact O-N 3.45Å; T56-M58 PolarHBondContact O-N 3.5Å; T56-M58 VanDerWaalsContact O-N 3.11Å; T56-M58 WeakPolarHBondContact OG1-CB 3.35Å; T56-M58 PolarHBondContact OG1-N 3.1Å; T56-Q59 WeakPolarHBondContact O-CB 3.17Å; T56-Q59 PolarHBondContact O-N 3.04Å; T56-Q59 VanDerWaalsContact O-N 3.12Å
57	S	94.4	Very high	96.6	Very high	110 Å²	110	67.3 Å²	67.3	77%	0.769	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-17.7	171.9	57.9	0	0	0	0	113.3
58	M	95.6	Very high	96.6	Very high	41 Å²	41	66.6 Å²	66.6	20%	0.202	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-21.5	178.2	-55.9	-172.6	-177.3	0	0	113	V27 L30 E31 T56 A60 K61 L62	V27-M58 HydrophobicContact CB-SD 4.37Å; L30-M58 HydrophobicContact CB-CB 4.08Å; L30-M58 HydrophobicContact CB-CG 4.12Å; L30-M58 HydrophobicContact CB-SD 3.84Å; L30-M58 HydrophobicContact CD1-CB 4.01Å; L30-M58 HydrophobicContact CD1-SD 4.4Å; L30-M58 HydrophobicContact CG-CB 4.47Å; E31-M58 HydrophobicContact CG-CE 3.4Å; T56-M58 PolarHBondContact O-N 3.5Å; T56-M58 VanDerWaalsContact O-N 3.11Å; T56-M58 WeakPolarHBondContact OG1-CB 3.35Å; T56-M58 PolarHBondContact OG1-N 3.1Å; M58-A60 VanDerWaalsContact C-N 3.3Å; M58-A60 PolarHBondContact O-N 3.34Å; M58-K61 WeakPolarHBondContact O-CB 3.33Å; M58-K61 PolarHBondContact O-N 3.35Å; M58-L62 PolarHBondContact O-N 2.88Å
59	Q	96.7	Very high	96.6	Very high	94 Å²	94	62.5 Å²	62.5	44%	0.439	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-56.2	-44.1	-176.2	-171.9	178.3	-28.6	0	0	112	V53 T56 K61 L62	V53-Q59 WeakPolarHBondContact O-CB 3.46Å; T56-Q59 WeakPolarHBondContact O-CB 3.17Å; T56-Q59 PolarHBondContact O-N 3.04Å; T56-Q59 VanDerWaalsContact O-N 3.12Å; Q59-K61 PolarHBondContact O-N 2.8Å; Q59-L62 PolarHBondContact O-N 3.02Å
60	A	96.6	Very high	96.5	Very high	100 Å²	100	64.9 Å²	64.9	83%	0.826	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-67.3	-16.8	-179.8	0	0	0	0	0	113.8	M58	M58-A60 VanDerWaalsContact C-N 3.3Å; M58-A60 PolarHBondContact O-N 3.34Å
61	K	97.8	Very high	96.5	Very high	63 Å²	63	70 Å²	70	27%	0.274	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-97.2	-10.3	-178.9	-59.4	175.2	68.8	178.2	0	112.4	L30 S33 R34 K35 V36 M58 Q59	L30-K61 HydrophobicContact CD2-CB 3.6Å; L30-K61 WeakPolarHBondContact O-CE 3.43Å; L30-K61 PolarHBondContact O-NZ 3.35Å; S33-K61 WeakPolarHBondContact O-CE 3.44Å; S33-K61 PolarHBondContact O-NZ 3.27Å; R34-K61 WeakPolarHBondContact O-CE 3.49Å; K35-K61 CarbonylContact C-O 3.55Å; K35-K61 WeakPolarHBondContact CA-O 3.25Å; K35-K61 WeakPolarHBondContact CG-O 3.22Å; V36-K61 PolarHBondContact N-O 2.83Å; M58-K61 WeakPolarHBondContact O-CB 3.33Å; M58-K61 PolarHBondContact O-N 3.35Å; Q59-K61 PolarHBondContact O-N 2.8Å
62	L	98.4	Very high	96.5	Very high	23 Å²	23	63.8 Å²	63.8	12%	0.12	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	124.4	-179.7	-176.3	61.9	0	0	0	110.5	T26 L30 V36 A38 L49 V53 M58 Q59 I64	T26-L62 HydrophobicContact CG2-CD1 3.63Å; T26-L62 HydrophobicContact CG2-CD2 4.26Å; L30-L62 HydrophobicContact CD1-CB 4.09Å; L30-L62 HydrophobicContact CD1-CD1 4.38Å; L30-L62 HydrophobicContact CD1-CD2 4.39Å; L30-L62 HydrophobicContact CD2-CB 3.95Å; V36-L62 HydrophobicContact CB-CD1 4.09Å; V36-L62 HydrophobicContact CG1-CD1 4.13Å; V36-L62 WeakPolarHBondContact O-CA 3.43Å; A38-L62 HydrophobicContact CB-CD1 4.08Å; L49-L62 HydrophobicContact CD1-CD2 4.25Å; L49-L62 HydrophobicContact CD2-CD2 4.22Å; L49-L62 HydrophobicContact CG-CD2 3.95Å; V53-L62 HydrophobicContact CB-CD2 4.48Å; V53-L62 HydrophobicContact CG1-CD2 4.08Å; V53-L62 HydrophobicContact CG2-CD2 3.66Å; M58-L62 PolarHBondContact O-N 2.88Å; Q59-L62 PolarHBondContact O-N 3.02Å; L62-I64 HydrophobicContact CD1-CG1 4.35Å; L62-I64 HydrophobicContact CD2-CD1 3.96Å; L62-I64 HydrophobicContact CD2-CG1 3.95Å; L62-I64 HydrophobicContact CG-CD1 4.44Å; L62-I64 HydrophobicContact CG-CG1 3.92Å
63	E	98.1	Very high	96.4	Very high	76 Å²	76	67.3 Å²	67.3	36%	0.355	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	134.9	163.5	-178.4	-178.1	147.2	0	0	108	K35 V36 I37 A38	K35-E63 WeakPolarHBondContact CE-OE2 3.34Å; K35-E63 IonicContact NZ-OE2 3.23Å; K35-E63 PolarHBondContact NZ-OE2 2.57Å; V36-E63 PolarHBondContact O-N 2.88Å; I37-E63 CarbonylContact C-O 3.54Å; I37-E63 WeakPolarHBondContact CA-O 3.44Å; I37-E63 HydrophobicContact CG1-CB 4.21Å; I37-E63 HydrophobicContact CG2-CB 4.34Å; I37-E63 HydrophobicContact CG2-CG 4.32Å; A38-E63 PolarHBondContact N-O 2.74Å
64	I	97.7	Very high	96.4	Very high	35 Å²	35	68 Å²	68	18%	0.179	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	127.7	176.5	-52.4	169.6	0	0	0	108	A38 V46 L49 T50 L62 P66	A38-I64 CarbonylContact O-C 3.47Å; A38-I64 WeakPolarHBondContact O-CA 3.37Å; V46-I64 HydrophobicContact CB-CG2 4.35Å; V46-I64 HydrophobicContact CG1-CG2 3.84Å; V46-I64 HydrophobicContact CG2-CG2 3.93Å; L49-I64 HydrophobicContact CB-CD1 4.24Å; L49-I64 HydrophobicContact CD2-CD1 3.85Å; L49-I64 HydrophobicContact CD2-CG1 4.12Å; L49-I64 HydrophobicContact CG-CD1 3.89Å; T50-I64 VanDerWaalsContact OG1-CD1 3.3Å; T50-I64 WeakPolarHBondContact OG1-CD1 3.5Å; L62-I64 HydrophobicContact CD1-CG1 4.35Å; L62-I64 HydrophobicContact CD2-CD1 3.96Å; L62-I64 HydrophobicContact CD2-CG1 3.95Å; L62-I64 HydrophobicContact CG-CD1 4.44Å; L62-I64 HydrophobicContact CG-CG1 3.92Å; I64-P66 WeakPolarHBondContact O-CD 3.28Å
65	V	97.4	Very high	96.4	Very high	35 Å²	35	64.7 Å²	64.7	21%	0.212	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	99.3	177.7	-178.1	0	0	0	0	108	I37 A38 C39 E40 G67 V72	I37-V65 HydrophobicContact CG2-CG2 3.77Å; A38-V65 PolarHBondContact O-N 3.3Å; C39-V65 WeakPolarHBondContact CA-O 3.41Å; E40-V65 PolarHBondContact N-O 3.01Å; V65-G67 PolarHBondContact O-N 2.73Å; V65-V72 HydrophobicContact CG1-CB 4.41Å; V65-V72 HydrophobicContact CG1-CG1 4.4Å
66	P	97	Very high	96.5	Very high	52 Å²	52	63.4 Å²	63.4	34%	0.338	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	131.9	176.6	-17.1	31.7	0	0	0	110.6	E40 Y43 V46 I64	E40-P66 CarbonylContact O-C 3.6Å; E40-P66 WeakPolarHBondContact O-CA 3.28Å; Y43-P66 HydrophobicContact CD1-CB 4.01Å; Y43-P66 HydrophobicContact CE1-CB 3.39Å; Y43-P66 HydrophobicContact CE1-CG 4.14Å; V46-P66 HydrophobicContact CG1-CG 4.29Å; V46-P66 HydrophobicContact CG2-CB 4.36Å; V46-P66 HydrophobicContact CG2-CG 4.41Å; I64-P66 WeakPolarHBondContact O-CD 3.28Å
67	G	95.8	Very high	96.6	Very high	14 Å²	14	60.5 Å²	60.5	14%	0.144	33%	0.327	C	S	.	.	S	Bend	trans	144.9	177.7	170.7	0	0	0	0	0	115.5	E40 V65 V69	E40-G67 PolarHBondContact O-N 3.34Å; V65-G67 PolarHBondContact O-N 2.73Å; G67-V69 PolarHBondContact O-N 2.89Å
68	D	95.6	Very high	96.8	Very high	45 Å²	45	57.1 Å²	57.1	24%	0.241	30%	0.301	C	S	.	.			trans	-70.2	115.9	173.8	178.3	-5.6	0	0	0	109.9	I41 L70 K71 V72	I41-D68 HydrophobicContact CD1-CB 4.29Å; D68-L70 PolarHBondContact O-N 2.8Å; D68-L70 WeakPolarHBondContact OD1-CB 3.32Å; D68-L70 PolarHBondContact OD1-N 2.82Å; D68-K71 HydrophobicContact CB-CB 4.22Å; D68-K71 HydrophobicContact CB-CD 4.06Å; D68-K71 HydrophobicContact CB-CG 4.16Å; D68-K71 PolarHBondContact O-N 3.47Å; D68-K71 WeakPolarHBondContact OD2-CD 3.26Å; D68-K71 WeakPolarHBondContact OD2-CE 3.26Å; D68-K71 IonicContact OD2-NZ 2.62Å; D68-V72 WeakPolarHBondContact O-CG1 3.5Å; D68-V72 PolarHBondContact O-N 2.82Å
69	V	96.6	Very high	96.9	Very high	8 Å²	8	55.2 Å²	55.2	5%	0.048	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-21.9	-179.5	72.7	0	0	0	0	113.4	F16 V18 C39 G67 W74 I88 F92 R95	F16-V69 HydrophobicContact CE1-CG2 4.22Å; F16-V69 HydrophobicContact CZ-CG2 4.06Å; V18-V69 HydrophobicContact CB-CG2 4.41Å; V18-V69 HydrophobicContact CG1-CB 3.7Å; V18-V69 HydrophobicContact CG1-CG1 3.85Å; V18-V69 HydrophobicContact CG1-CG2 3.55Å; V18-V69 HydrophobicContact CG2-CG2 3.94Å; C39-V69 HydrophobicContact CB-CG2 4.39Å; G67-V69 PolarHBondContact O-N 2.89Å; V69-W74 HydrophobicContact CG2-CZ2 3.87Å; V69-W74 PolarHBondContact O-NE1 2.95Å; V69-I88 HydrophobicContact CG1-CD1 3.94Å; V69-F92 HydrophobicContact CG1-CD2 4.11Å; V69-F92 HydrophobicContact CG1-CE2 4.45Å; V69-F92 HydrophobicContact CG2-CD2 4.36Å; V69-F92 HydrophobicContact CG2-CE2 3.99Å; V69-R95 PolarHBondContact O-NH1 2.91Å
70	L	96.2	Very high	96.9	Very high	51 Å²	51	50.7 Å²	50.7	27%	0.267	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-16	176.1	-60.3	-177	0	0	0	113.3	D68 I88 P91 F92 R95	D68-L70 PolarHBondContact O-N 2.8Å; D68-L70 WeakPolarHBondContact OD1-CB 3.32Å; D68-L70 PolarHBondContact OD1-N 2.82Å; L70-I88 HydrophobicContact CD1-CB 4.03Å; L70-I88 HydrophobicContact CD1-CG2 3.93Å; L70-P91 HydrophobicContact CD1-CB 4.04Å; L70-P91 HydrophobicContact CD1-CG 3.76Å; L70-P91 HydrophobicContact CD2-CB 4.15Å; L70-P91 HydrophobicContact CD2-CG 4.37Å; L70-F92 HydrophobicContact CD2-CB 4.2Å; L70-R95 PolarHBondContact O-NH1 3.17Å; L70-R95 VanDerWaalsContact O-NH1 3.09Å
71	K	96.4	Very high	97	Very high	172 Å²	172	46.3 Å²	46.3	75%	0.748	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.4	-34.1	-176	-62	178.8	-174.6	171	0	113.4	D68	D68-K71 HydrophobicContact CB-CB 4.22Å; D68-K71 HydrophobicContact CB-CD 4.06Å; D68-K71 HydrophobicContact CB-CG 4.16Å; D68-K71 PolarHBondContact O-N 3.47Å; D68-K71 WeakPolarHBondContact OD2-CD 3.26Å; D68-K71 WeakPolarHBondContact OD2-CE 3.26Å; D68-K71 IonicContact OD2-NZ 2.62Å
72	V	96.1	Very high	96.8	Very high	27 Å²	27	43.8 Å²	43.8	16%	0.164	22%	0.224	C	C	.	.	S	Bend	trans	-66.6	149.7	178.3	-59.5	0	0	0	0	111.2	V65 D68 R95	V65-V72 HydrophobicContact CG1-CB 4.41Å; V65-V72 HydrophobicContact CG1-CG1 4.4Å; D68-V72 WeakPolarHBondContact O-CG1 3.5Å; D68-V72 PolarHBondContact O-N 2.82Å; V72-R95 PolarHBondContact O-NH1 3.26Å; V72-R95 PolarHBondContact O-NH2 3.29Å
73	Q	95.6	Very high	96.4	Very high	179 Å²	179	46.3 Å²	46.3	84%	0.836	24%	0.238	S	C	*	.	P	Polyproline II helix	trans	-71.6	133.9	171.6	-173.3	174.5	0.9	0	0	109.9
74	W	96.7	Very high	95.7	Very high	17 Å²	17	43 Å²	43	6%	0.064	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-86.5	133.1	179.4	-69.4	6.1	0	0	0	110.4	F16 V69 F77 F92 R95 L96 H99	F16-W74 AromaticContact CE1-CD2 3.93Å; F16-W74 HydrophobicContact CE1-CD2 3.93Å; F16-W74 AromaticContact CE1-CE2 3.99Å; F16-W74 HydrophobicContact CE1-CE3 4.32Å; F16-W74 HydrophobicContact CE1-CG 4.16Å; F16-W74 HydrophobicContact CE1-CZ2 4.48Å; F16-W74 HydrophobicContact CZ-CD2 4.49Å; F16-W74 HydrophobicContact CZ-CG 4.31Å; V69-W74 HydrophobicContact CG2-CZ2 3.87Å; V69-W74 PolarHBondContact O-NE1 2.95Å; W74-F77 AromaticContact CE3-CE1 3.95Å; W74-F77 HydrophobicContact CE3-CE1 3.95Å; W74-F77 HydrophobicContact CE3-CZ 4.08Å; W74-F77 HydrophobicContact CZ3-CZ 4.35Å; W74-F92 AromaticContact CH2-CD2 3.81Å; W74-F92 HydrophobicContact CH2-CD2 3.81Å; W74-F92 AromaticContact CH2-CE2 3.46Å; W74-F92 HydrophobicContact CH2-CE2 3.46Å; W74-F92 VanDerWaalsContact CH2-CE2 3.46Å; W74-F92 AromaticContact CH2-CZ 3.9Å; W74-F92 HydrophobicContact CH2-CZ 3.9Å; W74-F92 AromaticContact CZ2-CD2 3.74Å; W74-F92 HydrophobicContact CZ2-CD2 3.74Å; W74-F92 AromaticContact CZ2-CE2 3.49Å; W74-F92 HydrophobicContact CZ2-CE2 3.49Å; W74-F92 VanDerWaalsContact CZ2-CE2 3.49Å; W74-F92 HydrophobicContact CZ2-CZ 4.35Å; W74-R95 HydrophobicContact CH2-CB 4.08Å; W74-R95 HydrophobicContact CH2-CG 3.96Å; W74-R95 HydrophobicContact CZ2-CB 4.31Å; W74-R95 HydrophobicContact CZ2-CG 3.94Å; W74-R95 HydrophobicContact CZ3-CG 4.3Å; W74-R95 VanDerWaalsContact NE1-NH1 3.15Å; W74-L96 HydrophobicContact CH2-CB 4.11Å; W74-L96 HydrophobicContact CH2-CD1 4.43Å; W74-L96 HydrophobicContact CZ3-CB 4Å; W74-L96 HydrophobicContact CZ3-CD1 3.8Å; W74-H99 HydrophobicContact CE3-CB 4.24Å; W74-H99 AromaticContact CE3-ND1 3.83Å; W74-H99 HydrophobicContact CZ3-CB 4.45Å
75	P	95.2	Very high	95	Very high	39 Å²	39	45.1 Å²	45.1	25%	0.253	24%	0.238	S	C	.	.			trans	-73	175.2	173.2	34.9	-37.5	0	0	0	110.4	F16 I37 F77 H99	F16-P75 HydrophobicContact CD2-CG 4.3Å; I37-P75 HydrophobicContact CB-CG 4.37Å; I37-P75 HydrophobicContact CD1-CB 3.76Å; I37-P75 HydrophobicContact CD1-CG 3.55Å; I37-P75 HydrophobicContact CG2-CG 4.02Å; P75-F77 VanDerWaalsContact O-CD1 3.27Å; P75-F77 WeakPolarHBondContact O-CD1 3.49Å; P75-H99 PolarHBondContact O-CE1 3Å; P75-H99 PolarHBondContact O-NE2 2.72Å
76	F	97.4	Very high	94.4	Very high	90 Å²	90	45.5 Å²	45.5	40%	0.395	24%	0.237	S	C	.	.			trans	-65.2	138.9	162.3	170.5	-94.9	0	0	0	110.6	D78 P101	F76-D78 WeakPolarHBondContact CZ-OD1 3.29Å; F76-P101 HydrophobicContact CD2-CB 3.97Å; F76-P101 HydrophobicContact CD2-CG 3.99Å; F76-P101 HydrophobicContact CE2-CB 4.24Å
77	F	98	Very high	94.1	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.257	C	S	.	.			trans	-148.9	148.3	170.2	55.2	-93.4	0	0	0	111.3	T14 F16 W74 P75 C80 L96 H99 F103	T14-F77 HydrophobicContact CG2-CB 4.37Å; F16-F77 HydrophobicContact CB-CB 3.64Å; F16-F77 HydrophobicContact CB-CD1 3.54Å; F16-F77 HydrophobicContact CB-CD2 4.03Å; F16-F77 HydrophobicContact CB-CE1 4.19Å; F16-F77 HydrophobicContact CB-CG 3.45Å; F16-F77 VanDerWaalsContact CB-CG 3.45Å; F16-F77 AromaticContact CD1-CD1 3.99Å; F16-F77 HydrophobicContact CD1-CD1 3.99Å; F16-F77 AromaticContact CD1-CE1 3.81Å; F16-F77 HydrophobicContact CD1-CE1 3.81Å; F16-F77 HydrophobicContact CD1-CZ 4.26Å; F16-F77 AromaticContact CG-CD1 3.89Å; F16-F77 HydrophobicContact CG-CD1 3.89Å; F16-F77 HydrophobicContact CG-CE1 4.2Å; F16-F77 HydrophobicContact CG-CG 4.3Å; W74-F77 AromaticContact CE3-CE1 3.95Å; W74-F77 HydrophobicContact CE3-CE1 3.95Å; W74-F77 HydrophobicContact CE3-CZ 4.08Å; W74-F77 HydrophobicContact CZ3-CZ 4.35Å; P75-F77 VanDerWaalsContact O-CD1 3.27Å; P75-F77 WeakPolarHBondContact O-CD1 3.49Å; F77-C80 HydrophobicContact CD2-CB 3.97Å; F77-C80 HydrophobicContact CE2-CB 3.6Å; F77-C80 HydrophobicContact CZ-CB 4.31Å; F77-L96 HydrophobicContact CE2-CD1 4.18Å; F77-L96 HydrophobicContact CZ-CD1 3.95Å; F77-H99 AromaticContact CD1-NE2 3.94Å; F77-H99 AromaticContact CE1-CD2 3.59Å; F77-H99 AromaticContact CE1-CE1 3.9Å; F77-H99 AromaticContact CE1-NE2 3.41Å; F77-H99 WeakPolarHBondContact CE1-NE2 3.34Å; F77-H99 AromaticContact CZ-CD2 3.57Å; F77-H99 AromaticContact CZ-NE2 3.91Å; F77-F103 HydrophobicContact CD2-CB 3.62Å; F77-F103 HydrophobicContact CD2-CG 4.21Å; F77-F103 HydrophobicContact CE2-CB 3.44Å; F77-F103 VanDerWaalsContact CE2-CB 3.44Å; F77-F103 AromaticContact CE2-CD1 3.64Å; F77-F103 HydrophobicContact CE2-CD1 3.64Å; F77-F103 HydrophobicContact CE2-CD2 4.37Å; F77-F103 AromaticContact CE2-CG 3.55Å; F77-F103 HydrophobicContact CE2-CG 3.55Å; F77-F103 HydrophobicContact CZ-CB 4.43Å; F77-F103 HydrophobicContact CZ-CD1 4.06Å; F77-F103 HydrophobicContact CZ-CG 4.41Å; F77-F103 VanDerWaalsContact O-CB 3.3Å; F77-F103 WeakPolarHBondContact O-CB 3.32Å
78	D	97.7	Very high	94	Very high	39 Å²	39	52 Å²	52	21%	0.209	26%	0.26	C	S	.	.	S	Bend	trans	-84.2	-37	175.1	-60.6	-77.7	0	0	0	111.1	D13 T14 F76 R104 C105	D13-D78 WeakPolarHBondContact CA-OD2 3.46Å; D13-D78 HydrophobicContact CB-CB 3.99Å; T14-D78 PolarHBondContact N-OD2 3.14Å; T14-D78 PolarHBondContact O-N 2.8Å; F76-D78 WeakPolarHBondContact CZ-OD1 3.29Å; D78-R104 WeakPolarHBondContact O-CA 3.4Å; D78-R104 VanDerWaalsContact O-CB 3.3Å; D78-R104 WeakPolarHBondContact O-CB 3.4Å; D78-R104 PolarHBondContact O-N 3.32Å; D78-C105 PolarHBondContact O-N 2.99Å
79	V	97.9	Very high	93.9	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	136.1	-176.8	178.6	0	0	0	0	110	V7 L9 T14 V15 F16 V81 C105	V7-V79 HydrophobicContact CG1-CG1 3.86Å; L9-V79 HydrophobicContact CD2-CB 4.15Å; L9-V79 HydrophobicContact CD2-CG1 4.02Å; L9-V79 HydrophobicContact CD2-CG2 4.12Å; T14-V79 PolarHBondContact O-N 2.97Å; V15-V79 CarbonylContact C-O 3.6Å; V15-V79 VanDerWaalsContact CA-O 3.3Å; V15-V79 WeakPolarHBondContact CA-O 3.27Å; V15-V79 HydrophobicContact CG2-CB 4.46Å; F16-V79 PolarHBondContact N-O 2.71Å; V79-V81 HydrophobicContact CG1-CG1 4.45Å; V79-C105 VanDerWaalsContact CA-O 3.26Å; V79-C105 WeakPolarHBondContact CA-O 3.43Å
80	C	97.8	Very high	93.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	137.7	170.4	179.4	0	0	0	0	111	F16 F77 L96 C105 A106 V107	F16-C80 CarbonylContact O-C 3.58Å; F16-C80 VanDerWaalsContact O-CA 3.29Å; F16-C80 WeakPolarHBondContact O-CA 3.33Å; F77-C80 HydrophobicContact CD2-CB 3.97Å; F77-C80 HydrophobicContact CE2-CB 3.6Å; F77-C80 HydrophobicContact CZ-CB 4.31Å; C80-L96 HydrophobicContact CB-CD1 4.26Å; C80-C105 PolarHBondContact N-O 2.8Å; C80-A106 HydrophobicContact CB-CB 3.89Å; C80-A106 CarbonylContact O-C 3.56Å; C80-A106 WeakPolarHBondContact O-CA 3.43Å; C80-V107 PolarHBondContact O-N 2.71Å
81	V	97.1	Very high	93.7	Very high	8 Å²	8	52.1 Å²	52.1	5%	0.048	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	138.9	168	-63.7	0	0	0	0	109.3	V7 V15 F16 E17 V18 L25 L29 V79 V107	V7-V81 HydrophobicContact CG2-CG1 4.03Å; V15-V81 HydrophobicContact CG1-CG2 3.97Å; F16-V81 PolarHBondContact O-N 2.66Å; E17-V81 CarbonylContact C-O 3.57Å; E17-V81 VanDerWaalsContact CA-O 3.32Å; E17-V81 WeakPolarHBondContact CA-O 3.32Å; E17-V81 HydrophobicContact CB-CG2 3.87Å; E17-V81 HydrophobicContact CG-CG2 4Å; V18-V81 PolarHBondContact N-O 3.09Å; L25-V81 HydrophobicContact CD2-CB 4.45Å; L25-V81 HydrophobicContact CD2-CG2 4.16Å; L29-V81 HydrophobicContact CD1-CG2 3.65Å; L29-V81 HydrophobicContact CD2-CG2 4.49Å; V79-V81 HydrophobicContact CG1-CG1 4.45Å; V81-V107 VanDerWaalsContact CA-O 3.32Å; V81-V107 WeakPolarHBondContact CA-O 3.19Å
82	A	95.1	Very high	93.7	Very high	10 Å²	10	43.9 Å²	43.9	8%	0.083	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	141.1	-178.2	0	0	0	0	0	113	V18 L84 F92 V107 L108 M109	V18-A82 HydrophobicContact CB-CB 3.87Å; V18-A82 HydrophobicContact CG2-CB 4.42Å; V18-A82 WeakPolarHBondContact O-CA 3.29Å; A82-L84 HydrophobicContact CB-CD1 4.19Å; A82-L84 HydrophobicContact CB-CD2 4.02Å; A82-L84 HydrophobicContact CB-CG 3.8Å; A82-F92 HydrophobicContact CB-CE1 4.39Å; A82-F92 HydrophobicContact CB-CZ 4.2Å; A82-V107 PolarHBondContact N-O 2.79Å; A82-L108 HydrophobicContact CB-CD2 3.55Å; A82-M109 PolarHBondContact O-N 3.13Å
83	N	89.2	Confident	93.7	Very high	76 Å²	76	42.6 Å²	42.6	41%	0.406	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	79	167.8	-175.4	27.8	0	0	0	109	V18 M109	V18-N83 PolarHBondContact O-N 3.31Å; N83-M109 PolarHBondContact OD1-SD 2.97Å
84	L	82.4	Confident	93.6	Very high	7 Å²	7	36 Å²	36	4%	0.037	19%	0.193	C	C	.	.			trans	-87.2	149.5	-168.3	-57.7	171.9	0	0	0	112.3	V18 A82 F86 I88 F92 F110	V18-L84 HydrophobicContact CB-CD2 3.86Å; V18-L84 HydrophobicContact CG1-CD2 3.28Å; A82-L84 HydrophobicContact CB-CD1 4.19Å; A82-L84 HydrophobicContact CB-CD2 4.02Å; A82-L84 HydrophobicContact CB-CG 3.8Å; L84-F86 PolarHBondContact O-N 2.84Å; L84-I88 HydrophobicContact CB-CD1 4.22Å; L84-I88 HydrophobicContact CB-CG1 4.12Å; L84-I88 HydrophobicContact CD2-CD1 4Å; L84-I88 HydrophobicContact CG-CD1 4.48Å; L84-F92 HydrophobicContact CD1-CB 3.69Å; L84-F92 HydrophobicContact CD1-CD1 3.29Å; L84-F92 HydrophobicContact CD1-CD2 3.6Å; L84-F92 HydrophobicContact CD1-CE1 3.72Å; L84-F92 HydrophobicContact CD1-CE2 4.01Å; L84-F92 HydrophobicContact CD1-CG 3.21Å; L84-F92 HydrophobicContact CD1-CZ 4.06Å; L84-F92 HydrophobicContact CD2-CD2 4.38Å; L84-F92 HydrophobicContact CD2-CE2 4.4Å; L84-F110 HydrophobicContact CD1-CE1 4.48Å
85	P	84	Confident	93.5	Very high	79 Å²	79	38.8 Å²	38.8	51%	0.513	20%	0.203	S	C	.	.			trans	-52.9	134.8	158.3	-22.3	32.7	0	0	0	110.6	Q87 I88	P85-Q87 PolarHBondContact O-N 3.01Å; P85-Q87 VanDerWaalsContact O-N 3.1Å; P85-I88 HydrophobicContact CB-CG1 4.48Å; P85-I88 WeakPolarHBondContact O-CG1 3.48Å; P85-I88 PolarHBondContact O-N 2.84Å; P85-I88 VanDerWaalsContact O-N 3.16Å
86	F	85.3	Confident	93.6	Very high	43 Å²	43	36.9 Å²	36.9	19%	0.189	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-64.7	-24.4	-169.8	-58.3	-44.5	0	0	0	113.9	L84 I88 S89 Q111 P155 V157	L84-F86 PolarHBondContact O-N 2.84Å; F86-I88 PolarHBondContact O-N 3.45Å; F86-S89 WeakPolarHBondContact CA-OG 3.26Å; F86-S89 WeakPolarHBondContact O-CB 3.47Å; F86-S89 PolarHBondContact O-N 2.91Å; F86-S89 PolarHBondContact O-OG 3.01Å; F86-Q111 HydrophobicContact CB-CG 3.71Å; F86-Q111 HydrophobicContact CD1-CB 4.38Å; F86-Q111 HydrophobicContact CD1-CG 3.37Å; F86-Q111 VanDerWaalsContact CD2-CD 3.45Å; F86-Q111 HydrophobicContact CD2-CG 3.23Å; F86-Q111 HydrophobicContact CE1-CB 4.43Å; F86-Q111 HydrophobicContact CE1-CG 3.61Å; F86-Q111 VanDerWaalsContact CE1-N 3.29Å; F86-Q111 HydrophobicContact CE2-CG 3.46Å; F86-Q111 VanDerWaalsContact CE2-CG 3.46Å; F86-Q111 HydrophobicContact CG-CB 4.48Å; F86-Q111 HydrophobicContact CG-CG 3.15Å; F86-Q111 HydrophobicContact CZ-CG 3.63Å; F86-P155 HydrophobicContact CE2-CB 4.16Å; F86-V157 HydrophobicContact CE2-CG2 4.45Å
87	Q	89.7	Confident	93.5	Very high	162 Å²	162	32.7 Å²	32.7	76%	0.757	17%	0.173	S	C	*	.	G	3₁₀ helix	trans	-63	-28.3	178.9	-59.9	83.9	-10.6	0	0	113	P85	P85-Q87 PolarHBondContact O-N 3.01Å; P85-Q87 VanDerWaalsContact O-N 3.1Å
88	I	93.7	Very high	93.2	Very high	39 Å²	39	36.7 Å²	36.7	20%	0.2	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-100.3	4.3	-177.4	63.8	162.3	0	0	0	113.5	V69 L70 L84 P85 F86 S90 P91 F92	V69-I88 HydrophobicContact CG1-CD1 3.94Å; L70-I88 HydrophobicContact CD1-CB 4.03Å; L70-I88 HydrophobicContact CD1-CG2 3.93Å; L84-I88 HydrophobicContact CB-CD1 4.22Å; L84-I88 HydrophobicContact CB-CG1 4.12Å; L84-I88 HydrophobicContact CD2-CD1 4Å; L84-I88 HydrophobicContact CG-CD1 4.48Å; P85-I88 HydrophobicContact CB-CG1 4.48Å; P85-I88 WeakPolarHBondContact O-CG1 3.48Å; P85-I88 PolarHBondContact O-N 2.84Å; P85-I88 VanDerWaalsContact O-N 3.16Å; F86-I88 PolarHBondContact O-N 3.45Å; I88-S90 PolarHBondContact O-N 3.06Å; I88-P91 HydrophobicContact CB-CG 4.5Å; I88-P91 VanDerWaalsContact O-CD 3.25Å; I88-P91 WeakPolarHBondContact O-CD 3.43Å; I88-P91 VanDerWaalsContact O-CG 3.31Å; I88-P91 WeakPolarHBondContact O-CG 3.41Å; I88-F92 WeakPolarHBondContact O-CB 3.11Å; I88-F92 PolarHBondContact O-N 2.95Å
89	S	94.2	Very high	93.1	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.007	19%	0.188	C	C	.	.	H	α-helix	trans	-58.2	-46.9	-173.4	-51.8	0	0	0	0	113	F86 I93 F110 F114	F86-S89 WeakPolarHBondContact CA-OG 3.26Å; F86-S89 WeakPolarHBondContact O-CB 3.47Å; F86-S89 PolarHBondContact O-N 2.91Å; F86-S89 PolarHBondContact O-OG 3.01Å; S89-I93 WeakPolarHBondContact O-CG1 3.41Å; S89-I93 PolarHBondContact O-N 3.08Å; S89-F110 WeakPolarHBondContact OG-CD1 3.37Å; S89-F114 VanDerWaalsContact CB-CZ 3.47Å
90	S	93.4	Very high	93	Very high	47 Å²	47	41.8 Å²	41.8	33%	0.329	21%	0.211	S	C	.	.	H	α-helix	trans	-66.6	-53.3	-178.2	-164.5	0	0	0	0	113.2	I88 F92 I93 F94	I88-S90 PolarHBondContact O-N 3.06Å; S90-F92 VanDerWaalsContact C-N 3.26Å; S90-F92 PolarHBondContact O-N 3.04Å; S90-I93 PolarHBondContact O-N 3.11Å; S90-F94 WeakPolarHBondContact O-CD2 3.3Å; S90-F94 PolarHBondContact O-N 3.18Å; S90-F94 WeakPolarHBondContact OG-CE2 3.17Å
91	P	94.9	Very high	92.9	Very high	59 Å²	59	45.1 Å²	45.1	38%	0.383	23%	0.233	S	C	.	.	H	α-helix	trans	-62.7	-34.9	178	23.1	-32.9	0	0	0	112.1	L70 I88 F94 R95	L70-P91 HydrophobicContact CD1-CB 4.04Å; L70-P91 HydrophobicContact CD1-CG 3.76Å; L70-P91 HydrophobicContact CD2-CB 4.15Å; L70-P91 HydrophobicContact CD2-CG 4.37Å; I88-P91 HydrophobicContact CB-CG 4.5Å; I88-P91 VanDerWaalsContact O-CD 3.25Å; I88-P91 WeakPolarHBondContact O-CD 3.43Å; I88-P91 VanDerWaalsContact O-CG 3.31Å; I88-P91 WeakPolarHBondContact O-CG 3.41Å; P91-F94 PolarHBondContact O-N 3.26Å; P91-R95 WeakPolarHBondContact O-CB 3.43Å; P91-R95 PolarHBondContact O-N 3.46Å
92	F	96.7	Very high	92.8	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.2	-47	175.3	-177.8	-92.1	0	0	0	112.4	V18 V69 L70 W74 A82 L84 I88 S90 F94 R95 L96 L108	V18-F92 HydrophobicContact CB-CE2 4.44Å; V18-F92 HydrophobicContact CG1-CE2 4.38Å; V18-F92 HydrophobicContact CG2-CE2 3.94Å; V18-F92 HydrophobicContact CG2-CZ 4.09Å; V69-F92 HydrophobicContact CG1-CD2 4.11Å; V69-F92 HydrophobicContact CG1-CE2 4.45Å; V69-F92 HydrophobicContact CG2-CD2 4.36Å; V69-F92 HydrophobicContact CG2-CE2 3.99Å; L70-F92 HydrophobicContact CD2-CB 4.2Å; W74-F92 AromaticContact CH2-CD2 3.81Å; W74-F92 HydrophobicContact CH2-CD2 3.81Å; W74-F92 AromaticContact CH2-CE2 3.46Å; W74-F92 HydrophobicContact CH2-CE2 3.46Å; W74-F92 VanDerWaalsContact CH2-CE2 3.46Å; W74-F92 AromaticContact CH2-CZ 3.9Å; W74-F92 HydrophobicContact CH2-CZ 3.9Å; W74-F92 AromaticContact CZ2-CD2 3.74Å; W74-F92 HydrophobicContact CZ2-CD2 3.74Å; W74-F92 AromaticContact CZ2-CE2 3.49Å; W74-F92 HydrophobicContact CZ2-CE2 3.49Å; W74-F92 VanDerWaalsContact CZ2-CE2 3.49Å; W74-F92 HydrophobicContact CZ2-CZ 4.35Å; A82-F92 HydrophobicContact CB-CE1 4.39Å; A82-F92 HydrophobicContact CB-CZ 4.2Å; L84-F92 HydrophobicContact CD1-CB 3.69Å; L84-F92 HydrophobicContact CD1-CD1 3.29Å; L84-F92 HydrophobicContact CD1-CD2 3.6Å; L84-F92 HydrophobicContact CD1-CE1 3.72Å; L84-F92 HydrophobicContact CD1-CE2 4.01Å; L84-F92 HydrophobicContact CD1-CG 3.21Å; L84-F92 HydrophobicContact CD1-CZ 4.06Å; L84-F92 HydrophobicContact CD2-CD2 4.38Å; L84-F92 HydrophobicContact CD2-CE2 4.4Å; I88-F92 WeakPolarHBondContact O-CB 3.11Å; I88-F92 PolarHBondContact O-N 2.95Å; S90-F92 VanDerWaalsContact C-N 3.26Å; S90-F92 PolarHBondContact O-N 3.04Å; F92-F94 PolarHBondContact O-N 2.85Å; F92-R95 PolarHBondContact O-N 3.24Å; F92-L96 HydrophobicContact CE1-CB 4.43Å; F92-L96 HydrophobicContact CE1-CD2 4.12Å; F92-L96 VanDerWaalsContact O-CB 3.3Å; F92-L96 WeakPolarHBondContact O-CB 3.36Å; F92-L96 PolarHBondContact O-N 2.87Å; F92-L108 HydrophobicContact CE1-CD1 4.07Å; F92-L108 HydrophobicContact CE1-CD2 3.87Å; F92-L108 HydrophobicContact CZ-CD2 4.45Å
93	I	96.1	Very high	92.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.8	-47.1	177.9	-76.3	-63.4	0	0	0	111.2	S89 S90 R95 L96 L97 L108 F110 F114 L118 L130 T134 I164	S89-I93 WeakPolarHBondContact O-CG1 3.41Å; S89-I93 PolarHBondContact O-N 3.08Å; S90-I93 PolarHBondContact O-N 3.11Å; I93-R95 VanDerWaalsContact C-N 3.34Å; I93-R95 PolarHBondContact O-N 2.93Å; I93-L96 PolarHBondContact O-N 2.78Å; I93-L97 HydrophobicContact CG2-CD1 3.76Å; I93-L97 HydrophobicContact CG2-CG 4.26Å; I93-L97 VanDerWaalsContact O-CG 3.27Å; I93-L97 WeakPolarHBondContact O-CG 3.4Å; I93-L97 PolarHBondContact O-N 2.82Å; I93-L108 HydrophobicContact CD1-CD1 3.6Å; I93-F110 HydrophobicContact CD1-CE2 3.8Å; I93-F110 HydrophobicContact CD1-CZ 3.49Å; I93-F110 VanDerWaalsContact CD1-CZ 3.49Å; I93-F110 HydrophobicContact CG1-CE1 4.4Å; I93-F110 HydrophobicContact CG1-CE2 4.24Å; I93-F110 HydrophobicContact CG1-CZ 3.68Å; I93-F114 HydrophobicContact CG1-CE1 4.13Å; I93-F114 HydrophobicContact CG1-CZ 4.27Å; I93-L118 HydrophobicContact CG1-CD2 4.48Å; I93-L118 HydrophobicContact CG2-CD2 4.35Å; I93-L130 HydrophobicContact CG2-CD1 4.46Å; I93-T134 HydrophobicContact CG2-CG2 4.46Å; I93-I164 HydrophobicContact CD1-CD1 3.35Å
94	F	93.1	Very high	93.1	Very high	41 Å²	41	47.2 Å²	47.2	18%	0.18	24%	0.238	C	C	.	.	H	α-helix	trans	-63.1	-42	179.1	-72.8	-62	0	0	0	112.1	S90 P91 F92 L96 L97 L98 L130 N133 F175	S90-F94 WeakPolarHBondContact O-CD2 3.3Å; S90-F94 PolarHBondContact O-N 3.18Å; S90-F94 WeakPolarHBondContact OG-CE2 3.17Å; P91-F94 PolarHBondContact O-N 3.26Å; F92-F94 PolarHBondContact O-N 2.85Å; F94-L96 VanDerWaalsContact C-N 3.31Å; F94-L96 PolarHBondContact O-N 2.93Å; F94-L97 PolarHBondContact O-N 3.23Å; F94-L98 WeakPolarHBondContact O-CG 3.35Å; F94-L98 PolarHBondContact O-N 2.81Å; F94-L130 HydrophobicContact CZ-CD1 4.37Å; F94-N133 HydrophobicContact CE1-CB 3.89Å; F94-N133 HydrophobicContact CZ-CB 4.47Å; F94-F175 HydrophobicContact CD1-CE1 4.39Å; F94-F175 HydrophobicContact CD1-CZ 4.14Å; F94-F175 HydrophobicContact CE1-CZ 4.14Å
95	R	95.6	Very high	93.8	Very high	74 Å²	74	47 Å²	47	28%	0.279	24%	0.237	S	C	.	.	H	α-helix	trans	-62.2	-40.6	175.4	-169.4	171.6	-168.1	-162.8	2.5	112	V69 L70 V72 W74 P91 F92 I93 H99	V69-R95 PolarHBondContact O-NH1 2.91Å; L70-R95 PolarHBondContact O-NH1 3.17Å; L70-R95 VanDerWaalsContact O-NH1 3.09Å; V72-R95 PolarHBondContact O-NH1 3.26Å; V72-R95 PolarHBondContact O-NH2 3.29Å; W74-R95 HydrophobicContact CH2-CB 4.08Å; W74-R95 HydrophobicContact CH2-CG 3.96Å; W74-R95 HydrophobicContact CZ2-CB 4.31Å; W74-R95 HydrophobicContact CZ2-CG 3.94Å; W74-R95 HydrophobicContact CZ3-CG 4.3Å; W74-R95 VanDerWaalsContact NE1-NH1 3.15Å; P91-R95 WeakPolarHBondContact O-CB 3.43Å; P91-R95 PolarHBondContact O-N 3.46Å; F92-R95 PolarHBondContact O-N 3.24Å; I93-R95 VanDerWaalsContact C-N 3.34Å; I93-R95 PolarHBondContact O-N 2.93Å; R95-H99 PolarHBondContact O-N 2.93Å; R95-H99 VanDerWaalsContact O-N 3.08Å
96	L	96.6	Very high	94.4	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64	-50.9	177.4	-177	71.4	0	0	0	112	W74 F77 C80 F92 I93 F94 L98 H99 F103 A106 L108	W74-L96 HydrophobicContact CH2-CB 4.11Å; W74-L96 HydrophobicContact CH2-CD1 4.43Å; W74-L96 HydrophobicContact CZ3-CB 4Å; W74-L96 HydrophobicContact CZ3-CD1 3.8Å; F77-L96 HydrophobicContact CE2-CD1 4.18Å; F77-L96 HydrophobicContact CZ-CD1 3.95Å; C80-L96 HydrophobicContact CB-CD1 4.26Å; F92-L96 HydrophobicContact CE1-CB 4.43Å; F92-L96 HydrophobicContact CE1-CD2 4.12Å; F92-L96 VanDerWaalsContact O-CB 3.3Å; F92-L96 WeakPolarHBondContact O-CB 3.36Å; F92-L96 PolarHBondContact O-N 2.87Å; I93-L96 PolarHBondContact O-N 2.78Å; F94-L96 VanDerWaalsContact C-N 3.31Å; F94-L96 PolarHBondContact O-N 2.93Å; L96-L98 PolarHBondContact O-N 2.85Å; L96-H99 VanDerWaalsContact O-CB 3.28Å; L96-H99 WeakPolarHBondContact O-CB 3.38Å; L96-H99 PolarHBondContact O-N 2.88Å; L96-F103 HydrophobicContact CD1-CD1 4.02Å; L96-F103 HydrophobicContact CD1-CE1 3.43Å; L96-F103 VanDerWaalsContact CD1-CE1 3.43Å; L96-F103 HydrophobicContact CD1-CE2 4.47Å; L96-F103 HydrophobicContact CD1-CZ 3.71Å; L96-F103 HydrophobicContact CD2-CZ 4.03Å; L96-F103 HydrophobicContact CG-CE1 3.61Å; L96-F103 HydrophobicContact CG-CZ 3.59Å; L96-F103 WeakPolarHBondContact O-CE1 3.28Å; L96-A106 HydrophobicContact CD1-CB 4.5Å; L96-A106 HydrophobicContact CD2-CB 3.7Å; L96-L108 HydrophobicContact CD2-CD1 3.64Å
97	L	95	Very high	94.9	Very high	2 Å²	2	42 Å²	42	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-60.3	-30.5	-178.7	-66.2	169.8	0	0	0	113.2	I93 F94 R100 T134 L137 A138 I164 L166	I93-L97 HydrophobicContact CG2-CD1 3.76Å; I93-L97 HydrophobicContact CG2-CG 4.26Å; I93-L97 VanDerWaalsContact O-CG 3.27Å; I93-L97 WeakPolarHBondContact O-CG 3.4Å; I93-L97 PolarHBondContact O-N 2.82Å; F94-L97 PolarHBondContact O-N 3.23Å; L97-R100 PolarHBondContact O-NH1 2.84Å; L97-T134 HydrophobicContact CD1-CG2 4.08Å; L97-T134 HydrophobicContact CD2-CG2 4.32Å; L97-L137 HydrophobicContact CB-CB 4.35Å; L97-L137 HydrophobicContact CB-CD1 3.78Å; L97-L137 HydrophobicContact CD1-CD1 4.34Å; L97-L137 HydrophobicContact CD2-CB 4.2Å; L97-A138 HydrophobicContact CD2-CB 3.59Å; L97-I164 HydrophobicContact CD2-CG2 4.06Å; L97-L166 HydrophobicContact CD2-CD2 3.93Å
98	L	92.7	Very high	95.2	Very high	84 Å²	84	34.3 Å²	34.3	44%	0.44	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-3.3	179.7	-60	177.8	0	0	0	113.4	F94 L96 L137 F175	F94-L98 WeakPolarHBondContact O-CG 3.35Å; F94-L98 PolarHBondContact O-N 2.81Å; L96-L98 PolarHBondContact O-N 2.85Å; L98-L137 HydrophobicContact CD2-CD1 4Å; L98-F175 HydrophobicContact CD1-CD1 4.28Å; L98-F175 HydrophobicContact CD1-CE1 4.43Å; L98-F175 HydrophobicContact CD2-CD1 4.26Å; L98-F175 HydrophobicContact CD2-CG 4.28Å
99	H	95.5	Very high	95.3	Very high	21 Å²	21	34.4 Å²	34.4	10%	0.097	17%	0.173	C	C	.	.			trans	-62.9	139.3	-179.1	-178.9	69.5	0	0	0	111.6	W74 P75 F77 R95 L96 P101	W74-H99 HydrophobicContact CE3-CB 4.24Å; W74-H99 AromaticContact CE3-ND1 3.83Å; W74-H99 HydrophobicContact CZ3-CB 4.45Å; P75-H99 PolarHBondContact O-CE1 3Å; P75-H99 PolarHBondContact O-NE2 2.72Å; F77-H99 AromaticContact CD1-NE2 3.94Å; F77-H99 AromaticContact CE1-CD2 3.59Å; F77-H99 AromaticContact CE1-CE1 3.9Å; F77-H99 AromaticContact CE1-NE2 3.41Å; F77-H99 WeakPolarHBondContact CE1-NE2 3.34Å; F77-H99 AromaticContact CZ-CD2 3.57Å; F77-H99 AromaticContact CZ-NE2 3.91Å; R95-H99 PolarHBondContact O-N 2.93Å; R95-H99 VanDerWaalsContact O-N 3.08Å; L96-H99 VanDerWaalsContact O-CB 3.28Å; L96-H99 WeakPolarHBondContact O-CB 3.38Å; L96-H99 PolarHBondContact O-N 2.88Å; H99-P101 PolarHBondContact CD2-O 3.43Å
100	R	94.3	Very high	95.3	Very high	124 Å²	124	34.4 Å²	34.4	47%	0.468	17%	0.173	S	C	.	.	S	Bend	trans	-134.8	143.7	176.3	-64	-63.5	-179.8	-89.3	-0.4	109.7	L97	L97-R100 PolarHBondContact O-NH1 2.84Å
101	P	95.7	Very high	95.4	Very high	71 Å²	71	35.4 Å²	35.4	46%	0.461	17%	0.172	S	C	.	.	S	Bend	cis	-59.9	155.4	-6.6	-20.6	33	0	0	0	113.2	F76 H99	F76-P101 HydrophobicContact CD2-CB 3.97Å; F76-P101 HydrophobicContact CD2-CG 3.99Å; F76-P101 HydrophobicContact CE2-CB 4.24Å; H99-P101 PolarHBondContact CD2-O 3.43Å
102	P	95.2	Very high	95.4	Very high	48 Å²	48	36.8 Å²	36.8	31%	0.312	17%	0.17	S	C	.	.	P	Polyproline II helix	trans	-66.3	137.5	-176.2	27.6	-33.5	0	0	0	110.9	L166 M168	P102-L166 HydrophobicContact CB-CD1 3.88Å; P102-M168 HydrophobicContact CB-CE 4.18Å; P102-M168 HydrophobicContact CB-SD 3.72Å; P102-M168 HydrophobicContact CG-CE 3.55Å; P102-M168 HydrophobicContact CG-SD 3.79Å
103	F	96.3	Very high	95.3	Very high	6 Å²	6	42.2 Å²	42.2	3%	0.026	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-86.5	160.4	172.2	63.2	-89.6	0	0	0	110.6	F77 L96 C105 A106 L166	F77-F103 HydrophobicContact CD2-CB 3.62Å; F77-F103 HydrophobicContact CD2-CG 4.21Å; F77-F103 HydrophobicContact CE2-CB 3.44Å; F77-F103 VanDerWaalsContact CE2-CB 3.44Å; F77-F103 AromaticContact CE2-CD1 3.64Å; F77-F103 HydrophobicContact CE2-CD1 3.64Å; F77-F103 HydrophobicContact CE2-CD2 4.37Å; F77-F103 AromaticContact CE2-CG 3.55Å; F77-F103 HydrophobicContact CE2-CG 3.55Å; F77-F103 HydrophobicContact CZ-CB 4.43Å; F77-F103 HydrophobicContact CZ-CD1 4.06Å; F77-F103 HydrophobicContact CZ-CG 4.41Å; F77-F103 VanDerWaalsContact O-CB 3.3Å; F77-F103 WeakPolarHBondContact O-CB 3.32Å; L96-F103 HydrophobicContact CD1-CD1 4.02Å; L96-F103 HydrophobicContact CD1-CE1 3.43Å; L96-F103 VanDerWaalsContact CD1-CE1 3.43Å; L96-F103 HydrophobicContact CD1-CE2 4.47Å; L96-F103 HydrophobicContact CD1-CZ 3.71Å; L96-F103 HydrophobicContact CD2-CZ 4.03Å; L96-F103 HydrophobicContact CG-CE1 3.61Å; L96-F103 HydrophobicContact CG-CZ 3.59Å; L96-F103 WeakPolarHBondContact O-CE1 3.28Å; F103-C105 VanDerWaalsContact CD2-C 3.43Å; F103-C105 WeakPolarHBondContact CD2-O 3.2Å; F103-A106 HydrophobicContact CD2-CB 4.32Å; F103-A106 HydrophobicContact CE2-CB 3.66Å; F103-A106 HydrophobicContact CZ-CB 4.19Å; F103-L166 HydrophobicContact CD1-CD1 3.89Å; F103-L166 HydrophobicContact CD1-CG 4.4Å; F103-L166 HydrophobicContact CE1-CD1 3.61Å; F103-L166 HydrophobicContact CE1-CD2 4Å; F103-L166 HydrophobicContact CE1-CG 3.81Å; F103-L166 HydrophobicContact CE2-CG 4.16Å; F103-L166 HydrophobicContact CZ-CD1 4.03Å; F103-L166 HydrophobicContact CZ-CD2 3.76Å; F103-L166 HydrophobicContact CZ-CG 3.68Å
104	R	95.1	Very high	95.4	Very high	84 Å²	84	43.3 Å²	43.3	32%	0.317	20%	0.2	S	C	.	.	S	Bend	trans	-74.9	-52.5	179.7	179.1	172.3	60.2	120	2	112.1	V8 D13 D78	V8-R104 PolarHBondContact O-NH1 2.94Å; V8-R104 VanDerWaalsContact O-NH1 3.08Å; V8-R104 PolarHBondContact O-NH2 2.88Å; D13-R104 IonicContact OD1-NH2 3.66Å; D13-R104 IonicContact OD2-CZ 3.43Å; D13-R104 IonicContact OD2-NH2 2.93Å; D13-R104 PolarHBondContact OD2-NH2 2.69Å; D78-R104 WeakPolarHBondContact O-CA 3.4Å; D78-R104 VanDerWaalsContact O-CB 3.3Å; D78-R104 WeakPolarHBondContact O-CB 3.4Å; D78-R104 PolarHBondContact O-N 3.32Å
105	C	96.2	Very high	95.5	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.007	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	158	175.6	68.5	0	0	0	0	113.1	D78 V79 C80 F103 I164 E165	D78-C105 PolarHBondContact O-N 2.99Å; V79-C105 VanDerWaalsContact CA-O 3.26Å; V79-C105 WeakPolarHBondContact CA-O 3.43Å; C80-C105 PolarHBondContact N-O 2.8Å; F103-C105 VanDerWaalsContact CD2-C 3.43Å; F103-C105 WeakPolarHBondContact CD2-O 3.2Å; C105-I164 CarbonylContact C-O 3.52Å; C105-I164 WeakPolarHBondContact CA-O 3.49Å; C105-E165 HydrophobicContact CB-CG 3.75Å
106	A	97.3	Very high	95.6	Very high	0 Å²	0	41 Å²	41	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	138.9	171.6	0	0	0	0	0	110.1	C80 L96 F103 L108 R163 I164	C80-A106 HydrophobicContact CB-CB 3.89Å; C80-A106 CarbonylContact O-C 3.56Å; C80-A106 WeakPolarHBondContact O-CA 3.43Å; L96-A106 HydrophobicContact CD1-CB 4.5Å; L96-A106 HydrophobicContact CD2-CB 3.7Å; F103-A106 HydrophobicContact CD2-CB 4.32Å; F103-A106 HydrophobicContact CE2-CB 3.66Å; F103-A106 HydrophobicContact CZ-CB 4.19Å; A106-L108 HydrophobicContact CB-CD1 4.33Å; A106-L108 HydrophobicContact CB-CD2 4.13Å; A106-L108 HydrophobicContact CB-CG 4.15Å; A106-R163 CarbonylContact O-C 3.52Å; A106-R163 VanDerWaalsContact O-CA 3.28Å; A106-R163 WeakPolarHBondContact O-CA 3.32Å; A106-I164 HydrophobicContact CB-CB 4.4Å; A106-I164 PolarHBondContact N-O 2.92Å; A106-I164 PolarHBondContact O-N 3.47Å
107	V	96.7	Very high	95.7	Very high	18 Å²	18	44.8 Å²	44.8	11%	0.109	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	109.9	175.3	177.2	0	0	0	0	109.5	V7 C80 V81 A82 V161 V162 R163	V7-V107 HydrophobicContact CB-CG2 4.36Å; V7-V107 HydrophobicContact CG2-CB 3.37Å; V7-V107 HydrophobicContact CG2-CG1 3.84Å; V7-V107 HydrophobicContact CG2-CG2 3.27Å; C80-V107 PolarHBondContact O-N 2.71Å; V81-V107 VanDerWaalsContact CA-O 3.32Å; V81-V107 WeakPolarHBondContact CA-O 3.19Å; A82-V107 PolarHBondContact N-O 2.79Å; V107-V161 HydrophobicContact CG1-CG1 3.36Å; V107-V162 CarbonylContact C-O 3.6Å; V107-V162 WeakPolarHBondContact CA-O 3.41Å; V107-R163 HydrophobicContact CG2-CB 4.15Å; V107-R163 HydrophobicContact CG2-CG 4.15Å
108	L	96	Very high	95.8	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	140.6	-162.6	-50.1	174.3	0	0	0	109.7	A82 F92 I93 L96 A106 F110 V161 V162 I164	A82-L108 HydrophobicContact CB-CD2 3.55Å; F92-L108 HydrophobicContact CE1-CD1 4.07Å; F92-L108 HydrophobicContact CE1-CD2 3.87Å; F92-L108 HydrophobicContact CZ-CD2 4.45Å; I93-L108 HydrophobicContact CD1-CD1 3.6Å; L96-L108 HydrophobicContact CD2-CD1 3.64Å; A106-L108 HydrophobicContact CB-CD1 4.33Å; A106-L108 HydrophobicContact CB-CD2 4.13Å; A106-L108 HydrophobicContact CB-CG 4.15Å; L108-F110 HydrophobicContact CB-CD2 4.2Å; L108-F110 HydrophobicContact CB-CE2 3.48Å; L108-F110 VanDerWaalsContact CB-CE2 3.48Å; L108-F110 HydrophobicContact CB-CZ 3.71Å; L108-F110 HydrophobicContact CD1-CE2 3.8Å; L108-F110 HydrophobicContact CD1-CZ 3.69Å; L108-F110 HydrophobicContact CG-CE2 4.3Å; L108-F110 HydrophobicContact CG-CZ 4.34Å; L108-V161 CarbonylContact O-C 3.49Å; L108-V161 WeakPolarHBondContact O-CA 3.48Å; L108-V162 PolarHBondContact N-O 3.34Å; L108-V162 PolarHBondContact O-N 2.78Å; L108-I164 HydrophobicContact CD1-CD1 3.76Å; L108-I164 HydrophobicContact CD1-CG1 4.5Å
109	M	94.1	Very high	96	Very high	41 Å²	41	42.8 Å²	42.8	20%	0.202	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	128.8	173.9	-163.1	174.3	-58.7	0	0	110.4	A82 N83 F151 A159 V161	A82-M109 PolarHBondContact O-N 3.13Å; N83-M109 PolarHBondContact OD1-SD 2.97Å; M109-F151 HydrophobicContact SD-CE1 3.51Å; M109-F151 VanDerWaalsContact SD-CE1 3.51Å; M109-F151 HydrophobicContact SD-CZ 3.38Å; M109-F151 WeakPolarHBondContact SD-CZ 3.44Å; M109-A159 HydrophobicContact CG-CB 4.08Å; M109-A159 HydrophobicContact SD-CB 4.37Å; M109-V161 HydrophobicContact CE-CG2 4.16Å; M109-V161 HydrophobicContact CG-CG2 4.49Å
110	F	94.7	Very high	96.2	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	167.3	178.4	-64.9	-60.6	0	0	0	111.7	L84 S89 I93 L108 F114 A115 L118 A159 S160 V162	L84-F110 HydrophobicContact CD1-CE1 4.48Å; S89-F110 WeakPolarHBondContact OG-CD1 3.37Å; I93-F110 HydrophobicContact CD1-CE2 3.8Å; I93-F110 HydrophobicContact CD1-CZ 3.49Å; I93-F110 VanDerWaalsContact CD1-CZ 3.49Å; I93-F110 HydrophobicContact CG1-CE1 4.4Å; I93-F110 HydrophobicContact CG1-CE2 4.24Å; I93-F110 HydrophobicContact CG1-CZ 3.68Å; L108-F110 HydrophobicContact CB-CD2 4.2Å; L108-F110 HydrophobicContact CB-CE2 3.48Å; L108-F110 VanDerWaalsContact CB-CE2 3.48Å; L108-F110 HydrophobicContact CB-CZ 3.71Å; L108-F110 HydrophobicContact CD1-CE2 3.8Å; L108-F110 HydrophobicContact CD1-CZ 3.69Å; L108-F110 HydrophobicContact CG-CE2 4.3Å; L108-F110 HydrophobicContact CG-CZ 4.34Å; F110-F114 HydrophobicContact CB-CB 4.34Å; F110-F114 HydrophobicContact CB-CD1 3.76Å; F110-F114 HydrophobicContact CB-CG 4.45Å; F110-F114 AromaticContact CD1-CD1 3.76Å; F110-F114 HydrophobicContact CD1-CD1 3.76Å; F110-F114 AromaticContact CD1-CE1 3.84Å; F110-F114 HydrophobicContact CD1-CE1 3.84Å; F110-F114 AromaticContact CD2-CD1 3.97Å; F110-F114 HydrophobicContact CD2-CD1 3.97Å; F110-F114 HydrophobicContact CD2-CE1 4.12Å; F110-F114 HydrophobicContact CE1-CD1 4.34Å; F110-F114 AromaticContact CE1-CE1 3.94Å; F110-F114 HydrophobicContact CE1-CE1 3.94Å; F110-F114 HydrophobicContact CE2-CE1 4.21Å; F110-F114 AromaticContact CG-CD1 3.55Å; F110-F114 HydrophobicContact CG-CD1 3.55Å; F110-F114 AromaticContact CG-CE1 3.94Å; F110-F114 HydrophobicContact CG-CE1 3.94Å; F110-F114 HydrophobicContact CZ-CE1 4.13Å; F110-A115 HydrophobicContact CB-CB 4.35Å; F110-L118 HydrophobicContact CD2-CD1 3.81Å; F110-L118 HydrophobicContact CE2-CD1 3.79Å; F110-A159 CarbonylContact O-C 3.43Å; F110-A159 WeakPolarHBondContact O-CA 3.13Å; F110-A159 WeakPolarHBondContact O-CB 3.25Å; F110-S160 PolarHBondContact N-O 3.26Å; F110-S160 PolarHBondContact O-N 2.75Å; F110-V162 HydrophobicContact CD2-CB 4.36Å; F110-V162 HydrophobicContact CD2-CG2 4.19Å
111	Q	95	Very high	96.4	Very high	68 Å²	68	44.8 Å²	44.8	32%	0.318	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	145.9	164.2	-63.2	-175.3	-41.2	0	0	110	F86 E113 F114 A115 V157	F86-Q111 HydrophobicContact CB-CG 3.71Å; F86-Q111 HydrophobicContact CD1-CB 4.38Å; F86-Q111 HydrophobicContact CD1-CG 3.37Å; F86-Q111 VanDerWaalsContact CD2-CD 3.45Å; F86-Q111 HydrophobicContact CD2-CG 3.23Å; F86-Q111 HydrophobicContact CE1-CB 4.43Å; F86-Q111 HydrophobicContact CE1-CG 3.61Å; F86-Q111 VanDerWaalsContact CE1-N 3.29Å; F86-Q111 HydrophobicContact CE2-CG 3.46Å; F86-Q111 VanDerWaalsContact CE2-CG 3.46Å; F86-Q111 HydrophobicContact CG-CB 4.48Å; F86-Q111 HydrophobicContact CG-CG 3.15Å; F86-Q111 HydrophobicContact CZ-CG 3.63Å; Q111-E113 VanDerWaalsContact C-N 3.31Å; Q111-E113 PolarHBondContact O-N 3.26Å; Q111-F114 HydrophobicContact CB-CB 4.34Å; Q111-F114 PolarHBondContact O-N 3Å; Q111-F114 VanDerWaalsContact O-N 3.1Å; Q111-A115 PolarHBondContact O-N 3.18Å; Q111-V157 HydrophobicContact CB-CG2 4.17Å; Q111-V157 HydrophobicContact CG-CG2 3.78Å
112	R	94.9	Very high	96.5	Very high	89 Å²	89	43.8 Å²	43.8	34%	0.336	20%	0.199	S	C	.	.	H	α-helix	trans	-54.3	-45.2	-178.1	-179.5	145.8	60.3	86.2	-7.8	112.7	A115 Q116 D158	R112-A115 PolarHBondContact O-N 3.01Å; R112-Q116 WeakPolarHBondContact O-CB 3.3Å; R112-Q116 WeakPolarHBondContact O-CG 3.36Å; R112-Q116 PolarHBondContact O-N 3.01Å; R112-D158 HydrophobicContact CB-CB 4.3Å; R112-D158 WeakPolarHBondContact CB-O 3.43Å; R112-D158 IonicContact CZ-OD2 3.24Å; R112-D158 PolarHBondContact N-O 3.31Å; R112-D158 IonicContact NE-OD2 2.95Å; R112-D158 PolarHBondContact NE-OD2 3.48Å; R112-D158 IonicContact NH2-OD2 3Å; R112-D158 PolarHBondContact NH2-OD2 3.28Å
113	E	96.2	Very high	96.6	Very high	113 Å²	113	43.4 Å²	43.4	53%	0.528	20%	0.204	S	C	.	.	H	α-helix	trans	-64.3	-43.6	178.3	-170.7	-169.4	148.7	0	0	112.1	Q111 A115 Q116 R117 L126	Q111-E113 VanDerWaalsContact C-N 3.31Å; Q111-E113 PolarHBondContact O-N 3.26Å; E113-A115 PolarHBondContact O-N 3.39Å; E113-Q116 PolarHBondContact O-N 3.4Å; E113-R117 WeakPolarHBondContact O-CG 3.2Å; E113-R117 PolarHBondContact O-N 3.07Å; E113-L126 HydrophobicContact CG-CD2 4.18Å
114	F	96.7	Very high	96.7	Very high	23 Å²	23	46.9 Å²	46.9	10%	0.101	22%	0.223	C	C	.	.	H	α-helix	trans	-61.7	-46.1	178	-172.7	-86.5	0	0	0	111.3	S89 I93 F110 Q111 Q116 R117 L118 L130	S89-F114 VanDerWaalsContact CB-CZ 3.47Å; I93-F114 HydrophobicContact CG1-CE1 4.13Å; I93-F114 HydrophobicContact CG1-CZ 4.27Å; F110-F114 HydrophobicContact CB-CB 4.34Å; F110-F114 HydrophobicContact CB-CD1 3.76Å; F110-F114 HydrophobicContact CB-CG 4.45Å; F110-F114 AromaticContact CD1-CD1 3.76Å; F110-F114 HydrophobicContact CD1-CD1 3.76Å; F110-F114 AromaticContact CD1-CE1 3.84Å; F110-F114 HydrophobicContact CD1-CE1 3.84Å; F110-F114 AromaticContact CD2-CD1 3.97Å; F110-F114 HydrophobicContact CD2-CD1 3.97Å; F110-F114 HydrophobicContact CD2-CE1 4.12Å; F110-F114 HydrophobicContact CE1-CD1 4.34Å; F110-F114 AromaticContact CE1-CE1 3.94Å; F110-F114 HydrophobicContact CE1-CE1 3.94Å; F110-F114 HydrophobicContact CE2-CE1 4.21Å; F110-F114 AromaticContact CG-CD1 3.55Å; F110-F114 HydrophobicContact CG-CD1 3.55Å; F110-F114 AromaticContact CG-CE1 3.94Å; F110-F114 HydrophobicContact CG-CE1 3.94Å; F110-F114 HydrophobicContact CZ-CE1 4.13Å; Q111-F114 HydrophobicContact CB-CB 4.34Å; Q111-F114 PolarHBondContact O-N 3Å; Q111-F114 VanDerWaalsContact O-N 3.1Å; F114-Q116 VanDerWaalsContact C-N 3.31Å; F114-Q116 PolarHBondContact O-N 3.45Å; F114-R117 WeakPolarHBondContact O-CB 3.41Å; F114-R117 PolarHBondContact O-N 3.45Å; F114-L118 HydrophobicContact CD1-CD1 3.97Å; F114-L118 HydrophobicContact CD1-CG 4.25Å; F114-L118 HydrophobicContact CE1-CD1 3.77Å; F114-L118 HydrophobicContact CE1-CD2 4.19Å; F114-L118 HydrophobicContact CE1-CG 4.04Å; F114-L118 PolarHBondContact O-N 3.46Å; F114-L118 VanDerWaalsContact O-N 3.11Å; F114-L130 HydrophobicContact CD2-CD2 4.01Å; F114-L130 HydrophobicContact CE1-CD2 4.28Å; F114-L130 HydrophobicContact CE2-CD2 3.52Å; F114-L130 HydrophobicContact CZ-CD1 4.37Å; F114-L130 HydrophobicContact CZ-CD2 3.68Å
115	A	96.7	Very high	96.8	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-58.3	-42.9	174.2	0	0	0	0	0	112.2	F110 Q111 R112 E113 L118 V119 L142 V162	F110-A115 HydrophobicContact CB-CB 4.35Å; Q111-A115 PolarHBondContact O-N 3.18Å; R112-A115 PolarHBondContact O-N 3.01Å; E113-A115 PolarHBondContact O-N 3.39Å; A115-L118 PolarHBondContact O-N 3.23Å; A115-V119 PolarHBondContact O-N 3.47Å; A115-L142 HydrophobicContact CB-CD1 4.02Å; A115-V162 HydrophobicContact CB-CG2 3.5Å
116	Q	97.6	Very high	96.9	Very high	66 Å²	66	54.5 Å²	54.5	31%	0.308	26%	0.26	S	S	.	.	H	α-helix	trans	-64.9	-37.3	176.6	-74	174.2	-42.4	0	0	112.4	R112 E113 F114 L118 V119 A120 L126	R112-Q116 WeakPolarHBondContact O-CB 3.3Å; R112-Q116 WeakPolarHBondContact O-CG 3.36Å; R112-Q116 PolarHBondContact O-N 3.01Å; E113-Q116 PolarHBondContact O-N 3.4Å; F114-Q116 VanDerWaalsContact C-N 3.31Å; F114-Q116 PolarHBondContact O-N 3.45Å; Q116-L118 VanDerWaalsContact C-N 3.34Å; Q116-L118 PolarHBondContact O-N 2.85Å; Q116-V119 PolarHBondContact O-N 2.91Å; Q116-A120 WeakPolarHBondContact O-CB 3.19Å; Q116-A120 PolarHBondContact O-N 3.45Å; Q116-L126 HydrophobicContact CB-CD1 3.51Å; Q116-L126 HydrophobicContact CG-CD1 4.41Å
117	R	97.9	Very high	97	Very high	81 Å²	81	54.5 Å²	54.5	31%	0.306	26%	0.26	S	S	.	.	H	α-helix	trans	-63.4	-38.2	174.2	-71.6	172	62	-167.4	-4.2	111.9	E113 F114 V119 A120 L126 C128 L130 S131	E113-R117 WeakPolarHBondContact O-CG 3.2Å; E113-R117 PolarHBondContact O-N 3.07Å; F114-R117 WeakPolarHBondContact O-CB 3.41Å; F114-R117 PolarHBondContact O-N 3.45Å; R117-V119 VanDerWaalsContact C-N 3.31Å; R117-V119 PolarHBondContact O-N 2.68Å; R117-A120 PolarHBondContact O-N 2.68Å; R117-L126 HydrophobicContact CG-CB 4.03Å; R117-L126 HydrophobicContact CG-CD2 4.4Å; R117-C128 PolarHBondContact NE-SG 2.91Å; R117-C128 PolarHBondContact NH2-SG 3.03Å; R117-C128 VanDerWaalsContact NH2-SG 3.43Å; R117-L130 HydrophobicContact CB-CD2 4.2Å; R117-S131 VanDerWaalsContact O-CB 3.28Å; R117-S131 WeakPolarHBondContact O-CB 3.3Å; R117-S131 PolarHBondContact O-OG 3.39Å
118	L	97.6	Very high	97	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.5	-37.7	178.5	-67.8	169.9	0	0	0	112.5	I93 F110 F114 A115 Q116 L130 T134 Q135 V140 V162	I93-L118 HydrophobicContact CG1-CD2 4.48Å; I93-L118 HydrophobicContact CG2-CD2 4.35Å; F110-L118 HydrophobicContact CD2-CD1 3.81Å; F110-L118 HydrophobicContact CE2-CD1 3.79Å; F114-L118 HydrophobicContact CD1-CD1 3.97Å; F114-L118 HydrophobicContact CD1-CG 4.25Å; F114-L118 HydrophobicContact CE1-CD1 3.77Å; F114-L118 HydrophobicContact CE1-CD2 4.19Å; F114-L118 HydrophobicContact CE1-CG 4.04Å; F114-L118 PolarHBondContact O-N 3.46Å; F114-L118 VanDerWaalsContact O-N 3.11Å; A115-L118 PolarHBondContact O-N 3.23Å; Q116-L118 VanDerWaalsContact C-N 3.34Å; Q116-L118 PolarHBondContact O-N 2.85Å; L118-L130 HydrophobicContact CD2-CD1 3.87Å; L118-L130 HydrophobicContact CD2-CD2 3.94Å; L118-L130 HydrophobicContact CD2-CG 3.77Å; L118-L130 HydrophobicContact CG-CD2 4.35Å; L118-T134 HydrophobicContact CD2-CG2 3.96Å; L118-T134 WeakPolarHBondContact CD2-OG1 3.46Å; L118-Q135 PolarHBondContact O-NE2 3.13Å; L118-V140 HydrophobicContact CB-CG1 4.09Å; L118-V162 HydrophobicContact CD1-CG1 4.27Å; L118-V162 HydrophobicContact CD1-CG2 4.41Å
119	V	97.5	Very high	97.1	Very high	43 Å²	43	58.3 Å²	58.3	26%	0.261	28%	0.275	S	S	.	.	H	α-helix	trans	-98.2	-1	-177.8	-58.8	0	0	0	0	114.2	A115 Q116 R117 V140	A115-V119 PolarHBondContact O-N 3.47Å; Q116-V119 PolarHBondContact O-N 2.91Å; R117-V119 VanDerWaalsContact C-N 3.31Å; R117-V119 PolarHBondContact O-N 2.68Å; V119-V140 HydrophobicContact CG1-CB 4.17Å; V119-V140 HydrophobicContact CG1-CG1 3.65Å
120	A	98.3	Very high	97.2	Very high	4 Å²	4	56.7 Å²	56.7	3%	0.033	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-61.7	136.6	-179.3	0	0	0	0	0	110.2	Q116 R117 D124 L126 Y127 Q135	Q116-A120 WeakPolarHBondContact O-CB 3.19Å; Q116-A120 PolarHBondContact O-N 3.45Å; R117-A120 PolarHBondContact O-N 2.68Å; A120-D124 HydrophobicContact CB-CB 4.2Å; A120-L126 HydrophobicContact CB-CB 4.26Å; A120-Y127 HydrophobicContact CB-CD2 4.38Å; A120-Y127 VanDerWaalsContact O-CD2 3.3Å; A120-Y127 WeakPolarHBondContact O-CD2 3.27Å; A120-Q135 PolarHBondContact O-NE2 3.12Å
121	R	98.1	Very high	97.4	Very high	184 Å²	184	56.7 Å²	56.7	69%	0.694	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-95.8	160.3	178.2	-65.2	-178.2	-177.3	-177	-0.3	110.9	G123 D124 Y127	R121-G123 PolarHBondContact O-N 2.81Å; R121-D124 PolarHBondContact N-OD2 2.96Å; R121-D124 VanDerWaalsContact O-CB 3.25Å; R121-D124 WeakPolarHBondContact O-CB 3.33Å; R121-D124 PolarHBondContact O-N 3.48Å; R121-Y127 VanDerWaalsContact C-CD2 3.44Å; R121-Y127 WeakPolarHBondContact O-CB 3.36Å; R121-Y127 WeakPolarHBondContact O-CD2 3.3Å
122	P	98.5	Very high	97.5	Very high	49 Å²	49	53.4 Å²	53.4	32%	0.318	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.7	131.2	171.3	-25	32.4	0	0	0	111.5	Y127 D249	P122-Y127 HydrophobicContact CB-CE1 4.28Å; P122-Y127 HydrophobicContact CG-CE1 4.32Å; P122-Y127 HydrophobicContact CG-CE2 4.14Å; P122-D249 HydrophobicContact CG-CB 3.69Å
123	G	97.9	Very high	97.6	Very high	40 Å²	40	49.2 Å²	49.2	41%	0.412	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.8	-24.2	-175.3	0	0	0	0	0	114.3	R121 R246	R121-G123 PolarHBondContact O-N 2.81Å; G123-R246 PolarHBondContact N-O 2.75Å
124	D	98.2	Very high	97.6	Very high	79 Å²	79	43.8 Å²	43.8	42%	0.422	21%	0.211	S	C	.	.			trans	-66.1	147.9	-179.8	-71.8	-19.8	0	0	0	112	A120 R121 L126 Y127	A120-D124 HydrophobicContact CB-CB 4.2Å; R121-D124 PolarHBondContact N-OD2 2.96Å; R121-D124 VanDerWaalsContact O-CB 3.25Å; R121-D124 WeakPolarHBondContact O-CB 3.33Å; R121-D124 PolarHBondContact O-N 3.48Å; D124-L126 PolarHBondContact O-N 2.86Å; D124-L126 VanDerWaalsContact O-N 3.16Å; D124-Y127 VanDerWaalsContact O-CB 3.28Å; D124-Y127 WeakPolarHBondContact O-CB 3.32Å; D124-Y127 PolarHBondContact O-N 2.8Å
125	K	97.6	Very high	97.7	Very high	193 Å²	193	44.2 Å²	44.2	84%	0.839	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-40.7	177.4	-175.3	176.6	179.7	179.3	0	112.2	K189	K125-K189 PolarHBondContact O-NZ 2.88Å
126	L	97.9	Very high	97.7	Very high	52 Å²	52	44.3 Å²	44.3	27%	0.272	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-2.8	-177.1	-65.8	178	0	0	0	114	E113 Q116 R117 A120 D124 C128	E113-L126 HydrophobicContact CG-CD2 4.18Å; Q116-L126 HydrophobicContact CB-CD1 3.51Å; Q116-L126 HydrophobicContact CG-CD1 4.41Å; R117-L126 HydrophobicContact CG-CB 4.03Å; R117-L126 HydrophobicContact CG-CD2 4.4Å; A120-L126 HydrophobicContact CB-CB 4.26Å; D124-L126 PolarHBondContact O-N 2.86Å; D124-L126 VanDerWaalsContact O-N 3.16Å; L126-C128 PolarHBondContact O-N 3.01Å
127	Y	98.5	Very high	97.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.203	C	C	.	.			trans	-61.4	128.7	177.7	-170.1	-114.6	0	0	0	111.1	A120 R121 P122 D124 S131 V132 F186 K189 A245 R246 M248	A120-Y127 HydrophobicContact CB-CD2 4.38Å; A120-Y127 VanDerWaalsContact O-CD2 3.3Å; A120-Y127 WeakPolarHBondContact O-CD2 3.27Å; R121-Y127 VanDerWaalsContact C-CD2 3.44Å; R121-Y127 WeakPolarHBondContact O-CB 3.36Å; R121-Y127 WeakPolarHBondContact O-CD2 3.3Å; P122-Y127 HydrophobicContact CB-CE1 4.28Å; P122-Y127 HydrophobicContact CG-CE1 4.32Å; P122-Y127 HydrophobicContact CG-CE2 4.14Å; D124-Y127 VanDerWaalsContact O-CB 3.28Å; D124-Y127 WeakPolarHBondContact O-CB 3.32Å; D124-Y127 PolarHBondContact O-N 2.8Å; Y127-S131 VanDerWaalsContact CD2-CB 3.46Å; Y127-V132 WeakPolarHBondContact OH-CG2 3.35Å; Y127-F186 HydrophobicContact CD1-CE1 4.08Å; Y127-F186 HydrophobicContact CD1-CZ 4.19Å; Y127-F186 HydrophobicContact CE1-CE1 4.07Å; Y127-F186 AromaticContact CE1-CZ 3.7Å; Y127-F186 HydrophobicContact CE1-CZ 3.7Å; Y127-K189 WeakPolarHBondContact O-CD 3.42Å; Y127-K189 PolarHBondContact O-NZ 3.16Å; Y127-A245 WeakPolarHBondContact CE1-O 3.05Å; Y127-R246 VanDerWaalsContact CD1-O 3.25Å; Y127-R246 WeakPolarHBondContact CD1-O 3Å; Y127-M248 VanDerWaalsContact CE1-O 3.28Å; Y127-M248 WeakPolarHBondContact CE1-O 3.41Å; Y127-M248 PolarHBondContact OH-O 3.16Å
128	C	98	Very high	97.6	Very high	18 Å²	18	38.1 Å²	38.1	12%	0.122	19%	0.189	C	C	.	.			trans	-156.9	-179.6	-174.5	66.1	0	0	0	0	111.5	R117 L126 L130 S131 V132 F186	R117-C128 PolarHBondContact NE-SG 2.91Å; R117-C128 PolarHBondContact NH2-SG 3.03Å; R117-C128 VanDerWaalsContact NH2-SG 3.43Å; L126-C128 PolarHBondContact O-N 3.01Å; C128-L130 PolarHBondContact O-N 3.29Å; C128-L130 VanDerWaalsContact O-N 3.16Å; C128-S131 PolarHBondContact N-OG 2.99Å; C128-S131 WeakPolarHBondContact O-CA 3.43Å; C128-S131 WeakPolarHBondContact O-CB 3.38Å; C128-S131 PolarHBondContact O-N 2.98Å; C128-S131 PolarHBondContact O-OG 3.23Å; C128-V132 PolarHBondContact O-N 3.29Å; C128-F186 VanDerWaalsContact C-CE1 3.5Å
129	R	97.2	Very high	97.5	Very high	81 Å²	81	44.4 Å²	44.4	31%	0.306	22%	0.216	S	C	.	.	H	α-helix	trans	-52.3	-37.3	176.5	-172.4	176.5	73.3	143.5	-0.3	113.6	S131 N133 D179 F186	R129-S131 VanDerWaalsContact C-N 3.28Å; R129-S131 PolarHBondContact O-N 3.3Å; R129-N133 VanDerWaalsContact O-CB 3.32Å; R129-N133 WeakPolarHBondContact O-CB 3.33Å; R129-N133 VanDerWaalsContact O-CG 3.28Å; R129-N133 PolarHBondContact O-N 3.18Å; R129-D179 IonicContact CZ-OD1 3.1Å; R129-D179 IonicContact NE-OD1 2.73Å; R129-D179 VanDerWaalsContact NH1-CG 3.27Å; R129-D179 IonicContact NH1-OD1 3.04Å; R129-D179 PolarHBondContact NH1-OD1 3.43Å; R129-D179 IonicContact NH1-OD2 3.5Å; R129-D179 PolarHBondContact NH1-OD2 3.39Å; R129-F186 HydrophobicContact CB-CB 4.09Å; R129-F186 HydrophobicContact CB-CD2 4.05Å; R129-F186 HydrophobicContact CB-CG 4.03Å
130	L	96.9	Very high	97.5	Very high	7 Å²	7	43.3 Å²	43.3	4%	0.037	21%	0.21	C	C	.	.	H	α-helix	trans	-61.7	-39.2	176.7	178.4	65.4	0	0	0	111.6	I93 F94 F114 R117 L118 C128 T134	I93-L130 HydrophobicContact CG2-CD1 4.46Å; F94-L130 HydrophobicContact CZ-CD1 4.37Å; F114-L130 HydrophobicContact CD2-CD2 4.01Å; F114-L130 HydrophobicContact CE1-CD2 4.28Å; F114-L130 HydrophobicContact CE2-CD2 3.52Å; F114-L130 HydrophobicContact CZ-CD1 4.37Å; F114-L130 HydrophobicContact CZ-CD2 3.68Å; R117-L130 HydrophobicContact CB-CD2 4.2Å; L118-L130 HydrophobicContact CD2-CD1 3.87Å; L118-L130 HydrophobicContact CD2-CD2 3.94Å; L118-L130 HydrophobicContact CD2-CG 3.77Å; L118-L130 HydrophobicContact CG-CD2 4.35Å; C128-L130 PolarHBondContact O-N 3.29Å; C128-L130 VanDerWaalsContact O-N 3.16Å; L130-T134 VanDerWaalsContact O-CB 3.3Å; L130-T134 WeakPolarHBondContact O-CB 3.46Å; L130-T134 PolarHBondContact O-N 3.23Å; L130-T134 VanDerWaalsContact O-N 3.12Å; L130-T134 PolarHBondContact O-OG1 3.08Å
131	S	98	Very high	97.3	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.8	-59.3	178.9	-42.5	0	0	0	0	109.8	R117 Y127 C128 R129 N133 T134 Q135	R117-S131 VanDerWaalsContact O-CB 3.28Å; R117-S131 WeakPolarHBondContact O-CB 3.3Å; R117-S131 PolarHBondContact O-OG 3.39Å; Y127-S131 VanDerWaalsContact CD2-CB 3.46Å; C128-S131 PolarHBondContact N-OG 2.99Å; C128-S131 WeakPolarHBondContact O-CA 3.43Å; C128-S131 WeakPolarHBondContact O-CB 3.38Å; C128-S131 PolarHBondContact O-N 2.98Å; C128-S131 PolarHBondContact O-OG 3.23Å; R129-S131 VanDerWaalsContact C-N 3.28Å; R129-S131 PolarHBondContact O-N 3.3Å; S131-N133 PolarHBondContact O-N 3.24Å; S131-T134 PolarHBondContact O-N 2.7Å; S131-Q135 VanDerWaalsContact O-CB 3.3Å; S131-Q135 WeakPolarHBondContact O-CB 3.33Å; S131-Q135 VanDerWaalsContact O-CG 3.29Å; S131-Q135 WeakPolarHBondContact O-CG 3.42Å; S131-Q135 PolarHBondContact O-N 3.35Å
132	V	97.5	Very high	97.2	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-65.4	-39.6	-174.8	81.1	0	0	0	0	112.3	Y127 C128 T134 Q135 L136 W178 T182 F186 E250 F253	Y127-V132 WeakPolarHBondContact OH-CG2 3.35Å; C128-V132 PolarHBondContact O-N 3.29Å; V132-T134 PolarHBondContact O-N 3.34Å; V132-Q135 PolarHBondContact O-N 2.89Å; V132-L136 WeakPolarHBondContact O-CB 3.43Å; V132-L136 PolarHBondContact O-N 3.47Å; V132-W178 HydrophobicContact CG2-CZ2 3.91Å; V132-T182 HydrophobicContact CG1-CG2 3.96Å; V132-F186 HydrophobicContact CB-CE2 4.41Å; V132-F186 HydrophobicContact CG1-CE2 3.74Å; V132-F186 HydrophobicContact CG1-CZ 4.26Å; V132-E250 HydrophobicContact CG2-CG 4Å; V132-F253 HydrophobicContact CG2-CD2 3.83Å; V132-F253 HydrophobicContact CG2-CE2 4.25Å
133	N	96.9	Very high	97	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-67.7	-38.5	179.7	-73.3	2.7	0	0	0	112	F94 R129 S131 F175 W178 D179 T182	F94-N133 HydrophobicContact CE1-CB 3.89Å; F94-N133 HydrophobicContact CZ-CB 4.47Å; R129-N133 VanDerWaalsContact O-CB 3.32Å; R129-N133 WeakPolarHBondContact O-CB 3.33Å; R129-N133 VanDerWaalsContact O-CG 3.28Å; R129-N133 PolarHBondContact O-N 3.18Å; S131-N133 PolarHBondContact O-N 3.24Å; N133-F175 HydrophobicContact CB-CE2 4.41Å; N133-F175 HydrophobicContact CB-CZ 4.24Å; N133-W178 PolarHBondContact OD1-NE1 2.81Å; N133-D179 PolarHBondContact ND2-OD1 3.4Å; N133-T182 PolarHBondContact OD1-OG1 2.72Å
134	T	97.1	Very high	96.8	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-70.6	-45	177.6	-51.2	0	0	0	0	110.2	I93 L97 L118 L130 S131 V132 L136 L137 A138 V140	I93-T134 HydrophobicContact CG2-CG2 4.46Å; L97-T134 HydrophobicContact CD1-CG2 4.08Å; L97-T134 HydrophobicContact CD2-CG2 4.32Å; L118-T134 HydrophobicContact CD2-CG2 3.96Å; L118-T134 WeakPolarHBondContact CD2-OG1 3.46Å; L130-T134 VanDerWaalsContact O-CB 3.3Å; L130-T134 WeakPolarHBondContact O-CB 3.46Å; L130-T134 PolarHBondContact O-N 3.23Å; L130-T134 VanDerWaalsContact O-N 3.12Å; L130-T134 PolarHBondContact O-OG1 3.08Å; S131-T134 PolarHBondContact O-N 2.7Å; V132-T134 PolarHBondContact O-N 3.34Å; T134-L136 VanDerWaalsContact C-N 3.33Å; T134-L136 PolarHBondContact O-N 3.36Å; T134-L137 PolarHBondContact O-N 3.42Å; T134-A138 PolarHBondContact O-N 2.96Å; T134-V140 HydrophobicContact CG2-CG2 3.5Å
135	Q	97.3	Very high	96.7	Very high	31 Å²	31	48.3 Å²	48.3	15%	0.145	22%	0.22	C	C	.	.	H	α-helix	trans	-72.6	-23.5	-177.1	-71.1	170.7	39.9	0	0	113.2	L118 A120 S131 V132 A138 K167 E250	L118-Q135 PolarHBondContact O-NE2 3.13Å; A120-Q135 PolarHBondContact O-NE2 3.12Å; S131-Q135 VanDerWaalsContact O-CB 3.3Å; S131-Q135 WeakPolarHBondContact O-CB 3.33Å; S131-Q135 VanDerWaalsContact O-CG 3.29Å; S131-Q135 WeakPolarHBondContact O-CG 3.42Å; S131-Q135 PolarHBondContact O-N 3.35Å; V132-Q135 PolarHBondContact O-N 2.89Å; Q135-A138 WeakPolarHBondContact CA-O 3.37Å; Q135-K167 WeakPolarHBondContact O-CE 3.44Å; Q135-K167 PolarHBondContact O-NZ 2.96Å; Q135-E250 HydrophobicContact CB-CG 4.41Å; Q135-E250 WeakPolarHBondContact CB-OE1 3.44Å; Q135-E250 PolarHBondContact OE1-OE1 3.18Å
136	L	96.8	Very high	96.5	Very high	2 Å²	2	40.1 Å²	40.1	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-57.5	-50.5	167.2	175.1	70.6	0	0	0	110.6	V132 T134 K167 P171 V173 F175 W178 E250	V132-L136 WeakPolarHBondContact O-CB 3.43Å; V132-L136 PolarHBondContact O-N 3.47Å; T134-L136 VanDerWaalsContact C-N 3.33Å; T134-L136 PolarHBondContact O-N 3.36Å; L136-K167 WeakPolarHBondContact O-CD 3.48Å; L136-K167 WeakPolarHBondContact O-CE 3.39Å; L136-K167 PolarHBondContact O-NZ 3.15Å; L136-P171 HydrophobicContact CD1-CB 4.29Å; L136-P171 HydrophobicContact CD1-CG 3.82Å; L136-P171 HydrophobicContact CG-CG 3.95Å; L136-V173 HydrophobicContact CD2-CG1 3.78Å; L136-F175 HydrophobicContact CD2-CD2 4.24Å; L136-F175 HydrophobicContact CD2-CE2 4.43Å; L136-W178 HydrophobicContact CB-CZ2 3.99Å; L136-W178 HydrophobicContact CD1-CH2 3.95Å; L136-W178 HydrophobicContact CD1-CZ2 4.1Å; L136-W178 HydrophobicContact CD1-CZ3 4.23Å; L136-W178 HydrophobicContact CD2-CD2 3.6Å; L136-W178 VanDerWaalsContact CD2-CE2 3.48Å; L136-W178 HydrophobicContact CD2-CE3 4.18Å; L136-W178 HydrophobicContact CD2-CG 3.79Å; L136-W178 HydrophobicContact CD2-CH2 4.42Å; L136-W178 HydrophobicContact CD2-CZ2 3.91Å; L136-W178 HydrophobicContact CG-CZ2 4.19Å; L136-E250 HydrophobicContact CB-CG 4.29Å
137	L	96.1	Very high	96.3	Very high	15 Å²	15	39 Å²	39	8%	0.079	19%	0.187	C	C	.	.	H	α-helix	trans	-92.4	-20.2	-169.8	-62.3	-179.5	0	0	0	114.1	L97 L98 T134 K167 P171 F175	L97-L137 HydrophobicContact CB-CB 4.35Å; L97-L137 HydrophobicContact CB-CD1 3.78Å; L97-L137 HydrophobicContact CD1-CD1 4.34Å; L97-L137 HydrophobicContact CD2-CB 4.2Å; L98-L137 HydrophobicContact CD2-CD1 4Å; T134-L137 PolarHBondContact O-N 3.42Å; L137-K167 PolarHBondContact O-N 3.1Å; L137-P171 HydrophobicContact CD2-CG 4.19Å; L137-F175 HydrophobicContact CD1-CD2 3.79Å; L137-F175 HydrophobicContact CD1-CE2 3.56Å; L137-F175 HydrophobicContact CD1-CZ 4.23Å; L137-F175 HydrophobicContact CD2-CD2 4.37Å; L137-F175 HydrophobicContact CG-CD2 4.29Å; L137-F175 HydrophobicContact CG-CE2 4.14Å
138	A	96.9	Very high	96	Very high	2 Å²	2	43.5 Å²	43.5	2%	0.017	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	155.5	-172.5	0	0	0	0	0	113.7	L97 T134 Q135 V140 I164 E165 L166	L97-A138 HydrophobicContact CD2-CB 3.59Å; T134-A138 PolarHBondContact O-N 2.96Å; Q135-A138 WeakPolarHBondContact CA-O 3.37Å; A138-V140 HydrophobicContact CB-CG2 4.48Å; A138-I164 HydrophobicContact CB-CG2 3.55Å; A138-E165 CarbonylContact C-O 3.54Å; A138-E165 WeakPolarHBondContact CA-O 3.44Å; A138-E165 VanDerWaalsContact CB-O 3.3Å; A138-E165 WeakPolarHBondContact CB-O 3.45Å; A138-L166 HydrophobicContact CB-CD2 4.35Å
139	K	96.2	Very high	95.7	Very high	132 Å²	132	49 Å²	49	57%	0.574	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-84	131.6	161.5	-62.8	178.8	-177.4	176	0	108.2	I164 E165	K139-I164 WeakPolarHBondContact O-CA 3.32Å; K139-E165 HydrophobicContact CB-CB 4.49Å; K139-E165 PolarHBondContact N-O 3.42Å; K139-E165 PolarHBondContact O-N 3.35Å
140	V	96.7	Very high	95.3	Very high	20 Å²	20	51.2 Å²	51.2	12%	0.121	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	130.1	-174.7	-167.6	0	0	0	0	110.3	L118 V119 T134 A138 V162 R163 I164	L118-V140 HydrophobicContact CB-CG1 4.09Å; V119-V140 HydrophobicContact CG1-CB 4.17Å; V119-V140 HydrophobicContact CG1-CG1 3.65Å; T134-V140 HydrophobicContact CG2-CG2 3.5Å; A138-V140 HydrophobicContact CB-CG2 4.48Å; V140-V162 HydrophobicContact CG1-CG1 3.32Å; V140-R163 WeakPolarHBondContact CA-O 3.27Å; V140-I164 HydrophobicContact CG1-CG1 4.22Å
141	H	95.9	Very high	94.8	Very high	85 Å²	85	52.6 Å²	52.6	39%	0.394	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	135.2	-178.2	-60.2	-71	0	0	0	111.7	V5 V143 V162 R163	V5-H141 HydrophobicContact CG1-CB 4.15Å; H141-V143 PolarHBondContact O-N 2.95Å; H141-V162 CarbonylContact O-C 3.45Å; H141-V162 WeakPolarHBondContact O-CA 3.36Å; H141-R163 PolarHBondContact N-O 3.22Å; H141-R163 PolarHBondContact O-N 3.36Å
142	L	95.4	Very high	94.3	Very high	69 Å²	69	64.6 Å²	64.6	36%	0.361	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	118.2	168	-164.7	74.5	0	0	0	108.7	A115 V162	A115-L142 HydrophobicContact CB-CD1 4.02Å; L142-V162 HydrophobicContact CD1-CG2 4.24Å
143	V	94.6	Very high	93.8	Very high	32 Å²	32	70.3 Å²	70.3	19%	0.194	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-55.8	-176.4	-173.7	0	0	0	0	110.2	V5 M6 H141 V161 R163	V5-V143 HydrophobicContact CB-CG1 4.46Å; V5-V143 HydrophobicContact CG1-CB 4.05Å; V5-V143 HydrophobicContact CG1-CG1 4.08Å; V5-V143 HydrophobicContact CG1-CG2 3.86Å; M6-V143 HydrophobicContact CG-CG1 4.37Å; H141-V143 PolarHBondContact O-N 2.95Å; V143-V161 HydrophobicContact CB-CB 4.07Å; V143-V161 HydrophobicContact CB-CG1 3.96Å; V143-V161 WeakPolarHBondContact CB-O 3.48Å; V143-V161 HydrophobicContact CG1-CG1 4.45Å; V143-V161 HydrophobicContact CG2-CB 4.44Å; V143-V161 HydrophobicContact CG2-CG1 3.91Å; V143-V161 PolarHBondContact N-O 2.97Å; V143-R163 HydrophobicContact CG2-CB 3.72Å
144	M	94.1	Very high	93.3	Very high	90 Å²	90	74.1 Å²	74.1	44%	0.443	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	157.7	-177.7	63.8	179.9	80.4	0	0	111.4	V146 S160 V161	M144-V146 HydrophobicContact CG-CG2 4.38Å; M144-S160 CarbonylContact O-C 3.54Å; M144-S160 WeakPolarHBondContact O-CA 3.31Å; M144-V161 HydrophobicContact CG-CB 3.86Å; M144-V161 HydrophobicContact CG-CG2 3.79Å; M144-V161 PolarHBondContact O-N 3.41Å; M144-V161 HydrophobicContact SD-CG2 4.43Å
145	R	95.1	Very high	92.9	Very high	186 Å²	186	75.6 Å²	75.6	70%	0.702	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.8	142.4	169.7	-62	179	-175.8	174.3	2.2	109
146	V	93	Very high	92.7	Very high	20 Å²	20	84 Å²	84	12%	0.121	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	112.8	177.6	-176.9	0	0	0	0	107.8	M144 N150 F151 A159 V161	M144-V146 HydrophobicContact CG-CG2 4.38Å; V146-N150 HydrophobicContact CG1-CB 3.98Å; V146-F151 HydrophobicContact CG1-CE2 3.72Å; V146-F151 HydrophobicContact CG1-CZ 3.91Å; V146-A159 HydrophobicContact CB-CB 4.16Å; V146-A159 PolarHBondContact N-O 3.25Å; V146-A159 PolarHBondContact O-N 3.16Å; V146-V161 HydrophobicContact CG2-CG2 3.77Å
147	G	94	Very high	92.5	Very high	30 Å²	30	86.8 Å²	86.8	31%	0.309	43%	0.428	S	S	.	.			trans	-67.9	144.4	178.8	0	0	0	0	0	111.3	N149 N150	G147-N149 PolarHBondContact O-N 2.97Å; G147-N150 WeakPolarHBondContact O-CB 3.41Å; G147-N150 PolarHBondContact O-N 3.16Å; G147-N150 PolarHBondContact O-ND2 3.46Å
148	K	91.6	Very high	92.5	Very high	94 Å²	94	88.3 Å²	88.3	41%	0.409	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-53	-25	-179.7	65	-175.4	-179.6	-179.3	0	115.3	N150 F151 P155 D158	K148-N150 PolarHBondContact O-N 2.86Å; K148-F151 WeakPolarHBondContact O-CD2 3.44Å; K148-F151 PolarHBondContact O-N 3.31Å; K148-P155 HydrophobicContact CB-CG 4.04Å; K148-D158 PolarHBondContact N-OD1 3.01Å; K148-D158 VanDerWaalsContact N-OD1 3.16Å
149	N	92.8	Very high	92.4	Very high	134 Å²	134	88.2 Å²	88.2	72%	0.717	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-71	-7.6	179.7	-60.9	-14.7	0	0	0	113.6	G147 F151	G147-N149 PolarHBondContact O-N 2.97Å; N149-F151 VanDerWaalsContact C-N 3.28Å
150	N	89.2	Confident	92.3	Very high	127 Å²	127	82 Å²	82	68%	0.679	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-85.2	1.6	175.6	-65.3	-83.5	0	0	0	113.4	V146 G147 K148	V146-N150 HydrophobicContact CG1-CB 3.98Å; G147-N150 WeakPolarHBondContact O-CB 3.41Å; G147-N150 PolarHBondContact O-N 3.16Å; G147-N150 PolarHBondContact O-ND2 3.46Å; K148-N150 PolarHBondContact O-N 2.86Å
151	F	86	Confident	92.2	Very high	36 Å²	36	81.8 Å²	81.8	16%	0.158	41%	0.408	C	S	.	.	S	Bend	trans	-115	153.4	-178.4	-58.9	-94.3	0	0	0	111	M109 V146 K148 N149 P153 P155 A159	M109-F151 HydrophobicContact SD-CE1 3.51Å; M109-F151 VanDerWaalsContact SD-CE1 3.51Å; M109-F151 HydrophobicContact SD-CZ 3.38Å; M109-F151 WeakPolarHBondContact SD-CZ 3.44Å; V146-F151 HydrophobicContact CG1-CE2 3.72Å; V146-F151 HydrophobicContact CG1-CZ 3.91Å; K148-F151 WeakPolarHBondContact O-CD2 3.44Å; K148-F151 PolarHBondContact O-N 3.31Å; N149-F151 VanDerWaalsContact C-N 3.28Å; F151-P153 CarbonylContact O-C 3.55Å; F151-P155 VanDerWaalsContact CB-CD 3.47Å; F151-P155 HydrophobicContact CB-CG 4.46Å; F151-P155 HydrophobicContact CD2-CG 3.86Å; F151-P155 HydrophobicContact CE2-CG 4.28Å; F151-P155 HydrophobicContact CG-CG 4.17Å; F151-A159 HydrophobicContact CE2-CB 3.97Å; F151-A159 HydrophobicContact CZ-CB 3.65Å
152	R	86.4	Confident	92.2	Very high	252 Å²	252	77.8 Å²	77.8	95%	0.951	39%	0.389	S	S	*	.	S	Bend	trans	-130.3	114.2	172.6	-69.7	-171.3	179.7	-155.8	0.4	109.8
153	P	87.1	Confident	92.3	Very high	119 Å²	119	75.9 Å²	75.9	77%	0.773	38%	0.377	S	S	*	.	S	Bend	cis	-67.7	157.1	-11.2	30.1	-34.6	0	0	0	112.5	F151	F151-P153 CarbonylContact O-C 3.55Å
154	P	88.1	Confident	92.4	Very high	81 Å²	81	74.3 Å²	74.3	53%	0.526	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-62.4	132.5	176.3	-22.9	33.7	0	0	0	112.5
155	P	88.6	Confident	92.5	Very high	30 Å²	30	72.5 Å²	72.5	20%	0.195	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-71	165.6	171.6	30.1	-36.1	0	0	0	111.8	F86 K148 F151 V157	F86-P155 HydrophobicContact CE2-CB 4.16Å; K148-P155 HydrophobicContact CB-CG 4.04Å; F151-P155 VanDerWaalsContact CB-CD 3.47Å; F151-P155 HydrophobicContact CB-CG 4.46Å; F151-P155 HydrophobicContact CD2-CG 3.86Å; F151-P155 HydrophobicContact CE2-CG 4.28Å; F151-P155 HydrophobicContact CG-CG 4.17Å; P155-V157 WeakPolarHBondContact CG-O 3.41Å; P155-V157 PolarHBondContact O-N 3.35Å
156	K	91.8	Very high	92.5	Very high	207 Å²	207	64.7 Å²	64.7	90%	0.9	33%	0.33	S	S	*	.	S	Bend	trans	-68.3	-22.2	176.5	-66.9	-174.4	178.2	-178	0	113.8
157	V	93.5	Very high	92.6	Very high	62 Å²	62	67.3 Å²	67.3	38%	0.376	34%	0.34	S	S	.	.	S	Bend	trans	-131.8	154.9	-174	-62	0	0	0	0	110.7	F86 Q111 P155	F86-V157 HydrophobicContact CE2-CG2 4.45Å; Q111-V157 HydrophobicContact CB-CG2 4.17Å; Q111-V157 HydrophobicContact CG-CG2 3.78Å; P155-V157 WeakPolarHBondContact CG-O 3.41Å; P155-V157 PolarHBondContact O-N 3.35Å
158	D	94.9	Very high	92.5	Very high	47 Å²	47	71.8 Å²	71.8	25%	0.251	35%	0.354	S	S	.	.			trans	-67.1	157.5	172.2	-63.9	-41.9	0	0	0	111.8	R112 K148	R112-D158 HydrophobicContact CB-CB 4.3Å; R112-D158 WeakPolarHBondContact CB-O 3.43Å; R112-D158 IonicContact CZ-OD2 3.24Å; R112-D158 PolarHBondContact N-O 3.31Å; R112-D158 IonicContact NE-OD2 2.95Å; R112-D158 PolarHBondContact NE-OD2 3.48Å; R112-D158 IonicContact NH2-OD2 3Å; R112-D158 PolarHBondContact NH2-OD2 3.28Å; K148-D158 PolarHBondContact N-OD1 3.01Å; K148-D158 VanDerWaalsContact N-OD1 3.16Å
159	A	94.4	Very high	92.5	Very high	0 Å²	0	72.7 Å²	72.7	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	170.2	175.3	0	0	0	0	0	111.6	M109 F110 V146 F151	M109-A159 HydrophobicContact CG-CB 4.08Å; M109-A159 HydrophobicContact SD-CB 4.37Å; F110-A159 CarbonylContact O-C 3.43Å; F110-A159 WeakPolarHBondContact O-CA 3.13Å; F110-A159 WeakPolarHBondContact O-CB 3.25Å; V146-A159 HydrophobicContact CB-CB 4.16Å; V146-A159 PolarHBondContact N-O 3.25Å; V146-A159 PolarHBondContact O-N 3.16Å; F151-A159 HydrophobicContact CE2-CB 3.97Å; F151-A159 HydrophobicContact CZ-CB 3.65Å
160	S	95.3	Very high	92.3	Very high	0 Å²	0	69 Å²	69	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	145.9	170.3	-64.5	0	0	0	0	109.8	F110 M144	F110-S160 PolarHBondContact N-O 3.26Å; F110-S160 PolarHBondContact O-N 2.75Å; M144-S160 CarbonylContact O-C 3.54Å; M144-S160 WeakPolarHBondContact O-CA 3.31Å
161	V	95.1	Very high	92.4	Very high	17 Å²	17	64.4 Å²	64.4	10%	0.103	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	131.3	175.1	-177.6	0	0	0	0	108.2	V107 L108 M109 V143 M144 V146	V107-V161 HydrophobicContact CG1-CG1 3.36Å; L108-V161 CarbonylContact O-C 3.49Å; L108-V161 WeakPolarHBondContact O-CA 3.48Å; M109-V161 HydrophobicContact CE-CG2 4.16Å; M109-V161 HydrophobicContact CG-CG2 4.49Å; V143-V161 HydrophobicContact CB-CB 4.07Å; V143-V161 HydrophobicContact CB-CG1 3.96Å; V143-V161 WeakPolarHBondContact CB-O 3.48Å; V143-V161 HydrophobicContact CG1-CG1 4.45Å; V143-V161 HydrophobicContact CG2-CB 4.44Å; V143-V161 HydrophobicContact CG2-CG1 3.91Å; V143-V161 PolarHBondContact N-O 2.97Å; M144-V161 HydrophobicContact CG-CB 3.86Å; M144-V161 HydrophobicContact CG-CG2 3.79Å; M144-V161 PolarHBondContact O-N 3.41Å; M144-V161 HydrophobicContact SD-CG2 4.43Å; V146-V161 HydrophobicContact CG2-CG2 3.77Å
162	V	95.8	Very high	92.7	Very high	0 Å²	0	69.6 Å²	69.6	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	137.1	-179.1	179.9	0	0	0	0	109	V107 L108 F110 A115 L118 V140 H141 L142 I164	V107-V162 CarbonylContact C-O 3.6Å; V107-V162 WeakPolarHBondContact CA-O 3.41Å; L108-V162 PolarHBondContact N-O 3.34Å; L108-V162 PolarHBondContact O-N 2.78Å; F110-V162 HydrophobicContact CD2-CB 4.36Å; F110-V162 HydrophobicContact CD2-CG2 4.19Å; A115-V162 HydrophobicContact CB-CG2 3.5Å; L118-V162 HydrophobicContact CD1-CG1 4.27Å; L118-V162 HydrophobicContact CD1-CG2 4.41Å; V140-V162 HydrophobicContact CG1-CG1 3.32Å; H141-V162 CarbonylContact O-C 3.45Å; H141-V162 WeakPolarHBondContact O-CA 3.36Å; L142-V162 HydrophobicContact CD1-CG2 4.24Å; V162-I164 HydrophobicContact CG1-CG1 4.06Å
163	R	96.7	Very high	93	Very high	29 Å²	29	59.2 Å²	59.2	11%	0.109	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	132.6	170.2	176.6	169.4	165.2	164.9	-9.1	109.6	S4 V5 M6 A106 V107 V140 H141 V143 E165	S4-R163 PolarHBondContact O-NH1 3.48Å; V5-R163 VanDerWaalsContact O-CD 3.29Å; V5-R163 WeakPolarHBondContact O-CD 3.34Å; M6-R163 PolarHBondContact O-NH1 2.91Å; A106-R163 CarbonylContact O-C 3.52Å; A106-R163 VanDerWaalsContact O-CA 3.28Å; A106-R163 WeakPolarHBondContact O-CA 3.32Å; V107-R163 HydrophobicContact CG2-CB 4.15Å; V107-R163 HydrophobicContact CG2-CG 4.15Å; V140-R163 WeakPolarHBondContact CA-O 3.27Å; H141-R163 PolarHBondContact N-O 3.22Å; H141-R163 PolarHBondContact O-N 3.36Å; V143-R163 HydrophobicContact CG2-CB 3.72Å; R163-E165 HydrophobicContact CG-CG 4.48Å; R163-E165 IonicContact CZ-OE1 3.53Å; R163-E165 VanDerWaalsContact CZ-OE1 3.24Å; R163-E165 IonicContact CZ-OE2 3.79Å; R163-E165 IonicContact NE-OE1 2.7Å; R163-E165 PolarHBondContact NE-OE1 3.01Å; R163-E165 IonicContact NE-OE2 2.85Å; R163-E165 IonicContact NH2-OE1 3.51Å; R163-E165 PolarHBondContact NH2-OE1 2.75Å; R163-E165 IonicContact NH2-OE2 3.51Å; R163-E165 PolarHBondContact NH2-OE2 3.3Å
164	I	96.7	Very high	93.3	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	129.1	179.9	-58.1	-175.5	0	0	0	108.6	I93 L97 C105 A106 L108 A138 K139 V140 V162	I93-I164 HydrophobicContact CD1-CD1 3.35Å; L97-I164 HydrophobicContact CD2-CG2 4.06Å; C105-I164 CarbonylContact C-O 3.52Å; C105-I164 WeakPolarHBondContact CA-O 3.49Å; A106-I164 HydrophobicContact CB-CB 4.4Å; A106-I164 PolarHBondContact N-O 2.92Å; A106-I164 PolarHBondContact O-N 3.47Å; L108-I164 HydrophobicContact CD1-CD1 3.76Å; L108-I164 HydrophobicContact CD1-CG1 4.5Å; A138-I164 HydrophobicContact CB-CG2 3.55Å; K139-I164 WeakPolarHBondContact O-CA 3.32Å; V140-I164 HydrophobicContact CG1-CG1 4.22Å; V162-I164 HydrophobicContact CG1-CG1 4.06Å
165	E	96	Very high	93.5	Very high	52 Å²	52	55.9 Å²	55.9	24%	0.243	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	121.4	176.8	-71.6	172.4	-105.4	0	0	109	C105 A138 K139 R163	C105-E165 HydrophobicContact CB-CG 3.75Å; A138-E165 CarbonylContact C-O 3.54Å; A138-E165 WeakPolarHBondContact CA-O 3.44Å; A138-E165 VanDerWaalsContact CB-O 3.3Å; A138-E165 WeakPolarHBondContact CB-O 3.45Å; K139-E165 HydrophobicContact CB-CB 4.49Å; K139-E165 PolarHBondContact N-O 3.42Å; K139-E165 PolarHBondContact O-N 3.35Å; R163-E165 HydrophobicContact CG-CG 4.48Å; R163-E165 IonicContact CZ-OE1 3.53Å; R163-E165 VanDerWaalsContact CZ-OE1 3.24Å; R163-E165 IonicContact CZ-OE2 3.79Å; R163-E165 IonicContact NE-OE1 2.7Å; R163-E165 PolarHBondContact NE-OE1 3.01Å; R163-E165 IonicContact NE-OE2 2.85Å; R163-E165 IonicContact NH2-OE1 3.51Å; R163-E165 PolarHBondContact NH2-OE1 2.75Å; R163-E165 IonicContact NH2-OE2 3.51Å; R163-E165 PolarHBondContact NH2-OE2 3.3Å
166	L	95.8	Very high	93.8	Very high	22 Å²	22	60.5 Å²	60.5	12%	0.115	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	141.1	-179.1	-60.6	-176.2	0	0	0	110.6	L97 P102 F103 A138	L97-L166 HydrophobicContact CD2-CD2 3.93Å; P102-L166 HydrophobicContact CB-CD1 3.88Å; F103-L166 HydrophobicContact CD1-CD1 3.89Å; F103-L166 HydrophobicContact CD1-CG 4.4Å; F103-L166 HydrophobicContact CE1-CD1 3.61Å; F103-L166 HydrophobicContact CE1-CD2 4Å; F103-L166 HydrophobicContact CE1-CG 3.81Å; F103-L166 HydrophobicContact CE2-CG 4.16Å; F103-L166 HydrophobicContact CZ-CD1 4.03Å; F103-L166 HydrophobicContact CZ-CD2 3.76Å; F103-L166 HydrophobicContact CZ-CG 3.68Å; A138-L166 HydrophobicContact CB-CD2 4.35Å
167	K	95	Very high	94	Very high	74 Å²	74	51.3 Å²	51.3	32%	0.322	28%	0.279	S	S	.	.			trans	-72.5	129.6	168.8	-64.7	-174.4	-167.9	166.2	0	108.6	Q135 L136 L137 P169 P170	Q135-K167 WeakPolarHBondContact O-CE 3.44Å; Q135-K167 PolarHBondContact O-NZ 2.96Å; L136-K167 WeakPolarHBondContact O-CD 3.48Å; L136-K167 WeakPolarHBondContact O-CE 3.39Å; L136-K167 PolarHBondContact O-NZ 3.15Å; L137-K167 PolarHBondContact O-N 3.1Å; K167-P169 CarbonylContact C-O 3.54Å; K167-P169 CarbonylContact O-C 3.58Å; K167-P170 WeakPolarHBondContact O-CA 3.43Å
168	M	91.5	Very high	94.2	Very high	125 Å²	125	48.3 Å²	48.3	62%	0.616	26%	0.261	S	S	*	.	S	Bend	trans	-128.4	119.3	-177.6	-70.4	-62.6	-65.8	0	0	109.1	P102	P102-M168 HydrophobicContact CB-CE 4.18Å; P102-M168 HydrophobicContact CB-SD 3.72Å; P102-M168 HydrophobicContact CG-CE 3.55Å; P102-M168 HydrophobicContact CG-SD 3.79Å
169	P	92	Very high	94.2	Very high	113 Å²	113	47.7 Å²	47.7	73%	0.734	26%	0.257	S	S	*	.	S	Bend	cis	-64.6	156.9	-6.1	30.1	-35.5	0	0	0	112.2	K167	K167-P169 CarbonylContact C-O 3.54Å; K167-P169 CarbonylContact O-C 3.58Å
170	P	88.4	Confident	94.3	Very high	55 Å²	55	47.8 Å²	47.8	36%	0.357	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-62.7	150.8	170.5	28.5	-34.3	0	0	0	109.8	K167	K167-P170 WeakPolarHBondContact O-CA 3.43Å
171	P	91	Very high	94.5	Very high	31 Å²	31	47.8 Å²	47.8	20%	0.201	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-58.8	139.5	175.1	24.2	-31.9	0	0	0	109.9	L136 L137 V173	L136-P171 HydrophobicContact CD1-CB 4.29Å; L136-P171 HydrophobicContact CD1-CG 3.82Å; L136-P171 HydrophobicContact CG-CG 3.95Å; L137-P171 HydrophobicContact CD2-CG 4.19Å; P171-V173 PolarHBondContact O-N 2.95Å
172	P	91.7	Very high	94.6	Very high	146 Å²	146	47 Å²	47	95%	0.948	25%	0.254	S	S	*	.	S	Bend	trans	-77	57.1	-177.9	34.1	-37.2	0	0	0	111
173	V	93	Very high	94.7	Very high	33 Å²	33	52.5 Å²	52.5	20%	0.2	27%	0.274	C	S	.	.			trans	-118	137.5	-178.5	96	0	0	0	0	110	L136 P171 F175 W178 L254 L257	L136-V173 HydrophobicContact CD2-CG1 3.78Å; P171-V173 PolarHBondContact O-N 2.95Å; V173-F175 PolarHBondContact O-N 3.47Å; V173-F175 VanDerWaalsContact O-N 3.13Å; V173-W178 HydrophobicContact CG1-CB 4.25Å; V173-W178 HydrophobicContact CG2-CE3 4.44Å; V173-L254 HydrophobicContact CB-CD2 4.26Å; V173-L254 HydrophobicContact CG2-CD2 3.74Å; V173-L257 HydrophobicContact CG2-CD2 3.66Å
174	N	93.4	Very high	94.7	Very high	92 Å²	92	51.7 Å²	51.7	49%	0.492	27%	0.272	S	S	.	.			trans	-68.5	110.2	168.5	-179.3	-27.1	0	0	0	108.6	K176 E177 W178	N174-K176 PolarHBondContact O-N 3.38Å; N174-K176 VanDerWaalsContact OD1-CB 3.32Å; N174-K176 WeakPolarHBondContact OD1-CB 3.29Å; N174-K176 PolarHBondContact OD1-N 3.46Å; N174-E177 HydrophobicContact CB-CB 4.01Å; N174-E177 HydrophobicContact CB-CG 3.96Å; N174-E177 WeakPolarHBondContact O-CB 3.23Å; N174-E177 PolarHBondContact O-N 3.29Å; N174-E177 PolarHBondContact OD1-N 2.9Å; N174-W178 WeakPolarHBondContact O-CB 3.42Å; N174-W178 PolarHBondContact O-N 3.25Å
175	F	93.2	Very high	94.8	Very high	38 Å²	38	51.8 Å²	51.8	17%	0.167	27%	0.273	C	S	.	.	H	α-helix	trans	-64.9	-27	-175.8	-170.3	-100.4	0	0	0	113.2	F94 L98 N133 L136 L137 V173 D179	F94-F175 HydrophobicContact CD1-CE1 4.39Å; F94-F175 HydrophobicContact CD1-CZ 4.14Å; F94-F175 HydrophobicContact CE1-CZ 4.14Å; L98-F175 HydrophobicContact CD1-CD1 4.28Å; L98-F175 HydrophobicContact CD1-CE1 4.43Å; L98-F175 HydrophobicContact CD2-CD1 4.26Å; L98-F175 HydrophobicContact CD2-CG 4.28Å; N133-F175 HydrophobicContact CB-CE2 4.41Å; N133-F175 HydrophobicContact CB-CZ 4.24Å; L136-F175 HydrophobicContact CD2-CD2 4.24Å; L136-F175 HydrophobicContact CD2-CE2 4.43Å; L137-F175 HydrophobicContact CD1-CD2 3.79Å; L137-F175 HydrophobicContact CD1-CE2 3.56Å; L137-F175 HydrophobicContact CD1-CZ 4.23Å; L137-F175 HydrophobicContact CD2-CD2 4.37Å; L137-F175 HydrophobicContact CG-CD2 4.29Å; L137-F175 HydrophobicContact CG-CE2 4.14Å; V173-F175 PolarHBondContact O-N 3.47Å; V173-F175 VanDerWaalsContact O-N 3.13Å; F175-D179 HydrophobicContact CE1-CB 4.43Å; F175-D179 WeakPolarHBondContact O-CB 3.42Å; F175-D179 PolarHBondContact O-N 2.87Å
176	K	94	Very high	94.9	Very high	128 Å²	128	50.5 Å²	50.5	56%	0.557	27%	0.266	S	S	*	.	H	α-helix	trans	-70	-43.7	177.4	-164.2	-169	168.4	-147.5	0	110.8	N174 G180 C268	N174-K176 PolarHBondContact O-N 3.38Å; N174-K176 VanDerWaalsContact OD1-CB 3.32Å; N174-K176 WeakPolarHBondContact OD1-CB 3.29Å; N174-K176 PolarHBondContact OD1-N 3.46Å; K176-G180 PolarHBondContact O-N 3.42Å; K176-C268 HydrophobicContact CB-CB 4.21Å; K176-C268 HydrophobicContact CD-CB 3.69Å; K176-C268 HydrophobicContact CG-CB 3.71Å; K176-C268 PolarHBondContact NZ-OXT 3.47Å
177	E	96.2	Very high	94.9	Very high	13 Å²	13	54.6 Å²	54.6	6%	0.061	29%	0.288	C	S	.	.	H	α-helix	trans	-59.6	-50.1	171.7	-75.9	-70.6	173	0	0	111.1	N174 D179 G180 L181 L257 H266 F267 C268	N174-E177 HydrophobicContact CB-CB 4.01Å; N174-E177 HydrophobicContact CB-CG 3.96Å; N174-E177 WeakPolarHBondContact O-CB 3.23Å; N174-E177 PolarHBondContact O-N 3.29Å; N174-E177 PolarHBondContact OD1-N 2.9Å; E177-D179 PolarHBondContact O-N 3.29Å; E177-G180 PolarHBondContact O-N 3.3Å; E177-G180 VanDerWaalsContact O-N 3.16Å; E177-L181 PolarHBondContact O-N 3.12Å; E177-L257 HydrophobicContact CB-CD1 4.43Å; E177-H266 WeakPolarHBondContact OE1-CB 3.17Å; E177-H266 IonicContact OE1-CG 2.67Å; E177-H266 IonicContact OE1-ND1 3.87Å; E177-H266 PolarHBondContact OE1-ND1 3.43Å; E177-F267 WeakPolarHBondContact OE2-CA 3.28Å; E177-F267 WeakPolarHBondContact OE2-CB 3.45Å; E177-F267 PolarHBondContact OE2-N 3.11Å; E177-C268 VanDerWaalsContact CD-SG 3.56Å; E177-C268 HydrophobicContact CG-CB 4.33Å; E177-C268 PolarHBondContact OE1-SG 2.91Å
178	W	97.2	Very high	94.9	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-56.8	-49.8	177.6	173.1	-87	0	0	0	113.3	V132 N133 L136 V173 N174 G180 L181 T182 E250 F253 L254 L257	V132-W178 HydrophobicContact CG2-CZ2 3.91Å; N133-W178 PolarHBondContact OD1-NE1 2.81Å; L136-W178 HydrophobicContact CB-CZ2 3.99Å; L136-W178 HydrophobicContact CD1-CH2 3.95Å; L136-W178 HydrophobicContact CD1-CZ2 4.1Å; L136-W178 HydrophobicContact CD1-CZ3 4.23Å; L136-W178 HydrophobicContact CD2-CD2 3.6Å; L136-W178 VanDerWaalsContact CD2-CE2 3.48Å; L136-W178 HydrophobicContact CD2-CE3 4.18Å; L136-W178 HydrophobicContact CD2-CG 3.79Å; L136-W178 HydrophobicContact CD2-CH2 4.42Å; L136-W178 HydrophobicContact CD2-CZ2 3.91Å; L136-W178 HydrophobicContact CG-CZ2 4.19Å; V173-W178 HydrophobicContact CG1-CB 4.25Å; V173-W178 HydrophobicContact CG2-CE3 4.44Å; N174-W178 WeakPolarHBondContact O-CB 3.42Å; N174-W178 PolarHBondContact O-N 3.25Å; W178-G180 VanDerWaalsContact C-N 3.27Å; W178-G180 PolarHBondContact O-N 3.18Å; W178-L181 PolarHBondContact O-N 3.41Å; W178-T182 HydrophobicContact CD2-CG2 4.28Å; W178-T182 HydrophobicContact CZ2-CG2 4.14Å; W178-T182 WeakPolarHBondContact O-CG2 3.48Å; W178-T182 PolarHBondContact O-N 2.82Å; W178-T182 PolarHBondContact O-OG1 3.34Å; W178-E250 HydrophobicContact CH2-CB 4.25Å; W178-E250 WeakPolarHBondContact CH2-O 3.28Å; W178-F253 HydrophobicContact CH2-CB 3.37Å; W178-F253 HydrophobicContact CH2-CG 4.4Å; W178-F253 HydrophobicContact CZ2-CB 4.12Å; W178-F253 HydrophobicContact CZ3-CB 3.59Å; W178-L254 HydrophobicContact CE3-CD2 4.06Å; W178-L254 HydrophobicContact CH2-CG 4.36Å; W178-L254 HydrophobicContact CZ3-CB 4.47Å; W178-L254 HydrophobicContact CZ3-CD2 3.62Å; W178-L254 HydrophobicContact CZ3-CG 3.72Å; W178-L257 HydrophobicContact CE3-CD2 4.41Å
179	D	95.7	Very high	95.1	Very high	34 Å²	34	53.4 Å²	53.4	18%	0.182	28%	0.276	C	S	.	.	H	α-helix	trans	-66.3	-33	178.8	-171.9	58.8	0	0	0	111.2	R129 N133 F175 E177 T182 R183	R129-D179 IonicContact CZ-OD1 3.1Å; R129-D179 IonicContact NE-OD1 2.73Å; R129-D179 VanDerWaalsContact NH1-CG 3.27Å; R129-D179 IonicContact NH1-OD1 3.04Å; R129-D179 PolarHBondContact NH1-OD1 3.43Å; R129-D179 IonicContact NH1-OD2 3.5Å; R129-D179 PolarHBondContact NH1-OD2 3.39Å; N133-D179 PolarHBondContact ND2-OD1 3.4Å; F175-D179 HydrophobicContact CE1-CB 4.43Å; F175-D179 WeakPolarHBondContact O-CB 3.42Å; F175-D179 PolarHBondContact O-N 2.87Å; E177-D179 PolarHBondContact O-N 3.29Å; D179-T182 WeakPolarHBondContact CA-OG1 3.37Å; D179-T182 PolarHBondContact O-OG1 3.47Å; D179-R183 WeakPolarHBondContact O-CB 3.21Å; D179-R183 PolarHBondContact O-N 2.94Å
180	G	97.1	Very high	95.4	Very high	2 Å²	2	52.2 Å²	52.2	2%	0.021	26%	0.263	C	S	.	.	H	α-helix	trans	-59.4	-51.7	172.9	0	0	0	0	0	112.4	K176 E177 W178 L184	K176-G180 PolarHBondContact O-N 3.42Å; E177-G180 PolarHBondContact O-N 3.3Å; E177-G180 VanDerWaalsContact O-N 3.16Å; W178-G180 VanDerWaalsContact C-N 3.27Å; W178-G180 PolarHBondContact O-N 3.18Å; G180-L184 WeakPolarHBondContact O-CG 3.3Å; G180-L184 PolarHBondContact O-N 3.5Å
181	L	98.1	Very high	95.9	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60.1	-54.3	177	172.9	67.8	0	0	0	111.6	E177 W178 R183 L184 A185 F197 F253 L256 L257 F260 F267	E177-L181 PolarHBondContact O-N 3.12Å; W178-L181 PolarHBondContact O-N 3.41Å; L181-R183 VanDerWaalsContact C-N 3.3Å; L181-R183 PolarHBondContact O-N 3.27Å; L181-L184 PolarHBondContact O-N 3.44Å; L181-L184 VanDerWaalsContact O-N 3.15Å; L181-A185 PolarHBondContact O-N 2.88Å; L181-F197 HydrophobicContact CD1-CE1 4.45Å; L181-F197 HydrophobicContact CD1-CZ 3.73Å; L181-F253 HydrophobicContact CD2-CD1 4.2Å; L181-F253 HydrophobicContact CG-CD1 4.45Å; L181-L256 HydrophobicContact CD1-CD2 3.81Å; L181-L256 HydrophobicContact CD1-CG 4.06Å; L181-L256 HydrophobicContact CD2-CB 4.33Å; L181-L256 HydrophobicContact CD2-CD2 4.16Å; L181-L256 HydrophobicContact CD2-CG 4.11Å; L181-L256 HydrophobicContact CG-CD2 4.34Å; L181-L257 HydrophobicContact CB-CD1 4.41Å; L181-L257 HydrophobicContact CD2-CB 3.72Å; L181-L257 HydrophobicContact CD2-CD1 4.12Å; L181-L257 HydrophobicContact CD2-CG 4.46Å; L181-F260 HydrophobicContact CD1-CD2 4.32Å; L181-F260 HydrophobicContact CD1-CE2 4.37Å; L181-F267 HydrophobicContact CB-CD1 4.11Å; L181-F267 HydrophobicContact CB-CD2 3.83Å; L181-F267 HydrophobicContact CB-CE1 4.25Å; L181-F267 HydrophobicContact CB-CE2 3.99Å; L181-F267 HydrophobicContact CB-CG 3.9Å; L181-F267 HydrophobicContact CB-CZ 4.2Å; L181-F267 HydrophobicContact CD1-CD1 4.35Å; L181-F267 HydrophobicContact CD1-CD2 4.43Å; L181-F267 HydrophobicContact CD1-CE1 3.65Å; L181-F267 HydrophobicContact CD1-CE2 3.75Å; L181-F267 HydrophobicContact CD1-CZ 3.31Å; L181-F267 HydrophobicContact CG-CE2 4.31Å; L181-F267 HydrophobicContact CG-CZ 4.29Å
182	T	97.7	Very high	96.2	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-65.2	-34.2	-176.5	56.8	0	0	0	0	111.6	V132 N133 W178 D179 L184 A185 F186 F253	V132-T182 HydrophobicContact CG1-CG2 3.96Å; N133-T182 PolarHBondContact OD1-OG1 2.72Å; W178-T182 HydrophobicContact CD2-CG2 4.28Å; W178-T182 HydrophobicContact CZ2-CG2 4.14Å; W178-T182 WeakPolarHBondContact O-CG2 3.48Å; W178-T182 PolarHBondContact O-N 2.82Å; W178-T182 PolarHBondContact O-OG1 3.34Å; D179-T182 WeakPolarHBondContact CA-OG1 3.37Å; D179-T182 PolarHBondContact O-OG1 3.47Å; T182-L184 VanDerWaalsContact C-N 3.33Å; T182-L184 PolarHBondContact O-N 2.91Å; T182-A185 PolarHBondContact O-N 2.93Å; T182-F186 WeakPolarHBondContact O-CB 3.37Å; T182-F186 VanDerWaalsContact O-CD2 3.29Å; T182-F186 WeakPolarHBondContact O-CD2 3.43Å; T182-F186 PolarHBondContact O-N 3.22Å; T182-F253 HydrophobicContact CG2-CD1 3.98Å; T182-F253 HydrophobicContact CG2-CE1 4.26Å; T182-F253 HydrophobicContact CG2-CG 4.19Å
183	R	97.5	Very high	96.5	Very high	115 Å²	115	46.8 Å²	46.8	43%	0.434	22%	0.218	S	C	.	.	H	α-helix	trans	-56.1	-46.9	172.4	-178.6	178.3	70	-143	1.6	111.6	D179 L181 L187	D179-R183 WeakPolarHBondContact O-CB 3.21Å; D179-R183 PolarHBondContact O-N 2.94Å; L181-R183 VanDerWaalsContact C-N 3.3Å; L181-R183 PolarHBondContact O-N 3.27Å; R183-L187 PolarHBondContact O-N 2.92Å
184	L	97.8	Very high	96.8	Very high	13 Å²	13	45.5 Å²	45.5	7%	0.068	21%	0.211	C	C	.	.	H	α-helix	trans	-66.2	-49	178.5	-63.7	173.9	0	0	0	111.1	G180 L181 T182 F186 L187 T196 F197 V202 L205 F267	G180-L184 WeakPolarHBondContact O-CG 3.3Å; G180-L184 PolarHBondContact O-N 3.5Å; L181-L184 PolarHBondContact O-N 3.44Å; L181-L184 VanDerWaalsContact O-N 3.15Å; T182-L184 VanDerWaalsContact C-N 3.33Å; T182-L184 PolarHBondContact O-N 2.91Å; L184-F186 VanDerWaalsContact C-N 3.32Å; L184-F186 PolarHBondContact O-N 3.49Å; L184-L187 HydrophobicContact CD2-CD1 4.34Å; L184-L187 WeakPolarHBondContact O-CB 3.14Å; L184-L187 WeakPolarHBondContact O-CG 3.37Å; L184-L187 PolarHBondContact O-N 2.9Å; L184-T196 VanDerWaalsContact O-CG2 3.22Å; L184-T196 WeakPolarHBondContact O-CG2 3.44Å; L184-F197 HydrophobicContact CB-CE1 4.06Å; L184-F197 HydrophobicContact CB-CZ 4.2Å; L184-F197 HydrophobicContact CD1-CE1 3.91Å; L184-V202 HydrophobicContact CD1-CG1 3.98Å; L184-V202 HydrophobicContact CD2-CG1 4.32Å; L184-V202 HydrophobicContact CD2-CG2 4.17Å; L184-L205 HydrophobicContact CD1-CD2 4.25Å; L184-L205 HydrophobicContact CD2-CD2 4.28Å; L184-F267 HydrophobicContact CD1-CD1 3.72Å; L184-F267 HydrophobicContact CD1-CE1 3.93Å
185	A	97.9	Very high	97	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.008	21%	0.206	C	C	.	.	H	α-helix	trans	-61.1	-37.5	-177.7	0	0	0	0	0	113.1	L181 T182 L193 A245 F253	L181-A185 PolarHBondContact O-N 2.88Å; T182-A185 PolarHBondContact O-N 2.93Å; A185-L193 HydrophobicContact CB-CD2 3.99Å; A185-A245 HydrophobicContact CB-CB 4.04Å; A185-A245 WeakPolarHBondContact O-CB 3.17Å; A185-F253 HydrophobicContact CB-CE1 3.59Å; A185-F253 HydrophobicContact CB-CZ 4.07Å
186	F	98	Very high	97.2	Very high	26 Å²	26	42 Å²	42	11%	0.114	20%	0.199	C	C	.	.	H	α-helix	trans	-84.5	-2.9	-179.6	-79.6	-83.2	0	0	0	114.7	Y127 C128 R129 V132 T182 L184 R188 K189 A245 F253	Y127-F186 HydrophobicContact CD1-CE1 4.08Å; Y127-F186 HydrophobicContact CD1-CZ 4.19Å; Y127-F186 HydrophobicContact CE1-CE1 4.07Å; Y127-F186 AromaticContact CE1-CZ 3.7Å; Y127-F186 HydrophobicContact CE1-CZ 3.7Å; C128-F186 VanDerWaalsContact C-CE1 3.5Å; R129-F186 HydrophobicContact CB-CB 4.09Å; R129-F186 HydrophobicContact CB-CD2 4.05Å; R129-F186 HydrophobicContact CB-CG 4.03Å; V132-F186 HydrophobicContact CB-CE2 4.41Å; V132-F186 HydrophobicContact CG1-CE2 3.74Å; V132-F186 HydrophobicContact CG1-CZ 4.26Å; T182-F186 WeakPolarHBondContact O-CB 3.37Å; T182-F186 VanDerWaalsContact O-CD2 3.29Å; T182-F186 WeakPolarHBondContact O-CD2 3.43Å; T182-F186 PolarHBondContact O-N 3.22Å; L184-F186 VanDerWaalsContact C-N 3.32Å; L184-F186 PolarHBondContact O-N 3.49Å; F186-R188 PolarHBondContact O-N 3.27Å; F186-K189 HydrophobicContact CD1-CB 3.85Å; F186-K189 HydrophobicContact CE1-CB 4.35Å; F186-A245 HydrophobicContact CD1-CB 4.29Å; F186-A245 HydrophobicContact CD2-CB 4.38Å; F186-A245 HydrophobicContact CE1-CB 4.23Å; F186-A245 HydrophobicContact CE2-CB 4.31Å; F186-A245 HydrophobicContact CG-CB 4.36Å; F186-A245 HydrophobicContact CZ-CB 4.24Å; F186-F253 HydrophobicContact CD2-CZ 4.23Å; F186-F253 HydrophobicContact CE2-CE1 4.45Å; F186-F253 AromaticContact CE2-CE2 3.68Å; F186-F253 HydrophobicContact CE2-CE2 3.68Å; F186-F253 AromaticContact CE2-CZ 3.51Å; F186-F253 HydrophobicContact CE2-CZ 3.51Å; F186-F253 HydrophobicContact CZ-CE2 4.03Å; F186-F253 HydrophobicContact CZ-CZ 4.12Å
187	L	95.5	Very high	97.3	Very high	108 Å²	108	36 Å²	36	57%	0.565	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-42	173.8	-77.4	173.2	0	0	0	112	R183 L184	R183-L187 PolarHBondContact O-N 2.92Å; L184-L187 HydrophobicContact CD2-CD1 4.34Å; L184-L187 WeakPolarHBondContact O-CB 3.14Å; L184-L187 WeakPolarHBondContact O-CG 3.37Å; L184-L187 PolarHBondContact O-N 2.9Å
188	R	95.2	Very high	97.4	Very high	122 Å²	122	36.5 Å²	36.5	46%	0.46	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-137.3	73.2	172.6	-64.9	-172.1	78.7	-179.1	12	109.6	F186 N190 K191	F186-R188 PolarHBondContact O-N 3.27Å; R188-N190 PolarHBondContact O-N 2.84Å; R188-K191 HydrophobicContact CB-CB 4.01Å; R188-K191 HydrophobicContact CB-CG 3.94Å; R188-K191 PolarHBondContact O-N 2.86Å
189	K	97	Very high	97.3	Very high	52 Å²	52	40.8 Å²	40.8	23%	0.226	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.7	-23.1	-174.3	73.5	179.8	-171.2	177.2	0	116.6	K125 Y127 F186 A245 R246	K125-K189 PolarHBondContact O-NZ 2.88Å; Y127-K189 WeakPolarHBondContact O-CD 3.42Å; Y127-K189 PolarHBondContact O-NZ 3.16Å; F186-K189 HydrophobicContact CD1-CB 3.85Å; F186-K189 HydrophobicContact CE1-CB 4.35Å; K189-A245 HydrophobicContact CB-CB 4.44Å; K189-R246 HydrophobicContact CB-CB 4.19Å; K189-R246 HydrophobicContact CD-CB 4.4Å; K189-R246 HydrophobicContact CG-CB 4.17Å; K189-R246 VanDerWaalsContact O-CB 3.31Å; K189-R246 WeakPolarHBondContact O-CB 3.35Å; K189-R246 PolarHBondContact O-N 2.99Å
190	N	97.9	Very high	97.4	Very high	88 Å²	88	46.7 Å²	46.7	47%	0.471	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-8.1	178.9	-63	-46.7	0	0	0	114.3	R188 R244 R246	R188-N190 PolarHBondContact O-N 2.84Å; N190-R244 VanDerWaalsContact O-CD 3.28Å; N190-R244 WeakPolarHBondContact O-CD 3.31Å; N190-R244 PolarHBondContact O-NE 3.09Å; N190-R246 WeakPolarHBondContact OD1-CD 3.48Å; N190-R246 PolarHBondContact OD1-NH1 3.43Å
191	K	98	Very high	97.4	Very high	94 Å²	94	55.3 Å²	55.3	41%	0.409	26%	0.261	S	S	.	.	S	Bend	trans	-92.7	156.8	173.8	-67.4	-61.5	-174.1	178.6	0	109.8	R188	R188-K191 HydrophobicContact CB-CB 4.01Å; R188-K191 HydrophobicContact CB-CG 3.94Å; R188-K191 PolarHBondContact O-N 2.86Å
192	T	98.4	Very high	97.3	Very high	23 Å²	23	55.6 Å²	55.6	14%	0.141	26%	0.262	C	S	.	.	B	Isolated β-bridge	trans	-66.1	154.6	178.5	59.4	0	0	0	0	110.4	G194 S195 T196 Q241 R243 R244	T192-G194 VanDerWaalsContact C-N 3.31Å; T192-S195 PolarHBondContact O-N 3.36Å; T192-S195 WeakPolarHBondContact OG1-CB 3.4Å; T192-S195 PolarHBondContact OG1-N 2.96Å; T192-T196 PolarHBondContact O-N 3.19Å; T192-T196 VanDerWaalsContact O-N 3.08Å; T192-T196 PolarHBondContact O-OG1 2.86Å; T192-Q241 WeakPolarHBondContact CB-O 3.44Å; T192-R243 CarbonylContact C-O 3.56Å; T192-R243 VanDerWaalsContact CA-O 3.26Å; T192-R243 WeakPolarHBondContact CA-O 2.99Å; T192-R244 HydrophobicContact CG2-CG 4.4Å
193	L	98.3	Very high	97.3	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-64.1	-39.1	176.3	-68	-173.4	0	0	0	111	A185 S195 T196 F197 L235 F240 Q241 R243 M248 L256	A185-L193 HydrophobicContact CB-CD2 3.99Å; L193-S195 VanDerWaalsContact C-N 3.29Å; L193-S195 PolarHBondContact O-N 2.96Å; L193-T196 WeakPolarHBondContact O-CA 3.39Å; L193-T196 PolarHBondContact O-N 3.27Å; L193-F197 HydrophobicContact CB-CD2 4.11Å; L193-F197 HydrophobicContact CB-CE2 4.38Å; L193-F197 HydrophobicContact CD2-CE2 4.08Å; L193-F197 WeakPolarHBondContact O-CD2 3.49Å; L193-F197 PolarHBondContact O-N 2.96Å; L193-L235 HydrophobicContact CB-CD2 4.22Å; L193-F240 WeakPolarHBondContact CB-O 3.46Å; L193-F240 HydrophobicContact CD1-CB 4.02Å; L193-F240 HydrophobicContact CD1-CD1 4.34Å; L193-Q241 PolarHBondContact N-O 3.22Å; L193-R243 PolarHBondContact N-O 3.02Å; L193-M248 HydrophobicContact CD1-CE 3.92Å; L193-M248 HydrophobicContact CD1-SD 3.63Å; L193-M248 HydrophobicContact CG-SD 4.26Å; L193-L256 HydrophobicContact CD1-CD1 4.37Å; L193-L256 HydrophobicContact CD1-CD2 3.62Å
194	G	98	Very high	97.3	Very high	5 Å²	5	55 Å²	55	5%	0.052	27%	0.268	C	S	.	.	H	α-helix	trans	-56.1	-42.5	172.8	0	0	0	0	0	112.5	T192 T196 G198 M232 Q241	T192-G194 VanDerWaalsContact C-N 3.31Å; G194-T196 VanDerWaalsContact C-N 3.3Å; G194-T196 PolarHBondContact O-N 3.49Å; G194-G198 WeakPolarHBondContact O-CA 3.48Å; G194-G198 PolarHBondContact O-N 3.33Å; G194-M232 WeakPolarHBondContact O-CE 3.35Å; G194-Q241 PolarHBondContact N-O 2.78Å
195	S	97.8	Very high	97.3	Very high	54 Å²	54	57 Å²	57	38%	0.378	28%	0.279	S	S	.	.	H	α-helix	trans	-66.6	-30.7	174.8	179.8	0	0	0	0	113.3	T192 L193	T192-S195 PolarHBondContact O-N 3.36Å; T192-S195 WeakPolarHBondContact OG1-CB 3.4Å; T192-S195 PolarHBondContact OG1-N 2.96Å; L193-S195 VanDerWaalsContact C-N 3.29Å; L193-S195 PolarHBondContact O-N 2.96Å
196	T	97.5	Very high	97.3	Very high	4 Å²	4	57 Å²	57	3%	0.025	28%	0.278	C	S	.	.	H	α-helix	trans	-79.9	-49.9	-177.6	-60.2	0	0	0	0	111.3	L184 T192 L193 G194 K199	L184-T196 VanDerWaalsContact O-CG2 3.22Å; L184-T196 WeakPolarHBondContact O-CG2 3.44Å; T192-T196 PolarHBondContact O-N 3.19Å; T192-T196 VanDerWaalsContact O-N 3.08Å; T192-T196 PolarHBondContact O-OG1 2.86Å; L193-T196 WeakPolarHBondContact O-CA 3.39Å; L193-T196 PolarHBondContact O-N 3.27Å; G194-T196 VanDerWaalsContact C-N 3.3Å; G194-T196 PolarHBondContact O-N 3.49Å; T196-K199 WeakPolarHBondContact O-CB 3.45Å; T196-K199 PolarHBondContact O-N 3.14Å
197	F	97.5	Very high	97.2	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-77.2	-21.8	-179.7	-74.6	-74.2	0	0	0	113.3	L181 L184 L193 K199 V202 L203 L206 V231 L235 F260 F267	L181-F197 HydrophobicContact CD1-CE1 4.45Å; L181-F197 HydrophobicContact CD1-CZ 3.73Å; L184-F197 HydrophobicContact CB-CE1 4.06Å; L184-F197 HydrophobicContact CB-CZ 4.2Å; L184-F197 HydrophobicContact CD1-CE1 3.91Å; L193-F197 HydrophobicContact CB-CD2 4.11Å; L193-F197 HydrophobicContact CB-CE2 4.38Å; L193-F197 HydrophobicContact CD2-CE2 4.08Å; L193-F197 WeakPolarHBondContact O-CD2 3.49Å; L193-F197 PolarHBondContact O-N 2.96Å; F197-K199 PolarHBondContact O-N 3.14Å; F197-V202 HydrophobicContact CD1-CG1 3.61Å; F197-V202 HydrophobicContact CE1-CG1 4.15Å; F197-V202 HydrophobicContact CG-CG1 4.47Å; F197-L203 VanDerWaalsContact O-CD2 3.23Å; F197-L203 WeakPolarHBondContact O-CD2 3.29Å; F197-L203 WeakPolarHBondContact O-CG 3.28Å; F197-L206 HydrophobicContact CD1-CD1 3.96Å; F197-L206 HydrophobicContact CE1-CD1 4.45Å; F197-V231 HydrophobicContact CB-CG1 3.84Å; F197-L235 HydrophobicContact CB-CD1 3.92Å; F197-L235 HydrophobicContact CD2-CD1 4.14Å; F197-L235 HydrophobicContact CD2-CD2 4.27Å; F197-L235 HydrophobicContact CG-CD1 4.34Å; F197-F260 HydrophobicContact CD1-CZ 4.17Å; F197-F260 HydrophobicContact CD2-CZ 4.48Å; F197-F260 HydrophobicContact CE1-CE2 4.47Å; F197-F260 HydrophobicContact CE1-CZ 4.33Å; F197-F260 HydrophobicContact CE2-CE2 4.43Å; F197-F260 HydrophobicContact CG-CZ 4.28Å; F197-F260 HydrophobicContact CZ-CE2 4.32Å; F197-F267 AromaticContact CE1-CE1 3.84Å; F197-F267 HydrophobicContact CE1-CE1 3.84Å; F197-F267 HydrophobicContact CE1-CZ 4.45Å; F197-F267 HydrophobicContact CZ-CE1 4.35Å
198	G	96.8	Very high	97.3	Very high	24 Å²	24	59 Å²	59	25%	0.247	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-1.9	171.8	0	0	0	0	0	114.9	G194	G194-G198 WeakPolarHBondContact O-CA 3.48Å; G194-G198 PolarHBondContact O-N 3.33Å
199	K	96.5	Very high	97.4	Very high	90 Å²	90	54.3 Å²	54.3	39%	0.391	27%	0.268	S	S	.	.	S	Bend	trans	-74	135.3	176.7	-74.9	-173.5	172.2	-171.2	0	110.8	T196 F197 K201 V202 L203	T196-K199 WeakPolarHBondContact O-CB 3.45Å; T196-K199 PolarHBondContact O-N 3.14Å; F197-K199 PolarHBondContact O-N 3.14Å; K199-K201 PolarHBondContact O-N 3.4Å; K199-V202 HydrophobicContact CB-CG2 4.18Å; K199-V202 WeakPolarHBondContact O-CA 3.03Å; K199-V202 WeakPolarHBondContact O-CB 3.44Å; K199-V202 PolarHBondContact O-N 2.97Å; K199-L203 PolarHBondContact O-N 3.32Å
200	K	96.9	Very high	97.4	Very high	159 Å²	159	53.7 Å²	53.7	69%	0.691	26%	0.264	S	S	*	.	H	α-helix	trans	-43.7	-55.9	178.6	-173.9	173.8	-179.5	177.4	0	113.5	V202 L203 D204	K200-V202 PolarHBondContact O-N 3.43Å; K200-V202 VanDerWaalsContact O-N 3.11Å; K200-L203 WeakPolarHBondContact O-CB 3.41Å; K200-L203 PolarHBondContact O-N 3.06Å; K200-L203 VanDerWaalsContact O-N 3.08Å; K200-D204 PolarHBondContact O-N 2.88Å
201	K	96.3	Very high	97.4	Very high	183 Å²	183	55.1 Å²	55.1	80%	0.796	26%	0.263	S	S	*	.	H	α-helix	trans	-57.5	-30.4	179.7	-68.3	-171.3	176.6	-174.1	0	114.7	K199 L205	K199-K201 PolarHBondContact O-N 3.4Å; K201-L205 PolarHBondContact O-N 2.99Å
202	V	97	Very high	97.3	Very high	5 Å²	5	54.6 Å²	54.6	3%	0.03	27%	0.268	C	S	.	.	H	α-helix	trans	-79.7	-42.7	178.3	-178.9	0	0	0	0	110	L184 F197 K199 K200 L205 L206	L184-V202 HydrophobicContact CD1-CG1 3.98Å; L184-V202 HydrophobicContact CD2-CG1 4.32Å; L184-V202 HydrophobicContact CD2-CG2 4.17Å; F197-V202 HydrophobicContact CD1-CG1 3.61Å; F197-V202 HydrophobicContact CE1-CG1 4.15Å; F197-V202 HydrophobicContact CG-CG1 4.47Å; K199-V202 HydrophobicContact CB-CG2 4.18Å; K199-V202 WeakPolarHBondContact O-CA 3.03Å; K199-V202 WeakPolarHBondContact O-CB 3.44Å; K199-V202 PolarHBondContact O-N 2.97Å; K200-V202 PolarHBondContact O-N 3.43Å; K200-V202 VanDerWaalsContact O-N 3.11Å; V202-L205 PolarHBondContact O-N 3.31Å; V202-L206 HydrophobicContact CG1-CD1 4.17Å; V202-L206 WeakPolarHBondContact O-CG 3.31Å; V202-L206 PolarHBondContact O-N 3.3Å
203	L	97.9	Very high	97.2	Very high	15 Å²	15	55.3 Å²	55.3	8%	0.079	27%	0.27	C	S	.	.	H	α-helix	trans	-60.2	-44.2	173.9	-65.9	171.8	0	0	0	111.7	F197 K199 K200 L205 L206 D207 V227 K228 V231	F197-L203 VanDerWaalsContact O-CD2 3.23Å; F197-L203 WeakPolarHBondContact O-CD2 3.29Å; F197-L203 WeakPolarHBondContact O-CG 3.28Å; K199-L203 PolarHBondContact O-N 3.32Å; K200-L203 WeakPolarHBondContact O-CB 3.41Å; K200-L203 PolarHBondContact O-N 3.06Å; K200-L203 VanDerWaalsContact O-N 3.08Å; L203-L205 VanDerWaalsContact C-N 3.29Å; L203-L205 PolarHBondContact O-N 2.88Å; L203-L206 PolarHBondContact O-N 2.93Å; L203-D207 WeakPolarHBondContact O-CB 3.16Å; L203-D207 PolarHBondContact O-N 2.82Å; L203-V227 HydrophobicContact CB-CG1 4.21Å; L203-K228 HydrophobicContact CD1-CB 3.85Å; L203-K228 HydrophobicContact CD1-CD 4.21Å; L203-K228 HydrophobicContact CD1-CG 3.86Å; L203-K228 HydrophobicContact CD2-CB 4.21Å; L203-K228 HydrophobicContact CD2-CG 4.44Å; L203-V231 HydrophobicContact CD2-CB 4.1Å; L203-V231 HydrophobicContact CD2-CG1 4.14Å; L203-V231 HydrophobicContact CD2-CG2 4.18Å
204	D	97.6	Very high	97.1	Very high	87 Å²	87	55.3 Å²	55.3	47%	0.465	27%	0.27	S	S	.	.	H	α-helix	trans	-60.4	-39.5	178.5	-59.5	-21.3	0	0	0	111.5	K200 K208	K200-D204 PolarHBondContact O-N 2.88Å; D204-K208 WeakPolarHBondContact O-CB 2.99Å; D204-K208 PolarHBondContact O-N 2.85Å; D204-K208 VanDerWaalsContact O-N 3.13Å
205	L	97.1	Very high	97	Very high	57 Å²	57	59.5 Å²	59.5	30%	0.298	30%	0.298	S	S	.	.	H	α-helix	trans	-65.1	-47.2	175.4	174	66.4	0	0	0	111.4	L184 K201 V202 L203 K208 N209	L184-L205 HydrophobicContact CD1-CD2 4.25Å; L184-L205 HydrophobicContact CD2-CD2 4.28Å; K201-L205 PolarHBondContact O-N 2.99Å; V202-L205 PolarHBondContact O-N 3.31Å; L203-L205 VanDerWaalsContact C-N 3.29Å; L203-L205 PolarHBondContact O-N 2.88Å; L205-K208 PolarHBondContact O-N 3.3Å; L205-N209 PolarHBondContact O-N 3.16Å; L205-N209 VanDerWaalsContact O-N 3.11Å
206	L	97.5	Very high	96.9	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-68.8	-37.9	-178.7	-69	176.5	0	0	0	112.1	F197 V202 L203 N209 Y210 V231 F265 F267	F197-L206 HydrophobicContact CD1-CD1 3.96Å; F197-L206 HydrophobicContact CE1-CD1 4.45Å; V202-L206 HydrophobicContact CG1-CD1 4.17Å; V202-L206 WeakPolarHBondContact O-CG 3.31Å; V202-L206 PolarHBondContact O-N 3.3Å; L203-L206 PolarHBondContact O-N 2.93Å; L206-N209 PolarHBondContact O-N 3.23Å; L206-Y210 WeakPolarHBondContact O-CB 3.26Å; L206-Y210 PolarHBondContact O-N 2.94Å; L206-V231 HydrophobicContact CB-CG2 4.42Å; L206-V231 HydrophobicContact CD1-CG1 4.28Å; L206-V231 HydrophobicContact CD1-CG2 3.76Å; L206-F265 HydrophobicContact CB-CD1 4.06Å; L206-F265 HydrophobicContact CB-CE1 4.36Å; L206-F267 HydrophobicContact CD2-CD1 3.95Å; L206-F267 HydrophobicContact CD2-CE1 3.69Å; L206-F267 HydrophobicContact CD2-CZ 4.34Å
207	D	97.4	Very high	96.8	Very high	34 Å²	34	67 Å²	67	18%	0.182	33%	0.333	C	S	.	.	H	α-helix	trans	-61.7	-46.7	175.2	-172.4	61	0	0	0	110.7	L203 N209 Y210 R211 V227	L203-D207 WeakPolarHBondContact O-CB 3.16Å; L203-D207 PolarHBondContact O-N 2.82Å; D207-N209 VanDerWaalsContact C-N 3.35Å; D207-N209 PolarHBondContact O-N 2.85Å; D207-Y210 PolarHBondContact O-N 3.31Å; D207-R211 VanDerWaalsContact O-CG 3.3Å; D207-R211 WeakPolarHBondContact O-CG 3.38Å; D207-R211 PolarHBondContact O-N 3Å; D207-R211 IonicContact OD1-CZ 3.06Å; D207-R211 IonicContact OD1-NE 3.77Å; D207-R211 PolarHBondContact OD1-NE 3.36Å; D207-R211 IonicContact OD1-NH2 2.71Å; D207-R211 PolarHBondContact OD1-NH2 2.99Å; D207-R211 IonicContact OD2-CZ 3.87Å; D207-R211 IonicContact OD2-NE 3.34Å; D207-R211 PolarHBondContact OD2-NE 3.28Å; D207-R211 IonicContact OD2-NH2 3.44Å; D207-R211 PolarHBondContact OD2-NH2 3.24Å; D207-V227 HydrophobicContact CB-CB 4.03Å; D207-V227 HydrophobicContact CB-CG1 4.12Å; D207-V227 HydrophobicContact CB-CG2 3.87Å
208	K	97.3	Very high	96.7	Very high	143 Å²	143	74.2 Å²	74.2	62%	0.622	37%	0.372	S	S	*	.	H	α-helix	trans	-56.6	-49.7	175.7	-179	-176.9	175.6	-177.7	0	111.4	D204 L205 R211 V212	D204-K208 WeakPolarHBondContact O-CB 2.99Å; D204-K208 PolarHBondContact O-N 2.85Å; D204-K208 VanDerWaalsContact O-N 3.13Å; L205-K208 PolarHBondContact O-N 3.3Å; K208-R211 PolarHBondContact O-N 3.37Å; K208-V212 WeakPolarHBondContact O-CG2 3.35Å; K208-V212 PolarHBondContact O-N 3.05Å; K208-V212 VanDerWaalsContact O-N 3.14Å
209	N	97.1	Very high	96.6	Very high	23 Å²	23	76.9 Å²	76.9	12%	0.123	38%	0.379	C	S	.	.	H	α-helix	trans	-67.1	-39	-178.3	-77.1	9.7	0	0	0	112	L205 L206 D207 V212 H213 H266 C268	L205-N209 PolarHBondContact O-N 3.16Å; L205-N209 VanDerWaalsContact O-N 3.11Å; L206-N209 PolarHBondContact O-N 3.23Å; D207-N209 VanDerWaalsContact C-N 3.35Å; D207-N209 PolarHBondContact O-N 2.85Å; N209-V212 PolarHBondContact O-N 3.22Å; N209-H213 PolarHBondContact O-N 3.43Å; N209-H266 WeakPolarHBondContact CB-O 3.36Å; N209-H266 PolarHBondContact ND2-O 2.97Å; N209-C268 PolarHBondContact ND2-O 3.31Å; N209-C268 VanDerWaalsContact ND2-O 3.14Å
210	Y	97.4	Very high	96.5	Very high	38 Å²	38	76.9 Å²	76.9	15%	0.149	40%	0.396	C	S	.	.	H	α-helix	trans	-61.9	-45.1	175.3	-178.8	-103.6	0	0	0	111.8	L206 D207 V212 H213 C214 I221 F225 R263 G264 F265	L206-Y210 WeakPolarHBondContact O-CB 3.26Å; L206-Y210 PolarHBondContact O-N 2.94Å; D207-Y210 PolarHBondContact O-N 3.31Å; Y210-V212 VanDerWaalsContact C-N 3.32Å; Y210-V212 PolarHBondContact O-N 2.58Å; Y210-H213 WeakPolarHBondContact O-CB 3.28Å; Y210-H213 PolarHBondContact O-N 3.3Å; Y210-H213 VanDerWaalsContact O-N 3.14Å; Y210-C214 VanDerWaalsContact CE1-SG 3.55Å; Y210-C214 VanDerWaalsContact CZ-SG 3.51Å; Y210-C214 PolarHBondContact O-N 3.1Å; Y210-C214 PolarHBondContact O-SG 2.7Å; Y210-C214 VanDerWaalsContact O-SG 3.4Å; Y210-I221 HydrophobicContact CE1-CG1 4.5Å; Y210-F225 AromaticContact CD1-CE1 3.72Å; Y210-F225 HydrophobicContact CD1-CE1 3.72Å; Y210-F225 HydrophobicContact CD1-CE2 4.1Å; Y210-F225 AromaticContact CD1-CZ 3.41Å; Y210-F225 HydrophobicContact CD1-CZ 3.41Å; Y210-F225 VanDerWaalsContact CD1-CZ 3.41Å; Y210-F225 HydrophobicContact CE1-CD1 4.42Å; Y210-F225 HydrophobicContact CE1-CD2 4.13Å; Y210-F225 AromaticContact CE1-CE1 3.83Å; Y210-F225 HydrophobicContact CE1-CE1 3.83Å; Y210-F225 AromaticContact CE1-CE2 3.49Å; Y210-F225 HydrophobicContact CE1-CE2 3.49Å; Y210-F225 VanDerWaalsContact CE1-CE2 3.49Å; Y210-F225 AromaticContact CE1-CZ 3.31Å; Y210-F225 HydrophobicContact CE1-CZ 3.31Å; Y210-F225 HydrophobicContact CG-CZ 4.19Å; Y210-F225 AromaticContact CZ-CE2 3.9Å; Y210-R263 VanDerWaalsContact CE2-O 3.28Å; Y210-R263 WeakPolarHBondContact CE2-O 3.47Å; Y210-G264 WeakPolarHBondContact CD2-O 3.33Å; Y210-F265 HydrophobicContact CD2-CD1 4.09Å; Y210-F265 AromaticContact CD2-CE1 3.93Å; Y210-F265 HydrophobicContact CD2-CE1 3.93Å; Y210-F265 HydrophobicContact CD2-CG 4.44Å; Y210-F265 HydrophobicContact CD2-CZ 4.15Å; Y210-F265 HydrophobicContact CG-CD1 4.26Å; Y210-F265 AromaticContact CG-CE1 3.86Å; Y210-F265 HydrophobicContact CG-CE1 3.86Å; Y210-F265 HydrophobicContact CG-CZ 4.32Å
211	R	96.7	Very high	96.3	Very high	119 Å²	119	71.6 Å²	71.6	45%	0.449	38%	0.375	S	S	.	.	H	α-helix	trans	-61.4	-39.3	176.4	-70.9	176.7	-171.4	-76.8	-9.1	112.6	D207 K208 C214 S215 I221	D207-R211 VanDerWaalsContact O-CG 3.3Å; D207-R211 WeakPolarHBondContact O-CG 3.38Å; D207-R211 PolarHBondContact O-N 3Å; D207-R211 IonicContact OD1-CZ 3.06Å; D207-R211 IonicContact OD1-NE 3.77Å; D207-R211 PolarHBondContact OD1-NE 3.36Å; D207-R211 IonicContact OD1-NH2 2.71Å; D207-R211 PolarHBondContact OD1-NH2 2.99Å; D207-R211 IonicContact OD2-CZ 3.87Å; D207-R211 IonicContact OD2-NE 3.34Å; D207-R211 PolarHBondContact OD2-NE 3.28Å; D207-R211 IonicContact OD2-NH2 3.44Å; D207-R211 PolarHBondContact OD2-NH2 3.24Å; K208-R211 PolarHBondContact O-N 3.37Å; R211-C214 PolarHBondContact O-N 2.92Å; R211-S215 WeakPolarHBondContact O-CB 3.49Å; R211-S215 PolarHBondContact O-N 2.96Å; R211-I221 HydrophobicContact CB-CD1 4.25Å; R211-I221 HydrophobicContact CG-CD1 3.72Å
212	V	96.6	Very high	96.1	Very high	83 Å²	83	68.3 Å²	68.3	50%	0.503	37%	0.366	S	S	.	.	H	α-helix	trans	-62.7	-46.7	173.5	172.3	0	0	0	0	110.6	K208 N209 Y210 C214 S215 V216	K208-V212 WeakPolarHBondContact O-CG2 3.35Å; K208-V212 PolarHBondContact O-N 3.05Å; K208-V212 VanDerWaalsContact O-N 3.14Å; N209-V212 PolarHBondContact O-N 3.22Å; Y210-V212 VanDerWaalsContact C-N 3.32Å; Y210-V212 PolarHBondContact O-N 2.58Å; V212-C214 PolarHBondContact O-N 3.16Å; V212-S215 PolarHBondContact O-N 3.3Å; V212-V216 HydrophobicContact CG1-CG2 4.38Å; V212-V216 WeakPolarHBondContact O-CG2 3.28Å; V212-V216 PolarHBondContact O-N 2.67Å
213	H	95.9	Very high	95.7	Very high	38 Å²	38	76.4 Å²	76.4	18%	0.176	41%	0.41	C	S	.	.	H	α-helix	trans	-56.8	-50.6	176	173.7	87.2	0	0	0	111.6	N209 Y210 S215 V216 H217 H266	N209-H213 PolarHBondContact O-N 3.43Å; Y210-H213 WeakPolarHBondContact O-CB 3.28Å; Y210-H213 PolarHBondContact O-N 3.3Å; Y210-H213 VanDerWaalsContact O-N 3.14Å; H213-S215 VanDerWaalsContact C-N 3.32Å; H213-S215 PolarHBondContact O-N 2.67Å; H213-V216 PolarHBondContact O-N 3.29Å; H213-H217 AromaticContact CE1-CD2 3.29Å; H213-H217 PolarHBondContact CE1-CD2 2.73Å; H213-H217 AromaticContact CE1-NE2 3.65Å; H213-H217 AromaticContact CG-CD2 3.9Å; H213-H217 AromaticContact ND1-CD2 3.34Å; H213-H217 PolarHBondContact ND1-CD2 2.98Å; H213-H217 VanDerWaalsContact ND1-CD2 3.34Å; H213-H217 AromaticContact ND1-NE2 3.67Å; H213-H217 AromaticContact NE2-CD2 3.83Å; H213-H217 PolarHBondContact O-CD2 3.29Å; H213-H217 VanDerWaalsContact O-CD2 3.23Å; H213-H217 PolarHBondContact O-N 3.14Å; H213-H266 AromaticContact CE1-NE2 3.72Å; H213-H266 AromaticContact CG-CD2 3.95Å; H213-H266 AromaticContact ND1-CD2 3.56Å; H213-H266 AromaticContact ND1-NE2 3.24Å; H213-H266 PolarHBondContact ND1-NE2 3.34Å
214	C	96.3	Very high	95.5	Very high	1 Å²	1	82 Å²	82	1%	0.007	44%	0.439	C	S	.	.	H	α-helix	trans	-58.5	-42.8	177.7	-70.8	0	0	0	0	112.5	Y210 R211 V212 H217 N218 I219 I221	Y210-C214 VanDerWaalsContact CE1-SG 3.55Å; Y210-C214 VanDerWaalsContact CZ-SG 3.51Å; Y210-C214 PolarHBondContact O-N 3.1Å; Y210-C214 PolarHBondContact O-SG 2.7Å; Y210-C214 VanDerWaalsContact O-SG 3.4Å; R211-C214 PolarHBondContact O-N 2.92Å; V212-C214 PolarHBondContact O-N 3.16Å; C214-H217 CarbonylContact O-C 3.42Å; C214-H217 PolarHBondContact O-N 3.02Å; C214-N218 PolarHBondContact O-N 3.49Å; C214-I219 HydrophobicContact CB-CB 4.1Å; C214-I219 WeakPolarHBondContact CB-O 3.47Å; C214-I219 PolarHBondContact O-N 3.4Å; C214-I221 HydrophobicContact CB-CD1 3.83Å; C214-I221 HydrophobicContact CB-CG1 3.77Å
215	S	96	Very high	95.3	Very high	92 Å²	92	80.2 Å²	80.2	64%	0.643	43%	0.427	S	S	*	.	H	α-helix	trans	-63.9	-40.5	177	-178	0	0	0	0	112.7	R211 V212 H213 H217	R211-S215 WeakPolarHBondContact O-CB 3.49Å; R211-S215 PolarHBondContact O-N 2.96Å; V212-S215 PolarHBondContact O-N 3.3Å; H213-S215 VanDerWaalsContact C-N 3.32Å; H213-S215 PolarHBondContact O-N 2.67Å; S215-H217 VanDerWaalsContact C-N 3.34Å
216	V	95.8	Very high	95.3	Very high	102 Å²	102	81.5 Å²	81.5	62%	0.618	44%	0.435	S	S	*	.	H	α-helix	trans	-69.7	-35	179.8	169.8	0	0	0	0	111.3	V212 H213	V212-V216 HydrophobicContact CG1-CG2 4.38Å; V212-V216 WeakPolarHBondContact O-CG2 3.28Å; V212-V216 PolarHBondContact O-N 2.67Å; H213-V216 PolarHBondContact O-N 3.29Å
217	H	95.7	Very high	95.3	Very high	114 Å²	114	82.6 Å²	82.6	53%	0.528	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	8.8	-176.9	-67.5	-73.9	0	0	0	114.2	H213 C214 S215 I219	H213-H217 AromaticContact CE1-CD2 3.29Å; H213-H217 PolarHBondContact CE1-CD2 2.73Å; H213-H217 AromaticContact CE1-NE2 3.65Å; H213-H217 AromaticContact CG-CD2 3.9Å; H213-H217 AromaticContact ND1-CD2 3.34Å; H213-H217 PolarHBondContact ND1-CD2 2.98Å; H213-H217 VanDerWaalsContact ND1-CD2 3.34Å; H213-H217 AromaticContact ND1-NE2 3.67Å; H213-H217 AromaticContact NE2-CD2 3.83Å; H213-H217 PolarHBondContact O-CD2 3.29Å; H213-H217 VanDerWaalsContact O-CD2 3.23Å; H213-H217 PolarHBondContact O-N 3.14Å; C214-H217 CarbonylContact O-C 3.42Å; C214-H217 PolarHBondContact O-N 3.02Å; S215-H217 VanDerWaalsContact C-N 3.34Å; H217-I219 HydrophobicContact CB-CD1 3.88Å; H217-I219 HydrophobicContact CB-CG1 3.96Å; H217-I219 PolarHBondContact O-N 3.35Å
218	N	95.4	Very high	95.3	Very high	152 Å²	152	86.2 Å²	86.2	81%	0.813	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	38.7	-176.6	-63.2	-46	0	0	0	113.7	C214	C214-N218 PolarHBondContact O-N 3.49Å
219	I	95.2	Very high	95.3	Very high	79 Å²	79	83.9 Å²	83.9	41%	0.405	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-90.9	119.7	175.4	-56.8	170.3	0	0	0	107.7	C214 H217	C214-I219 HydrophobicContact CB-CB 4.1Å; C214-I219 WeakPolarHBondContact CB-O 3.47Å; C214-I219 PolarHBondContact O-N 3.4Å; H217-I219 HydrophobicContact CB-CD1 3.88Å; H217-I219 HydrophobicContact CB-CG1 3.96Å; H217-I219 PolarHBondContact O-N 3.35Å
220	A	93.8	Very high	95.3	Very high	90 Å²	90	84 Å²	84	74%	0.744	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-67.8	135.2	172.9	0	0	0	0	0	110.2
221	I	92.9	Very high	95.3	Very high	48 Å²	48	82.2 Å²	82.2	25%	0.246	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-97.4	121.5	175	-55.4	176.8	0	0	0	107.1	Y210 R211 C214 F225	Y210-I221 HydrophobicContact CE1-CG1 4.5Å; R211-I221 HydrophobicContact CB-CD1 4.25Å; R211-I221 HydrophobicContact CG-CD1 3.72Å; C214-I221 HydrophobicContact CB-CD1 3.83Å; C214-I221 HydrophobicContact CB-CG1 3.77Å; I221-F225 HydrophobicContact CG2-CB 3.63Å; I221-F225 HydrophobicContact CG2-CD1 3.99Å; I221-F225 HydrophobicContact CG2-CG 3.82Å
222	N	92	Very high	95.3	Very high	114 Å²	114	78.5 Å²	78.5	61%	0.61	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-63.4	146.6	177.3	-63.9	-14.6	0	0	0	111.1	D224 F225	N222-D224 WeakPolarHBondContact CB-OD1 3.44Å; N222-D224 PolarHBondContact O-N 3.38Å; N222-F225 WeakPolarHBondContact O-CB 3.25Å; N222-F225 PolarHBondContact O-N 3.14Å
223	D	89	Confident	95.4	Very high	176 Å²	176	78.3 Å²	78.3	94%	0.941	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-25	-179.4	-68.3	-29.2	0	0	0	113.2	F225	D223-F225 VanDerWaalsContact C-N 3.34Å
224	D	92.7	Very high	95.4	Very high	131 Å²	131	76.5 Å²	76.5	70%	0.701	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	3.2	177.3	70.3	-27.4	0	0	0	113.8	N222 N226	N222-D224 WeakPolarHBondContact CB-OD1 3.44Å; N222-D224 PolarHBondContact O-N 3.38Å; D224-N226 PolarHBondContact O-N 2.91Å
225	F	94.7	Very high	95.5	Very high	50 Å²	50	76.4 Å²	76.4	22%	0.219	43%	0.426	C	S	.	.			trans	-57.9	122.9	-177.2	175.2	-101	0	0	0	112.1	Y210 I221 N222 D223 V227 A230 F265	Y210-F225 AromaticContact CD1-CE1 3.72Å; Y210-F225 HydrophobicContact CD1-CE1 3.72Å; Y210-F225 HydrophobicContact CD1-CE2 4.1Å; Y210-F225 AromaticContact CD1-CZ 3.41Å; Y210-F225 HydrophobicContact CD1-CZ 3.41Å; Y210-F225 VanDerWaalsContact CD1-CZ 3.41Å; Y210-F225 HydrophobicContact CE1-CD1 4.42Å; Y210-F225 HydrophobicContact CE1-CD2 4.13Å; Y210-F225 AromaticContact CE1-CE1 3.83Å; Y210-F225 HydrophobicContact CE1-CE1 3.83Å; Y210-F225 AromaticContact CE1-CE2 3.49Å; Y210-F225 HydrophobicContact CE1-CE2 3.49Å; Y210-F225 VanDerWaalsContact CE1-CE2 3.49Å; Y210-F225 AromaticContact CE1-CZ 3.31Å; Y210-F225 HydrophobicContact CE1-CZ 3.31Å; Y210-F225 HydrophobicContact CG-CZ 4.19Å; Y210-F225 AromaticContact CZ-CE2 3.9Å; I221-F225 HydrophobicContact CG2-CB 3.63Å; I221-F225 HydrophobicContact CG2-CD1 3.99Å; I221-F225 HydrophobicContact CG2-CG 3.82Å; N222-F225 WeakPolarHBondContact O-CB 3.25Å; N222-F225 PolarHBondContact O-N 3.14Å; D223-F225 VanDerWaalsContact C-N 3.34Å; F225-V227 HydrophobicContact CE1-CB 3.97Å; F225-V227 HydrophobicContact CZ-CB 4.27Å; F225-A230 HydrophobicContact CE2-CB 3.88Å; F225-A230 HydrophobicContact CZ-CB 4.27Å; F225-F265 HydrophobicContact CZ-CZ 4.12Å
226	N	96.3	Very high	95.5	Very high	85 Å²	85	76.2 Å²	76.2	46%	0.455	42%	0.417	S	S	.	.			trans	-117.5	107.6	175.6	-169.4	-60.3	0	0	0	110.8	D224 K228 T229 A230	D224-N226 PolarHBondContact O-N 2.91Å; N226-K228 PolarHBondContact O-N 3.42Å; N226-K228 WeakPolarHBondContact OD1-CA 3.28Å; N226-K228 VanDerWaalsContact OD1-CB 3.26Å; N226-K228 WeakPolarHBondContact OD1-CB 3.37Å; N226-K228 PolarHBondContact OD1-N 3.42Å; N226-T229 PolarHBondContact O-N 3.32Å; N226-T229 VanDerWaalsContact O-N 3.13Å; N226-T229 PolarHBondContact OD1-N 3.35Å; N226-T229 VanDerWaalsContact OD1-N 3.12Å; N226-T229 PolarHBondContact OD1-OG1 3.11Å; N226-A230 PolarHBondContact O-N 2.83Å
227	V	96.9	Very high	95.5	Very high	23 Å²	23	74.2 Å²	74.2	14%	0.139	41%	0.408	C	S	.	.	H	α-helix	trans	-55.5	-36.5	179.6	64.6	0	0	0	0	113	L203 D207 F225 A230 V231 F265	L203-V227 HydrophobicContact CB-CG1 4.21Å; D207-V227 HydrophobicContact CB-CB 4.03Å; D207-V227 HydrophobicContact CB-CG1 4.12Å; D207-V227 HydrophobicContact CB-CG2 3.87Å; F225-V227 HydrophobicContact CE1-CB 3.97Å; F225-V227 HydrophobicContact CZ-CB 4.27Å; V227-A230 PolarHBondContact O-N 3.41Å; V227-V231 HydrophobicContact CG2-CG2 4.01Å; V227-V231 VanDerWaalsContact O-CB 3.28Å; V227-V231 WeakPolarHBondContact O-CB 3.43Å; V227-V231 VanDerWaalsContact O-CG2 3.23Å; V227-V231 WeakPolarHBondContact O-CG2 3.21Å; V227-V231 PolarHBondContact O-N 3.15Å; V227-F265 HydrophobicContact CG2-CE1 3.91Å; V227-F265 HydrophobicContact CG2-CZ 4.27Å
228	K	97.6	Very high	95.3	Very high	109 Å²	109	70 Å²	70	47%	0.474	39%	0.394	S	S	.	.	H	α-helix	trans	-66.4	-45.1	-179.4	-174.6	-178.1	175.4	-171.4	0	110.6	L203 N226 M232	L203-K228 HydrophobicContact CD1-CB 3.85Å; L203-K228 HydrophobicContact CD1-CD 4.21Å; L203-K228 HydrophobicContact CD1-CG 3.86Å; L203-K228 HydrophobicContact CD2-CB 4.21Å; L203-K228 HydrophobicContact CD2-CG 4.44Å; N226-K228 PolarHBondContact O-N 3.42Å; N226-K228 WeakPolarHBondContact OD1-CA 3.28Å; N226-K228 VanDerWaalsContact OD1-CB 3.26Å; N226-K228 WeakPolarHBondContact OD1-CB 3.37Å; N226-K228 PolarHBondContact OD1-N 3.42Å; K228-M232 WeakPolarHBondContact O-CB 3.25Å; K228-M232 WeakPolarHBondContact O-CG 3.3Å; K228-M232 PolarHBondContact O-N 3.13Å
229	T	97.1	Very high	95.3	Very high	95 Å²	95	69.2 Å²	69.2	58%	0.583	39%	0.39	S	S	*	.	H	α-helix	trans	-62.4	-47.2	177.4	-53.7	0	0	0	0	110.5	N226 V231 M232 D233	N226-T229 PolarHBondContact O-N 3.32Å; N226-T229 VanDerWaalsContact O-N 3.13Å; N226-T229 PolarHBondContact OD1-N 3.35Å; N226-T229 VanDerWaalsContact OD1-N 3.12Å; N226-T229 PolarHBondContact OD1-OG1 3.11Å; T229-V231 PolarHBondContact O-N 3.47Å; T229-M232 PolarHBondContact O-N 3.19Å; T229-D233 WeakPolarHBondContact O-CB 3.33Å; T229-D233 PolarHBondContact O-N 3.03Å
230	A	97.1	Very high	95.5	Very high	25 Å²	25	65.8 Å²	65.8	21%	0.207	37%	0.373	C	S	.	.	H	α-helix	trans	-63.7	-41.5	179.9	0	0	0	0	0	113.2	F225 N226 V227 D233 A234 F265	F225-A230 HydrophobicContact CE2-CB 3.88Å; F225-A230 HydrophobicContact CZ-CB 4.27Å; N226-A230 PolarHBondContact O-N 2.83Å; V227-A230 PolarHBondContact O-N 3.41Å; A230-D233 PolarHBondContact O-N 3.05Å; A230-A234 PolarHBondContact O-N 3.41Å; A230-F265 HydrophobicContact CB-CE2 3.82Å; A230-F265 HydrophobicContact CB-CZ 3.74Å
231	V	97.7	Very high	95.6	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-66.1	-40.3	175.3	163.8	0	0	0	0	111.6	F197 L203 L206 V227 T229 A234 L235 F260 F265	F197-V231 HydrophobicContact CB-CG1 3.84Å; L203-V231 HydrophobicContact CD2-CB 4.1Å; L203-V231 HydrophobicContact CD2-CG1 4.14Å; L203-V231 HydrophobicContact CD2-CG2 4.18Å; L206-V231 HydrophobicContact CB-CG2 4.42Å; L206-V231 HydrophobicContact CD1-CG1 4.28Å; L206-V231 HydrophobicContact CD1-CG2 3.76Å; V227-V231 HydrophobicContact CG2-CG2 4.01Å; V227-V231 VanDerWaalsContact O-CB 3.28Å; V227-V231 WeakPolarHBondContact O-CB 3.43Å; V227-V231 VanDerWaalsContact O-CG2 3.23Å; V227-V231 WeakPolarHBondContact O-CG2 3.21Å; V227-V231 PolarHBondContact O-N 3.15Å; T229-V231 PolarHBondContact O-N 3.47Å; V231-A234 PolarHBondContact O-N 3.23Å; V231-L235 WeakPolarHBondContact O-CG 3.35Å; V231-L235 PolarHBondContact O-N 2.88Å; V231-F260 HydrophobicContact CB-CE1 4.44Å; V231-F260 HydrophobicContact CG1-CE1 3.99Å; V231-F260 HydrophobicContact CG1-CZ 4.27Å; V231-F260 HydrophobicContact CG2-CE1 4.34Å; V231-F265 HydrophobicContact CG2-CD1 4.32Å; V231-F265 HydrophobicContact CG2-CE1 3.93Å; V231-F265 HydrophobicContact CG2-CE2 4.22Å; V231-F265 HydrophobicContact CG2-CZ 3.87Å
232	M	97.6	Very high	95.9	Very high	41 Å²	41	67.9 Å²	67.9	20%	0.202	37%	0.366	C	S	.	.	H	α-helix	trans	-68.2	-38.2	176.2	-70.8	-61.1	-158.9	0	0	111.8	G194 K228 T229 A234 L235 I236	G194-M232 WeakPolarHBondContact O-CE 3.35Å; K228-M232 WeakPolarHBondContact O-CB 3.25Å; K228-M232 WeakPolarHBondContact O-CG 3.3Å; K228-M232 PolarHBondContact O-N 3.13Å; T229-M232 PolarHBondContact O-N 3.19Å; M232-A234 VanDerWaalsContact C-N 3.34Å; M232-A234 PolarHBondContact O-N 3.48Å; M232-L235 PolarHBondContact O-N 3.22Å; M232-L235 VanDerWaalsContact O-N 3.16Å; M232-L235 HydrophobicContact SD-CD1 4.25Å; M232-I236 WeakPolarHBondContact O-CB 3.35Å; M232-I236 VanDerWaalsContact O-CG1 3.26Å; M232-I236 WeakPolarHBondContact O-CG1 3.46Å; M232-I236 PolarHBondContact O-N 2.8Å
233	D	97	Very high	96.2	Very high	79 Å²	79	65.9 Å²	65.9	42%	0.422	35%	0.35	S	S	.	.	H	α-helix	trans	-59	-44.7	173	179.2	72.9	0	0	0	111.9	T229 A230 L235 I236 S237 R263	T229-D233 WeakPolarHBondContact O-CB 3.33Å; T229-D233 PolarHBondContact O-N 3.03Å; A230-D233 PolarHBondContact O-N 3.05Å; D233-L235 PolarHBondContact O-N 3.1Å; D233-I236 PolarHBondContact O-N 3.04Å; D233-S237 WeakPolarHBondContact O-CB 3.46Å; D233-S237 PolarHBondContact O-N 2.84Å; D233-S237 PolarHBondContact O-OG 3.16Å; D233-R263 IonicContact OD2-CZ 3.92Å; D233-R263 IonicContact OD2-NE 3.92Å; D233-R263 PolarHBondContact OD2-NE 2.82Å; D233-R263 IonicContact OD2-NH2 2.72Å; D233-R263 PolarHBondContact OD2-NH2 3.48Å; D233-R263 VanDerWaalsContact OD2-NH2 3.1Å
234	A	96.9	Very high	96.6	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-56.6	-41.4	175	0	0	0	0	0	111.8	A230 V231 M232 S237 G238 F260	A230-A234 PolarHBondContact O-N 3.41Å; V231-A234 PolarHBondContact O-N 3.23Å; M232-A234 VanDerWaalsContact C-N 3.34Å; M232-A234 PolarHBondContact O-N 3.48Å; A234-S237 PolarHBondContact O-OG 3.2Å; A234-G238 PolarHBondContact O-N 3.43Å; A234-F260 HydrophobicContact CB-CD1 3.98Å; A234-F260 HydrophobicContact CB-CE1 3.96Å
235	L	97.8	Very high	96.9	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-73.2	-38.1	177.8	-68.5	175.7	0	0	0	113.5	L193 F197 V231 M232 D233 N239 F240 Q241 L256 F260	L193-L235 HydrophobicContact CB-CD2 4.22Å; F197-L235 HydrophobicContact CB-CD1 3.92Å; F197-L235 HydrophobicContact CD2-CD1 4.14Å; F197-L235 HydrophobicContact CD2-CD2 4.27Å; F197-L235 HydrophobicContact CG-CD1 4.34Å; V231-L235 WeakPolarHBondContact O-CG 3.35Å; V231-L235 PolarHBondContact O-N 2.88Å; M232-L235 PolarHBondContact O-N 3.22Å; M232-L235 VanDerWaalsContact O-N 3.16Å; M232-L235 HydrophobicContact SD-CD1 4.25Å; D233-L235 PolarHBondContact O-N 3.1Å; L235-N239 PolarHBondContact O-N 3.43Å; L235-F240 HydrophobicContact CD2-CB 3.9Å; L235-F240 PolarHBondContact O-N 3.24Å; L235-Q241 HydrophobicContact CB-CB 4.25Å; L235-Q241 PolarHBondContact O-N 2.93Å; L235-L256 HydrophobicContact CD2-CD1 3.68Å; L235-F260 HydrophobicContact CD2-CE2 3.89Å; L235-F260 HydrophobicContact CD2-CZ 3.84Å; L235-F260 HydrophobicContact CG-CZ 4.04Å
236	I	97.1	Very high	97.1	Very high	88 Å²	88	59 Å²	59	45%	0.451	30%	0.299	S	S	.	.	H	α-helix	trans	-69.3	-52.3	-179.3	-72.2	163.1	0	0	0	109.8	M232 D233 G238 N239 Q241	M232-I236 WeakPolarHBondContact O-CB 3.35Å; M232-I236 VanDerWaalsContact O-CG1 3.26Å; M232-I236 WeakPolarHBondContact O-CG1 3.46Å; M232-I236 PolarHBondContact O-N 2.8Å; D233-I236 PolarHBondContact O-N 3.04Å; I236-G238 PolarHBondContact O-N 3.32Å; I236-N239 PolarHBondContact O-N 3.29Å; I236-Q241 HydrophobicContact CG1-CB 4.34Å
237	S	94.3	Very high	97.1	Very high	60 Å²	60	57.9 Å²	57.9	42%	0.42	30%	0.295	S	S	.	.	H	α-helix	trans	-59.8	-31.8	179.7	62.3	0	0	0	0	113	D233 A234 R263	D233-S237 WeakPolarHBondContact O-CB 3.46Å; D233-S237 PolarHBondContact O-N 2.84Å; D233-S237 PolarHBondContact O-OG 3.16Å; A234-S237 PolarHBondContact O-OG 3.2Å; S237-R263 VanDerWaalsContact OG-CZ 3.31Å; S237-R263 PolarHBondContact OG-NH2 3.2Å
238	G	91.9	Very high	97.2	Very high	24 Å²	24	56.8 Å²	56.8	25%	0.247	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	2	174.5	0	0	0	0	0	115.2	A234 I236 F240	A234-G238 PolarHBondContact O-N 3.43Å; I236-G238 PolarHBondContact O-N 3.32Å; G238-F240 WeakPolarHBondContact O-CD2 3.42Å; G238-F240 WeakPolarHBondContact O-CE2 3.45Å; G238-F240 PolarHBondContact O-N 3.2Å
239	N	96.4	Very high	97.2	Very high	136 Å²	136	54 Å²	54	73%	0.727	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	32.9	-173.4	-65.6	-45.4	0	0	0	114.2	L235 I236 R243	L235-N239 PolarHBondContact O-N 3.43Å; I236-N239 PolarHBondContact O-N 3.29Å; N239-R243 WeakPolarHBondContact O-CD 3.47Å; N239-R243 WeakPolarHBondContact O-CG 3.22Å
240	F	98	Very high	97.2	Very high	8 Å²	8	50.9 Å²	50.9	4%	0.035	26%	0.258	C	S	.	.			trans	-103.9	-16.3	-177	-73.9	-67.4	0	0	0	114.4	L193 L235 G238 E242 R243 M248 D252 L255 L256	L193-F240 WeakPolarHBondContact CB-O 3.46Å; L193-F240 HydrophobicContact CD1-CB 4.02Å; L193-F240 HydrophobicContact CD1-CD1 4.34Å; L235-F240 HydrophobicContact CD2-CB 3.9Å; L235-F240 PolarHBondContact O-N 3.24Å; G238-F240 WeakPolarHBondContact O-CD2 3.42Å; G238-F240 WeakPolarHBondContact O-CE2 3.45Å; G238-F240 PolarHBondContact O-N 3.2Å; F240-E242 VanDerWaalsContact C-N 3.33Å; F240-E242 PolarHBondContact O-N 3.33Å; F240-R243 HydrophobicContact CD1-CB 4.48Å; F240-R243 HydrophobicContact CD1-CG 4.48Å; F240-R243 WeakPolarHBondContact O-CB 3.37Å; F240-R243 PolarHBondContact O-N 3.22Å; F240-M248 HydrophobicContact CD1-CE 3.66Å; F240-M248 HydrophobicContact CD1-SD 4.48Å; F240-M248 HydrophobicContact CE1-CE 3.65Å; F240-D252 HydrophobicContact CE1-CB 4.36Å; F240-D252 WeakPolarHBondContact CE1-O 3.23Å; F240-D252 VanDerWaalsContact CZ-O 3.26Å; F240-D252 WeakPolarHBondContact CZ-O 3.33Å; F240-L255 HydrophobicContact CE2-CB 4.15Å; F240-L255 HydrophobicContact CZ-CB 3.82Å; F240-L256 HydrophobicContact CB-CD1 3.86Å; F240-L256 HydrophobicContact CD1-CB 4.4Å; F240-L256 HydrophobicContact CD1-CD1 4.33Å; F240-L256 HydrophobicContact CD2-CB 4.2Å; F240-L256 HydrophobicContact CD2-CD1 3.68Å; F240-L256 HydrophobicContact CE1-CB 4.25Å; F240-L256 HydrophobicContact CE2-CB 4.03Å; F240-L256 HydrophobicContact CE2-CD1 4.34Å; F240-L256 HydrophobicContact CG-CB 4.41Å; F240-L256 HydrophobicContact CG-CD1 3.7Å; F240-L256 HydrophobicContact CZ-CB 4.07Å
241	Q	97.5	Very high	97.1	Very high	68 Å²	68	54.5 Å²	54.5	32%	0.318	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	-49.9	-174.2	-176.9	-173.3	-8.8	0	0	113	T192 L193 G194 L235 I236	T192-Q241 WeakPolarHBondContact CB-O 3.44Å; L193-Q241 PolarHBondContact N-O 3.22Å; G194-Q241 PolarHBondContact N-O 2.78Å; L235-Q241 HydrophobicContact CB-CB 4.25Å; L235-Q241 PolarHBondContact O-N 2.93Å; I236-Q241 HydrophobicContact CG1-CB 4.34Å
242	E	97.9	Very high	97.2	Very high	114 Å²	114	55.9 Å²	55.9	53%	0.533	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-4.9	-177	-64	-52	128.5	0	0	113.9	F240 R244	F240-E242 VanDerWaalsContact C-N 3.33Å; F240-E242 PolarHBondContact O-N 3.33Å; E242-R244 PolarHBondContact O-NH1 3.3Å
243	R	98	Very high	97.2	Very high	72 Å²	72	53.9 Å²	53.9	27%	0.272	27%	0.272	S	S	.	.			trans	-73.3	157.8	177.5	-62.9	-161.8	69.8	-169.8	-2.1	111	T192 L193 N239 F240 M248 D252	T192-R243 CarbonylContact C-O 3.56Å; T192-R243 VanDerWaalsContact CA-O 3.26Å; T192-R243 WeakPolarHBondContact CA-O 2.99Å; L193-R243 PolarHBondContact N-O 3.02Å; N239-R243 WeakPolarHBondContact O-CD 3.47Å; N239-R243 WeakPolarHBondContact O-CG 3.22Å; F240-R243 HydrophobicContact CD1-CB 4.48Å; F240-R243 HydrophobicContact CD1-CG 4.48Å; F240-R243 WeakPolarHBondContact O-CB 3.37Å; F240-R243 PolarHBondContact O-N 3.22Å; R243-M248 HydrophobicContact CB-SD 4.06Å; R243-D252 IonicContact CZ-OD1 3.39Å; R243-D252 IonicContact CZ-OD2 3.56Å; R243-D252 IonicContact NH1-OD1 3.42Å; R243-D252 PolarHBondContact NH1-OD1 3.42Å; R243-D252 IonicContact NH1-OD2 3.41Å; R243-D252 IonicContact NH2-OD1 2.8Å; R243-D252 PolarHBondContact NH2-OD1 3.13Å; R243-D252 IonicContact NH2-OD2 3.79Å; R243-D252 PolarHBondContact NH2-OD2 3.03Å
244	R	98.5	Very high	97.2	Very high	106 Å²	106	52.9 Å²	52.9	40%	0.4	27%	0.266	S	S	.	.	B	Isolated β-bridge	trans	-125.6	132.8	-178.6	-62.9	176.4	175.3	74.7	-1.8	108.7	N190 T192 E242 R246 T247 M248	N190-R244 VanDerWaalsContact O-CD 3.28Å; N190-R244 WeakPolarHBondContact O-CD 3.31Å; N190-R244 PolarHBondContact O-NE 3.09Å; T192-R244 HydrophobicContact CG2-CG 4.4Å; E242-R244 PolarHBondContact O-NH1 3.3Å; R244-R246 HydrophobicContact CB-CG 4.28Å; R244-R246 PolarHBondContact O-N 3.21Å; R244-T247 PolarHBondContact O-N 3.06Å; R244-T247 PolarHBondContact O-OG1 2.74Å; R244-T247 VanDerWaalsContact O-OG1 3.09Å; R244-M248 WeakPolarHBondContact O-CG 3.49Å
245	A	98.4	Very high	97.2	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-52.8	-31.1	-179.7	0	0	0	0	0	113.3	Y127 A185 F186 K189 T247 M248 F253	Y127-A245 WeakPolarHBondContact CE1-O 3.05Å; A185-A245 HydrophobicContact CB-CB 4.04Å; A185-A245 WeakPolarHBondContact O-CB 3.17Å; F186-A245 HydrophobicContact CD1-CB 4.29Å; F186-A245 HydrophobicContact CD2-CB 4.38Å; F186-A245 HydrophobicContact CE1-CB 4.23Å; F186-A245 HydrophobicContact CE2-CB 4.31Å; F186-A245 HydrophobicContact CG-CB 4.36Å; F186-A245 HydrophobicContact CZ-CB 4.24Å; K189-A245 HydrophobicContact CB-CB 4.44Å; A245-T247 PolarHBondContact O-N 2.98Å; A245-T247 VanDerWaalsContact O-N 3.14Å; A245-M248 PolarHBondContact O-N 2.86Å; A245-F253 HydrophobicContact CB-CZ 3.9Å
246	R	98.2	Very high	97.2	Very high	106 Å²	106	57.4 Å²	57.4	40%	0.4	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-60.3	-23.7	179.1	80.9	179	-141.8	163.4	7.1	114.2	G123 Y127 K189 N190 R244	G123-R246 PolarHBondContact N-O 2.75Å; Y127-R246 VanDerWaalsContact CD1-O 3.25Å; Y127-R246 WeakPolarHBondContact CD1-O 3Å; K189-R246 HydrophobicContact CB-CB 4.19Å; K189-R246 HydrophobicContact CD-CB 4.4Å; K189-R246 HydrophobicContact CG-CB 4.17Å; K189-R246 VanDerWaalsContact O-CB 3.31Å; K189-R246 WeakPolarHBondContact O-CB 3.35Å; K189-R246 PolarHBondContact O-N 2.99Å; N190-R246 WeakPolarHBondContact OD1-CD 3.48Å; N190-R246 PolarHBondContact OD1-NH1 3.43Å; R244-R246 HydrophobicContact CB-CG 4.28Å; R244-R246 PolarHBondContact O-N 3.21Å
247	T	98.1	Very high	97.2	Very high	61 Å²	61	53.6 Å²	53.6	37%	0.374	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-115.4	11.2	-176	58.9	0	0	0	0	112.3	R244 A245	R244-T247 PolarHBondContact O-N 3.06Å; R244-T247 PolarHBondContact O-OG1 2.74Å; R244-T247 VanDerWaalsContact O-OG1 3.09Å; A245-T247 PolarHBondContact O-N 2.98Å; A245-T247 VanDerWaalsContact O-N 3.14Å
248	M	98.5	Very high	97.3	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.278	C	S	.	.			trans	-100.8	130.7	-179.9	-70.6	171.9	65.5	0	0	109.9	Y127 L193 F240 R243 R244 A245 D252 F253 L256	Y127-M248 VanDerWaalsContact CE1-O 3.28Å; Y127-M248 WeakPolarHBondContact CE1-O 3.41Å; Y127-M248 PolarHBondContact OH-O 3.16Å; L193-M248 HydrophobicContact CD1-CE 3.92Å; L193-M248 HydrophobicContact CD1-SD 3.63Å; L193-M248 HydrophobicContact CG-SD 4.26Å; F240-M248 HydrophobicContact CD1-CE 3.66Å; F240-M248 HydrophobicContact CD1-SD 4.48Å; F240-M248 HydrophobicContact CE1-CE 3.65Å; R243-M248 HydrophobicContact CB-SD 4.06Å; R244-M248 WeakPolarHBondContact O-CG 3.49Å; A245-M248 PolarHBondContact O-N 2.86Å; M248-D252 VanDerWaalsContact CA-OD2 3.28Å; M248-D252 WeakPolarHBondContact CA-OD2 3.47Å; M248-D252 HydrophobicContact CB-CB 3.83Å; M248-D252 HydrophobicContact CE-CB 3.91Å; M248-D252 HydrophobicContact CG-CB 4.14Å; M248-F253 HydrophobicContact CB-CD2 4.06Å; M248-F253 HydrophobicContact CB-CE2 3.62Å; M248-F253 HydrophobicContact CB-CZ 4.12Å; M248-F253 HydrophobicContact CE-CD1 4.22Å; M248-F253 HydrophobicContact CE-CE1 4.16Å; M248-F253 HydrophobicContact CE-CG 4.43Å; M248-F253 HydrophobicContact CE-CZ 4.34Å; M248-F253 HydrophobicContact SD-CZ 4.42Å; M248-L256 HydrophobicContact CE-CB 4.48Å; M248-L256 HydrophobicContact CE-CD2 4.03Å
249	D	97.6	Very high	97.5	Very high	52 Å²	52	56.1 Å²	56.1	28%	0.278	27%	0.271	S	S	.	.			trans	-86.3	-175.3	174.3	75.6	8.5	0	0	0	112	P122 N251 D252 F253	P122-D249 HydrophobicContact CG-CB 3.69Å; D249-N251 VanDerWaalsContact C-N 3.32Å; D249-N251 PolarHBondContact O-N 3.41Å; D249-N251 WeakPolarHBondContact OD1-CA 3.21Å; D249-N251 WeakPolarHBondContact OD1-CB 3.38Å; D249-N251 PolarHBondContact OD1-N 3.39Å; D249-D252 PolarHBondContact N-OD2 3.18Å; D249-D252 PolarHBondContact O-N 2.99Å; D249-D252 VanDerWaalsContact OD1-CG 3.24Å; D249-D252 PolarHBondContact OD1-N 2.8Å; D249-F253 VanDerWaalsContact O-CD2 3.23Å; D249-F253 WeakPolarHBondContact O-CD2 3.23Å; D249-F253 PolarHBondContact O-N 3.19Å
250	E	96.6	Very high	97.5	Very high	28 Å²	28	49.6 Å²	49.6	13%	0.131	24%	0.236	C	C	.	.	H	α-helix	trans	-63.6	-37.4	179.5	-59.1	71.2	-155.2	0	0	112.5	V132 Q135 L136 W178 F253 L254	V132-E250 HydrophobicContact CG2-CG 4Å; Q135-E250 HydrophobicContact CB-CG 4.41Å; Q135-E250 WeakPolarHBondContact CB-OE1 3.44Å; Q135-E250 PolarHBondContact OE1-OE1 3.18Å; L136-E250 HydrophobicContact CB-CG 4.29Å; W178-E250 HydrophobicContact CH2-CB 4.25Å; W178-E250 WeakPolarHBondContact CH2-O 3.28Å; E250-F253 PolarHBondContact O-N 2.79Å; E250-L254 WeakPolarHBondContact O-CG 3.26Å; E250-L254 PolarHBondContact O-N 2.83Å
251	N	96	Very high	97.4	Very high	102 Å²	102	51.8 Å²	51.8	55%	0.545	25%	0.248	S	C	.	.	H	α-helix	trans	-68.3	-40.1	-179	-64.7	-36.1	0	0	0	110.9	D249 F253 L254 L255	D249-N251 VanDerWaalsContact C-N 3.32Å; D249-N251 PolarHBondContact O-N 3.41Å; D249-N251 WeakPolarHBondContact OD1-CA 3.21Å; D249-N251 WeakPolarHBondContact OD1-CB 3.38Å; D249-N251 PolarHBondContact OD1-N 3.39Å; N251-F253 VanDerWaalsContact C-N 3.27Å; N251-F253 PolarHBondContact O-N 3.36Å; N251-L254 WeakPolarHBondContact O-CB 3.48Å; N251-L254 PolarHBondContact O-N 3.08Å; N251-L254 VanDerWaalsContact O-N 3.15Å; N251-L255 WeakPolarHBondContact O-CG 3.47Å; N251-L255 PolarHBondContact O-N 3.11Å
252	D	97.9	Very high	97.3	Very high	28 Å²	28	52.7 Å²	52.7	15%	0.15	26%	0.262	C	S	.	.	H	α-helix	trans	-57.9	-41.7	173.8	-66.5	-44.4	0	0	0	111.7	F240 R243 M248 D249 L256	F240-D252 HydrophobicContact CE1-CB 4.36Å; F240-D252 WeakPolarHBondContact CE1-O 3.23Å; F240-D252 VanDerWaalsContact CZ-O 3.26Å; F240-D252 WeakPolarHBondContact CZ-O 3.33Å; R243-D252 IonicContact CZ-OD1 3.39Å; R243-D252 IonicContact CZ-OD2 3.56Å; R243-D252 IonicContact NH1-OD1 3.42Å; R243-D252 PolarHBondContact NH1-OD1 3.42Å; R243-D252 IonicContact NH1-OD2 3.41Å; R243-D252 IonicContact NH2-OD1 2.8Å; R243-D252 PolarHBondContact NH2-OD1 3.13Å; R243-D252 IonicContact NH2-OD2 3.79Å; R243-D252 PolarHBondContact NH2-OD2 3.03Å; M248-D252 VanDerWaalsContact CA-OD2 3.28Å; M248-D252 WeakPolarHBondContact CA-OD2 3.47Å; M248-D252 HydrophobicContact CB-CB 3.83Å; M248-D252 HydrophobicContact CE-CB 3.91Å; M248-D252 HydrophobicContact CG-CB 4.14Å; D249-D252 PolarHBondContact N-OD2 3.18Å; D249-D252 PolarHBondContact O-N 2.99Å; D249-D252 VanDerWaalsContact OD1-CG 3.24Å; D249-D252 PolarHBondContact OD1-N 2.8Å; D252-L256 WeakPolarHBondContact O-CB 3.5Å; D252-L256 PolarHBondContact O-N 3.45Å
253	F	98	Very high	97.1	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-72.5	-31.6	176.5	-82.8	-70.2	0	0	0	113.1	V132 W178 L181 T182 A185 F186 A245 M248 D249 E250 N251 L256 L257	V132-F253 HydrophobicContact CG2-CD2 3.83Å; V132-F253 HydrophobicContact CG2-CE2 4.25Å; W178-F253 HydrophobicContact CH2-CB 3.37Å; W178-F253 HydrophobicContact CH2-CG 4.4Å; W178-F253 HydrophobicContact CZ2-CB 4.12Å; W178-F253 HydrophobicContact CZ3-CB 3.59Å; L181-F253 HydrophobicContact CD2-CD1 4.2Å; L181-F253 HydrophobicContact CG-CD1 4.45Å; T182-F253 HydrophobicContact CG2-CD1 3.98Å; T182-F253 HydrophobicContact CG2-CE1 4.26Å; T182-F253 HydrophobicContact CG2-CG 4.19Å; A185-F253 HydrophobicContact CB-CE1 3.59Å; A185-F253 HydrophobicContact CB-CZ 4.07Å; F186-F253 HydrophobicContact CD2-CZ 4.23Å; F186-F253 HydrophobicContact CE2-CE1 4.45Å; F186-F253 AromaticContact CE2-CE2 3.68Å; F186-F253 HydrophobicContact CE2-CE2 3.68Å; F186-F253 AromaticContact CE2-CZ 3.51Å; F186-F253 HydrophobicContact CE2-CZ 3.51Å; F186-F253 HydrophobicContact CZ-CE2 4.03Å; F186-F253 HydrophobicContact CZ-CZ 4.12Å; A245-F253 HydrophobicContact CB-CZ 3.9Å; M248-F253 HydrophobicContact CB-CD2 4.06Å; M248-F253 HydrophobicContact CB-CE2 3.62Å; M248-F253 HydrophobicContact CB-CZ 4.12Å; M248-F253 HydrophobicContact CE-CD1 4.22Å; M248-F253 HydrophobicContact CE-CE1 4.16Å; M248-F253 HydrophobicContact CE-CG 4.43Å; M248-F253 HydrophobicContact CE-CZ 4.34Å; M248-F253 HydrophobicContact SD-CZ 4.42Å; D249-F253 VanDerWaalsContact O-CD2 3.23Å; D249-F253 WeakPolarHBondContact O-CD2 3.23Å; D249-F253 PolarHBondContact O-N 3.19Å; E250-F253 PolarHBondContact O-N 2.79Å; N251-F253 VanDerWaalsContact C-N 3.27Å; N251-F253 PolarHBondContact O-N 3.36Å; F253-L256 HydrophobicContact CD1-CD2 4.21Å; F253-L256 HydrophobicContact CE1-CD2 4.39Å; F253-L256 PolarHBondContact O-N 3.31Å; F253-L257 WeakPolarHBondContact O-CB 3.26Å; F253-L257 PolarHBondContact O-N 3.45Å
254	L	96.9	Very high	97	Very high	58 Å²	58	48 Å²	48	30%	0.304	24%	0.241	S	C	.	.	H	α-helix	trans	-64.4	-47.1	173.6	-74	171.9	0	0	0	110.9	V173 W178 E250 N251 L256 L257 E258	V173-L254 HydrophobicContact CB-CD2 4.26Å; V173-L254 HydrophobicContact CG2-CD2 3.74Å; W178-L254 HydrophobicContact CE3-CD2 4.06Å; W178-L254 HydrophobicContact CH2-CG 4.36Å; W178-L254 HydrophobicContact CZ3-CB 4.47Å; W178-L254 HydrophobicContact CZ3-CD2 3.62Å; W178-L254 HydrophobicContact CZ3-CG 3.72Å; E250-L254 WeakPolarHBondContact O-CG 3.26Å; E250-L254 PolarHBondContact O-N 2.83Å; N251-L254 WeakPolarHBondContact O-CB 3.48Å; N251-L254 PolarHBondContact O-N 3.08Å; N251-L254 VanDerWaalsContact O-N 3.15Å; L254-L256 VanDerWaalsContact C-N 3.34Å; L254-L256 PolarHBondContact O-N 3.01Å; L254-L257 WeakPolarHBondContact O-CB 3.43Å; L254-L257 PolarHBondContact O-N 2.88Å; L254-E258 PolarHBondContact O-N 3.27Å
255	L	97.1	Very high	96.9	Very high	95 Å²	95	43.1 Å²	43.1	50%	0.497	22%	0.222	S	C	.	.	H	α-helix	trans	-63.9	-39.1	176.1	-69.3	173.2	0	0	0	111.9	F240 N251 E258 A259	F240-L255 HydrophobicContact CE2-CB 4.15Å; F240-L255 HydrophobicContact CZ-CB 3.82Å; N251-L255 WeakPolarHBondContact O-CG 3.47Å; N251-L255 PolarHBondContact O-N 3.11Å; L255-E258 PolarHBondContact O-N 3.48Å; L255-A259 WeakPolarHBondContact O-CB 3.28Å; L255-A259 PolarHBondContact O-N 3.29Å
256	L	97.8	Very high	96.8	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.6	-43.4	174	179.7	62.1	0	0	0	111.6	L181 L193 L235 F240 M248 D252 F253 L254 E258 A259 F260	L181-L256 HydrophobicContact CD1-CD2 3.81Å; L181-L256 HydrophobicContact CD1-CG 4.06Å; L181-L256 HydrophobicContact CD2-CB 4.33Å; L181-L256 HydrophobicContact CD2-CD2 4.16Å; L181-L256 HydrophobicContact CD2-CG 4.11Å; L181-L256 HydrophobicContact CG-CD2 4.34Å; L193-L256 HydrophobicContact CD1-CD1 4.37Å; L193-L256 HydrophobicContact CD1-CD2 3.62Å; L235-L256 HydrophobicContact CD2-CD1 3.68Å; F240-L256 HydrophobicContact CB-CD1 3.86Å; F240-L256 HydrophobicContact CD1-CB 4.4Å; F240-L256 HydrophobicContact CD1-CD1 4.33Å; F240-L256 HydrophobicContact CD2-CB 4.2Å; F240-L256 HydrophobicContact CD2-CD1 3.68Å; F240-L256 HydrophobicContact CE1-CB 4.25Å; F240-L256 HydrophobicContact CE2-CB 4.03Å; F240-L256 HydrophobicContact CE2-CD1 4.34Å; F240-L256 HydrophobicContact CG-CB 4.41Å; F240-L256 HydrophobicContact CG-CD1 3.7Å; F240-L256 HydrophobicContact CZ-CB 4.07Å; M248-L256 HydrophobicContact CE-CB 4.48Å; M248-L256 HydrophobicContact CE-CD2 4.03Å; D252-L256 WeakPolarHBondContact O-CB 3.5Å; D252-L256 PolarHBondContact O-N 3.45Å; F253-L256 HydrophobicContact CD1-CD2 4.21Å; F253-L256 HydrophobicContact CE1-CD2 4.39Å; F253-L256 PolarHBondContact O-N 3.31Å; L254-L256 VanDerWaalsContact C-N 3.34Å; L254-L256 PolarHBondContact O-N 3.01Å; L256-E258 VanDerWaalsContact C-N 3.34Å; L256-A259 PolarHBondContact O-N 2.83Å; L256-F260 HydrophobicContact CD1-CD2 3.89Å; L256-F260 HydrophobicContact CD1-CE2 3.57Å; L256-F260 HydrophobicContact CG-CD2 4.12Å; L256-F260 HydrophobicContact CG-CE2 4.06Å; L256-F260 VanDerWaalsContact O-CD2 3.31Å; L256-F260 WeakPolarHBondContact O-CD2 3.26Å; L256-F260 PolarHBondContact O-N 2.92Å
257	L	97.3	Very high	96.8	Very high	7 Å²	7	40.6 Å²	40.6	4%	0.037	22%	0.215	C	C	.	.	H	α-helix	trans	-62.2	-43.3	178.1	-176.2	59.3	0	0	0	111.1	V173 E177 W178 L181 F253 L254 F260 N261 F267	V173-L257 HydrophobicContact CG2-CD2 3.66Å; E177-L257 HydrophobicContact CB-CD1 4.43Å; W178-L257 HydrophobicContact CE3-CD2 4.41Å; L181-L257 HydrophobicContact CB-CD1 4.41Å; L181-L257 HydrophobicContact CD2-CB 3.72Å; L181-L257 HydrophobicContact CD2-CD1 4.12Å; L181-L257 HydrophobicContact CD2-CG 4.46Å; F253-L257 WeakPolarHBondContact O-CB 3.26Å; F253-L257 PolarHBondContact O-N 3.45Å; L254-L257 WeakPolarHBondContact O-CB 3.43Å; L254-L257 PolarHBondContact O-N 2.88Å; L257-F260 PolarHBondContact O-N 2.86Å; L257-N261 WeakPolarHBondContact O-CB 3.46Å; L257-N261 VanDerWaalsContact O-CG 3.24Å; L257-N261 PolarHBondContact O-N 2.82Å; L257-N261 PolarHBondContact O-OD1 3.04Å; L257-F267 HydrophobicContact CD1-CD2 3.67Å; L257-F267 HydrophobicContact CD1-CE2 3.8Å
258	E	95.8	Very high	96.2	Very high	125 Å²	125	41 Å²	41	58%	0.584	22%	0.219	S	C	*	.	H	α-helix	trans	-61.6	-43.3	174.7	-176.4	-179.5	-168.7	0	0	112.2	L254 L255 L256 F260 N261 S262	L254-E258 PolarHBondContact O-N 3.27Å; L255-E258 PolarHBondContact O-N 3.48Å; L256-E258 VanDerWaalsContact C-N 3.34Å; E258-F260 PolarHBondContact O-N 2.88Å; E258-N261 PolarHBondContact O-N 3.32Å; E258-S262 VanDerWaalsContact O-CB 3.27Å; E258-S262 WeakPolarHBondContact O-CB 3.47Å; E258-S262 PolarHBondContact O-N 3.4Å; E258-S262 PolarHBondContact O-OG 2.96Å
259	A	96.4	Very high	96.1	Very high	12 Å²	12	43 Å²	43	10%	0.099	23%	0.23	C	C	.	.	H	α-helix	trans	-59.6	-33.5	178.8	0	0	0	0	0	113	L255 L256 S262 R263	L255-A259 WeakPolarHBondContact O-CB 3.28Å; L255-A259 PolarHBondContact O-N 3.29Å; L256-A259 PolarHBondContact O-N 2.83Å; A259-S262 PolarHBondContact O-OG 2.92Å; A259-R263 PolarHBondContact O-NH1 2.85Å; A259-R263 VanDerWaalsContact O-NH1 3.16Å
260	F	97.4	Very high	96	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-79.8	-50	173.2	-82.1	-69.8	0	0	0	112.7	L181 F197 V231 A234 L235 L256 L257 E258 S262 R263 G264 F265 F267	L181-F260 HydrophobicContact CD1-CD2 4.32Å; L181-F260 HydrophobicContact CD1-CE2 4.37Å; F197-F260 HydrophobicContact CD1-CZ 4.17Å; F197-F260 HydrophobicContact CD2-CZ 4.48Å; F197-F260 HydrophobicContact CE1-CE2 4.47Å; F197-F260 HydrophobicContact CE1-CZ 4.33Å; F197-F260 HydrophobicContact CE2-CE2 4.43Å; F197-F260 HydrophobicContact CG-CZ 4.28Å; F197-F260 HydrophobicContact CZ-CE2 4.32Å; V231-F260 HydrophobicContact CB-CE1 4.44Å; V231-F260 HydrophobicContact CG1-CE1 3.99Å; V231-F260 HydrophobicContact CG1-CZ 4.27Å; V231-F260 HydrophobicContact CG2-CE1 4.34Å; A234-F260 HydrophobicContact CB-CD1 3.98Å; A234-F260 HydrophobicContact CB-CE1 3.96Å; L235-F260 HydrophobicContact CD2-CE2 3.89Å; L235-F260 HydrophobicContact CD2-CZ 3.84Å; L235-F260 HydrophobicContact CG-CZ 4.04Å; L256-F260 HydrophobicContact CD1-CD2 3.89Å; L256-F260 HydrophobicContact CD1-CE2 3.57Å; L256-F260 HydrophobicContact CG-CD2 4.12Å; L256-F260 HydrophobicContact CG-CE2 4.06Å; L256-F260 VanDerWaalsContact O-CD2 3.31Å; L256-F260 WeakPolarHBondContact O-CD2 3.26Å; L256-F260 PolarHBondContact O-N 2.92Å; L257-F260 PolarHBondContact O-N 2.86Å; E258-F260 PolarHBondContact O-N 2.88Å; F260-S262 VanDerWaalsContact C-N 3.31Å; F260-S262 PolarHBondContact O-N 2.85Å; F260-R263 CarbonylContact O-C 3.47Å; F260-R263 WeakPolarHBondContact O-CA 3.4Å; F260-R263 PolarHBondContact O-N 3.43Å; F260-G264 PolarHBondContact O-N 3.31Å; F260-F265 CarbonylContact C-O 3.34Å; F260-F265 HydrophobicContact CB-CB 4.02Å; F260-F265 HydrophobicContact CD1-CB 3.76Å; F260-F265 HydrophobicContact CD1-CD2 4.21Å; F260-F265 HydrophobicContact CD1-CG 4.17Å; F260-F265 HydrophobicContact CG-CB 4.36Å; F260-F265 PolarHBondContact O-N 3.12Å; F260-F267 HydrophobicContact CB-CE2 3.77Å; F260-F267 HydrophobicContact CB-CZ 3.95Å; F260-F267 HydrophobicContact CD1-CZ 4.2Å; F260-F267 HydrophobicContact CD2-CE2 4.06Å; F260-F267 AromaticContact CD2-CZ 3.55Å; F260-F267 HydrophobicContact CD2-CZ 3.55Å; F260-F267 HydrophobicContact CE2-CZ 4.02Å; F260-F267 AromaticContact CG-CE2 4Å; F260-F267 HydrophobicContact CG-CE2 4Å; F260-F267 AromaticContact CG-CZ 3.65Å; F260-F267 HydrophobicContact CG-CZ 3.65Å
261	N	95.6	Very high	96	Very high	54 Å²	54	43.3 Å²	43.3	29%	0.289	23%	0.233	S	C	.	.	H	α-helix	trans	-62.2	-38.1	-176.1	-73.4	-1.8	0	0	0	112.1	L257 E258 R263 G264 F265	L257-N261 WeakPolarHBondContact O-CB 3.46Å; L257-N261 VanDerWaalsContact O-CG 3.24Å; L257-N261 PolarHBondContact O-N 2.82Å; L257-N261 PolarHBondContact O-OD1 3.04Å; E258-N261 PolarHBondContact O-N 3.32Å; N261-R263 PolarHBondContact O-N 2.96Å; N261-R263 VanDerWaalsContact O-N 3.13Å; N261-G264 PolarHBondContact O-N 3.47Å; N261-F265 PolarHBondContact OD1-O 3.08Å; N261-F265 VanDerWaalsContact OD1-O 3.12Å
262	S	94.5	Very high	96	Very high	86 Å²	86	39.9 Å²	39.9	60%	0.601	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-17.2	175.5	55.4	0	0	0	0	113.8	E258 A259 F260	E258-S262 VanDerWaalsContact O-CB 3.27Å; E258-S262 WeakPolarHBondContact O-CB 3.47Å; E258-S262 PolarHBondContact O-N 3.4Å; E258-S262 PolarHBondContact O-OG 2.96Å; A259-S262 PolarHBondContact O-OG 2.92Å; F260-S262 VanDerWaalsContact C-N 3.31Å; F260-S262 PolarHBondContact O-N 2.85Å
263	R	95	Very high	95.8	Very high	84 Å²	84	40.6 Å²	40.6	32%	0.317	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	11.2	175.4	-68.9	172.5	170.5	70.1	3.3	112.8	Y210 D233 S237 A259 F260 N261 F265	Y210-R263 VanDerWaalsContact CE2-O 3.28Å; Y210-R263 WeakPolarHBondContact CE2-O 3.47Å; D233-R263 IonicContact OD2-CZ 3.92Å; D233-R263 IonicContact OD2-NE 3.92Å; D233-R263 PolarHBondContact OD2-NE 2.82Å; D233-R263 IonicContact OD2-NH2 2.72Å; D233-R263 PolarHBondContact OD2-NH2 3.48Å; D233-R263 VanDerWaalsContact OD2-NH2 3.1Å; S237-R263 VanDerWaalsContact OG-CZ 3.31Å; S237-R263 PolarHBondContact OG-NH2 3.2Å; A259-R263 PolarHBondContact O-NH1 2.85Å; A259-R263 VanDerWaalsContact O-NH1 3.16Å; F260-R263 CarbonylContact O-C 3.47Å; F260-R263 WeakPolarHBondContact O-CA 3.4Å; F260-R263 PolarHBondContact O-N 3.43Å; N261-R263 PolarHBondContact O-N 2.96Å; N261-R263 VanDerWaalsContact O-N 3.13Å; R263-F265 VanDerWaalsContact C-N 3.3Å; R263-F265 HydrophobicContact CB-CD2 4.02Å; R263-F265 HydrophobicContact CB-CE2 4.46Å; R263-F265 PolarHBondContact O-N 3.25Å
264	G	95.4	Very high	95.7	Very high	5 Å²	5	43.3 Å²	43.3	5%	0.052	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.4	9.8	-179.5	0	0	0	0	0	114.9	Y210 F260 N261 H266	Y210-G264 WeakPolarHBondContact CD2-O 3.33Å; F260-G264 PolarHBondContact O-N 3.31Å; N261-G264 PolarHBondContact O-N 3.47Å; G264-H266 PolarHBondContact O-CD2 3.21Å
265	F	96.8	Very high	95.6	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.009	23%	0.228	C	C	.	.			trans	-87.7	119.8	174.9	-73.6	-68.9	0	0	0	111	L206 Y210 F225 V227 A230 V231 F260 N261 R263	L206-F265 HydrophobicContact CB-CD1 4.06Å; L206-F265 HydrophobicContact CB-CE1 4.36Å; Y210-F265 HydrophobicContact CD2-CD1 4.09Å; Y210-F265 AromaticContact CD2-CE1 3.93Å; Y210-F265 HydrophobicContact CD2-CE1 3.93Å; Y210-F265 HydrophobicContact CD2-CG 4.44Å; Y210-F265 HydrophobicContact CD2-CZ 4.15Å; Y210-F265 HydrophobicContact CG-CD1 4.26Å; Y210-F265 AromaticContact CG-CE1 3.86Å; Y210-F265 HydrophobicContact CG-CE1 3.86Å; Y210-F265 HydrophobicContact CG-CZ 4.32Å; F225-F265 HydrophobicContact CZ-CZ 4.12Å; V227-F265 HydrophobicContact CG2-CE1 3.91Å; V227-F265 HydrophobicContact CG2-CZ 4.27Å; A230-F265 HydrophobicContact CB-CE2 3.82Å; A230-F265 HydrophobicContact CB-CZ 3.74Å; V231-F265 HydrophobicContact CG2-CD1 4.32Å; V231-F265 HydrophobicContact CG2-CE1 3.93Å; V231-F265 HydrophobicContact CG2-CE2 4.22Å; V231-F265 HydrophobicContact CG2-CZ 3.87Å; F260-F265 CarbonylContact C-O 3.34Å; F260-F265 HydrophobicContact CB-CB 4.02Å; F260-F265 HydrophobicContact CD1-CB 3.76Å; F260-F265 HydrophobicContact CD1-CD2 4.21Å; F260-F265 HydrophobicContact CD1-CG 4.17Å; F260-F265 HydrophobicContact CG-CB 4.36Å; F260-F265 PolarHBondContact O-N 3.12Å; N261-F265 PolarHBondContact OD1-O 3.08Å; N261-F265 VanDerWaalsContact OD1-O 3.12Å; R263-F265 VanDerWaalsContact C-N 3.3Å; R263-F265 HydrophobicContact CB-CD2 4.02Å; R263-F265 HydrophobicContact CB-CE2 4.46Å; R263-F265 PolarHBondContact O-N 3.25Å
266	H	96.6	Very high	95.5	Very high	48 Å²	48	38.2 Å²	38.2	22%	0.222	21%	0.208	C	C	.	.			trans	-119.6	150.9	-178.5	-69.1	-81.1	0	0	0	111.3	E177 N209 H213 G264	E177-H266 WeakPolarHBondContact OE1-CB 3.17Å; E177-H266 IonicContact OE1-CG 2.67Å; E177-H266 IonicContact OE1-ND1 3.87Å; E177-H266 PolarHBondContact OE1-ND1 3.43Å; N209-H266 WeakPolarHBondContact CB-O 3.36Å; N209-H266 PolarHBondContact ND2-O 2.97Å; H213-H266 AromaticContact CE1-NE2 3.72Å; H213-H266 AromaticContact CG-CD2 3.95Å; H213-H266 AromaticContact ND1-CD2 3.56Å; H213-H266 AromaticContact ND1-NE2 3.24Å; H213-H266 PolarHBondContact ND1-NE2 3.34Å; G264-H266 PolarHBondContact O-CD2 3.21Å
267	F	96.9	Very high	95.3	Very high	5 Å²	5	41.4 Å²	41.4	2%	0.022	23%	0.225	C	C	.	.			trans	-107.5	-2	-172.9	-63.1	-80.9	0	0	0	114.5	E177 L181 L184 F197 L206 L257 F260	E177-F267 WeakPolarHBondContact OE2-CA 3.28Å; E177-F267 WeakPolarHBondContact OE2-CB 3.45Å; E177-F267 PolarHBondContact OE2-N 3.11Å; L181-F267 HydrophobicContact CB-CD1 4.11Å; L181-F267 HydrophobicContact CB-CD2 3.83Å; L181-F267 HydrophobicContact CB-CE1 4.25Å; L181-F267 HydrophobicContact CB-CE2 3.99Å; L181-F267 HydrophobicContact CB-CG 3.9Å; L181-F267 HydrophobicContact CB-CZ 4.2Å; L181-F267 HydrophobicContact CD1-CD1 4.35Å; L181-F267 HydrophobicContact CD1-CD2 4.43Å; L181-F267 HydrophobicContact CD1-CE1 3.65Å; L181-F267 HydrophobicContact CD1-CE2 3.75Å; L181-F267 HydrophobicContact CD1-CZ 3.31Å; L181-F267 HydrophobicContact CG-CE2 4.31Å; L181-F267 HydrophobicContact CG-CZ 4.29Å; L184-F267 HydrophobicContact CD1-CD1 3.72Å; L184-F267 HydrophobicContact CD1-CE1 3.93Å; F197-F267 AromaticContact CE1-CE1 3.84Å; F197-F267 HydrophobicContact CE1-CE1 3.84Å; F197-F267 HydrophobicContact CE1-CZ 4.45Å; F197-F267 HydrophobicContact CZ-CE1 4.35Å; L206-F267 HydrophobicContact CD2-CD1 3.95Å; L206-F267 HydrophobicContact CD2-CE1 3.69Å; L206-F267 HydrophobicContact CD2-CZ 4.34Å; L257-F267 HydrophobicContact CD1-CD2 3.67Å; L257-F267 HydrophobicContact CD1-CE2 3.8Å; F260-F267 HydrophobicContact CB-CE2 3.77Å; F260-F267 HydrophobicContact CB-CZ 3.95Å; F260-F267 HydrophobicContact CD1-CZ 4.2Å; F260-F267 HydrophobicContact CD2-CE2 4.06Å; F260-F267 AromaticContact CD2-CZ 3.55Å; F260-F267 HydrophobicContact CD2-CZ 3.55Å; F260-F267 HydrophobicContact CE2-CZ 4.02Å; F260-F267 AromaticContact CG-CE2 4Å; F260-F267 HydrophobicContact CG-CE2 4Å; F260-F267 AromaticContact CG-CZ 3.65Å; F260-F267 HydrophobicContact CG-CZ 3.65Å
268	C	86.3	Confident	95.1	Very high	69 Å²	69	44.5 Å²	44.5	47%	0.466	24%	0.242	S	C	.	.			trans	-119.4	0	-174.7	85	0	0	0	0	115.6	K176 E177 N209	K176-C268 HydrophobicContact CB-CB 4.21Å; K176-C268 HydrophobicContact CD-CB 3.69Å; K176-C268 HydrophobicContact CG-CB 3.71Å; K176-C268 PolarHBondContact NZ-OXT 3.47Å; E177-C268 VanDerWaalsContact CD-SG 3.56Å; E177-C268 HydrophobicContact CG-CB 4.33Å; E177-C268 PolarHBondContact OE1-SG 2.91Å; N209-C268 PolarHBondContact ND2-O 3.31Å; N209-C268 VanDerWaalsContact ND2-O 3.14Å

Retrieved 268 of 268 residues in 289.3 ms (Link to these results)

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