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Heterogeneous nuclear ribonucleoprotein A1

Involved in the packaging of pre-mRNA into hnRNP particles, transport of poly(A) mRNA from the nucleus to the cytoplasm and modulation of splice site selection. Plays a role in the splicing of pyruvate kinase PKM by binding repressively to sequences flanking PKM exon 9, inhibiting exon 9 inclusion and resulting in exon 10 inclusion and production of the PKM M2 isoform. Binds to the IRES and thereby inhibits the translation of the apoptosis protease activating factor APAF1. May bind to specific miRNA hairpins.

AlphaFold DB , UniProt , Accession P09867, Species BOVIN (Bos taurus, Bovine), Gene HNRNPA1, Length 320 aa.

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.4	Very low	58.4	Low	249 Å²	249	131.9 Å²	131.9	100%	1.227	72%	0.717	S	S	*	*				0	98.7	0	-76	167.3	170.6	0	0	107.8	K3	M1-K3 PolarHBondContact O-N 3.15Å
2	S	41.3	Very low	61	Low	126 Å²	126	125.8 Å²	125.8	88%	0.881	68%	0.68	S	S	*	*			trans	-74.3	111.3	175.2	23	0	0	0	0	108.7	S4	S2-S4 PolarHBondContact O-N 3.29Å
3	K	41.5	Very low	63.4	Low	204 Å²	204	120.6 Å²	120.6	89%	0.887	65%	0.652	S	S	*	*			trans	-61.3	116.7	169.8	-110.5	177.1	176.1	179.3	0	107.4	M1 E5	M1-K3 PolarHBondContact O-N 3.15Å; K3-E5 PolarHBondContact O-N 2.76Å; K3-E5 VanDerWaalsContact O-N 3.11Å
4	S	40.2	Very low	65.7	Low	112 Å²	112	113.6 Å²	113.6	78%	0.783	61%	0.611	S	S	*	*			trans	-52.8	113.4	168.2	49.3	0	0	0	0	108.8	S2 S6	S2-S4 PolarHBondContact O-N 3.29Å; S4-S6 PolarHBondContact O-N 2.86Å; S4-S6 VanDerWaalsContact O-N 3.16Å
5	E	46	Very low	67.8	Low	141 Å²	141	108.5 Å²	108.5	66%	0.659	58%	0.581	S	S	*	*			trans	-76.6	99.5	-178.8	-153.9	170.4	-164.6	0	0	107.6	K3 K8	K3-E5 PolarHBondContact O-N 2.76Å; K3-E5 VanDerWaalsContact O-N 3.11Å; E5-K8 HydrophobicContact CG-CD 4Å; E5-K8 HydrophobicContact CG-CG 4.18Å; E5-K8 WeakPolarHBondContact OE1-CD 3.32Å; E5-K8 WeakPolarHBondContact OE1-CE 3.4Å; E5-K8 IonicContact OE1-NZ 3.16Å; E5-K8 PolarHBondContact OE1-NZ 3.28Å
6	S	52.7	Low	69.7	Low	91 Å²	91	101.8 Å²	101.8	64%	0.636	55%	0.545	S	S	*	.			trans	-47.7	147.7	165.4	-29.1	0	0	0	0	108.6	S4 K8	S4-S6 PolarHBondContact O-N 2.86Å; S4-S6 VanDerWaalsContact O-N 3.16Å; S6-K8 PolarHBondContact O-N 3.18Å
7	P	53.7	Low	71.3	Confident	133 Å²	133	98 Å²	98	86%	0.864	52%	0.523	S	S	*	.			trans	-54.5	104	175.1	22.7	-31.5	0	0	0	108.4	E9	P7-E9 PolarHBondContact O-N 3.41Å
8	K	67.6	Low	72.8	Confident	135 Å²	135	92.6 Å²	92.6	59%	0.587	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-65.2	129.3	-172.8	-78.7	177.1	167.3	173.5	0	107.7	E5 S6	E5-K8 HydrophobicContact CG-CD 4Å; E5-K8 HydrophobicContact CG-CG 4.18Å; E5-K8 WeakPolarHBondContact OE1-CD 3.32Å; E5-K8 WeakPolarHBondContact OE1-CE 3.4Å; E5-K8 IonicContact OE1-NZ 3.16Å; E5-K8 PolarHBondContact OE1-NZ 3.28Å; S6-K8 PolarHBondContact O-N 3.18Å
9	E	81.5	Confident	74.1	Confident	79 Å²	79	87.7 Å²	87.7	37%	0.369	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-49.2	141.4	172.7	-60.1	166.6	134.4	0	0	109.5	P7 E11 R14 T64 V65	P7-E9 PolarHBondContact O-N 3.41Å; E9-E11 PolarHBondContact O-N 2.78Å; E9-R14 HydrophobicContact CB-CG 4.29Å; E9-R14 PolarHBondContact O-NE 3.38Å; E9-R14 PolarHBondContact O-NH2 2.72Å; E9-R14 VanDerWaalsContact O-NH2 3.15Å; E9-T64 WeakPolarHBondContact OE2-CA 3.33Å; E9-V65 HydrophobicContact CB-CG2 4.14Å; E9-V65 VanDerWaalsContact CD-CG2 3.49Å; E9-V65 HydrophobicContact CG-CG2 4.35Å; E9-V65 VanDerWaalsContact OE2-CG2 3.3Å; E9-V65 WeakPolarHBondContact OE2-CG2 3.49Å; E9-V65 PolarHBondContact OE2-N 3.14Å
10	P	89.5	Confident	75.2	Confident	83 Å²	83	84.7 Å²	84.7	54%	0.539	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-47.7	134.3	179.7	-27.6	31.6	0	0	0	111.7	Q12 L13	P10-Q12 PolarHBondContact O-N 3.39Å; P10-L13 HydrophobicContact CB-CG 4.34Å; P10-L13 HydrophobicContact CG-CD1 4.21Å; P10-L13 PolarHBondContact O-N 2.82Å
11	E	90.6	Very high	76.3	Confident	98 Å²	98	80.9 Å²	80.9	46%	0.458	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-51	-38	-179.4	-170.8	-162.5	139.4	0	0	111.6	E9 L13 R14 K15 T61	E9-E11 PolarHBondContact O-N 2.78Å; E11-L13 VanDerWaalsContact C-N 3.25Å; E11-L13 PolarHBondContact O-N 2.91Å; E11-R14 CarbonylContact O-C 3.58Å; E11-R14 WeakPolarHBondContact O-CA 3.35Å; E11-R14 PolarHBondContact O-N 3.31Å; E11-K15 WeakPolarHBondContact O-CB 3.42Å; E11-K15 PolarHBondContact O-N 3.42Å; E11-K15 VanDerWaalsContact O-N 3.14Å; E11-K15 IonicContact OE1-NZ 2.88Å; E11-K15 PolarHBondContact OE1-NZ 3.23Å; E11-T61 HydrophobicContact CG-CG2 3.67Å
12	Q	90.1	Very high	79.1	Confident	58 Å²	58	70.1 Å²	70.1	27%	0.271	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-54.9	-37.6	178.4	-170.8	62	52.9	0	0	113.5	P10 R14 A89 V90	P10-Q12 PolarHBondContact O-N 3.39Å; Q12-R14 VanDerWaalsContact C-N 3.31Å; Q12-A89 PolarHBondContact NE2-O 3.39Å; Q12-V90 PolarHBondContact NE2-O 2.77Å
13	L	92.6	Very high	81.7	Confident	59 Å²	59	70.7 Å²	70.7	31%	0.309	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-75.5	-24.9	179.2	-61.7	-178.4	0	0	0	112.3	P10 E11 V65 I164	P10-L13 HydrophobicContact CB-CG 4.34Å; P10-L13 HydrophobicContact CG-CD1 4.21Å; P10-L13 PolarHBondContact O-N 2.82Å; E11-L13 VanDerWaalsContact C-N 3.25Å; E11-L13 PolarHBondContact O-N 2.91Å; L13-V65 HydrophobicContact CB-CG2 3.65Å; L13-I164 HydrophobicContact CD2-CB 4.3Å; L13-I164 HydrophobicContact CD2-CD1 4.02Å; L13-I164 HydrophobicContact CD2-CG2 3.47Å; L13-I164 VanDerWaalsContact CD2-CG2 3.47Å
14	R	95.4	Very high	84.2	Confident	23 Å²	23	68.7 Å²	68.7	9%	0.087	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-94.7	3.3	-178.2	-63.9	-172.9	-72.3	104.9	1.1	113.5	E9 E11 Q12 T61 Y62 A63 V65 V68	E9-R14 HydrophobicContact CB-CG 4.29Å; E9-R14 PolarHBondContact O-NE 3.38Å; E9-R14 PolarHBondContact O-NH2 2.72Å; E9-R14 VanDerWaalsContact O-NH2 3.15Å; E11-R14 CarbonylContact O-C 3.58Å; E11-R14 WeakPolarHBondContact O-CA 3.35Å; E11-R14 PolarHBondContact O-N 3.31Å; Q12-R14 VanDerWaalsContact C-N 3.31Å; R14-T61 HydrophobicContact CB-CG2 4.35Å; R14-T61 CarbonylContact O-C 3.45Å; R14-T61 WeakPolarHBondContact O-CA 3.4Å; R14-Y62 PolarHBondContact NH1-O 3.38Å; R14-Y62 PolarHBondContact O-N 2.87Å; R14-A63 WeakPolarHBondContact CD-O 3.4Å; R14-V65 HydrophobicContact CG-CG2 3.75Å; R14-V68 VanDerWaalsContact C-CG2 3.5Å; R14-V68 HydrophobicContact CB-CG2 4.46Å; R14-V68 WeakPolarHBondContact O-CG2 3.38Å
15	K	96.7	Very high	86.9	Confident	37 Å²	37	63.4 Å²	63.4	16%	0.161	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130.1	-172.4	-167.7	171	-153.8	148	0	111.4	E11 F59 V60 T61 A89	E11-K15 WeakPolarHBondContact O-CB 3.42Å; E11-K15 PolarHBondContact O-N 3.42Å; E11-K15 VanDerWaalsContact O-N 3.14Å; E11-K15 IonicContact OE1-NZ 2.88Å; E11-K15 PolarHBondContact OE1-NZ 3.23Å; K15-F59 HydrophobicContact CD-CD1 4.35Å; K15-F59 HydrophobicContact CG-CB 4.46Å; K15-F59 HydrophobicContact CG-CD1 4.27Å; K15-V60 CarbonylContact C-O 3.58Å; K15-V60 WeakPolarHBondContact CA-O 3.03Å; K15-T61 HydrophobicContact CB-CG2 4.42Å; K15-A89 HydrophobicContact CB-CB 3.86Å; K15-A89 HydrophobicContact CD-CB 4.23Å; K15-A89 HydrophobicContact CG-CB 3.81Å; K15-A89 VanDerWaalsContact O-CB 3.25Å; K15-A89 WeakPolarHBondContact O-CB 3.21Å; K15-A89 PolarHBondContact O-N 3Å
16	L	97.7	Very high	89.4	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	138.2	171.7	-66.5	180	0	0	0	110.5	I18 F59 V60 Y62 V68 A71 M72 K87 R88	L16-I18 HydrophobicContact CB-CD1 3.9Å; L16-F59 VanDerWaalsContact O-CA 3.24Å; L16-F59 WeakPolarHBondContact O-CA 3.48Å; L16-V60 HydrophobicContact CB-CG2 3.79Å; L16-V60 HydrophobicContact CD1-CG2 4.4Å; L16-V60 PolarHBondContact N-O 3.01Å; L16-V60 PolarHBondContact O-N 3.35Å; L16-Y62 HydrophobicContact CD1-CE2 4.07Å; L16-V68 HydrophobicContact CD1-CG1 4.22Å; L16-V68 HydrophobicContact CD2-CG1 3.53Å; L16-V68 HydrophobicContact CG-CG1 3.86Å; L16-A71 HydrophobicContact CD1-CB 4.14Å; L16-M72 HydrophobicContact CD1-CG 4.32Å; L16-M72 HydrophobicContact CD1-SD 4.08Å; L16-M72 HydrophobicContact CD2-CG 3.97Å; L16-M72 HydrophobicContact CD2-SD 3.67Å; L16-K87 CarbonylContact C-O 3.57Å; L16-K87 VanDerWaalsContact CA-O 3.32Å; L16-K87 WeakPolarHBondContact CA-O 3.22Å; L16-K87 WeakPolarHBondContact CD2-O 3.41Å; L16-R88 HydrophobicContact CD2-CG 4.25Å
17	F	97.6	Very high	91.5	Very high	38 Å²	38	57.2 Å²	57.2	17%	0.167	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	129.7	160.8	168.1	-92.2	0	0	0	108.5	G19 F57 F59 P86 K87	F17-G19 VanDerWaalsContact CE1-CA 3.49Å; F17-F57 HydrophobicContact CD2-CD2 4.11Å; F17-F57 HydrophobicContact CE2-CB 3.8Å; F17-F57 AromaticContact CE2-CD2 3.44Å; F17-F57 HydrophobicContact CE2-CD2 3.44Å; F17-F57 VanDerWaalsContact CE2-CD2 3.44Å; F17-F57 HydrophobicContact CE2-CE2 4.22Å; F17-F57 AromaticContact CE2-CG 3.85Å; F17-F57 HydrophobicContact CE2-CG 3.85Å; F17-F57 HydrophobicContact CZ-CB 3.88Å; F17-F57 HydrophobicContact CZ-CD2 4.33Å; F17-F57 HydrophobicContact CZ-CG 4.31Å; F17-F59 HydrophobicContact CB-CD1 4.19Å; F17-F59 HydrophobicContact CB-CE1 3.89Å; F17-F59 AromaticContact CD2-CE1 3.85Å; F17-F59 HydrophobicContact CD2-CE1 3.85Å; F17-F59 AromaticContact CD2-CZ 3.88Å; F17-F59 HydrophobicContact CD2-CZ 3.88Å; F17-F59 HydrophobicContact CG-CE1 4.38Å; F17-P86 CarbonylContact O-C 3.52Å; F17-P86 WeakPolarHBondContact O-CA 3.43Å; F17-K87 HydrophobicContact CD1-CB 4.42Å; F17-K87 PolarHBondContact N-O 3.06Å; F17-K87 PolarHBondContact O-N 2.83Å
18	I	98.1	Very high	93.6	Very high	0 Å²	0	57 Å²	57	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	104	176.9	-45.5	-58.5	0	0	0	108.7	L16 L21 L30 F34 F57 G58 V60 V84 P86	L16-I18 HydrophobicContact CB-CD1 3.9Å; I18-L21 HydrophobicContact CB-CD2 4.27Å; I18-L21 HydrophobicContact CG2-CD2 3.48Å; I18-L21 VanDerWaalsContact CG2-CD2 3.48Å; I18-L21 HydrophobicContact CG2-CG 4.24Å; I18-L30 HydrophobicContact CG1-CD1 4.47Å; I18-L30 HydrophobicContact CG2-CD1 4.28Å; I18-F34 HydrophobicContact CD1-CE1 3.92Å; I18-F34 HydrophobicContact CD1-CE2 3.91Å; I18-F34 HydrophobicContact CD1-CZ 3.5Å; I18-F34 VanDerWaalsContact CD1-CZ 3.5Å; I18-F34 HydrophobicContact CG1-CE2 4Å; I18-F34 HydrophobicContact CG1-CZ 4.1Å; I18-F34 HydrophobicContact CG2-CE2 4.01Å; I18-F34 HydrophobicContact CG2-CZ 4.11Å; I18-F57 CarbonylContact O-C 3.59Å; I18-F57 WeakPolarHBondContact O-CA 3.38Å; I18-F57 WeakPolarHBondContact O-CB 3.11Å; I18-G58 PolarHBondContact N-O 2.83Å; I18-G58 PolarHBondContact O-N 3.13Å; I18-V60 HydrophobicContact CD1-CG2 3.95Å; I18-V60 HydrophobicContact CG1-CG1 4.25Å; I18-V60 HydrophobicContact CG1-CG2 4.13Å; I18-V84 HydrophobicContact CG2-CB 3.89Å; I18-V84 HydrophobicContact CG2-CG1 4.47Å; I18-V84 HydrophobicContact CG2-CG2 3.9Å; I18-P86 HydrophobicContact CD1-CB 3.7Å
19	G	97.2	Very high	95	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.01	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	156.7	177	0	0	0	0	0	112.9	F17 L21 V84 E85	F17-G19 VanDerWaalsContact CE1-CA 3.49Å; G19-L21 PolarHBondContact O-N 3.03Å; G19-V84 WeakPolarHBondContact O-CA 3.31Å; G19-V84 WeakPolarHBondContact O-CB 3.4Å; G19-E85 PolarHBondContact N-O 3.43Å; G19-E85 PolarHBondContact O-N 2.79Å
20	G	96.4	Very high	95.8	Very high	27 Å²	27	48 Å²	48	28%	0.278	25%	0.247	S	C	.	.	S	Bend	trans	74.4	24.1	171.1	0	0	0	0	0	114.6	G56 R82	G20-G56 PolarHBondContact N-O 2.93Å; G20-R82 WeakPolarHBondContact O-CD 3.32Å; G20-R82 WeakPolarHBondContact O-CG 3.5Å; G20-R82 PolarHBondContact O-NE 2.91Å
21	L	97.7	Very high	96.2	Very high	5 Å²	5	47.9 Å²	47.9	3%	0.026	24%	0.236	C	C	.	.			trans	-59.2	152.4	174.5	-62.1	-177.9	0	0	0	111.5	I18 G19 T25 L30 V45 G56 V84	I18-L21 HydrophobicContact CB-CD2 4.27Å; I18-L21 HydrophobicContact CG2-CD2 3.48Å; I18-L21 VanDerWaalsContact CG2-CD2 3.48Å; I18-L21 HydrophobicContact CG2-CG 4.24Å; G19-L21 PolarHBondContact O-N 3.03Å; L21-T25 HydrophobicContact CB-CG2 4.44Å; L21-T25 HydrophobicContact CD1-CG2 4.2Å; L21-T25 HydrophobicContact CD2-CG2 4.24Å; L21-L30 HydrophobicContact CD1-CD1 4.43Å; L21-L30 HydrophobicContact CD1-CD2 4.17Å; L21-L30 HydrophobicContact CD2-CD1 3.8Å; L21-V45 HydrophobicContact CD1-CG1 4.24Å; L21-V45 HydrophobicContact CD1-CG2 4.12Å; L21-G56 PolarHBondContact N-O 3.19Å; L21-V84 HydrophobicContact CD2-CB 4.38Å; L21-V84 HydrophobicContact CD2-CG1 3.71Å
22	S	96.6	Very high	96.5	Very high	22 Å²	22	47.1 Å²	47.1	15%	0.154	24%	0.241	C	C	.	.			trans	-63.7	150.4	167.5	-176.4	0	0	0	0	109.5	E24 T25	S22-E24 PolarHBondContact O-N 3.48Å; S22-E24 PolarHBondContact OG-N 3.46Å; S22-T25 WeakPolarHBondContact CB-OG1 3.12Å; S22-T25 PolarHBondContact N-OG1 3.24Å; S22-T25 WeakPolarHBondContact O-CB 3.18Å; S22-T25 PolarHBondContact O-N 3.19Å; S22-T25 VanDerWaalsContact O-N 3.14Å; S22-T25 PolarHBondContact O-OG1 2.78Å
23	F	95.6	Very high	96.9	Very high	138 Å²	138	45.9 Å²	45.9	61%	0.605	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-18.6	172.7	-65.5	-50.1	0	0	0	112.6	S54	F23-S54 WeakPolarHBondContact CD1-O 3.49Å; F23-S54 WeakPolarHBondContact O-CB 3.37Å
24	E	95.1	Very high	97.2	Very high	163 Å²	163	43.1 Å²	43.1	76%	0.762	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-15.6	176.5	-62.2	177.5	173.7	0	0	112.8	S22 T26	S22-E24 PolarHBondContact O-N 3.48Å; S22-E24 PolarHBondContact OG-N 3.46Å; E24-T26 PolarHBondContact O-N 3.23Å
25	T	97.1	Very high	97.3	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.236	C	C	.	.			trans	-59.7	132.5	-179.7	-62.3	0	0	0	0	111.1	L21 S22 L30 V45 R47 V79 D80	L21-T25 HydrophobicContact CB-CG2 4.44Å; L21-T25 HydrophobicContact CD1-CG2 4.2Å; L21-T25 HydrophobicContact CD2-CG2 4.24Å; S22-T25 WeakPolarHBondContact CB-OG1 3.12Å; S22-T25 PolarHBondContact N-OG1 3.24Å; S22-T25 WeakPolarHBondContact O-CB 3.18Å; S22-T25 PolarHBondContact O-N 3.19Å; S22-T25 VanDerWaalsContact O-N 3.14Å; S22-T25 PolarHBondContact O-OG1 2.78Å; T25-L30 HydrophobicContact CG2-CB 4.04Å; T25-V45 HydrophobicContact CG2-CG2 4.11Å; T25-R47 PolarHBondContact O-NH2 2.85Å; T25-V79 HydrophobicContact CG2-CG1 4.1Å; T25-D80 WeakPolarHBondContact CA-OD2 3.29Å; T25-D80 VanDerWaalsContact CB-OD2 3.22Å; T25-D80 WeakPolarHBondContact CB-OD2 3.26Å; T25-D80 WeakPolarHBondContact CG2-OD2 3.17Å; T25-D80 PolarHBondContact OG1-OD2 3.26Å
26	T	97.1	Very high	97.3	Very high	48 Å²	48	50.5 Å²	50.5	29%	0.294	26%	0.257	S	S	.	.			trans	-110.2	169.4	177.8	77.7	0	0	0	0	111.1	E24 E28 S29 L30 V45	E24-T26 PolarHBondContact O-N 3.23Å; T26-E28 WeakPolarHBondContact CB-OE2 3.48Å; T26-E28 PolarHBondContact O-N 2.9Å; T26-E28 PolarHBondContact OG1-N 2.96Å; T26-E28 PolarHBondContact OG1-OE2 3.26Å; T26-S29 PolarHBondContact N-OG 3.41Å; T26-S29 PolarHBondContact O-N 2.98Å; T26-S29 PolarHBondContact O-OG 3.44Å; T26-S29 PolarHBondContact OG1-N 3.36Å; T26-L30 VanDerWaalsContact O-CB 3.29Å; T26-L30 WeakPolarHBondContact O-CB 3.13Å; T26-L30 PolarHBondContact O-N 3.27Å; T26-V45 WeakPolarHBondContact O-CG2 3.39Å
27	D	97.3	Very high	97.3	Very high	54 Å²	54	53.5 Å²	53.5	29%	0.289	27%	0.269	S	S	.	.	H	α-helix	trans	-62.7	-34	178.1	-59.2	-11	0	0	0	109.8	R31 C43 V45	D27-R31 WeakPolarHBondContact O-CB 3.47Å; D27-R31 PolarHBondContact O-N 2.97Å; D27-C43 PolarHBondContact O-SG 3.39Å; D27-C43 VanDerWaalsContact O-SG 3.37Å; D27-V45 WeakPolarHBondContact OD1-CA 3.42Å; D27-V45 WeakPolarHBondContact OD1-CB 2.99Å; D27-V45 WeakPolarHBondContact OD1-CG2 3.42Å; D27-V45 PolarHBondContact OD1-N 3.4Å
28	E	97.6	Very high	97.3	Very high	129 Å²	129	52.5 Å²	52.5	60%	0.603	27%	0.269	S	S	*	.	H	α-helix	trans	-71.6	-46.7	177.6	-55	75.5	-162.5	0	0	112.5	T26 L30 R31 S32	T26-E28 WeakPolarHBondContact CB-OE2 3.48Å; T26-E28 PolarHBondContact O-N 2.9Å; T26-E28 PolarHBondContact OG1-N 2.96Å; T26-E28 PolarHBondContact OG1-OE2 3.26Å; E28-L30 VanDerWaalsContact C-N 3.35Å; E28-R31 PolarHBondContact O-N 3.22Å; E28-S32 VanDerWaalsContact O-CB 3.29Å; E28-S32 WeakPolarHBondContact O-CB 3.35Å; E28-S32 PolarHBondContact O-N 3.32Å
29	S	97.4	Very high	97.3	Very high	26 Å²	26	56.9 Å²	56.9	18%	0.182	30%	0.295	C	S	.	.	H	α-helix	trans	-67.1	-39.2	179.3	70	0	0	0	0	111.4	T26 H33 D80	T26-S29 PolarHBondContact N-OG 3.41Å; T26-S29 PolarHBondContact O-N 2.98Å; T26-S29 PolarHBondContact O-OG 3.44Å; T26-S29 PolarHBondContact OG1-N 3.36Å; S29-H33 PolarHBondContact O-N 2.91Å; S29-H33 VanDerWaalsContact O-N 3.14Å; S29-D80 WeakPolarHBondContact CB-OD1 3.35Å; S29-D80 WeakPolarHBondContact CB-OD2 3.25Å; S29-D80 PolarHBondContact OG-OD2 3.33Å
30	L	98.1	Very high	97.3	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-62.9	-47.6	174.1	-174.4	65.2	0	0	0	111.4	I18 L21 T25 T26 E28 H33 F34 V45 V60 V79	I18-L30 HydrophobicContact CG1-CD1 4.47Å; I18-L30 HydrophobicContact CG2-CD1 4.28Å; L21-L30 HydrophobicContact CD1-CD1 4.43Å; L21-L30 HydrophobicContact CD1-CD2 4.17Å; L21-L30 HydrophobicContact CD2-CD1 3.8Å; T25-L30 HydrophobicContact CG2-CB 4.04Å; T26-L30 VanDerWaalsContact O-CB 3.29Å; T26-L30 WeakPolarHBondContact O-CB 3.13Å; T26-L30 PolarHBondContact O-N 3.27Å; E28-L30 VanDerWaalsContact C-N 3.35Å; L30-H33 PolarHBondContact O-N 3.13Å; L30-F34 HydrophobicContact CD1-CD2 3.59Å; L30-F34 HydrophobicContact CD1-CE2 3.52Å; L30-F34 HydrophobicContact CG-CD2 4.19Å; L30-F34 WeakPolarHBondContact O-CD2 3.43Å; L30-F34 PolarHBondContact O-N 2.84Å; L30-F34 VanDerWaalsContact O-N 3.09Å; L30-V45 HydrophobicContact CB-CG2 4.29Å; L30-V45 HydrophobicContact CD2-CG2 3.94Å; L30-V60 HydrophobicContact CD2-CG1 3.96Å; L30-V60 HydrophobicContact CG-CG1 3.94Å; L30-V79 HydrophobicContact CD1-CG1 4.42Å
31	R	98.2	Very high	97.3	Very high	79 Å²	79	59.7 Å²	59.7	30%	0.298	31%	0.307	S	S	.	.	H	α-helix	trans	-58.9	-52	177.1	173.6	-179.7	-72.1	-90.4	2.2	111	D27 E28 H33 F34 E35 L40 C43	D27-R31 WeakPolarHBondContact O-CB 3.47Å; D27-R31 PolarHBondContact O-N 2.97Å; E28-R31 PolarHBondContact O-N 3.22Å; R31-H33 PolarHBondContact O-N 2.85Å; R31-F34 PolarHBondContact O-N 3.01Å; R31-E35 VanDerWaalsContact CD-OE1 3.25Å; R31-E35 WeakPolarHBondContact CD-OE1 3.19Å; R31-E35 HydrophobicContact CG-CG 3.91Å; R31-E35 WeakPolarHBondContact CG-OE1 3.45Å; R31-E35 IonicContact CZ-OE1 3.8Å; R31-E35 IonicContact NE-OE1 2.59Å; R31-E35 IonicContact NH1-OE1 3.97Å; R31-E35 PolarHBondContact NH1-OE1 3.03Å; R31-E35 WeakPolarHBondContact O-CB 3.37Å; R31-E35 WeakPolarHBondContact O-CG 2.95Å; R31-E35 PolarHBondContact O-N 2.78Å; R31-L40 HydrophobicContact CB-CD1 4.33Å; R31-L40 HydrophobicContact CG-CD1 4.16Å; R31-L40 PolarHBondContact NH1-O 3.16Å; R31-C43 HydrophobicContact CB-CB 4.11Å
32	S	97.7	Very high	97.3	Very high	82 Å²	82	62.6 Å²	62.6	57%	0.573	32%	0.323	S	S	*	.	H	α-helix	trans	-58.6	-31.4	-178.2	-176.9	0	0	0	0	112.8	E28	E28-S32 VanDerWaalsContact O-CB 3.29Å; E28-S32 WeakPolarHBondContact O-CB 3.35Å; E28-S32 PolarHBondContact O-N 3.32Å
33	H	98.2	Very high	97.3	Very high	33 Å²	33	62.1 Å²	62.1	15%	0.153	32%	0.319	C	S	.	.	H	α-helix	trans	-73.7	-53.2	174.8	-174	81.5	0	0	0	111.7	S29 L30 R31 E35 Q36 W37 H77 K78 V79	S29-H33 PolarHBondContact O-N 2.91Å; S29-H33 VanDerWaalsContact O-N 3.14Å; L30-H33 PolarHBondContact O-N 3.13Å; R31-H33 PolarHBondContact O-N 2.85Å; H33-E35 PolarHBondContact O-N 2.66Å; H33-Q36 WeakPolarHBondContact O-CB 3.27Å; H33-Q36 VanDerWaalsContact O-CG 3.23Å; H33-Q36 WeakPolarHBondContact O-CG 3.3Å; H33-Q36 PolarHBondContact O-N 2.77Å; H33-W37 AromaticContact CD2-CH2 4Å; H33-W37 AromaticContact CD2-CZ3 3.66Å; H33-W37 AromaticContact CE1-CH2 3.97Å; H33-W37 AromaticContact NE2-CH2 3.53Å; H33-W37 AromaticContact NE2-CZ3 3.69Å; H33-W37 WeakPolarHBondContact O-CZ3 3.4Å; H33-H77 AromaticContact NE2-CG 3.87Å; H33-H77 AromaticContact NE2-ND1 3.38Å; H33-H77 PolarHBondContact NE2-ND1 3.39Å; H33-K78 PolarHBondContact CE1-O 2.81Å; H33-K78 PolarHBondContact ND1-O 2.68Å; H33-V79 HydrophobicContact CB-CG1 4.47Å; H33-V79 HydrophobicContact CB-CG2 4.2Å; H33-V79 VanDerWaalsContact CD2-CG2 3.47Å; H33-V79 WeakPolarHBondContact CD2-CG2 3.36Å
34	F	98.2	Very high	97.4	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-76.5	-20	-172.9	-81.1	-77.6	0	0	0	114.1	I18 L30 R31 Q36 W37 L40 V60 Y62 H77 V79 V84	I18-F34 HydrophobicContact CD1-CE1 3.92Å; I18-F34 HydrophobicContact CD1-CE2 3.91Å; I18-F34 HydrophobicContact CD1-CZ 3.5Å; I18-F34 VanDerWaalsContact CD1-CZ 3.5Å; I18-F34 HydrophobicContact CG1-CE2 4Å; I18-F34 HydrophobicContact CG1-CZ 4.1Å; I18-F34 HydrophobicContact CG2-CE2 4.01Å; I18-F34 HydrophobicContact CG2-CZ 4.11Å; L30-F34 HydrophobicContact CD1-CD2 3.59Å; L30-F34 HydrophobicContact CD1-CE2 3.52Å; L30-F34 HydrophobicContact CG-CD2 4.19Å; L30-F34 WeakPolarHBondContact O-CD2 3.43Å; L30-F34 PolarHBondContact O-N 2.84Å; L30-F34 VanDerWaalsContact O-N 3.09Å; R31-F34 PolarHBondContact O-N 3.01Å; F34-Q36 PolarHBondContact O-N 3.26Å; F34-Q36 VanDerWaalsContact O-N 3.13Å; F34-W37 HydrophobicContact CD1-CE3 4.16Å; F34-W37 HydrophobicContact CD1-CZ3 4.2Å; F34-W37 PolarHBondContact O-N 2.83Å; F34-L40 HydrophobicContact CB-CD1 3.94Å; F34-V60 HydrophobicContact CB-CG1 4.26Å; F34-V60 HydrophobicContact CD1-CG2 4.38Å; F34-V60 HydrophobicContact CD2-CG1 4.09Å; F34-V60 HydrophobicContact CG-CG1 4.25Å; F34-V60 HydrophobicContact CG-CG2 4.26Å; F34-Y62 WeakPolarHBondContact CB-OH 3.46Å; F34-Y62 WeakPolarHBondContact CD1-OH 3.18Å; F34-Y62 WeakPolarHBondContact O-CE1 3.34Å; F34-Y62 PolarHBondContact O-OH 3.15Å; F34-H77 AromaticContact CE1-ND1 3.93Å; F34-H77 HydrophobicContact CZ-CB 4.43Å; F34-V79 HydrophobicContact CE2-CG2 4.06Å; F34-V84 HydrophobicContact CZ-CG2 4.31Å
35	E	97.6	Very high	97.6	Very high	84 Å²	84	50 Å²	50	39%	0.393	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-63.7	-12.9	172.2	-79.8	-179.7	174.2	0	0	113.3	R31 H33 W37 G38 L40	R31-E35 VanDerWaalsContact CD-OE1 3.25Å; R31-E35 WeakPolarHBondContact CD-OE1 3.19Å; R31-E35 HydrophobicContact CG-CG 3.91Å; R31-E35 WeakPolarHBondContact CG-OE1 3.45Å; R31-E35 IonicContact CZ-OE1 3.8Å; R31-E35 IonicContact NE-OE1 2.59Å; R31-E35 IonicContact NH1-OE1 3.97Å; R31-E35 PolarHBondContact NH1-OE1 3.03Å; R31-E35 WeakPolarHBondContact O-CB 3.37Å; R31-E35 WeakPolarHBondContact O-CG 2.95Å; R31-E35 PolarHBondContact O-N 2.78Å; H33-E35 PolarHBondContact O-N 2.66Å; E35-W37 PolarHBondContact O-N 2.74Å; E35-G38 CarbonylContact C-O 3.57Å; E35-G38 VanDerWaalsContact CA-O 3.31Å; E35-G38 WeakPolarHBondContact CA-O 3.18Å; E35-G38 PolarHBondContact O-N 3.23Å; E35-L40 HydrophobicContact CG-CB 4.06Å; E35-L40 HydrophobicContact CG-CD1 3.92Å; E35-L40 HydrophobicContact CG-CG 3.76Å
36	Q	97.7	Very high	97.6	Very high	131 Å²	131	52.7 Å²	52.7	61%	0.612	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-62.6	-22.1	174.1	-65.8	174.1	28.4	0	0	113.6	H33 F34	H33-Q36 WeakPolarHBondContact O-CB 3.27Å; H33-Q36 VanDerWaalsContact O-CG 3.23Å; H33-Q36 WeakPolarHBondContact O-CG 3.3Å; H33-Q36 PolarHBondContact O-N 2.77Å; F34-Q36 PolarHBondContact O-N 3.26Å; F34-Q36 VanDerWaalsContact O-N 3.13Å
37	W	98	Very high	97.6	Very high	64 Å²	64	54.6 Å²	54.6	24%	0.242	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-110	1	-178	-61.5	-79.5	0	0	0	114	H33 F34 E35 Y62 A70 A71 A74 H77	H33-W37 AromaticContact CD2-CH2 4Å; H33-W37 AromaticContact CD2-CZ3 3.66Å; H33-W37 AromaticContact CE1-CH2 3.97Å; H33-W37 AromaticContact NE2-CH2 3.53Å; H33-W37 AromaticContact NE2-CZ3 3.69Å; H33-W37 WeakPolarHBondContact O-CZ3 3.4Å; F34-W37 HydrophobicContact CD1-CE3 4.16Å; F34-W37 HydrophobicContact CD1-CZ3 4.2Å; F34-W37 PolarHBondContact O-N 2.83Å; E35-W37 PolarHBondContact O-N 2.74Å; W37-Y62 HydrophobicContact CB-CE1 4.5Å; W37-A70 HydrophobicContact CB-CB 4.35Å; W37-A71 HydrophobicContact CB-CB 4.01Å; W37-A71 HydrophobicContact CD2-CB 4.44Å; W37-A71 HydrophobicContact CG-CB 4.21Å; W37-A74 HydrophobicContact CD2-CB 4.42Å; W37-A74 VanDerWaalsContact CE2-CB 3.49Å; W37-A74 HydrophobicContact CZ2-CB 3.78Å; W37-H77 AromaticContact CD2-CE1 3.98Å; W37-H77 AromaticContact CE2-CE1 3.81Å; W37-H77 AromaticContact CE3-CE1 3.74Å; W37-H77 AromaticContact CH2-CE1 3.31Å; W37-H77 WeakPolarHBondContact CH2-CE1 3.33Å; W37-H77 AromaticContact CH2-ND1 3.07Å; W37-H77 WeakPolarHBondContact CH2-ND1 3.2Å; W37-H77 AromaticContact CZ2-CE1 3.48Å; W37-H77 VanDerWaalsContact CZ2-CE1 3.48Å; W37-H77 WeakPolarHBondContact CZ2-CE1 3.24Å; W37-H77 AromaticContact CZ2-ND1 3.65Å; W37-H77 AromaticContact CZ3-CE1 3.41Å; W37-H77 VanDerWaalsContact CZ3-CE1 3.41Å; W37-H77 WeakPolarHBondContact CZ3-CE1 3.44Å; W37-H77 AromaticContact CZ3-ND1 3.29Å; W37-H77 VanDerWaalsContact CZ3-ND1 3.29Å; W37-H77 WeakPolarHBondContact CZ3-ND1 3.37Å
38	G	96.7	Very high	97.4	Very high	16 Å²	16	54.5 Å²	54.5	17%	0.165	28%	0.282	C	S	.	.	S	Bend	trans	158.9	178.6	-178.8	0	0	0	0	0	114.3	E35 E67	E35-G38 CarbonylContact C-O 3.57Å; E35-G38 VanDerWaalsContact CA-O 3.31Å; E35-G38 WeakPolarHBondContact CA-O 3.18Å; E35-G38 PolarHBondContact O-N 3.23Å; G38-E67 VanDerWaalsContact CA-OE1 3.24Å; G38-E67 WeakPolarHBondContact CA-OE1 3.39Å
39	T	97.4	Very high	97.3	Very high	92 Å²	92	52.6 Å²	52.6	56%	0.564	28%	0.281	S	S	*	.			trans	-83.8	118.3	-177.8	-55.3	0	0	0	0	111	T41 Y62 A63 E67	T39-T41 PolarHBondContact O-N 2.64Å; T39-Y62 CarbonylContact O-C 3.58Å; T39-Y62 WeakPolarHBondContact O-CA 3.48Å; T39-A63 PolarHBondContact O-N 2.81Å; T39-E67 PolarHBondContact N-OE1 3.49Å
40	L	97.4	Very high	97.1	Very high	9 Å²	9	58.3 Å²	58.3	5%	0.047	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	116.2	175.7	-65.8	-173.6	0	0	0	112.3	R31 F34 E35 C43 V60 T61 Y62	R31-L40 HydrophobicContact CB-CD1 4.33Å; R31-L40 HydrophobicContact CG-CD1 4.16Å; R31-L40 PolarHBondContact NH1-O 3.16Å; F34-L40 HydrophobicContact CB-CD1 3.94Å; E35-L40 HydrophobicContact CG-CB 4.06Å; E35-L40 HydrophobicContact CG-CD1 3.92Å; E35-L40 HydrophobicContact CG-CG 3.76Å; L40-C43 HydrophobicContact CD1-CB 4.23Å; L40-V60 HydrophobicContact CD1-CB 4.24Å; L40-V60 HydrophobicContact CD1-CG1 4.22Å; L40-V60 HydrophobicContact CD2-CB 3.95Å; L40-T61 CarbonylContact C-O 3.57Å; L40-T61 WeakPolarHBondContact CA-O 3.38Å; L40-Y62 HydrophobicContact CD2-CD1 3.58Å; L40-Y62 HydrophobicContact CD2-CD2 4.04Å; L40-Y62 HydrophobicContact CD2-CE1 3.51Å; L40-Y62 HydrophobicContact CD2-CE2 4Å; L40-Y62 HydrophobicContact CD2-CG 3.86Å; L40-Y62 HydrophobicContact CG-CE1 4.37Å
41	T	96.9	Very high	97	Very high	78 Å²	78	62.9 Å²	62.9	48%	0.479	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	-28.6	171.6	60	0	0	0	0	112.9	T39 T61 Y62 A63	T39-T41 PolarHBondContact O-N 2.64Å; T41-T61 PolarHBondContact N-O 2.8Å; T41-T61 WeakPolarHBondContact OG1-CG2 3.09Å; T41-T61 PolarHBondContact OG1-O 3.2Å; T41-Y62 PolarHBondContact OG1-O 3.02Å; T41-A63 HydrophobicContact CG2-CB 4.14Å
42	D	97	Very high	96.7	Very high	67 Å²	67	65.8 Å²	65.8	36%	0.358	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	147.9	175.7	-171.6	26.4	0	0	0	110.2	T61	D42-T61 PolarHBondContact N-O 2.8Å; D42-T61 PolarHBondContact O-N 3.36Å
43	C	97.7	Very high	96.5	Very high	11 Å²	11	70.1 Å²	70.1	7%	0.074	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	123.5	178.1	-178	0	0	0	0	109	D27 R31 L40 F59	D27-C43 PolarHBondContact O-SG 3.39Å; D27-C43 VanDerWaalsContact O-SG 3.37Å; R31-C43 HydrophobicContact CB-CB 4.11Å; L40-C43 HydrophobicContact CD1-CB 4.23Å; C43-F59 WeakPolarHBondContact CA-O 3.36Å
44	V	97.8	Very high	96.3	Very high	42 Å²	42	68.8 Å²	68.8	26%	0.255	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	129.7	-176.9	60.6	0	0	0	0	111.8	M46 G58 F59	V44-M46 HydrophobicContact CG1-SD 4.39Å; V44-M46 HydrophobicContact CG2-SD 4.23Å; V44-G58 CarbonylContact O-C 3.53Å; V44-G58 WeakPolarHBondContact O-CA 3.29Å; V44-F59 HydrophobicContact CG1-CB 4.16Å; V44-F59 HydrophobicContact CG1-CD2 4.5Å; V44-F59 PolarHBondContact N-O 3.27Å; V44-F59 PolarHBondContact O-N 3.45Å
45	V	98	Very high	96.2	Very high	5 Å²	5	74.2 Å²	74.2	3%	0.03	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	123.4	165.9	179.4	0	0	0	0	108.5	L21 T25 T26 D27 L30 R47	L21-V45 HydrophobicContact CD1-CG1 4.24Å; L21-V45 HydrophobicContact CD1-CG2 4.12Å; T25-V45 HydrophobicContact CG2-CG2 4.11Å; T26-V45 WeakPolarHBondContact O-CG2 3.39Å; D27-V45 WeakPolarHBondContact OD1-CA 3.42Å; D27-V45 WeakPolarHBondContact OD1-CB 2.99Å; D27-V45 WeakPolarHBondContact OD1-CG2 3.42Å; D27-V45 PolarHBondContact OD1-N 3.4Å; L30-V45 HydrophobicContact CB-CG2 4.29Å; L30-V45 HydrophobicContact CD2-CG2 3.94Å; V45-R47 PolarHBondContact O-N 3.12Å
46	M	97.3	Very high	96.2	Very high	57 Å²	57	70.8 Å²	70.8	28%	0.281	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	121.6	-179.7	-63	-57	-62.4	0	0	109.7	V44 R55 F57 F59	V44-M46 HydrophobicContact CG1-SD 4.39Å; V44-M46 HydrophobicContact CG2-SD 4.23Å; M46-R55 VanDerWaalsContact O-CB 3.28Å; M46-R55 WeakPolarHBondContact O-CB 3.48Å; M46-R55 PolarHBondContact O-N 3.34Å; M46-F57 HydrophobicContact CB-CD1 4.38Å; M46-F57 HydrophobicContact CB-CD2 4.07Å; M46-F57 HydrophobicContact CB-CE1 4Å; M46-F57 HydrophobicContact CB-CE2 3.71Å; M46-F57 HydrophobicContact CB-CG 4.42Å; M46-F57 HydrophobicContact CB-CZ 3.65Å; M46-F57 WeakPolarHBondContact CB-O 3.29Å; M46-F57 HydrophobicContact CG-CD2 3.82Å; M46-F57 HydrophobicContact CG-CE2 3.38Å; M46-F57 HydrophobicContact CG-CZ 3.8Å; M46-F57 PolarHBondContact N-O 2.86Å; M46-F59 HydrophobicContact CG-CD2 4.27Å; M46-F59 HydrophobicContact CG-CE2 4.2Å; M46-F59 HydrophobicContact SD-CD2 4.43Å
47	R	97.1	Very high	96.2	Very high	87 Å²	87	66 Å²	66	33%	0.328	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	152.3	179.7	-65.6	173.6	-175.2	-80	-9.5	110.7	T25 V45 K52 R53	T25-R47 PolarHBondContact O-NH2 2.85Å; V45-R47 PolarHBondContact O-N 3.12Å; R47-K52 WeakPolarHBondContact CD-O 3.24Å; R47-K52 PolarHBondContact NH1-O 2.85Å; R47-R53 CarbonylContact C-O 3.45Å; R47-R53 VanDerWaalsContact CA-O 3.26Å; R47-R53 WeakPolarHBondContact CA-O 3.38Å
48	D	93.8	Very high	96.2	Very high	53 Å²	53	62.9 Å²	62.9	28%	0.283	32%	0.323	S	S	.	.			trans	-64.8	129.1	170.3	177.4	-92	0	0	0	109.3	N50 T51 K52 R53	D48-N50 PolarHBondContact O-N 3.33Å; D48-N50 WeakPolarHBondContact OD1-CA 3.24Å; D48-N50 WeakPolarHBondContact OD1-CB 3.5Å; D48-N50 PolarHBondContact OD1-N 2.97Å; D48-T51 VanDerWaalsContact CB-OG1 3.29Å; D48-T51 WeakPolarHBondContact CB-OG1 3.32Å; D48-T51 PolarHBondContact OD1-N 3.33Å; D48-T51 PolarHBondContact OD1-OG1 3.35Å; D48-K52 VanDerWaalsContact O-CA 3.23Å; D48-K52 WeakPolarHBondContact O-CA 3.47Å; D48-K52 PolarHBondContact O-N 2.82Å; D48-R53 PolarHBondContact N-O 2.84Å
49	P	94.2	Very high	96.2	Very high	89 Å²	89	64.6 Å²	64.6	58%	0.578	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-27.2	-172.6	24.2	-33.5	0	0	0	113	K52	P49-K52 WeakPolarHBondContact O-CE 3.34Å; P49-K52 PolarHBondContact O-NZ 3.04Å
50	N	95.2	Very high	96.3	Very high	145 Å²	145	60.2 Å²	60.2	78%	0.775	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-52.1	-175.8	-59.1	-41.8	0	0	0	111.7	D48	D48-N50 PolarHBondContact O-N 3.33Å; D48-N50 WeakPolarHBondContact OD1-CA 3.24Å; D48-N50 WeakPolarHBondContact OD1-CB 3.5Å; D48-N50 PolarHBondContact OD1-N 2.97Å
51	T	94.8	Very high	96.3	Very high	96 Å²	96	59.9 Å²	59.9	59%	0.589	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-12.7	-174.2	63.3	0	0	0	0	113.6	D48 R53	D48-T51 VanDerWaalsContact CB-OG1 3.29Å; D48-T51 WeakPolarHBondContact CB-OG1 3.32Å; D48-T51 PolarHBondContact OD1-N 3.33Å; D48-T51 PolarHBondContact OD1-OG1 3.35Å; T51-R53 PolarHBondContact O-N 3.04Å; T51-R53 PolarHBondContact OG1-N 2.91Å
52	K	92.4	Very high	96.3	Very high	140 Å²	140	56.1 Å²	56.1	61%	0.609	28%	0.275	S	S	*	.			trans	58.2	7.9	-173.2	-52.1	-53.9	-172.9	-165.7	0	115	R47 D48 P49	R47-K52 WeakPolarHBondContact CD-O 3.24Å; R47-K52 PolarHBondContact NH1-O 2.85Å; D48-K52 VanDerWaalsContact O-CA 3.23Å; D48-K52 WeakPolarHBondContact O-CA 3.47Å; D48-K52 PolarHBondContact O-N 2.82Å; P49-K52 WeakPolarHBondContact O-CE 3.34Å; P49-K52 PolarHBondContact O-NZ 3.04Å
53	R	92.9	Very high	96.3	Very high	174 Å²	174	54.7 Å²	54.7	66%	0.657	27%	0.272	S	S	*	.			trans	-68.7	140.3	175.2	-168.5	-175.3	-69.1	-171.9	-1.9	109.6	R47 D48 T51	R47-R53 CarbonylContact C-O 3.45Å; R47-R53 VanDerWaalsContact CA-O 3.26Å; R47-R53 WeakPolarHBondContact CA-O 3.38Å; D48-R53 PolarHBondContact N-O 2.84Å; T51-R53 PolarHBondContact O-N 3.04Å; T51-R53 PolarHBondContact OG1-N 2.91Å
54	S	95.2	Very high	96.2	Very high	5 Å²	5	56.5 Å²	56.5	4%	0.035	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	138	171	173.3	0	0	0	0	110.7	F23 G56	F23-S54 WeakPolarHBondContact CD1-O 3.49Å; F23-S54 WeakPolarHBondContact O-CB 3.37Å; S54-G56 PolarHBondContact OG-N 3.5Å; S54-G56 VanDerWaalsContact OG-N 3.09Å
55	R	96	Very high	96.1	Very high	113 Å²	113	55.6 Å²	55.6	43%	0.426	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	4.4	173.1	-62.6	172.7	62	-166.7	-3.7	111.9	M46 F57	M46-R55 VanDerWaalsContact O-CB 3.28Å; M46-R55 WeakPolarHBondContact O-CB 3.48Å; M46-R55 PolarHBondContact O-N 3.34Å; R55-F57 VanDerWaalsContact C-N 3.32Å; R55-F57 HydrophobicContact CB-CD1 3.8Å; R55-F57 HydrophobicContact CB-CE1 3.58Å; R55-F57 HydrophobicContact CG-CE1 4.49Å; R55-F57 PolarHBondContact O-N 3.37Å
56	G	96.4	Very high	95.9	Very high	12 Å²	12	62.7 Å²	62.7	12%	0.124	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	75.4	17.2	178.3	0	0	0	0	0	114.3	G20 L21 S54	G20-G56 PolarHBondContact N-O 2.93Å; L21-G56 PolarHBondContact N-O 3.19Å; S54-G56 PolarHBondContact OG-N 3.5Å; S54-G56 VanDerWaalsContact OG-N 3.09Å
57	F	97.3	Very high	95.9	Very high	30 Å²	30	61.6 Å²	61.6	13%	0.132	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	162.2	173.5	74.6	-84.1	0	0	0	111.8	F17 I18 M46 R55 F59	F17-F57 HydrophobicContact CD2-CD2 4.11Å; F17-F57 HydrophobicContact CE2-CB 3.8Å; F17-F57 AromaticContact CE2-CD2 3.44Å; F17-F57 HydrophobicContact CE2-CD2 3.44Å; F17-F57 VanDerWaalsContact CE2-CD2 3.44Å; F17-F57 HydrophobicContact CE2-CE2 4.22Å; F17-F57 AromaticContact CE2-CG 3.85Å; F17-F57 HydrophobicContact CE2-CG 3.85Å; F17-F57 HydrophobicContact CZ-CB 3.88Å; F17-F57 HydrophobicContact CZ-CD2 4.33Å; F17-F57 HydrophobicContact CZ-CG 4.31Å; I18-F57 CarbonylContact O-C 3.59Å; I18-F57 WeakPolarHBondContact O-CA 3.38Å; I18-F57 WeakPolarHBondContact O-CB 3.11Å; M46-F57 HydrophobicContact CB-CD1 4.38Å; M46-F57 HydrophobicContact CB-CD2 4.07Å; M46-F57 HydrophobicContact CB-CE1 4Å; M46-F57 HydrophobicContact CB-CE2 3.71Å; M46-F57 HydrophobicContact CB-CG 4.42Å; M46-F57 HydrophobicContact CB-CZ 3.65Å; M46-F57 WeakPolarHBondContact CB-O 3.29Å; M46-F57 HydrophobicContact CG-CD2 3.82Å; M46-F57 HydrophobicContact CG-CE2 3.38Å; M46-F57 HydrophobicContact CG-CZ 3.8Å; M46-F57 PolarHBondContact N-O 2.86Å; R55-F57 VanDerWaalsContact C-N 3.32Å; R55-F57 HydrophobicContact CB-CD1 3.8Å; R55-F57 HydrophobicContact CB-CE1 3.58Å; R55-F57 HydrophobicContact CG-CE1 4.49Å; R55-F57 PolarHBondContact O-N 3.37Å; F57-F59 HydrophobicContact CD2-CE2 4.27Å; F57-F59 AromaticContact CE2-CE2 3.99Å; F57-F59 HydrophobicContact CE2-CE2 3.99Å; F57-F59 HydrophobicContact CE2-CZ 4.5Å
58	G	97.6	Very high	95.9	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	-175.2	179.7	0	0	0	0	0	112.5	I18 V44	I18-G58 PolarHBondContact N-O 2.83Å; I18-G58 PolarHBondContact O-N 3.13Å; V44-G58 CarbonylContact O-C 3.53Å; V44-G58 WeakPolarHBondContact O-CA 3.29Å
59	F	98.1	Very high	96	Very high	52 Å²	52	57.2 Å²	57.2	23%	0.228	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	144.4	173.5	-63.5	-88.7	0	0	0	110.4	K15 L16 F17 C43 V44 M46 F57 A89	K15-F59 HydrophobicContact CD-CD1 4.35Å; K15-F59 HydrophobicContact CG-CB 4.46Å; K15-F59 HydrophobicContact CG-CD1 4.27Å; L16-F59 VanDerWaalsContact O-CA 3.24Å; L16-F59 WeakPolarHBondContact O-CA 3.48Å; F17-F59 HydrophobicContact CB-CD1 4.19Å; F17-F59 HydrophobicContact CB-CE1 3.89Å; F17-F59 AromaticContact CD2-CE1 3.85Å; F17-F59 HydrophobicContact CD2-CE1 3.85Å; F17-F59 AromaticContact CD2-CZ 3.88Å; F17-F59 HydrophobicContact CD2-CZ 3.88Å; F17-F59 HydrophobicContact CG-CE1 4.38Å; C43-F59 WeakPolarHBondContact CA-O 3.36Å; V44-F59 HydrophobicContact CG1-CB 4.16Å; V44-F59 HydrophobicContact CG1-CD2 4.5Å; V44-F59 PolarHBondContact N-O 3.27Å; V44-F59 PolarHBondContact O-N 3.45Å; M46-F59 HydrophobicContact CG-CD2 4.27Å; M46-F59 HydrophobicContact CG-CE2 4.2Å; M46-F59 HydrophobicContact SD-CD2 4.43Å; F57-F59 HydrophobicContact CD2-CE2 4.27Å; F57-F59 AromaticContact CE2-CE2 3.99Å; F57-F59 HydrophobicContact CE2-CE2 3.99Å; F57-F59 HydrophobicContact CE2-CZ 4.5Å; F59-A89 HydrophobicContact CD1-CB 4.43Å; F59-A89 HydrophobicContact CE1-CB 4.4Å
60	V	98.2	Very high	96.2	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	138	168.9	-60	0	0	0	0	108.4	K15 L16 I18 L30 F34 L40 Y62	K15-V60 CarbonylContact C-O 3.58Å; K15-V60 WeakPolarHBondContact CA-O 3.03Å; L16-V60 HydrophobicContact CB-CG2 3.79Å; L16-V60 HydrophobicContact CD1-CG2 4.4Å; L16-V60 PolarHBondContact N-O 3.01Å; L16-V60 PolarHBondContact O-N 3.35Å; I18-V60 HydrophobicContact CD1-CG2 3.95Å; I18-V60 HydrophobicContact CG1-CG1 4.25Å; I18-V60 HydrophobicContact CG1-CG2 4.13Å; L30-V60 HydrophobicContact CD2-CG1 3.96Å; L30-V60 HydrophobicContact CG-CG1 3.94Å; F34-V60 HydrophobicContact CB-CG1 4.26Å; F34-V60 HydrophobicContact CD1-CG2 4.38Å; F34-V60 HydrophobicContact CD2-CG1 4.09Å; F34-V60 HydrophobicContact CG-CG1 4.25Å; F34-V60 HydrophobicContact CG-CG2 4.26Å; L40-V60 HydrophobicContact CD1-CB 4.24Å; L40-V60 HydrophobicContact CD1-CG1 4.22Å; L40-V60 HydrophobicContact CD2-CB 3.95Å; V60-Y62 HydrophobicContact CG2-CE2 4.11Å
61	T	97.8	Very high	96.3	Very high	1 Å²	1	48 Å²	48	1%	0.006	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	113.1	179.4	-51.3	0	0	0	0	109.3	E11 R14 K15 L40 T41 D42	E11-T61 HydrophobicContact CG-CG2 3.67Å; R14-T61 HydrophobicContact CB-CG2 4.35Å; R14-T61 CarbonylContact O-C 3.45Å; R14-T61 WeakPolarHBondContact O-CA 3.4Å; K15-T61 HydrophobicContact CB-CG2 4.42Å; L40-T61 CarbonylContact C-O 3.57Å; L40-T61 WeakPolarHBondContact CA-O 3.38Å; T41-T61 PolarHBondContact N-O 2.8Å; T41-T61 WeakPolarHBondContact OG1-CG2 3.09Å; T41-T61 PolarHBondContact OG1-O 3.2Å; D42-T61 PolarHBondContact N-O 2.8Å; D42-T61 PolarHBondContact O-N 3.36Å
62	Y	98.2	Very high	96.4	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	169	178.3	-76.9	-79.6	0	0	0	112.8	R14 L16 F34 W37 T39 L40 T41 V60 E67 V68 A71	R14-Y62 PolarHBondContact NH1-O 3.38Å; R14-Y62 PolarHBondContact O-N 2.87Å; L16-Y62 HydrophobicContact CD1-CE2 4.07Å; F34-Y62 WeakPolarHBondContact CB-OH 3.46Å; F34-Y62 WeakPolarHBondContact CD1-OH 3.18Å; F34-Y62 WeakPolarHBondContact O-CE1 3.34Å; F34-Y62 PolarHBondContact O-OH 3.15Å; W37-Y62 HydrophobicContact CB-CE1 4.5Å; T39-Y62 CarbonylContact O-C 3.58Å; T39-Y62 WeakPolarHBondContact O-CA 3.48Å; L40-Y62 HydrophobicContact CD2-CD1 3.58Å; L40-Y62 HydrophobicContact CD2-CD2 4.04Å; L40-Y62 HydrophobicContact CD2-CE1 3.51Å; L40-Y62 HydrophobicContact CD2-CE2 4Å; L40-Y62 HydrophobicContact CD2-CG 3.86Å; L40-Y62 HydrophobicContact CG-CE1 4.37Å; T41-Y62 PolarHBondContact OG1-O 3.02Å; V60-Y62 HydrophobicContact CG2-CE2 4.11Å; Y62-E67 HydrophobicContact CD1-CB 3.55Å; Y62-E67 HydrophobicContact CD1-CG 4.44Å; Y62-E67 HydrophobicContact CE1-CB 4.29Å; Y62-E67 HydrophobicContact CG-CB 3.8Å; Y62-V68 HydrophobicContact CD2-CG2 3.81Å; Y62-V68 HydrophobicContact CG-CG2 4.3Å; Y62-A71 HydrophobicContact CE2-CB 3.89Å; Y62-A71 WeakPolarHBondContact OH-CB 3.11Å
63	A	96.3	Very high	96.6	Very high	36 Å²	36	42.8 Å²	42.8	30%	0.298	21%	0.214	S	C	.	.	S	Bend	trans	-77.9	-30.9	176.5	0	0	0	0	0	112	R14 T39 T41 E67	R14-A63 WeakPolarHBondContact CD-O 3.4Å; T39-A63 PolarHBondContact O-N 2.81Å; T41-A63 HydrophobicContact CG2-CB 4.14Å; A63-E67 WeakPolarHBondContact CA-OE2 3.38Å; A63-E67 WeakPolarHBondContact CB-OE2 3.19Å; A63-E67 PolarHBondContact N-OE2 3.12Å
64	T	95.5	Very high	96.9	Very high	49 Å²	49	36.1 Å²	36.1	30%	0.301	20%	0.196	S	C	.	.	S	Bend	trans	-133.9	162	177.2	69.3	0	0	0	0	112.6	E9 E66 E67	E9-T64 WeakPolarHBondContact OE2-CA 3.33Å; T64-E66 VanDerWaalsContact C-N 3.3Å; T64-E67 PolarHBondContact N-OE2 3.32Å; T64-E67 WeakPolarHBondContact OG1-CG 3.28Å; T64-E67 PolarHBondContact OG1-N 3.18Å
65	V	94.8	Very high	96.9	Very high	24 Å²	24	38.7 Å²	38.7	15%	0.145	21%	0.205	C	C	.	.	H	α-helix	trans	-68.2	-30.7	172.9	174.2	0	0	0	0	111.3	E9 L13 R14 E67 V68 D69	E9-V65 HydrophobicContact CB-CG2 4.14Å; E9-V65 VanDerWaalsContact CD-CG2 3.49Å; E9-V65 HydrophobicContact CG-CG2 4.35Å; E9-V65 VanDerWaalsContact OE2-CG2 3.3Å; E9-V65 WeakPolarHBondContact OE2-CG2 3.49Å; E9-V65 PolarHBondContact OE2-N 3.14Å; L13-V65 HydrophobicContact CB-CG2 3.65Å; R14-V65 HydrophobicContact CG-CG2 3.75Å; V65-E67 VanDerWaalsContact C-N 3.3Å; V65-E67 PolarHBondContact O-N 3.47Å; V65-V68 WeakPolarHBondContact O-CA 3.47Å; V65-V68 VanDerWaalsContact O-CB 3.26Å; V65-V68 WeakPolarHBondContact O-CB 3.38Å; V65-V68 PolarHBondContact O-N 3.17Å; V65-V68 VanDerWaalsContact O-N 3.08Å; V65-D69 PolarHBondContact O-N 2.98Å
66	E	95.5	Very high	97	Very high	153 Å²	153	38.6 Å²	38.6	72%	0.715	22%	0.219	S	C	*	.	H	α-helix	trans	-60.6	-39	176.1	-63.2	179.3	171.5	0	0	112.2	T64 V68 D69 A70	T64-E66 VanDerWaalsContact C-N 3.3Å; E66-V68 VanDerWaalsContact C-N 3.33Å; E66-D69 PolarHBondContact O-N 3.5Å; E66-A70 PolarHBondContact O-N 3.38Å
67	E	97.3	Very high	97.1	Very high	35 Å²	35	38.2 Å²	38.2	16%	0.164	21%	0.214	C	C	.	.	H	α-helix	trans	-67.5	-34.3	175	-67.9	172.6	145.7	0	0	111.8	G38 T39 Y62 A63 T64 V65 A70 A71	G38-E67 VanDerWaalsContact CA-OE1 3.24Å; G38-E67 WeakPolarHBondContact CA-OE1 3.39Å; T39-E67 PolarHBondContact N-OE1 3.49Å; Y62-E67 HydrophobicContact CD1-CB 3.55Å; Y62-E67 HydrophobicContact CD1-CG 4.44Å; Y62-E67 HydrophobicContact CE1-CB 4.29Å; Y62-E67 HydrophobicContact CG-CB 3.8Å; A63-E67 WeakPolarHBondContact CA-OE2 3.38Å; A63-E67 WeakPolarHBondContact CB-OE2 3.19Å; A63-E67 PolarHBondContact N-OE2 3.12Å; T64-E67 PolarHBondContact N-OE2 3.32Å; T64-E67 WeakPolarHBondContact OG1-CG 3.28Å; T64-E67 PolarHBondContact OG1-N 3.18Å; V65-E67 VanDerWaalsContact C-N 3.3Å; V65-E67 PolarHBondContact O-N 3.47Å; E67-A70 PolarHBondContact O-N 3.1Å; E67-A71 PolarHBondContact O-N 2.96Å
68	V	97	Very high	97.1	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.5	-47.1	170.4	176.4	0	0	0	0	110.5	R14 L16 Y62 V65 E66 A70 A71 M72	R14-V68 VanDerWaalsContact C-CG2 3.5Å; R14-V68 HydrophobicContact CB-CG2 4.46Å; R14-V68 WeakPolarHBondContact O-CG2 3.38Å; L16-V68 HydrophobicContact CD1-CG1 4.22Å; L16-V68 HydrophobicContact CD2-CG1 3.53Å; L16-V68 HydrophobicContact CG-CG1 3.86Å; Y62-V68 HydrophobicContact CD2-CG2 3.81Å; Y62-V68 HydrophobicContact CG-CG2 4.3Å; V65-V68 WeakPolarHBondContact O-CA 3.47Å; V65-V68 VanDerWaalsContact O-CB 3.26Å; V65-V68 WeakPolarHBondContact O-CB 3.38Å; V65-V68 PolarHBondContact O-N 3.17Å; V65-V68 VanDerWaalsContact O-N 3.08Å; E66-V68 VanDerWaalsContact C-N 3.33Å; V68-A70 VanDerWaalsContact C-N 3.32Å; V68-A70 PolarHBondContact O-N 2.89Å; V68-A71 PolarHBondContact O-N 2.92Å; V68-M72 HydrophobicContact CG1-CG 4.22Å; V68-M72 WeakPolarHBondContact O-CB 3.41Å; V68-M72 WeakPolarHBondContact O-CG 3.21Å; V68-M72 PolarHBondContact O-N 3.16Å
69	D	96.1	Very high	97.1	Very high	48 Å²	48	43.2 Å²	43.2	26%	0.257	24%	0.236	S	C	.	.	H	α-helix	trans	-63.5	-40.5	-180	-67	-10.3	0	0	0	110.9	V65 E66 M72 N73 R88	V65-D69 PolarHBondContact O-N 2.98Å; E66-D69 PolarHBondContact O-N 3.5Å; D69-M72 PolarHBondContact O-N 2.88Å; D69-N73 WeakPolarHBondContact O-CB 3.36Å; D69-N73 PolarHBondContact O-N 2.68Å; D69-N73 PolarHBondContact O-ND2 3.07Å; D69-N73 VanDerWaalsContact O-ND2 3.11Å; D69-R88 IonicContact OD1-CZ 2.68Å; D69-R88 VanDerWaalsContact OD1-CZ 3.24Å; D69-R88 IonicContact OD1-NH1 3.75Å; D69-R88 PolarHBondContact OD1-NH1 3.15Å; D69-R88 IonicContact OD1-NH2 2.94Å; D69-R88 PolarHBondContact OD1-NH2 2.71Å
70	A	97.3	Very high	97	Very high	41 Å²	41	44.3 Å²	44.3	34%	0.339	24%	0.244	S	C	.	.	H	α-helix	trans	-60	-45.9	174.6	0	0	0	0	0	112	W37 E66 E67 V68 N73 A74	W37-A70 HydrophobicContact CB-CB 4.35Å; E66-A70 PolarHBondContact O-N 3.38Å; E67-A70 PolarHBondContact O-N 3.1Å; V68-A70 VanDerWaalsContact C-N 3.32Å; V68-A70 PolarHBondContact O-N 2.89Å; A70-N73 PolarHBondContact O-N 2.95Å; A70-A74 PolarHBondContact O-N 3.39Å
71	A	98	Very high	96.9	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.4	-48.4	174.2	0	0	0	0	0	110.9	L16 W37 Y62 E67 V68 N73 A74 H77	L16-A71 HydrophobicContact CD1-CB 4.14Å; W37-A71 HydrophobicContact CB-CB 4.01Å; W37-A71 HydrophobicContact CD2-CB 4.44Å; W37-A71 HydrophobicContact CG-CB 4.21Å; Y62-A71 HydrophobicContact CE2-CB 3.89Å; Y62-A71 WeakPolarHBondContact OH-CB 3.11Å; E67-A71 PolarHBondContact O-N 2.96Å; V68-A71 PolarHBondContact O-N 2.92Å; A71-N73 VanDerWaalsContact C-N 3.28Å; A71-N73 PolarHBondContact O-N 2.78Å; A71-A74 PolarHBondContact O-N 3.36Å; A71-H77 PolarHBondContact O-CE1 3.47Å; A71-H77 PolarHBondContact O-NE2 2.9Å
72	M	97.3	Very high	96.8	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-61.9	-33.9	179.6	-70.9	-59.1	-72	0	0	112.8	L16 V68 D69 A74 R75 P86 D157	L16-M72 HydrophobicContact CD1-CG 4.32Å; L16-M72 HydrophobicContact CD1-SD 4.08Å; L16-M72 HydrophobicContact CD2-CG 3.97Å; L16-M72 HydrophobicContact CD2-SD 3.67Å; V68-M72 HydrophobicContact CG1-CG 4.22Å; V68-M72 WeakPolarHBondContact O-CB 3.41Å; V68-M72 WeakPolarHBondContact O-CG 3.21Å; V68-M72 PolarHBondContact O-N 3.16Å; D69-M72 PolarHBondContact O-N 2.88Å; M72-A74 VanDerWaalsContact C-N 3.28Å; M72-A74 PolarHBondContact O-N 3.15Å; M72-R75 VanDerWaalsContact O-CZ 3.31Å; M72-R75 PolarHBondContact O-NE 3.07Å; M72-R75 PolarHBondContact O-NH2 3.23Å; M72-P86 HydrophobicContact SD-CB 3.98Å; M72-P86 HydrophobicContact SD-CG 4.33Å; M72-D157 HydrophobicContact CE-CB 3.76Å; M72-D157 VanDerWaalsContact CE-OD1 3.27Å; M72-D157 WeakPolarHBondContact CE-OD1 3.39Å
73	N	96.4	Very high	96.8	Very high	124 Å²	124	58.5 Å²	58.5	66%	0.663	33%	0.327	S	S	*	.	H	α-helix	trans	-73.8	-19.3	176.5	-70.2	-27.9	0	0	0	113.2	D69 A70 A71 R75	D69-N73 WeakPolarHBondContact O-CB 3.36Å; D69-N73 PolarHBondContact O-N 2.68Å; D69-N73 PolarHBondContact O-ND2 3.07Å; D69-N73 VanDerWaalsContact O-ND2 3.11Å; A70-N73 PolarHBondContact O-N 2.95Å; A71-N73 VanDerWaalsContact C-N 3.28Å; A71-N73 PolarHBondContact O-N 2.78Å; N73-R75 VanDerWaalsContact C-N 3.31Å
74	A	97.5	Very high	96.9	Very high	34 Å²	34	57.1 Å²	57.1	28%	0.281	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	6.9	178.8	0	0	0	0	0	114.1	W37 A70 A71 M72	W37-A74 HydrophobicContact CD2-CB 4.42Å; W37-A74 VanDerWaalsContact CE2-CB 3.49Å; W37-A74 HydrophobicContact CZ2-CB 3.78Å; A70-A74 PolarHBondContact O-N 3.39Å; A71-A74 PolarHBondContact O-N 3.36Å; M72-A74 VanDerWaalsContact C-N 3.28Å; M72-A74 PolarHBondContact O-N 3.15Å
75	R	96.9	Very high	96.9	Very high	60 Å²	60	58.3 Å²	58.3	23%	0.226	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-58.5	144.5	172	-81.7	176.4	-73.3	150.4	14.7	110.9	M72 N73 P86 D155 H156	M72-R75 VanDerWaalsContact O-CZ 3.31Å; M72-R75 PolarHBondContact O-NE 3.07Å; M72-R75 PolarHBondContact O-NH2 3.23Å; N73-R75 VanDerWaalsContact C-N 3.31Å; R75-P86 HydrophobicContact CG-CG 3.58Å; R75-D155 IonicContact CZ-OD1 2.97Å; R75-D155 IonicContact CZ-OD2 2.79Å; R75-D155 IonicContact NH1-OD1 2.63Å; R75-D155 PolarHBondContact NH1-OD1 2.84Å; R75-D155 IonicContact NH1-OD2 3.07Å; R75-D155 PolarHBondContact NH1-OD2 3.5Å; R75-D155 VanDerWaalsContact NH1-OD2 3.16Å; R75-D155 IonicContact NH2-OD1 3.94Å; R75-D155 IonicContact NH2-OD2 2.82Å; R75-D155 PolarHBondContact NH2-OD2 2.93Å; R75-H156 PolarHBondContact NH1-CD2 3.29Å; R75-H156 PolarHBondContact NH1-CE1 2.82Å; R75-H156 PolarHBondContact NH1-NE2 3.06Å
76	P	96.9	Very high	97	Very high	110 Å²	110	57.2 Å²	57.2	71%	0.714	31%	0.31	S	S	*	.	S	Bend	cis	-81.8	142.8	2.7	32.2	-34.6	0	0	0	113.4	V83	P76-V83 HydrophobicContact CB-CG1 4.38Å
77	H	98.1	Very high	97.1	Very high	4 Å²	4	51.1 Å²	51.1	2%	0.019	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	144.6	174.3	-66.4	-96.4	0	0	0	111.6	H33 F34 W37 A71 V83 V84	H33-H77 AromaticContact NE2-CG 3.87Å; H33-H77 AromaticContact NE2-ND1 3.38Å; H33-H77 PolarHBondContact NE2-ND1 3.39Å; F34-H77 AromaticContact CE1-ND1 3.93Å; F34-H77 HydrophobicContact CZ-CB 4.43Å; W37-H77 AromaticContact CD2-CE1 3.98Å; W37-H77 AromaticContact CE2-CE1 3.81Å; W37-H77 AromaticContact CE3-CE1 3.74Å; W37-H77 AromaticContact CH2-CE1 3.31Å; W37-H77 WeakPolarHBondContact CH2-CE1 3.33Å; W37-H77 AromaticContact CH2-ND1 3.07Å; W37-H77 WeakPolarHBondContact CH2-ND1 3.2Å; W37-H77 AromaticContact CZ2-CE1 3.48Å; W37-H77 VanDerWaalsContact CZ2-CE1 3.48Å; W37-H77 WeakPolarHBondContact CZ2-CE1 3.24Å; W37-H77 AromaticContact CZ2-ND1 3.65Å; W37-H77 AromaticContact CZ3-CE1 3.41Å; W37-H77 VanDerWaalsContact CZ3-CE1 3.41Å; W37-H77 WeakPolarHBondContact CZ3-CE1 3.44Å; W37-H77 AromaticContact CZ3-ND1 3.29Å; W37-H77 VanDerWaalsContact CZ3-ND1 3.29Å; W37-H77 WeakPolarHBondContact CZ3-ND1 3.37Å; A71-H77 PolarHBondContact O-CE1 3.47Å; A71-H77 PolarHBondContact O-NE2 2.9Å; H77-V83 WeakPolarHBondContact O-CA 2.89Å; H77-V84 HydrophobicContact CB-CG2 3.6Å; H77-V84 PolarHBondContact O-N 3.32Å
78	K	97.7	Very high	97	Very high	133 Å²	133	50.1 Å²	50.1	58%	0.578	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.6	113.9	173	-172.6	178	-179.5	-179.5	0	109.8	H33 G81 R82	H33-K78 PolarHBondContact CE1-O 2.81Å; H33-K78 PolarHBondContact ND1-O 2.68Å; K78-G81 VanDerWaalsContact CE-C 3.42Å; K78-G81 WeakPolarHBondContact CE-O 3.47Å; K78-R82 CarbonylContact C-O 3.55Å; K78-R82 VanDerWaalsContact CA-O 3.28Å; K78-R82 WeakPolarHBondContact CA-O 3.5Å
79	V	97.4	Very high	96.9	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.012	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	129.1	-179.9	-174.1	0	0	0	0	108.3	T25 L30 H33 F34 G81 R82 V84	T25-V79 HydrophobicContact CG2-CG1 4.1Å; L30-V79 HydrophobicContact CD1-CG1 4.42Å; H33-V79 HydrophobicContact CB-CG1 4.47Å; H33-V79 HydrophobicContact CB-CG2 4.2Å; H33-V79 VanDerWaalsContact CD2-CG2 3.47Å; H33-V79 WeakPolarHBondContact CD2-CG2 3.36Å; F34-V79 HydrophobicContact CE2-CG2 4.06Å; V79-G81 PolarHBondContact O-N 3.41Å; V79-G81 VanDerWaalsContact O-N 3.14Å; V79-R82 PolarHBondContact N-O 3.25Å; V79-R82 PolarHBondContact O-N 2.69Å; V79-V84 HydrophobicContact CB-CG1 3.96Å; V79-V84 HydrophobicContact CG2-CG1 3.98Å; V79-V84 HydrophobicContact CG2-CG2 3.87Å
80	D	96.7	Very high	96.7	Very high	76 Å²	76	49.8 Å²	49.8	41%	0.406	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.1	43.9	-179.8	-54.8	-40	0	0	0	113.2	T25 S29 R82	T25-D80 WeakPolarHBondContact CA-OD2 3.29Å; T25-D80 VanDerWaalsContact CB-OD2 3.22Å; T25-D80 WeakPolarHBondContact CB-OD2 3.26Å; T25-D80 WeakPolarHBondContact CG2-OD2 3.17Å; T25-D80 PolarHBondContact OG1-OD2 3.26Å; S29-D80 WeakPolarHBondContact CB-OD1 3.35Å; S29-D80 WeakPolarHBondContact CB-OD2 3.25Å; S29-D80 PolarHBondContact OG-OD2 3.33Å; D80-R82 VanDerWaalsContact C-N 3.26Å; D80-R82 PolarHBondContact O-N 3.07Å
81	G	95.5	Very high	96.3	Very high	59 Å²	59	48.6 Å²	48.6	61%	0.608	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.4	-8.2	179.2	0	0	0	0	0	115.5	K78 V79	K78-G81 VanDerWaalsContact CE-C 3.42Å; K78-G81 WeakPolarHBondContact CE-O 3.47Å; V79-G81 PolarHBondContact O-N 3.41Å; V79-G81 VanDerWaalsContact O-N 3.14Å
82	R	97	Very high	95.7	Very high	140 Å²	140	59 Å²	59	53%	0.528	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	136.3	-175.3	-169.6	167.8	178.5	99.3	2.8	112.1	G20 K78 V79 D80 V84	G20-R82 WeakPolarHBondContact O-CD 3.32Å; G20-R82 WeakPolarHBondContact O-CG 3.5Å; G20-R82 PolarHBondContact O-NE 2.91Å; K78-R82 CarbonylContact C-O 3.55Å; K78-R82 VanDerWaalsContact CA-O 3.28Å; K78-R82 WeakPolarHBondContact CA-O 3.5Å; V79-R82 PolarHBondContact N-O 3.25Å; V79-R82 PolarHBondContact O-N 2.69Å; D80-R82 VanDerWaalsContact C-N 3.26Å; D80-R82 PolarHBondContact O-N 3.07Å; R82-V84 PolarHBondContact O-N 3.13Å
83	V	97.5	Very high	95.3	Very high	100 Å²	100	65.7 Å²	65.7	61%	0.606	34%	0.336	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.1	125.1	172.5	-179.9	0	0	0	0	108.7	P76 H77	P76-V83 HydrophobicContact CB-CG1 4.38Å; H77-V83 WeakPolarHBondContact O-CA 2.89Å
84	V	97.8	Very high	94.8	Very high	7 Å²	7	61.7 Å²	61.7	4%	0.042	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	157.4	-176.7	-56.1	0	0	0	0	110.6	I18 G19 L21 F34 H77 V79 R82 P86	I18-V84 HydrophobicContact CG2-CB 3.89Å; I18-V84 HydrophobicContact CG2-CG1 4.47Å; I18-V84 HydrophobicContact CG2-CG2 3.9Å; G19-V84 WeakPolarHBondContact O-CA 3.31Å; G19-V84 WeakPolarHBondContact O-CB 3.4Å; L21-V84 HydrophobicContact CD2-CB 4.38Å; L21-V84 HydrophobicContact CD2-CG1 3.71Å; F34-V84 HydrophobicContact CZ-CG2 4.31Å; H77-V84 HydrophobicContact CB-CG2 3.6Å; H77-V84 PolarHBondContact O-N 3.32Å; V79-V84 HydrophobicContact CB-CG1 3.96Å; V79-V84 HydrophobicContact CG2-CG1 3.98Å; V79-V84 HydrophobicContact CG2-CG2 3.87Å; R82-V84 PolarHBondContact O-N 3.13Å; V84-P86 VanDerWaalsContact O-CD 3.27Å; V84-P86 WeakPolarHBondContact O-CD 3.24Å
85	E	96.2	Very high	94.3	Very high	73 Å²	73	61.6 Å²	61.6	34%	0.341	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	90.3	-178.3	-164.7	-171.3	-171.4	0	0	109.7	G19 K87 T103	G19-E85 PolarHBondContact N-O 3.43Å; G19-E85 PolarHBondContact O-N 2.79Å; E85-K87 WeakPolarHBondContact OE1-CE 3.46Å; E85-K87 IonicContact OE1-NZ 2.68Å; E85-K87 PolarHBondContact OE1-NZ 2.85Å; E85-K87 VanDerWaalsContact OE2-CE 3.32Å; E85-K87 WeakPolarHBondContact OE2-CE 3.16Å; E85-K87 IonicContact OE2-NZ 2.79Å; E85-K87 PolarHBondContact OE2-NZ 2.78Å; E85-T103 PolarHBondContact OE1-OG1 3.05Å; E85-T103 VanDerWaalsContact OE1-OG1 3.07Å
86	P	97.5	Very high	93.8	Very high	2 Å²	2	66.5 Å²	66.5	1%	0.013	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	137.4	172.8	28.2	-28.6	0	0	0	110.8	F17 I18 M72 R75 V84	F17-P86 CarbonylContact O-C 3.52Å; F17-P86 WeakPolarHBondContact O-CA 3.43Å; I18-P86 HydrophobicContact CD1-CB 3.7Å; M72-P86 HydrophobicContact SD-CB 3.98Å; M72-P86 HydrophobicContact SD-CG 4.33Å; R75-P86 HydrophobicContact CG-CG 3.58Å; V84-P86 VanDerWaalsContact O-CD 3.27Å; V84-P86 WeakPolarHBondContact O-CD 3.24Å
87	K	96.5	Very high	93.2	Very high	25 Å²	25	65.1 Å²	65.1	11%	0.109	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	154.9	175.1	-62.7	179.9	-170.5	166.4	0	109.4	L16 F17 E85 A89 T103	L16-K87 CarbonylContact C-O 3.57Å; L16-K87 VanDerWaalsContact CA-O 3.32Å; L16-K87 WeakPolarHBondContact CA-O 3.22Å; L16-K87 WeakPolarHBondContact CD2-O 3.41Å; F17-K87 HydrophobicContact CD1-CB 4.42Å; F17-K87 PolarHBondContact N-O 3.06Å; F17-K87 PolarHBondContact O-N 2.83Å; E85-K87 WeakPolarHBondContact OE1-CE 3.46Å; E85-K87 IonicContact OE1-NZ 2.68Å; E85-K87 PolarHBondContact OE1-NZ 2.85Å; E85-K87 VanDerWaalsContact OE2-CE 3.32Å; E85-K87 WeakPolarHBondContact OE2-CE 3.16Å; E85-K87 IonicContact OE2-NZ 2.79Å; E85-K87 PolarHBondContact OE2-NZ 2.78Å; K87-A89 PolarHBondContact O-N 3.31Å; K87-T103 WeakPolarHBondContact CE-OG1 3.44Å; K87-T103 PolarHBondContact NZ-OG1 3.43Å
88	R	95.2	Very high	92.6	Very high	13 Å²	13	67.5 Å²	67.5	5%	0.049	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	135.8	170	-55.4	-160.3	-179.4	-117.3	-6.6	109.9	L16 D69 V90 D157 D160 I164	L16-R88 HydrophobicContact CD2-CG 4.25Å; D69-R88 IonicContact OD1-CZ 2.68Å; D69-R88 VanDerWaalsContact OD1-CZ 3.24Å; D69-R88 IonicContact OD1-NH1 3.75Å; D69-R88 PolarHBondContact OD1-NH1 3.15Å; D69-R88 IonicContact OD1-NH2 2.94Å; D69-R88 PolarHBondContact OD1-NH2 2.71Å; R88-V90 PolarHBondContact O-N 3.32Å; R88-D157 IonicContact CZ-OD1 2.98Å; R88-D157 IonicContact CZ-OD2 3.86Å; R88-D157 IonicContact NE-OD1 2.97Å; R88-D157 PolarHBondContact NE-OD1 2.98Å; R88-D157 IonicContact NE-OD2 3.86Å; R88-D157 IonicContact NH2-OD1 3.87Å; R88-D157 PolarHBondContact NH2-OD1 3.23Å; R88-D157 IonicContact NH2-OD2 2.92Å; R88-D157 PolarHBondContact NH2-OD2 3.05Å; R88-D160 HydrophobicContact CB-CB 4.1Å; R88-D160 HydrophobicContact CG-CB 4.09Å; R88-I164 HydrophobicContact CB-CD1 4.23Å
89	A	94.8	Very high	92	Very high	3 Å²	3	62.2 Å²	62.2	3%	0.025	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-62.2	139.2	177	0	0	0	0	0	108.8	Q12 K15 F59 K87	Q12-A89 PolarHBondContact NE2-O 3.39Å; K15-A89 HydrophobicContact CB-CB 3.86Å; K15-A89 HydrophobicContact CD-CB 4.23Å; K15-A89 HydrophobicContact CG-CB 3.81Å; K15-A89 VanDerWaalsContact O-CB 3.25Å; K15-A89 WeakPolarHBondContact O-CB 3.21Å; K15-A89 PolarHBondContact O-N 3Å; F59-A89 HydrophobicContact CD1-CB 4.43Å; F59-A89 HydrophobicContact CE1-CB 4.4Å; K87-A89 PolarHBondContact O-N 3.31Å
90	V	91.9	Very high	91.6	Very high	39 Å²	39	62.8 Å²	62.8	24%	0.236	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-92.8	139.5	170.5	-177	0	0	0	0	107.7	Q12 R88 D94 A100	Q12-V90 PolarHBondContact NE2-O 2.77Å; R88-V90 PolarHBondContact O-N 3.32Å; V90-D94 HydrophobicContact CG1-CB 3.72Å; V90-A100 HydrophobicContact CG1-CB 4.1Å
91	S	88.4	Confident	91.2	Very high	16 Å²	16	64.5 Å²	64.5	11%	0.112	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-59.4	157.1	174.9	71.8	0	0	0	0	110.5	E93 D94 S95	S91-E93 PolarHBondContact O-N 3.35Å; S91-D94 PolarHBondContact O-N 2.65Å; S91-D94 WeakPolarHBondContact OG-CB 3.5Å; S91-D94 PolarHBondContact OG-N 2.88Å; S91-D94 PolarHBondContact OG-OD2 3.38Å; S91-S95 WeakPolarHBondContact O-CB 3.47Å; S91-S95 PolarHBondContact O-N 3.41Å; S91-S95 PolarHBondContact O-OG 2.89Å
92	R	87.3	Confident	91	Very high	217 Å²	217	64.5 Å²	64.5	82%	0.819	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-35.6	179.3	-70.8	-179	177.4	-122.1	2.1	111.3
93	E	86.9	Confident	90.9	Very high	142 Å²	142	60.8 Å²	60.8	66%	0.664	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-45.5	178.5	-61.9	70.2	-152.9	0	0	111	S91 Q96	S91-E93 PolarHBondContact O-N 3.35Å; E93-Q96 PolarHBondContact O-N 3.44Å
94	D	86.6	Confident	90.7	Very high	40 Å²	40	57.2 Å²	57.2	21%	0.214	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-79	-22.8	-179	-63.6	-44.1	0	0	0	112.9	V90 S91 Q96 R97 A100	V90-D94 HydrophobicContact CG1-CB 3.72Å; S91-D94 PolarHBondContact O-N 2.65Å; S91-D94 WeakPolarHBondContact OG-CB 3.5Å; S91-D94 PolarHBondContact OG-N 2.88Å; S91-D94 PolarHBondContact OG-OD2 3.38Å; D94-Q96 PolarHBondContact O-N 2.99Å; D94-Q96 VanDerWaalsContact O-N 3.12Å; D94-R97 VanDerWaalsContact O-CB 3.29Å; D94-R97 WeakPolarHBondContact O-CB 3.48Å; D94-R97 WeakPolarHBondContact O-CG 3.44Å; D94-R97 PolarHBondContact O-N 2.8Å; D94-R97 IonicContact OD1-CZ 2.81Å; D94-R97 IonicContact OD1-NE 3.71Å; D94-R97 PolarHBondContact OD1-NE 3.1Å; D94-R97 VanDerWaalsContact OD1-NE 3.07Å; D94-R97 IonicContact OD1-NH1 3.04Å; D94-R97 IonicContact OD1-NH2 3.76Å; D94-R97 PolarHBondContact OD1-NH2 3Å; D94-A100 WeakPolarHBondContact O-CB 3.5Å
95	S	88.4	Confident	90.7	Very high	33 Å²	33	61.7 Å²	61.7	23%	0.231	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-59.2	-23	173.9	-63.4	0	0	0	0	112.5	S91 R97 H101	S91-S95 WeakPolarHBondContact O-CB 3.47Å; S91-S95 PolarHBondContact O-N 3.41Å; S91-S95 PolarHBondContact O-OG 2.89Å; S95-R97 VanDerWaalsContact C-N 3.28Å; S95-R97 PolarHBondContact O-N 3.48Å; S95-H101 WeakPolarHBondContact CB-NE2 3.28Å; S95-H101 PolarHBondContact OG-CE1 3.01Å; S95-H101 PolarHBondContact OG-NE2 2.94Å
96	Q	85.7	Confident	90.8	Very high	163 Å²	163	61.2 Å²	61.2	76%	0.762	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-76.8	-13.1	174.9	-59.7	-57.2	-45.7	0	0	113.3	E93 D94	E93-Q96 PolarHBondContact O-N 3.44Å; D94-Q96 PolarHBondContact O-N 2.99Å; D94-Q96 VanDerWaalsContact O-N 3.12Å
97	R	84.3	Confident	90.8	Very high	81 Å²	81	61.1 Å²	61.1	31%	0.306	30%	0.299	S	S	.	.	S	Bend	trans	-73.3	138.7	179.6	-63.2	-175.1	-171.5	176.8	11.7	109.9	D94 S95 G99 A100	D94-R97 VanDerWaalsContact O-CB 3.29Å; D94-R97 WeakPolarHBondContact O-CB 3.48Å; D94-R97 WeakPolarHBondContact O-CG 3.44Å; D94-R97 PolarHBondContact O-N 2.8Å; D94-R97 IonicContact OD1-CZ 2.81Å; D94-R97 IonicContact OD1-NE 3.71Å; D94-R97 PolarHBondContact OD1-NE 3.1Å; D94-R97 VanDerWaalsContact OD1-NE 3.07Å; D94-R97 IonicContact OD1-NH1 3.04Å; D94-R97 IonicContact OD1-NH2 3.76Å; D94-R97 PolarHBondContact OD1-NH2 3Å; S95-R97 VanDerWaalsContact C-N 3.28Å; S95-R97 PolarHBondContact O-N 3.48Å; R97-G99 PolarHBondContact O-N 3.11Å; R97-G99 VanDerWaalsContact O-N 3.12Å; R97-A100 HydrophobicContact CB-CB 4.37Å; R97-A100 WeakPolarHBondContact O-CB 3.29Å; R97-A100 PolarHBondContact O-N 3.2Å; R97-A100 VanDerWaalsContact O-N 3.1Å
98	P	84.9	Confident	90.8	Very high	54 Å²	54	62.9 Å²	62.9	35%	0.351	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	123.2	173.2	-25.6	34.1	0	0	0	110.8	L181 A189	P98-L181 HydrophobicContact CB-CD1 4.46Å; P98-A189 HydrophobicContact CB-CB 3.54Å; P98-A189 HydrophobicContact CG-CB 3.85Å
99	G	85.9	Confident	90.9	Very high	21 Å²	21	62.3 Å²	62.3	22%	0.216	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.9	12.9	177.1	0	0	0	0	0	116.5	R97 H101 L102	R97-G99 PolarHBondContact O-N 3.11Å; R97-G99 VanDerWaalsContact O-N 3.12Å; G99-H101 VanDerWaalsContact C-N 3.25Å; G99-H101 PolarHBondContact O-N 3.19Å; G99-L102 WeakPolarHBondContact O-CB 3.36Å; G99-L102 PolarHBondContact O-N 2.92Å; G99-L102 VanDerWaalsContact O-N 3.07Å
100	A	88.6	Confident	90.9	Very high	15 Å²	15	62.5 Å²	62.5	12%	0.124	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-38.1	-178.4	0	0	0	0	0	113.6	V90 D94 R97 K179	V90-A100 HydrophobicContact CG1-CB 4.1Å; D94-A100 WeakPolarHBondContact O-CB 3.5Å; R97-A100 HydrophobicContact CB-CB 4.37Å; R97-A100 WeakPolarHBondContact O-CB 3.29Å; R97-A100 PolarHBondContact O-N 3.2Å; R97-A100 VanDerWaalsContact O-N 3.1Å; A100-K179 PolarHBondContact O-NZ 2.75Å
101	H	89.2	Confident	91	Very high	111 Å²	111	62.9 Å²	62.9	51%	0.514	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	2.1	179.8	-58.8	-69.7	0	0	0	114.4	S95 G99 T103	S95-H101 WeakPolarHBondContact CB-NE2 3.28Å; S95-H101 PolarHBondContact OG-CE1 3.01Å; S95-H101 PolarHBondContact OG-NE2 2.94Å; G99-H101 VanDerWaalsContact C-N 3.25Å; G99-H101 PolarHBondContact O-N 3.19Å; H101-T103 PolarHBondContact O-N 2.85Å
102	L	91.4	Very high	91.3	Very high	59 Å²	59	62.5 Å²	62.5	31%	0.309	32%	0.316	S	S	.	.			trans	-67.3	136.3	178.8	-66.4	171.5	0	0	0	110.3	G99 V104 K179 L181 E185	G99-L102 WeakPolarHBondContact O-CB 3.36Å; G99-L102 PolarHBondContact O-N 2.92Å; G99-L102 VanDerWaalsContact O-N 3.07Å; L102-V104 HydrophobicContact CB-CG1 3.96Å; L102-V104 PolarHBondContact O-N 2.84Å; L102-K179 PolarHBondContact O-NZ 2.9Å; L102-L181 HydrophobicContact CD1-CD2 3.64Å; L102-E185 VanDerWaalsContact CD1-OE1 3.29Å; L102-E185 WeakPolarHBondContact CD1-OE1 3.29Å
103	T	93	Very high	91.6	Very high	63 Å²	63	58 Å²	58	39%	0.387	30%	0.302	S	S	.	.			trans	-80.1	99.2	168.7	-47.7	0	0	0	0	107.9	E85 K87 H101 H156	E85-T103 PolarHBondContact OE1-OG1 3.05Å; E85-T103 VanDerWaalsContact OE1-OG1 3.07Å; K87-T103 WeakPolarHBondContact CE-OG1 3.44Å; K87-T103 PolarHBondContact NZ-OG1 3.43Å; H101-T103 PolarHBondContact O-N 2.85Å; T103-H156 HydrophobicContact CG2-CB 3.67Å
104	V	95.2	Very high	91.8	Very high	24 Å²	24	57 Å²	57	15%	0.145	30%	0.298	C	S	.	.			trans	-124.6	146.2	176.3	-57.8	0	0	0	0	109.8	L102 K106 H156 V159 K179	L102-V104 HydrophobicContact CB-CG1 3.96Å; L102-V104 PolarHBondContact O-N 2.84Å; V104-K106 WeakPolarHBondContact CG2-O 3.32Å; V104-H156 WeakPolarHBondContact O-CB 3.38Å; V104-V159 HydrophobicContact CG2-CG1 3.98Å; V104-V159 WeakPolarHBondContact O-CB 3.15Å; V104-V159 WeakPolarHBondContact O-CG2 3.25Å; V104-K179 HydrophobicContact CG2-CB 3.73Å; V104-K179 HydrophobicContact CG2-CD 3.95Å; V104-K179 HydrophobicContact CG2-CG 3.78Å
105	K	96.8	Very high	92.1	Very high	102 Å²	102	58.9 Å²	58.9	44%	0.443	31%	0.308	S	S	.	.	S	Bend	trans	-98	4.3	173.7	-59	-174	177.8	-168.5	0	112.8	T152 F153 D154 H156 V159	K105-T152 CarbonylContact O-C 3.51Å; K105-T152 WeakPolarHBondContact O-CA 3.47Å; K105-F153 WeakPolarHBondContact CB-O 3.22Å; K105-F153 PolarHBondContact O-N 3.21Å; K105-D154 WeakPolarHBondContact CD-O 3.39Å; K105-D154 WeakPolarHBondContact CE-O 3.5Å; K105-D154 PolarHBondContact NZ-O 2.91Å; K105-H156 HydrophobicContact CG-CB 4.5Å; K105-V159 VanDerWaalsContact C-CG2 3.42Å
106	K	97.5	Very high	92.4	Very high	63 Å²	63	57.3 Å²	57.3	27%	0.274	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	131.2	-173.8	-168.5	170.8	-171.5	161.5	0	110.9	V104 E135 F150 V151 A180	V104-K106 WeakPolarHBondContact CG2-O 3.32Å; K106-E135 IonicContact NZ-OE2 2.64Å; K106-E135 PolarHBondContact NZ-OE2 3.4Å; K106-F150 HydrophobicContact CD-CB 4.33Å; K106-F150 HydrophobicContact CD-CD1 4.38Å; K106-F150 HydrophobicContact CG-CB 4.25Å; K106-F150 HydrophobicContact CG-CD1 4.31Å; K106-V151 CarbonylContact C-O 3.56Å; K106-V151 WeakPolarHBondContact CA-O 3.46Å; K106-A180 HydrophobicContact CB-CB 3.93Å; K106-A180 HydrophobicContact CD-CB 4.28Å; K106-A180 HydrophobicContact CG-CB 3.74Å; K106-A180 VanDerWaalsContact O-CB 3.24Å; K106-A180 WeakPolarHBondContact O-CB 2.99Å; K106-A180 PolarHBondContact O-N 2.67Å
107	I	97.7	Very high	92.8	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	148.6	171.1	57	172.3	0	0	0	111.1	V109 F125 F150 V151 F153 V159 I162 V163 V177 R178	I107-V109 HydrophobicContact CD1-CG2 3.79Å; I107-V109 HydrophobicContact CG1-CG2 4.08Å; I107-F125 HydrophobicContact CD1-CD1 3.94Å; I107-F125 HydrophobicContact CD1-CD2 4.48Å; I107-F125 HydrophobicContact CD1-CE1 3.76Å; I107-F125 HydrophobicContact CD1-CE2 4.34Å; I107-F125 HydrophobicContact CD1-CG 4.31Å; I107-F125 HydrophobicContact CD1-CZ 3.99Å; I107-F150 VanDerWaalsContact O-CA 3.24Å; I107-F150 WeakPolarHBondContact O-CA 3.4Å; I107-F150 WeakPolarHBondContact O-CD1 3.3Å; I107-V151 HydrophobicContact CD1-CB 3.95Å; I107-V151 HydrophobicContact CD1-CG2 4.35Å; I107-V151 HydrophobicContact CG1-CB 3.68Å; I107-V151 HydrophobicContact CG1-CG2 4.38Å; I107-V151 WeakPolarHBondContact CG1-O 3.18Å; I107-V151 PolarHBondContact N-O 3.07Å; I107-V151 PolarHBondContact O-N 2.79Å; I107-V151 VanDerWaalsContact O-N 3.13Å; I107-F153 HydrophobicContact CD1-CE2 3.84Å; I107-F153 HydrophobicContact CD1-CZ 4.35Å; I107-F153 HydrophobicContact CG1-CE2 3.98Å; I107-V159 HydrophobicContact CG2-CB 4.09Å; I107-V159 HydrophobicContact CG2-CG1 3.54Å; I107-V159 HydrophobicContact CG2-CG2 3.94Å; I107-I162 HydrophobicContact CD1-CD1 4.06Å; I107-I162 HydrophobicContact CD1-CG2 4.3Å; I107-V163 HydrophobicContact CG2-CG1 4.22Å; I107-V177 HydrophobicContact CB-CG1 3.92Å; I107-V177 HydrophobicContact CD1-CG1 3.85Å; I107-V177 HydrophobicContact CG1-CG1 4.42Å; I107-V177 HydrophobicContact CG2-CG1 4.13Å; I107-R178 CarbonylContact C-O 3.47Å; I107-R178 WeakPolarHBondContact CA-O 3.39Å
108	F	96.7	Very high	93.4	Very high	62 Å²	62	54.9 Å²	54.9	27%	0.272	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	130.7	162.8	168.9	-90.9	0	0	0	108.4	F148 F150 V177 R178	F108-F148 HydrophobicContact CD2-CB 4.47Å; F108-F148 AromaticContact CD2-CD2 3.96Å; F108-F148 HydrophobicContact CD2-CD2 3.96Å; F108-F148 HydrophobicContact CE2-CB 3.6Å; F108-F148 AromaticContact CE2-CD2 3.41Å; F108-F148 HydrophobicContact CE2-CD2 3.41Å; F108-F148 VanDerWaalsContact CE2-CD2 3.41Å; F108-F148 HydrophobicContact CE2-CE2 4.15Å; F108-F148 AromaticContact CE2-CG 3.66Å; F108-F148 HydrophobicContact CE2-CG 3.66Å; F108-F148 HydrophobicContact CZ-CB 3.78Å; F108-F148 HydrophobicContact CZ-CD2 4.39Å; F108-F148 HydrophobicContact CZ-CG 4.22Å; F108-F150 HydrophobicContact CB-CD1 4.21Å; F108-F150 HydrophobicContact CB-CE1 3.95Å; F108-F150 AromaticContact CD2-CE1 3.84Å; F108-F150 HydrophobicContact CD2-CE1 3.84Å; F108-F150 AromaticContact CD2-CZ 4Å; F108-F150 HydrophobicContact CD2-CZ 4Å; F108-F150 HydrophobicContact CG-CE1 4.41Å; F108-V177 WeakPolarHBondContact O-CA 3.38Å; F108-R178 PolarHBondContact N-O 3.33Å; F108-R178 PolarHBondContact O-N 3.36Å
109	V	97.1	Very high	94	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	102.6	177.3	-173.2	0	0	0	0	107.8	I107 I112 L121 F125 F148 A149 V151 C175 V177	I107-V109 HydrophobicContact CD1-CG2 3.79Å; I107-V109 HydrophobicContact CG1-CG2 4.08Å; V109-I112 HydrophobicContact CG1-CG2 3.83Å; V109-L121 HydrophobicContact CG1-CD2 4.13Å; V109-F125 HydrophobicContact CG1-CE2 4.15Å; V109-F125 HydrophobicContact CG1-CZ 4.15Å; V109-F125 HydrophobicContact CG2-CE2 3.7Å; V109-F125 HydrophobicContact CG2-CZ 3.75Å; V109-F148 CarbonylContact O-C 3.52Å; V109-F148 WeakPolarHBondContact O-CA 3.44Å; V109-F148 WeakPolarHBondContact O-CB 3.42Å; V109-A149 PolarHBondContact N-O 3.45Å; V109-A149 PolarHBondContact O-N 2.95Å; V109-V151 HydrophobicContact CG2-CG2 4.22Å; V109-C175 HydrophobicContact CG1-CB 4Å; V109-V177 HydrophobicContact CG1-CG2 4.25Å; V109-V177 HydrophobicContact CG2-CG2 4.32Å
110	G	96.5	Very high	94.5	Very high	7 Å²	7	57.4 Å²	57.4	7%	0.072	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	156	-178.2	0	0	0	0	0	113	C175 E176	G110-C175 CarbonylContact O-C 3.47Å; G110-C175 WeakPolarHBondContact O-CA 3.34Å; G110-C175 WeakPolarHBondContact O-CB 3.16Å; G110-E176 PolarHBondContact N-O 3.34Å; G110-E176 PolarHBondContact O-N 3.19Å
111	G	94	Very high	94.9	Very high	48 Å²	48	56.7 Å²	56.7	50%	0.495	28%	0.284	S	S	.	.	S	Bend	trans	83	13.4	177.6	0	0	0	0	0	114.1	G147	G111-G147 PolarHBondContact N-O 2.63Å
112	I	94.4	Very high	95.3	Very high	7 Å²	7	55 Å²	55	4%	0.036	27%	0.273	C	S	.	.			trans	-73.1	146.4	170.4	62.2	173.6	0	0	0	109.9	V109 T116 L121 I136 G147 A149 C175	V109-I112 HydrophobicContact CG1-CG2 3.83Å; I112-T116 HydrophobicContact CB-CG2 4.02Å; I112-T116 HydrophobicContact CD1-CG2 4.35Å; I112-T116 HydrophobicContact CG2-CG2 4.21Å; I112-L121 HydrophobicContact CG2-CD2 4.46Å; I112-I136 HydrophobicContact CD1-CG2 4.42Å; I112-G147 VanDerWaalsContact CG1-C 3.49Å; I112-G147 PolarHBondContact N-O 2.97Å; I112-G147 WeakPolarHBondContact O-CA 3.17Å; I112-A149 HydrophobicContact CD1-CB 3.66Å; I112-C175 HydrophobicContact CG2-CB 4.02Å
113	K	92.3	Very high	95.6	Very high	122 Å²	122	57.5 Å²	57.5	53%	0.53	29%	0.287	S	S	.	.			trans	-88.6	168.6	-179.4	-69.9	-65.7	-172.9	172.7	0	111.1	D115 T116 H173	K113-D115 WeakPolarHBondContact CB-OD1 3.17Å; K113-D115 PolarHBondContact O-N 2.89Å; K113-T116 PolarHBondContact N-OG1 3.48Å; K113-T116 VanDerWaalsContact O-CB 3.3Å; K113-T116 WeakPolarHBondContact O-CB 3.27Å; K113-T116 PolarHBondContact O-N 3.18Å; K113-T116 PolarHBondContact O-OG1 2.94Å; K113-H173 HydrophobicContact CG-CB 4.37Å; K113-H173 WeakPolarHBondContact CG-ND1 3.42Å
114	E	91.3	Very high	95.8	Very high	122 Å²	122	56.8 Å²	56.8	57%	0.57	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-21.2	-178.2	-65.4	-171.7	163.6	0	0	113.3	T116 K145	E114-T116 VanDerWaalsContact C-N 3.28Å; E114-K145 HydrophobicContact CG-CB 4.45Å; E114-K145 VanDerWaalsContact O-CD 3.27Å; E114-K145 WeakPolarHBondContact O-CD 3.43Å; E114-K145 WeakPolarHBondContact O-CE 3.09Å; E114-K145 PolarHBondContact O-NZ 3.46Å
115	D	93.4	Very high	95.9	Very high	80 Å²	80	55.7 Å²	55.7	43%	0.428	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-12.7	172.8	64.9	-13.8	0	0	0	113.3	K113 E117 N171 H173	K113-D115 WeakPolarHBondContact CB-OD1 3.17Å; K113-D115 PolarHBondContact O-N 2.89Å; D115-E117 PolarHBondContact O-N 3.43Å; D115-N171 PolarHBondContact OD1-ND2 3.02Å; D115-N171 PolarHBondContact OD2-ND2 3.48Å; D115-H173 IonicContact OD1-CD2 3.96Å; D115-H173 IonicContact OD1-NE2 2.97Å; D115-H173 PolarHBondContact OD1-NE2 3.11Å; D115-H173 IonicContact OD2-CD2 3.88Å; D115-H173 IonicContact OD2-CE1 3.33Å; D115-H173 IonicContact OD2-NE2 3.4Å; D115-H173 PolarHBondContact OD2-NE2 3.49Å
116	T	94.5	Very high	95.9	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.273	C	S	.	.			trans	-77.4	121	-176.1	-54.1	0	0	0	0	110.3	I112 K113 E114 H120 L121 K145	I112-T116 HydrophobicContact CB-CG2 4.02Å; I112-T116 HydrophobicContact CD1-CG2 4.35Å; I112-T116 HydrophobicContact CG2-CG2 4.21Å; K113-T116 PolarHBondContact N-OG1 3.48Å; K113-T116 VanDerWaalsContact O-CB 3.3Å; K113-T116 WeakPolarHBondContact O-CB 3.27Å; K113-T116 PolarHBondContact O-N 3.18Å; K113-T116 PolarHBondContact O-OG1 2.94Å; E114-T116 VanDerWaalsContact C-N 3.28Å; T116-H120 HydrophobicContact CG2-CB 4.34Å; T116-L121 HydrophobicContact CG2-CD2 4.41Å; T116-L121 HydrophobicContact CG2-CG 4.3Å; T116-K145 PolarHBondContact O-NZ 3.42Å
117	E	95.2	Very high	95.8	Very high	101 Å²	101	59 Å²	59	47%	0.472	29%	0.289	S	S	.	.			trans	-109.5	171.1	-179.6	-59	-172.7	175.2	0	0	112.8	D115 H119 H120 L121 I136	D115-E117 PolarHBondContact O-N 3.43Å; E117-H119 VanDerWaalsContact C-N 3.3Å; E117-H119 PolarHBondContact O-N 2.88Å; E117-H119 IonicContact OE2-CE1 3.73Å; E117-H119 PolarHBondContact OE2-CE1 3.24Å; E117-H119 IonicContact OE2-ND1 3.02Å; E117-H119 PolarHBondContact OE2-ND1 3.15Å; E117-H119 VanDerWaalsContact OE2-ND1 3.15Å; E117-H120 PolarHBondContact N-ND1 3.06Å; E117-H120 PolarHBondContact O-N 3.16Å; E117-L121 PolarHBondContact O-N 2.86Å; E117-I136 VanDerWaalsContact C-CD1 3.41Å
118	E	95.9	Very high	95.7	Very high	91 Å²	91	61 Å²	61	43%	0.425	30%	0.297	S	S	.	.	H	α-helix	trans	-56.8	-43.7	-178.2	179.9	177.5	158.9	0	0	112	H120 L121 R122 I134	E118-H120 VanDerWaalsContact C-N 3.32Å; E118-H120 PolarHBondContact O-N 2.66Å; E118-L121 PolarHBondContact O-N 3.23Å; E118-L121 VanDerWaalsContact O-N 3.13Å; E118-R122 WeakPolarHBondContact O-CB 3.46Å; E118-R122 PolarHBondContact O-N 3.36Å; E118-R122 IonicContact OE1-CZ 3.37Å; E118-R122 IonicContact OE1-NE 2.66Å; E118-R122 IonicContact OE1-NH2 3.15Å; E118-R122 PolarHBondContact OE1-NH2 2.75Å; E118-I134 HydrophobicContact CG-CB 3.83Å; E118-I134 HydrophobicContact CG-CD1 3.74Å; E118-I134 HydrophobicContact CG-CG1 4.33Å; E118-I134 HydrophobicContact CG-CG2 3.9Å
119	H	97	Very high	95.6	Very high	85 Å²	85	59.1 Å²	59.1	39%	0.394	30%	0.295	S	S	.	.	H	α-helix	trans	-61.6	-39.6	-177.8	69.3	-94.1	0	0	0	112	E117 L121 R122 D123	E117-H119 VanDerWaalsContact C-N 3.3Å; E117-H119 PolarHBondContact O-N 2.88Å; E117-H119 IonicContact OE2-CE1 3.73Å; E117-H119 PolarHBondContact OE2-CE1 3.24Å; E117-H119 IonicContact OE2-ND1 3.02Å; E117-H119 PolarHBondContact OE2-ND1 3.15Å; E117-H119 VanDerWaalsContact OE2-ND1 3.15Å; H119-L121 VanDerWaalsContact C-N 3.3Å; H119-L121 PolarHBondContact O-N 3.23Å; H119-R122 PolarHBondContact O-N 2.92Å; H119-R122 VanDerWaalsContact O-N 3.15Å; H119-D123 WeakPolarHBondContact O-CB 3.27Å; H119-D123 PolarHBondContact O-N 2.84Å
120	H	96.8	Very high	95.6	Very high	43 Å²	43	65.8 Å²	65.8	20%	0.199	32%	0.324	C	S	.	.	H	α-helix	trans	-60.4	-39.2	175.8	-57	105.4	0	0	0	112.8	T116 E117 E118 Y124 V170 N171	T116-H120 HydrophobicContact CG2-CB 4.34Å; E117-H120 PolarHBondContact N-ND1 3.06Å; E117-H120 PolarHBondContact O-N 3.16Å; E118-H120 VanDerWaalsContact C-N 3.32Å; E118-H120 PolarHBondContact O-N 2.66Å; H120-Y124 WeakPolarHBondContact O-CB 3.32Å; H120-Y124 PolarHBondContact O-N 3.16Å; H120-V170 HydrophobicContact CB-CG1 4.34Å; H120-N171 HydrophobicContact CB-CB 4.1Å; H120-N171 PolarHBondContact CD2-OD1 2.9Å; H120-N171 PolarHBondContact NE2-OD1 3.45Å
121	L	97.1	Very high	95.7	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-71.1	-42.6	176	-65.7	169.6	0	0	0	110.3	V109 I112 T116 E117 E118 H119 F125 I134 I136 A149 V170	V109-L121 HydrophobicContact CG1-CD2 4.13Å; I112-L121 HydrophobicContact CG2-CD2 4.46Å; T116-L121 HydrophobicContact CG2-CD2 4.41Å; T116-L121 HydrophobicContact CG2-CG 4.3Å; E117-L121 PolarHBondContact O-N 2.86Å; E118-L121 PolarHBondContact O-N 3.23Å; E118-L121 VanDerWaalsContact O-N 3.13Å; H119-L121 VanDerWaalsContact C-N 3.3Å; H119-L121 PolarHBondContact O-N 3.23Å; L121-F125 HydrophobicContact CB-CD2 4.25Å; L121-F125 HydrophobicContact CD2-CD2 4.26Å; L121-F125 HydrophobicContact CD2-CE2 3.77Å; L121-F125 VanDerWaalsContact O-CB 3.28Å; L121-F125 WeakPolarHBondContact O-CB 3.28Å; L121-F125 WeakPolarHBondContact O-CD2 3.04Å; L121-F125 PolarHBondContact O-N 3.03Å; L121-I134 HydrophobicContact CB-CD1 4.34Å; L121-I134 HydrophobicContact CB-CG2 4.22Å; L121-I134 HydrophobicContact CD1-CG2 3.72Å; L121-I136 HydrophobicContact CD1-CD1 3.94Å; L121-I136 HydrophobicContact CD1-CG1 3.75Å; L121-A149 HydrophobicContact CD1-CB 3.57Å; L121-V170 HydrophobicContact CD2-CG1 4.1Å
122	R	97.6	Very high	95.9	Very high	76 Å²	76	69.1 Å²	69.1	29%	0.287	33%	0.325	S	S	.	.	H	α-helix	trans	-59.8	-56.7	179.1	-172.8	174.2	-68	-82.5	-0.1	111.1	E118 H119 Y124 F125 E126 I131 I134	E118-R122 WeakPolarHBondContact O-CB 3.46Å; E118-R122 PolarHBondContact O-N 3.36Å; E118-R122 IonicContact OE1-CZ 3.37Å; E118-R122 IonicContact OE1-NE 2.66Å; E118-R122 IonicContact OE1-NH2 3.15Å; E118-R122 PolarHBondContact OE1-NH2 2.75Å; H119-R122 PolarHBondContact O-N 2.92Å; H119-R122 VanDerWaalsContact O-N 3.15Å; R122-Y124 PolarHBondContact O-N 3.44Å; R122-F125 PolarHBondContact O-N 3.09Å; R122-E126 WeakPolarHBondContact O-CB 3.47Å; R122-E126 PolarHBondContact O-N 3.48Å; R122-I131 HydrophobicContact CG-CD1 4.33Å; R122-I134 HydrophobicContact CB-CD1 3.62Å; R122-I134 HydrophobicContact CG-CD1 4.29Å
123	D	96.8	Very high	96	Very high	111 Å²	111	72 Å²	72	59%	0.594	34%	0.343	S	S	*	.	H	α-helix	trans	-56.6	-38	-176.8	-63.7	-12.1	0	0	0	111.8	H119	H119-D123 WeakPolarHBondContact O-CB 3.27Å; H119-D123 PolarHBondContact O-N 2.84Å
124	Y	97	Very high	96.3	Very high	49 Å²	49	67 Å²	67	19%	0.192	32%	0.322	C	S	.	.	H	α-helix	trans	-77.1	-45.6	178.2	-175	-98.5	0	0	0	113.3	H120 R122 Q127 Y128 H168 V170	H120-Y124 WeakPolarHBondContact O-CB 3.32Å; H120-Y124 PolarHBondContact O-N 3.16Å; R122-Y124 PolarHBondContact O-N 3.44Å; Y124-Q127 VanDerWaalsContact O-CD 3.31Å; Y124-Q127 WeakPolarHBondContact O-CG 3.36Å; Y124-Q127 PolarHBondContact O-NE2 2.71Å; Y124-Y128 HydrophobicContact CE1-CE2 4.03Å; Y124-H168 HydrophobicContact CE1-CB 3.69Å; Y124-H168 AromaticContact CE1-CG 3.86Å; Y124-H168 AromaticContact CE1-ND1 3.5Å; Y124-H168 WeakPolarHBondContact CE1-ND1 3.1Å; Y124-H168 AromaticContact CZ-ND1 3.6Å; Y124-H168 WeakPolarHBondContact OH-CB 3.11Å; Y124-H168 PolarHBondContact OH-ND1 3.27Å; Y124-V170 HydrophobicContact CD1-CG2 3.51Å; Y124-V170 HydrophobicContact CD2-CG2 4.32Å; Y124-V170 HydrophobicContact CE1-CG2 3.94Å; Y124-V170 HydrophobicContact CG-CG2 3.72Å
125	F	97.5	Very high	96.5	Very high	0 Å²	0	65 Å²	65	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-85.6	-21.2	-171.1	-74.9	-58.5	0	0	0	113.7	I107 V109 L121 R122 Q127 Y128 I131 V151 F153 I162 V170 V177	I107-F125 HydrophobicContact CD1-CD1 3.94Å; I107-F125 HydrophobicContact CD1-CD2 4.48Å; I107-F125 HydrophobicContact CD1-CE1 3.76Å; I107-F125 HydrophobicContact CD1-CE2 4.34Å; I107-F125 HydrophobicContact CD1-CG 4.31Å; I107-F125 HydrophobicContact CD1-CZ 3.99Å; V109-F125 HydrophobicContact CG1-CE2 4.15Å; V109-F125 HydrophobicContact CG1-CZ 4.15Å; V109-F125 HydrophobicContact CG2-CE2 3.7Å; V109-F125 HydrophobicContact CG2-CZ 3.75Å; L121-F125 HydrophobicContact CB-CD2 4.25Å; L121-F125 HydrophobicContact CD2-CD2 4.26Å; L121-F125 HydrophobicContact CD2-CE2 3.77Å; L121-F125 VanDerWaalsContact O-CB 3.28Å; L121-F125 WeakPolarHBondContact O-CB 3.28Å; L121-F125 WeakPolarHBondContact O-CD2 3.04Å; L121-F125 PolarHBondContact O-N 3.03Å; R122-F125 PolarHBondContact O-N 3.09Å; F125-Q127 PolarHBondContact O-N 2.79Å; F125-Y128 HydrophobicContact CD1-CD2 4.3Å; F125-Y128 HydrophobicContact CD1-CE2 4.42Å; F125-Y128 PolarHBondContact O-N 2.89Å; F125-I131 HydrophobicContact CB-CD1 3.81Å; F125-V151 HydrophobicContact CD2-CG2 3.94Å; F125-V151 HydrophobicContact CE2-CG2 4.32Å; F125-F153 HydrophobicContact CB-CE1 4.4Å; F125-F153 HydrophobicContact CB-CZ 3.92Å; F125-F153 HydrophobicContact CG-CZ 4.45Å; F125-I162 HydrophobicContact CD1-CD1 3.79Å; F125-I162 HydrophobicContact CD1-CG1 4.39Å; F125-I162 HydrophobicContact CD1-CG2 4.44Å; F125-I162 HydrophobicContact CE1-CD1 4.34Å; F125-I162 HydrophobicContact CE1-CG2 3.94Å; F125-V170 HydrophobicContact CE2-CG2 4.35Å; F125-V170 HydrophobicContact CZ-CG2 4.33Å; F125-V177 HydrophobicContact CE1-CG2 4.27Å; F125-V177 HydrophobicContact CZ-CG2 3.95Å
126	E	96.6	Very high	96.6	Very high	105 Å²	105	63.1 Å²	63.1	49%	0.491	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-63.8	-25	179.5	-174.2	166.2	-165.2	0	0	112.1	R122 Y128 G129 I131	R122-E126 WeakPolarHBondContact O-CB 3.47Å; R122-E126 PolarHBondContact O-N 3.48Å; E126-Y128 PolarHBondContact O-N 2.87Å; E126-Y128 VanDerWaalsContact O-N 3.16Å; E126-G129 WeakPolarHBondContact CA-O 3.45Å; E126-G129 PolarHBondContact O-N 2.78Å; E126-G129 VanDerWaalsContact O-N 3.15Å; E126-I131 HydrophobicContact CB-CD1 4.12Å
127	Q	95.6	Very high	96.6	Very high	129 Å²	129	65.5 Å²	65.5	60%	0.603	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-62.4	-20.5	173.9	80.7	-170.9	-2.1	0	0	113.7	Y124 F125	Y124-Q127 VanDerWaalsContact O-CD 3.31Å; Y124-Q127 WeakPolarHBondContact O-CG 3.36Å; Y124-Q127 PolarHBondContact O-NE2 2.71Å; F125-Q127 PolarHBondContact O-N 2.79Å
128	Y	95.4	Very high	96.6	Very high	43 Å²	43	64 Å²	64	17%	0.169	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-93.4	-15.8	179.1	-63.2	-85.2	0	0	0	113	Y124 F125 E126 S158 K161 I162	Y124-Y128 HydrophobicContact CE1-CE2 4.03Å; F125-Y128 HydrophobicContact CD1-CD2 4.3Å; F125-Y128 HydrophobicContact CD1-CE2 4.42Å; F125-Y128 PolarHBondContact O-N 2.89Å; E126-Y128 PolarHBondContact O-N 2.87Å; E126-Y128 VanDerWaalsContact O-N 3.16Å; Y128-S158 WeakPolarHBondContact O-CB 3.44Å; Y128-S158 PolarHBondContact O-OG 2.94Å; Y128-K161 HydrophobicContact CD1-CB 4.02Å; Y128-K161 WeakPolarHBondContact O-CE 3.39Å; Y128-K161 PolarHBondContact O-NZ 2.96Å; Y128-I162 HydrophobicContact CD1-CG1 3.67Å; Y128-I162 HydrophobicContact CD2-CD1 3.98Å; Y128-I162 HydrophobicContact CD2-CG1 3.64Å; Y128-I162 HydrophobicContact CE1-CG1 4.08Å; Y128-I162 HydrophobicContact CE2-CG1 4.04Å; Y128-I162 HydrophobicContact CG-CD1 3.92Å; Y128-I162 HydrophobicContact CG-CG1 3.42Å; Y128-I162 VanDerWaalsContact CG-CG1 3.42Å
129	G	95.4	Very high	96.3	Very high	23 Å²	23	63.1 Å²	63.1	24%	0.237	31%	0.309	C	S	.	.	S	Bend	trans	152.6	179.9	178.1	0	0	0	0	0	113	E126 I131 S158	E126-G129 WeakPolarHBondContact CA-O 3.45Å; E126-G129 PolarHBondContact O-N 2.78Å; E126-G129 VanDerWaalsContact O-N 3.15Å; G129-I131 PolarHBondContact O-N 3.43Å; G129-S158 WeakPolarHBondContact CA-OG 3.48Å
130	K	97.4	Very high	95.8	Very high	139 Å²	139	71.1 Å²	71.1	60%	0.604	34%	0.336	S	S	*	.			trans	-73.9	122	-170.6	-178.4	-175.8	177.9	-170.8	0	111.2	F153 D154	K130-F153 WeakPolarHBondContact O-CA 3.36Å; K130-D154 WeakPolarHBondContact CB-OD2 3.26Å; K130-D154 WeakPolarHBondContact CD-OD2 3.46Å; K130-D154 PolarHBondContact O-N 3.47Å
131	I	98	Very high	95.5	Very high	14 Å²	14	72.7 Å²	72.7	7%	0.072	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	128	177.5	-60.8	172.7	0	0	0	109.8	R122 F125 E126 G129 I134 V151 F153	R122-I131 HydrophobicContact CG-CD1 4.33Å; F125-I131 HydrophobicContact CB-CD1 3.81Å; E126-I131 HydrophobicContact CB-CD1 4.12Å; G129-I131 PolarHBondContact O-N 3.43Å; I131-I134 HydrophobicContact CD1-CD1 4.29Å; I131-I134 HydrophobicContact CG2-CD1 4.05Å; I131-I134 HydrophobicContact CG2-CG1 3.62Å; I131-V151 HydrophobicContact CD1-CG1 4.1Å; I131-V151 HydrophobicContact CG1-CG1 4.04Å; I131-V151 HydrophobicContact CG2-CG1 3.83Å; I131-F153 HydrophobicContact CG1-CD1 4.03Å; I131-F153 HydrophobicContact CG1-CE1 3.7Å; I131-F153 HydrophobicContact CG1-CZ 4.37Å
132	E	97.9	Very high	95.2	Very high	112 Å²	112	75.9 Å²	75.9	52%	0.523	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-48.2	171.9	-66.7	-171.3	154.4	0	0	111.7	T152 D154	E132-T152 PolarHBondContact N-O 2.9Å; E132-D154 HydrophobicContact CG-CB 4.07Å
133	V	97.4	Very high	94.8	Very high	68 Å²	68	74.8 Å²	74.8	41%	0.412	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	137.5	-172	-172.9	0	0	0	0	111.1	E135 T152	V133-E135 HydrophobicContact CG1-CG 3.93Å; V133-T152 PolarHBondContact N-O 3.27Å; V133-T152 PolarHBondContact O-N 2.87Å
134	I	97.5	Very high	94.5	Very high	17 Å²	17	75.7 Å²	75.7	9%	0.087	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	129.3	169.9	-58.3	174.8	0	0	0	108.6	E118 L121 R122 I131 I136 V151	E118-I134 HydrophobicContact CG-CB 3.83Å; E118-I134 HydrophobicContact CG-CD1 3.74Å; E118-I134 HydrophobicContact CG-CG1 4.33Å; E118-I134 HydrophobicContact CG-CG2 3.9Å; L121-I134 HydrophobicContact CB-CD1 4.34Å; L121-I134 HydrophobicContact CB-CG2 4.22Å; L121-I134 HydrophobicContact CD1-CG2 3.72Å; R122-I134 HydrophobicContact CB-CD1 3.62Å; R122-I134 HydrophobicContact CG-CD1 4.29Å; I131-I134 HydrophobicContact CD1-CD1 4.29Å; I131-I134 HydrophobicContact CG2-CD1 4.05Å; I131-I134 HydrophobicContact CG2-CG1 3.62Å; I134-I136 HydrophobicContact CG2-CG1 4.49Å; I134-V151 HydrophobicContact CG1-CG1 4.28Å; I134-V151 HydrophobicContact CG1-CG2 4.43Å; I134-V151 HydrophobicContact CG2-CG2 4.46Å
135	E	96.2	Very high	94.2	Very high	80 Å²	80	76 Å²	76	37%	0.374	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	101.3	-179.6	-65.2	176.7	85.8	0	0	110	K106 V133 M137 A149 F150	K106-E135 IonicContact NZ-OE2 2.64Å; K106-E135 PolarHBondContact NZ-OE2 3.4Å; V133-E135 HydrophobicContact CG1-CG 3.93Å; E135-M137 HydrophobicContact CB-SD 4.41Å; E135-A149 CarbonylContact O-C 3.53Å; E135-A149 WeakPolarHBondContact O-CA 3.05Å; E135-A149 WeakPolarHBondContact O-CB 3.23Å; E135-F150 HydrophobicContact CB-CB 4.46Å; E135-F150 PolarHBondContact N-O 2.74Å; E135-F150 PolarHBondContact O-N 2.97Å
136	I	96.1	Very high	94	Very high	39 Å²	39	82.7 Å²	82.7	20%	0.2	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	120.1	171.9	-60.2	179.5	0	0	0	108.8	I112 E117 L121 I134 T138 K145 A149	I112-I136 HydrophobicContact CD1-CG2 4.42Å; E117-I136 VanDerWaalsContact C-CD1 3.41Å; L121-I136 HydrophobicContact CD1-CD1 3.94Å; L121-I136 HydrophobicContact CD1-CG1 3.75Å; I134-I136 HydrophobicContact CG2-CG1 4.49Å; I136-T138 PolarHBondContact O-N 3.37Å; I136-K145 HydrophobicContact CG2-CD 3.9Å; I136-K145 HydrophobicContact CG2-CG 4.05Å; I136-A149 HydrophobicContact CG1-CB 4.06Å
137	M	94.9	Very high	93.9	Very high	51 Å²	51	78.7 Å²	78.7	25%	0.251	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	120.5	-170.9	-60	-59.1	-59.1	0	0	110.7	E135 R146 F148 F150	E135-M137 HydrophobicContact CB-SD 4.41Å; M137-R146 WeakPolarHBondContact O-CB 3.49Å; M137-R146 PolarHBondContact O-N 2.91Å; M137-F148 HydrophobicContact CB-CD1 4.4Å; M137-F148 HydrophobicContact CB-CD2 3.95Å; M137-F148 HydrophobicContact CB-CE1 4.09Å; M137-F148 HydrophobicContact CB-CE2 3.65Å; M137-F148 HydrophobicContact CB-CG 4.34Å; M137-F148 HydrophobicContact CB-CZ 3.7Å; M137-F148 WeakPolarHBondContact CB-O 3.24Å; M137-F148 HydrophobicContact CG-CD2 3.66Å; M137-F148 HydrophobicContact CG-CE2 3.34Å; M137-F148 HydrophobicContact CG-CG 4.49Å; M137-F148 HydrophobicContact CG-CZ 3.89Å; M137-F148 PolarHBondContact N-O 3.36Å; M137-F150 HydrophobicContact CG-CD2 3.93Å; M137-F150 HydrophobicContact CG-CE2 3.95Å; M137-F150 HydrophobicContact SD-CD2 3.97Å; M137-F150 HydrophobicContact SD-CE2 4.14Å
138	T	93.5	Very high	93.9	Very high	68 Å²	68	74.1 Å²	74.1	42%	0.417	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	153.9	175	54	0	0	0	0	111.4	I136 K144 K145 R146	I136-T138 PolarHBondContact O-N 3.37Å; T138-K144 CarbonylContact C-O 3.51Å; T138-K144 VanDerWaalsContact CA-O 3.31Å; T138-K144 WeakPolarHBondContact CA-O 3.5Å; T138-K145 HydrophobicContact CG2-CG 4.05Å; T138-R146 WeakPolarHBondContact O-CD 3.35Å
139	D	90	Very high	94	Very high	73 Å²	73	72 Å²	72	39%	0.39	38%	0.382	S	S	.	.			trans	-74.6	129.2	171.6	177.6	-103.1	0	0	0	109.3	G141 S142 G143 K144 R146	D139-G141 PolarHBondContact O-N 3.23Å; D139-G141 PolarHBondContact OD1-N 3.45Å; D139-S142 WeakPolarHBondContact CB-OG 3.26Å; D139-S142 PolarHBondContact OD1-N 2.92Å; D139-S142 PolarHBondContact OD1-OG 3.48Å; D139-G143 WeakPolarHBondContact O-CA 3.36Å; D139-G143 PolarHBondContact O-N 2.96Å; D139-K144 PolarHBondContact N-O 3.14Å; D139-R146 HydrophobicContact CB-CG 4.12Å
140	R	87.8	Confident	94.1	Very high	254 Å²	254	72.7 Å²	72.7	96%	0.958	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-23.1	-172.2	-67.7	-177.1	178.7	-173.7	-3.7	113.4
141	G	89.9	Confident	94.2	Very high	75 Å²	75	66.1 Å²	66.1	77%	0.773	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-49.1	-179.6	0	0	0	0	0	112.4	D139	D139-G141 PolarHBondContact O-N 3.23Å; D139-G141 PolarHBondContact OD1-N 3.45Å
142	S	90.4	Very high	94.2	Very high	68 Å²	68	66.6 Å²	66.6	48%	0.476	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-15.5	-173.5	62.3	0	0	0	0	114.7	D139 K144	D139-S142 WeakPolarHBondContact CB-OG 3.26Å; D139-S142 PolarHBondContact OD1-N 2.92Å; D139-S142 PolarHBondContact OD1-OG 3.48Å; S142-K144 PolarHBondContact O-N 2.88Å; S142-K144 VanDerWaalsContact O-N 3.14Å; S142-K144 PolarHBondContact OG-N 2.86Å
143	G	88.7	Confident	94.2	Very high	52 Å²	52	61.2 Å²	61.2	54%	0.536	33%	0.328	S	S	.	.			trans	70.6	-3.4	-171.1	0	0	0	0	0	114.1	D139	D139-G143 WeakPolarHBondContact O-CA 3.36Å; D139-G143 PolarHBondContact O-N 2.96Å
144	K	90.4	Very high	94.2	Very high	130 Å²	130	60.8 Å²	60.8	57%	0.565	32%	0.323	S	S	*	.			trans	-69.2	143.1	-179.1	-66.3	-172.4	177.4	-169.1	0	111.1	T138 D139 S142 R146	T138-K144 CarbonylContact C-O 3.51Å; T138-K144 VanDerWaalsContact CA-O 3.31Å; T138-K144 WeakPolarHBondContact CA-O 3.5Å; D139-K144 PolarHBondContact N-O 3.14Å; S142-K144 PolarHBondContact O-N 2.88Å; S142-K144 VanDerWaalsContact O-N 3.14Å; S142-K144 PolarHBondContact OG-N 2.86Å; K144-R146 PolarHBondContact O-N 2.79Å
145	K	92.5	Very high	94.1	Very high	55 Å²	55	61.8 Å²	61.8	24%	0.239	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	132.3	174.9	-65.5	179	-170.5	164.8	0	109.3	E114 T116 I136 T138 G147	E114-K145 HydrophobicContact CG-CB 4.45Å; E114-K145 VanDerWaalsContact O-CD 3.27Å; E114-K145 WeakPolarHBondContact O-CD 3.43Å; E114-K145 WeakPolarHBondContact O-CE 3.09Å; E114-K145 PolarHBondContact O-NZ 3.46Å; T116-K145 PolarHBondContact O-NZ 3.42Å; I136-K145 HydrophobicContact CG2-CD 3.9Å; I136-K145 HydrophobicContact CG2-CG 4.05Å; T138-K145 HydrophobicContact CG2-CG 4.05Å; K145-G147 PolarHBondContact O-N 3.04Å
146	R	93.2	Very high	94.1	Very high	141 Å²	141	58.8 Å²	58.8	53%	0.532	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	3.3	-177	-64.3	174.4	61.1	-165	-4.5	113.5	M137 T138 D139 K144 F148	M137-R146 WeakPolarHBondContact O-CB 3.49Å; M137-R146 PolarHBondContact O-N 2.91Å; T138-R146 WeakPolarHBondContact O-CD 3.35Å; D139-R146 HydrophobicContact CB-CG 4.12Å; K144-R146 PolarHBondContact O-N 2.79Å; R146-F148 HydrophobicContact CB-CD1 3.76Å; R146-F148 HydrophobicContact CB-CE1 3.48Å; R146-F148 VanDerWaalsContact CB-CE1 3.48Å; R146-F148 HydrophobicContact CB-CZ 4.48Å; R146-F148 HydrophobicContact CG-CE1 4.4Å; R146-F148 VanDerWaalsContact CZ-CZ 3.47Å
147	G	94	Very high	94.1	Very high	22 Å²	22	57 Å²	57	23%	0.227	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	76.8	20.9	-179.2	0	0	0	0	0	114.9	G111 I112 K145	G111-G147 PolarHBondContact N-O 2.63Å; I112-G147 VanDerWaalsContact CG1-C 3.49Å; I112-G147 PolarHBondContact N-O 2.97Å; I112-G147 WeakPolarHBondContact O-CA 3.17Å; K145-G147 PolarHBondContact O-N 3.04Å
148	F	95.9	Very high	94.2	Very high	32 Å²	32	54.8 Å²	54.8	14%	0.14	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	156.8	171.8	69.4	-83.2	0	0	0	112.4	F108 V109 M137 R146 F150	F108-F148 HydrophobicContact CD2-CB 4.47Å; F108-F148 AromaticContact CD2-CD2 3.96Å; F108-F148 HydrophobicContact CD2-CD2 3.96Å; F108-F148 HydrophobicContact CE2-CB 3.6Å; F108-F148 AromaticContact CE2-CD2 3.41Å; F108-F148 HydrophobicContact CE2-CD2 3.41Å; F108-F148 VanDerWaalsContact CE2-CD2 3.41Å; F108-F148 HydrophobicContact CE2-CE2 4.15Å; F108-F148 AromaticContact CE2-CG 3.66Å; F108-F148 HydrophobicContact CE2-CG 3.66Å; F108-F148 HydrophobicContact CZ-CB 3.78Å; F108-F148 HydrophobicContact CZ-CD2 4.39Å; F108-F148 HydrophobicContact CZ-CG 4.22Å; V109-F148 CarbonylContact O-C 3.52Å; V109-F148 WeakPolarHBondContact O-CA 3.44Å; V109-F148 WeakPolarHBondContact O-CB 3.42Å; M137-F148 HydrophobicContact CB-CD1 4.4Å; M137-F148 HydrophobicContact CB-CD2 3.95Å; M137-F148 HydrophobicContact CB-CE1 4.09Å; M137-F148 HydrophobicContact CB-CE2 3.65Å; M137-F148 HydrophobicContact CB-CG 4.34Å; M137-F148 HydrophobicContact CB-CZ 3.7Å; M137-F148 WeakPolarHBondContact CB-O 3.24Å; M137-F148 HydrophobicContact CG-CD2 3.66Å; M137-F148 HydrophobicContact CG-CE2 3.34Å; M137-F148 HydrophobicContact CG-CG 4.49Å; M137-F148 HydrophobicContact CG-CZ 3.89Å; M137-F148 PolarHBondContact N-O 3.36Å; R146-F148 HydrophobicContact CB-CD1 3.76Å; R146-F148 HydrophobicContact CB-CE1 3.48Å; R146-F148 VanDerWaalsContact CB-CE1 3.48Å; R146-F148 HydrophobicContact CB-CZ 4.48Å; R146-F148 HydrophobicContact CG-CE1 4.4Å; R146-F148 VanDerWaalsContact CZ-CZ 3.47Å; F148-F150 HydrophobicContact CD2-CE2 4.07Å; F148-F150 HydrophobicContact CD2-CZ 4.43Å; F148-F150 AromaticContact CE2-CE2 3.72Å; F148-F150 HydrophobicContact CE2-CE2 3.72Å; F148-F150 HydrophobicContact CE2-CZ 4.15Å
149	A	97.4	Very high	94.4	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	166.9	176.4	0	0	0	0	0	110.9	V109 I112 L121 E135 I136	V109-A149 PolarHBondContact N-O 3.45Å; V109-A149 PolarHBondContact O-N 2.95Å; I112-A149 HydrophobicContact CD1-CB 3.66Å; L121-A149 HydrophobicContact CD1-CB 3.57Å; E135-A149 CarbonylContact O-C 3.53Å; E135-A149 WeakPolarHBondContact O-CA 3.05Å; E135-A149 WeakPolarHBondContact O-CB 3.23Å; I136-A149 HydrophobicContact CG1-CB 4.06Å
150	F	97.7	Very high	94.6	Very high	37 Å²	37	48.4 Å²	48.4	16%	0.162	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	143.7	164.3	-63	-85.7	0	0	0	110.7	K106 I107 F108 E135 M137 F148 A180	K106-F150 HydrophobicContact CD-CB 4.33Å; K106-F150 HydrophobicContact CD-CD1 4.38Å; K106-F150 HydrophobicContact CG-CB 4.25Å; K106-F150 HydrophobicContact CG-CD1 4.31Å; I107-F150 VanDerWaalsContact O-CA 3.24Å; I107-F150 WeakPolarHBondContact O-CA 3.4Å; I107-F150 WeakPolarHBondContact O-CD1 3.3Å; F108-F150 HydrophobicContact CB-CD1 4.21Å; F108-F150 HydrophobicContact CB-CE1 3.95Å; F108-F150 AromaticContact CD2-CE1 3.84Å; F108-F150 HydrophobicContact CD2-CE1 3.84Å; F108-F150 AromaticContact CD2-CZ 4Å; F108-F150 HydrophobicContact CD2-CZ 4Å; F108-F150 HydrophobicContact CG-CE1 4.41Å; E135-F150 HydrophobicContact CB-CB 4.46Å; E135-F150 PolarHBondContact N-O 2.74Å; E135-F150 PolarHBondContact O-N 2.97Å; M137-F150 HydrophobicContact CG-CD2 3.93Å; M137-F150 HydrophobicContact CG-CE2 3.95Å; M137-F150 HydrophobicContact SD-CD2 3.97Å; M137-F150 HydrophobicContact SD-CE2 4.14Å; F148-F150 HydrophobicContact CD2-CE2 4.07Å; F148-F150 HydrophobicContact CD2-CZ 4.43Å; F148-F150 AromaticContact CE2-CE2 3.72Å; F148-F150 HydrophobicContact CE2-CE2 3.72Å; F148-F150 HydrophobicContact CE2-CZ 4.15Å; F150-A180 HydrophobicContact CD1-CB 3.84Å; F150-A180 HydrophobicContact CE1-CB 3.9Å
151	V	98.1	Very high	94.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	127.4	173.3	-176.9	0	0	0	0	107.6	K106 I107 V109 F125 I131 I134 F153	K106-V151 CarbonylContact C-O 3.56Å; K106-V151 WeakPolarHBondContact CA-O 3.46Å; I107-V151 HydrophobicContact CD1-CB 3.95Å; I107-V151 HydrophobicContact CD1-CG2 4.35Å; I107-V151 HydrophobicContact CG1-CB 3.68Å; I107-V151 HydrophobicContact CG1-CG2 4.38Å; I107-V151 WeakPolarHBondContact CG1-O 3.18Å; I107-V151 PolarHBondContact N-O 3.07Å; I107-V151 PolarHBondContact O-N 2.79Å; I107-V151 VanDerWaalsContact O-N 3.13Å; V109-V151 HydrophobicContact CG2-CG2 4.22Å; F125-V151 HydrophobicContact CD2-CG2 3.94Å; F125-V151 HydrophobicContact CE2-CG2 4.32Å; I131-V151 HydrophobicContact CD1-CG1 4.1Å; I131-V151 HydrophobicContact CG1-CG1 4.04Å; I131-V151 HydrophobicContact CG2-CG1 3.83Å; I134-V151 HydrophobicContact CG1-CG1 4.28Å; I134-V151 HydrophobicContact CG1-CG2 4.43Å; I134-V151 HydrophobicContact CG2-CG2 4.46Å; V151-F153 HydrophobicContact CB-CE2 4.28Å; V151-F153 HydrophobicContact CG1-CD2 4.34Å; V151-F153 HydrophobicContact CG1-CE2 3.78Å; V151-F153 HydrophobicContact CG1-CZ 3.89Å
152	T	98.2	Very high	95.1	Very high	24 Å²	24	35 Å²	35	15%	0.147	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	126.4	178	-49.6	0	0	0	0	108.6	K105 E132 V133	K105-T152 CarbonylContact O-C 3.51Å; K105-T152 WeakPolarHBondContact O-CA 3.47Å; E132-T152 PolarHBondContact N-O 2.9Å; V133-T152 PolarHBondContact N-O 3.27Å; V133-T152 PolarHBondContact O-N 2.87Å
153	F	98.3	Very high	95.2	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	164.5	177.5	-65.4	-91.2	0	0	0	110.8	K105 I107 F125 K130 I131 V151 D155 V159 I162	K105-F153 WeakPolarHBondContact CB-O 3.22Å; K105-F153 PolarHBondContact O-N 3.21Å; I107-F153 HydrophobicContact CD1-CE2 3.84Å; I107-F153 HydrophobicContact CD1-CZ 4.35Å; I107-F153 HydrophobicContact CG1-CE2 3.98Å; F125-F153 HydrophobicContact CB-CE1 4.4Å; F125-F153 HydrophobicContact CB-CZ 3.92Å; F125-F153 HydrophobicContact CG-CZ 4.45Å; K130-F153 WeakPolarHBondContact O-CA 3.36Å; I131-F153 HydrophobicContact CG1-CD1 4.03Å; I131-F153 HydrophobicContact CG1-CE1 3.7Å; I131-F153 HydrophobicContact CG1-CZ 4.37Å; V151-F153 HydrophobicContact CB-CE2 4.28Å; V151-F153 HydrophobicContact CG1-CD2 4.34Å; V151-F153 HydrophobicContact CG1-CE2 3.78Å; V151-F153 HydrophobicContact CG1-CZ 3.89Å; F153-D155 VanDerWaalsContact C-N 3.29Å; F153-D155 WeakPolarHBondContact CB-O 3.48Å; F153-V159 HydrophobicContact CD2-CG2 3.87Å; F153-V159 HydrophobicContact CE2-CG2 4.49Å; F153-I162 HydrophobicContact CE1-CD1 4.21Å; F153-I162 HydrophobicContact CE2-CD1 3.63Å; F153-I162 HydrophobicContact CZ-CD1 3.31Å
154	D	96.9	Very high	95.2	Very high	58 Å²	58	33.2 Å²	33.2	31%	0.31	16%	0.159	S	C	.	.	S	Bend	trans	-74	-22.8	171.8	68.5	-16	0	0	0	112.6	K105 K130 E132	K105-D154 WeakPolarHBondContact CD-O 3.39Å; K105-D154 WeakPolarHBondContact CE-O 3.5Å; K105-D154 PolarHBondContact NZ-O 2.91Å; K130-D154 WeakPolarHBondContact CB-OD2 3.26Å; K130-D154 WeakPolarHBondContact CD-OD2 3.46Å; K130-D154 PolarHBondContact O-N 3.47Å; E132-D154 HydrophobicContact CG-CB 4.07Å
155	D	96.5	Very high	95.1	Very high	39 Å²	39	32 Å²	32	21%	0.209	16%	0.155	C	C	.	.			trans	-133.2	149.6	-176.6	-173.7	28.5	0	0	0	113.4	R75 F153 D157	R75-D155 IonicContact CZ-OD1 2.97Å; R75-D155 IonicContact CZ-OD2 2.79Å; R75-D155 IonicContact NH1-OD1 2.63Å; R75-D155 PolarHBondContact NH1-OD1 2.84Å; R75-D155 IonicContact NH1-OD2 3.07Å; R75-D155 PolarHBondContact NH1-OD2 3.5Å; R75-D155 VanDerWaalsContact NH1-OD2 3.16Å; R75-D155 IonicContact NH2-OD1 3.94Å; R75-D155 IonicContact NH2-OD2 2.82Å; R75-D155 PolarHBondContact NH2-OD2 2.93Å; F153-D155 VanDerWaalsContact C-N 3.29Å; F153-D155 WeakPolarHBondContact CB-O 3.48Å; D155-D157 WeakPolarHBondContact OD2-CB 3.47Å; D155-D157 PolarHBondContact OD2-N 3.14Å
156	H	96.1	Very high	94.9	Very high	17 Å²	17	32.3 Å²	32.3	8%	0.079	16%	0.157	C	C	.	.	H	α-helix	trans	-76.3	-23.9	178.6	73.5	85.3	0	0	0	112.7	R75 T103 V104 K105 S158 V159 D160	R75-H156 PolarHBondContact NH1-CD2 3.29Å; R75-H156 PolarHBondContact NH1-CE1 2.82Å; R75-H156 PolarHBondContact NH1-NE2 3.06Å; T103-H156 HydrophobicContact CG2-CB 3.67Å; V104-H156 WeakPolarHBondContact O-CB 3.38Å; K105-H156 HydrophobicContact CG-CB 4.5Å; H156-S158 VanDerWaalsContact C-N 3.26Å; H156-S158 PolarHBondContact O-N 2.99Å; H156-V159 WeakPolarHBondContact O-CB 3.31Å; H156-V159 PolarHBondContact O-N 3.46Å; H156-D160 IonicContact CE1-OD2 3.24Å; H156-D160 IonicContact ND1-OD2 3.92Å; H156-D160 PolarHBondContact ND1-OD2 2.87Å; H156-D160 PolarHBondContact O-N 2.75Å
157	D	96.4	Very high	95	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-61.2	-37.5	178.3	-178.7	58.1	0	0	0	111.5	M72 R88 D155 V159 D160 K161	M72-D157 HydrophobicContact CE-CB 3.76Å; M72-D157 VanDerWaalsContact CE-OD1 3.27Å; M72-D157 WeakPolarHBondContact CE-OD1 3.39Å; R88-D157 IonicContact CZ-OD1 2.98Å; R88-D157 IonicContact CZ-OD2 3.86Å; R88-D157 IonicContact NE-OD1 2.97Å; R88-D157 PolarHBondContact NE-OD1 2.98Å; R88-D157 IonicContact NE-OD2 3.86Å; R88-D157 IonicContact NH2-OD1 3.87Å; R88-D157 PolarHBondContact NH2-OD1 3.23Å; R88-D157 IonicContact NH2-OD2 2.92Å; R88-D157 PolarHBondContact NH2-OD2 3.05Å; D155-D157 WeakPolarHBondContact OD2-CB 3.47Å; D155-D157 PolarHBondContact OD2-N 3.14Å; D157-V159 VanDerWaalsContact C-N 3.29Å; D157-V159 PolarHBondContact O-N 2.93Å; D157-D160 PolarHBondContact O-N 2.94Å; D157-K161 WeakPolarHBondContact O-CG 3.47Å; D157-K161 PolarHBondContact O-N 2.82Å; D157-K161 WeakPolarHBondContact OD2-CE 3.45Å; D157-K161 IonicContact OD2-NZ 3.05Å; D157-K161 PolarHBondContact OD2-NZ 3.38Å
158	S	96.5	Very high	95.1	Very high	4 Å²	4	29.7 Å²	29.7	3%	0.028	14%	0.141	C	C	.	.	H	α-helix	trans	-57.7	-44.1	173.5	-60.1	0	0	0	0	111.4	Y128 G129 H156 I162	Y128-S158 WeakPolarHBondContact O-CB 3.44Å; Y128-S158 PolarHBondContact O-OG 2.94Å; G129-S158 WeakPolarHBondContact CA-OG 3.48Å; H156-S158 VanDerWaalsContact C-N 3.26Å; H156-S158 PolarHBondContact O-N 2.99Å; S158-I162 VanDerWaalsContact O-CD1 3.24Å; S158-I162 WeakPolarHBondContact O-CD1 3.41Å; S158-I162 WeakPolarHBondContact O-CG1 3.34Å; S158-I162 PolarHBondContact O-N 3.34Å
159	V	96.8	Very high	95.1	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.5	-47.5	175.4	175.8	0	0	0	0	111.2	V104 K105 I107 F153 H156 D157 K161 I162 V163 K179	V104-V159 HydrophobicContact CG2-CG1 3.98Å; V104-V159 WeakPolarHBondContact O-CB 3.15Å; V104-V159 WeakPolarHBondContact O-CG2 3.25Å; K105-V159 VanDerWaalsContact C-CG2 3.42Å; I107-V159 HydrophobicContact CG2-CB 4.09Å; I107-V159 HydrophobicContact CG2-CG1 3.54Å; I107-V159 HydrophobicContact CG2-CG2 3.94Å; F153-V159 HydrophobicContact CD2-CG2 3.87Å; F153-V159 HydrophobicContact CE2-CG2 4.49Å; H156-V159 WeakPolarHBondContact O-CB 3.31Å; H156-V159 PolarHBondContact O-N 3.46Å; D157-V159 VanDerWaalsContact C-N 3.29Å; D157-V159 PolarHBondContact O-N 2.93Å; V159-K161 VanDerWaalsContact C-N 3.33Å; V159-K161 PolarHBondContact O-N 3.04Å; V159-I162 PolarHBondContact O-N 2.98Å; V159-V163 HydrophobicContact CG1-CG1 4.11Å; V159-V163 WeakPolarHBondContact O-CG1 3.39Å; V159-V163 WeakPolarHBondContact O-CG2 3.35Å; V159-V163 PolarHBondContact O-N 3.37Å; V159-K179 HydrophobicContact CG1-CG 3.92Å
160	D	94.2	Very high	95	Very high	7 Å²	7	32.5 Å²	32.5	4%	0.037	16%	0.16	C	C	.	.	H	α-helix	trans	-61.8	-39.9	-178.5	-69.3	-32.3	0	0	0	111.6	R88 H156 D157 I164 K179	R88-D160 HydrophobicContact CB-CB 4.1Å; R88-D160 HydrophobicContact CG-CB 4.09Å; H156-D160 IonicContact CE1-OD2 3.24Å; H156-D160 IonicContact ND1-OD2 3.92Å; H156-D160 PolarHBondContact ND1-OD2 2.87Å; H156-D160 PolarHBondContact O-N 2.75Å; D157-D160 PolarHBondContact O-N 2.94Å; D160-I164 WeakPolarHBondContact O-CD1 3.07Å; D160-I164 VanDerWaalsContact O-CG1 3.25Å; D160-I164 WeakPolarHBondContact O-CG1 3.29Å; D160-K179 WeakPolarHBondContact OD1-CE 3.41Å; D160-K179 IonicContact OD1-NZ 2.99Å; D160-K179 PolarHBondContact OD1-NZ 2.85Å
161	K	93.2	Very high	94.8	Very high	49 Å²	49	33.2 Å²	33.2	21%	0.213	17%	0.166	C	C	.	.	H	α-helix	trans	-57.7	-48.2	172.4	-78.9	-177.4	-74.8	-141.5	0	112.3	Y128 D157 V159	Y128-K161 HydrophobicContact CD1-CB 4.02Å; Y128-K161 WeakPolarHBondContact O-CE 3.39Å; Y128-K161 PolarHBondContact O-NZ 2.96Å; D157-K161 WeakPolarHBondContact O-CG 3.47Å; D157-K161 PolarHBondContact O-N 2.82Å; D157-K161 WeakPolarHBondContact OD2-CE 3.45Å; D157-K161 IonicContact OD2-NZ 3.05Å; D157-K161 PolarHBondContact OD2-NZ 3.38Å; V159-K161 VanDerWaalsContact C-N 3.33Å; V159-K161 PolarHBondContact O-N 3.04Å
162	I	94.9	Very high	94.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-66.3	-51.5	-174.4	-67.1	163	0	0	0	109.8	I107 F125 Y128 F153 S158 V159 I164 Q165 H168 V177	I107-I162 HydrophobicContact CD1-CD1 4.06Å; I107-I162 HydrophobicContact CD1-CG2 4.3Å; F125-I162 HydrophobicContact CD1-CD1 3.79Å; F125-I162 HydrophobicContact CD1-CG1 4.39Å; F125-I162 HydrophobicContact CD1-CG2 4.44Å; F125-I162 HydrophobicContact CE1-CD1 4.34Å; F125-I162 HydrophobicContact CE1-CG2 3.94Å; Y128-I162 HydrophobicContact CD1-CG1 3.67Å; Y128-I162 HydrophobicContact CD2-CD1 3.98Å; Y128-I162 HydrophobicContact CD2-CG1 3.64Å; Y128-I162 HydrophobicContact CE1-CG1 4.08Å; Y128-I162 HydrophobicContact CE2-CG1 4.04Å; Y128-I162 HydrophobicContact CG-CD1 3.92Å; Y128-I162 HydrophobicContact CG-CG1 3.42Å; Y128-I162 VanDerWaalsContact CG-CG1 3.42Å; F153-I162 HydrophobicContact CE1-CD1 4.21Å; F153-I162 HydrophobicContact CE2-CD1 3.63Å; F153-I162 HydrophobicContact CZ-CD1 3.31Å; S158-I162 VanDerWaalsContact O-CD1 3.24Å; S158-I162 WeakPolarHBondContact O-CD1 3.41Å; S158-I162 WeakPolarHBondContact O-CG1 3.34Å; S158-I162 PolarHBondContact O-N 3.34Å; V159-I162 PolarHBondContact O-N 2.98Å; I162-I164 PolarHBondContact O-N 2.94Å; I162-I164 VanDerWaalsContact O-N 3.1Å; I162-Q165 CarbonylContact O-C 3.51Å; I162-Q165 PolarHBondContact O-N 3.08Å; I162-H168 WeakPolarHBondContact CG2-NE2 3.29Å; I162-H168 PolarHBondContact O-NE2 3.42Å; I162-H168 VanDerWaalsContact O-NE2 3.11Å; I162-V177 HydrophobicContact CG2-CB 4.1Å; I162-V177 HydrophobicContact CG2-CG1 3.46Å; I162-V177 VanDerWaalsContact CG2-CG1 3.46Å; I162-V177 HydrophobicContact CG2-CG2 4.49Å
163	V	93.5	Very high	94.4	Very high	30 Å²	30	37.6 Å²	37.6	18%	0.182	20%	0.203	C	C	.	.	H	α-helix	trans	-70.7	-11.7	-169.8	-59.8	0	0	0	0	114.7	I107 V159 V177 K179	I107-V163 HydrophobicContact CG2-CG1 4.22Å; V159-V163 HydrophobicContact CG1-CG1 4.11Å; V159-V163 WeakPolarHBondContact O-CG1 3.39Å; V159-V163 WeakPolarHBondContact O-CG2 3.35Å; V159-V163 PolarHBondContact O-N 3.37Å; V163-V177 HydrophobicContact CG1-CG1 4.49Å; V163-K179 HydrophobicContact CG1-CG 4.03Å; V163-K179 HydrophobicContact CG2-CG 4.29Å
164	I	88.4	Confident	94.2	Very high	52 Å²	52	42.4 Å²	42.4	27%	0.267	23%	0.229	S	C	.	.	H	α-helix	trans	-63.1	-37.9	169.8	-64	158.5	0	0	0	109.8	L13 R88 D160 I162	L13-I164 HydrophobicContact CD2-CB 4.3Å; L13-I164 HydrophobicContact CD2-CD1 4.02Å; L13-I164 HydrophobicContact CD2-CG2 3.47Å; L13-I164 VanDerWaalsContact CD2-CG2 3.47Å; R88-I164 HydrophobicContact CB-CD1 4.23Å; D160-I164 WeakPolarHBondContact O-CD1 3.07Å; D160-I164 VanDerWaalsContact O-CG1 3.25Å; D160-I164 WeakPolarHBondContact O-CG1 3.29Å; I162-I164 PolarHBondContact O-N 2.94Å; I162-I164 VanDerWaalsContact O-N 3.1Å
165	Q	88.3	Confident	94.2	Very high	103 Å²	103	39.7 Å²	39.7	48%	0.481	22%	0.215	S	C	.	.	S	Bend	trans	-89	113.1	169.6	-178.9	170.4	-22.9	0	0	108.9	I162 Y167 H168	I162-Q165 CarbonylContact O-C 3.51Å; I162-Q165 PolarHBondContact O-N 3.08Å; Q165-Y167 VanDerWaalsContact C-N 3.33Å; Q165-Y167 VanDerWaalsContact CG-O 3.24Å; Q165-Y167 WeakPolarHBondContact CG-O 3.38Å; Q165-Y167 PolarHBondContact NE2-O 2.84Å; Q165-Y167 PolarHBondContact O-N 2.81Å; Q165-H168 PolarHBondContact O-CD2 2.73Å; Q165-H168 PolarHBondContact O-NE2 2.69Å
166	K	88.7	Confident	94.1	Very high	62 Å²	62	40.6 Å²	40.6	27%	0.27	22%	0.217	S	C	.	.	S	Bend	trans	-67.9	-34.6	-176	-170.6	-177	179.3	-158.4	0	113	E176 V177	K166-E176 WeakPolarHBondContact CE-OE1 3.43Å; K166-E176 HydrophobicContact CG-CG 4.34Å; K166-E176 IonicContact NZ-OE1 3.35Å; K166-E176 PolarHBondContact NZ-OE1 2.94Å; K166-V177 PolarHBondContact O-N 3.33Å
167	Y	94.7	Very high	94.1	Very high	109 Å²	109	39.8 Å²	39.8	43%	0.427	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	131	-171.4	-60.6	-67.6	0	0	0	111	Q165 N174 C175 E176	Q165-Y167 VanDerWaalsContact C-N 3.33Å; Q165-Y167 VanDerWaalsContact CG-O 3.24Å; Q165-Y167 WeakPolarHBondContact CG-O 3.38Å; Q165-Y167 PolarHBondContact NE2-O 2.84Å; Q165-Y167 PolarHBondContact O-N 2.81Å; Y167-N174 WeakPolarHBondContact CB-OD1 3.43Å; Y167-C175 CarbonylContact C-O 3.47Å; Y167-C175 VanDerWaalsContact CA-O 3.29Å; Y167-C175 WeakPolarHBondContact CA-O 3.37Å; Y167-E176 HydrophobicContact CD1-CB 4.22Å; Y167-E176 HydrophobicContact CE1-CB 4.16Å; Y167-E176 HydrophobicContact CE1-CG 4.29Å
168	H	96.5	Very high	94	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	146	-179.1	-66.3	-96.1	0	0	0	109.8	Y124 I162 Q165 V170 N174 C175 V177	Y124-H168 HydrophobicContact CE1-CB 3.69Å; Y124-H168 AromaticContact CE1-CG 3.86Å; Y124-H168 AromaticContact CE1-ND1 3.5Å; Y124-H168 WeakPolarHBondContact CE1-ND1 3.1Å; Y124-H168 AromaticContact CZ-ND1 3.6Å; Y124-H168 WeakPolarHBondContact OH-CB 3.11Å; Y124-H168 PolarHBondContact OH-ND1 3.27Å; I162-H168 WeakPolarHBondContact CG2-NE2 3.29Å; I162-H168 PolarHBondContact O-NE2 3.42Å; I162-H168 VanDerWaalsContact O-NE2 3.11Å; Q165-H168 PolarHBondContact O-CD2 2.73Å; Q165-H168 PolarHBondContact O-NE2 2.69Å; H168-V170 HydrophobicContact CB-CG2 4.45Å; H168-N174 CarbonylContact O-C 3.59Å; H168-N174 WeakPolarHBondContact O-CA 3.5Å; H168-N174 PolarHBondContact O-OD1 3.29Å; H168-C175 PolarHBondContact N-O 3.15Å; H168-C175 PolarHBondContact O-N 3.24Å; H168-C175 PolarHBondContact O-SG 3.02Å; H168-V177 HydrophobicContact CB-CG2 4.32Å; H168-V177 WeakPolarHBondContact CD2-CG2 3.14Å
169	T	96	Very high	93.9	Very high	87 Å²	87	45.3 Å²	45.3	53%	0.534	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	108.6	174.7	-55.8	0	0	0	0	108.9	H173	T169-H173 CarbonylContact C-O 3.57Å; T169-H173 WeakPolarHBondContact CA-O 3.11Å
170	V	95.2	Very high	93.8	Very high	3 Å²	3	45.9 Å²	45.9	2%	0.018	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	128.9	178.5	-177.2	0	0	0	0	109	H120 L121 Y124 F125 H168 G172 H173	H120-V170 HydrophobicContact CB-CG1 4.34Å; L121-V170 HydrophobicContact CD2-CG1 4.1Å; Y124-V170 HydrophobicContact CD1-CG2 3.51Å; Y124-V170 HydrophobicContact CD2-CG2 4.32Å; Y124-V170 HydrophobicContact CE1-CG2 3.94Å; Y124-V170 HydrophobicContact CG-CG2 3.72Å; F125-V170 HydrophobicContact CE2-CG2 4.35Å; F125-V170 HydrophobicContact CZ-CG2 4.33Å; H168-V170 HydrophobicContact CB-CG2 4.45Å; V170-G172 PolarHBondContact O-N 3.29Å; V170-H173 PolarHBondContact N-O 3.25Å; V170-H173 PolarHBondContact O-N 3.11Å
171	N	94	Very high	93.7	Very high	53 Å²	53	47 Å²	47	28%	0.283	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	38.7	-175.1	-168.8	30.1	0	0	0	113.1	D115 H120 H173	D115-N171 PolarHBondContact OD1-ND2 3.02Å; D115-N171 PolarHBondContact OD2-ND2 3.48Å; H120-N171 HydrophobicContact CB-CB 4.1Å; H120-N171 PolarHBondContact CD2-OD1 2.9Å; H120-N171 PolarHBondContact NE2-OD1 3.45Å; N171-H173 PolarHBondContact O-CD2 3.14Å; N171-H173 PolarHBondContact O-N 2.84Å; N171-H173 VanDerWaalsContact O-N 3.15Å; N171-H173 PolarHBondContact O-NE2 3.38Å
172	G	93.6	Very high	93.4	Very high	69 Å²	69	47.2 Å²	47.2	71%	0.711	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	-0.2	-176.8	0	0	0	0	0	115.4	V170	V170-G172 PolarHBondContact O-N 3.29Å
173	H	93	Very high	92.9	Very high	47 Å²	47	56 Å²	56	22%	0.218	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	138.8	-179.8	-56.2	-63	0	0	0	111.2	K113 D115 T169 V170 N171 C175	K113-H173 HydrophobicContact CG-CB 4.37Å; K113-H173 WeakPolarHBondContact CG-ND1 3.42Å; D115-H173 IonicContact OD1-CD2 3.96Å; D115-H173 IonicContact OD1-NE2 2.97Å; D115-H173 PolarHBondContact OD1-NE2 3.11Å; D115-H173 IonicContact OD2-CD2 3.88Å; D115-H173 IonicContact OD2-CE1 3.33Å; D115-H173 IonicContact OD2-NE2 3.4Å; D115-H173 PolarHBondContact OD2-NE2 3.49Å; T169-H173 CarbonylContact C-O 3.57Å; T169-H173 WeakPolarHBondContact CA-O 3.11Å; V170-H173 PolarHBondContact N-O 3.25Å; V170-H173 PolarHBondContact O-N 3.11Å; N171-H173 PolarHBondContact O-CD2 3.14Å; N171-H173 PolarHBondContact O-N 2.84Å; N171-H173 VanDerWaalsContact O-N 3.15Å; N171-H173 PolarHBondContact O-NE2 3.38Å; H173-C175 PolarHBondContact O-N 3.44Å
174	N	95	Very high	92.5	Very high	101 Å²	101	62.3 Å²	62.3	54%	0.54	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	112	174.2	-167.7	40.1	0	0	0	110	Y167 H168	Y167-N174 WeakPolarHBondContact CB-OD1 3.43Å; H168-N174 CarbonylContact O-C 3.59Å; H168-N174 WeakPolarHBondContact O-CA 3.5Å; H168-N174 PolarHBondContact O-OD1 3.29Å
175	C	95.8	Very high	92.3	Very high	1 Å²	1	62.9 Å²	62.9	1%	0.007	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	148.5	179.1	66.9	0	0	0	0	111.3	V109 G110 I112 Y167 H168 H173	V109-C175 HydrophobicContact CG1-CB 4Å; G110-C175 CarbonylContact O-C 3.47Å; G110-C175 WeakPolarHBondContact O-CA 3.34Å; G110-C175 WeakPolarHBondContact O-CB 3.16Å; I112-C175 HydrophobicContact CG2-CB 4.02Å; Y167-C175 CarbonylContact C-O 3.47Å; Y167-C175 VanDerWaalsContact CA-O 3.29Å; Y167-C175 WeakPolarHBondContact CA-O 3.37Å; H168-C175 PolarHBondContact N-O 3.15Å; H168-C175 PolarHBondContact O-N 3.24Å; H168-C175 PolarHBondContact O-SG 3.02Å; H173-C175 PolarHBondContact O-N 3.44Å
176	E	95.7	Very high	92	Very high	57 Å²	57	62.4 Å²	62.4	27%	0.266	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	126.9	174.2	-179.4	175.9	-179.5	0	0	109.4	G110 K166 Y167 R178	G110-E176 PolarHBondContact N-O 3.34Å; G110-E176 PolarHBondContact O-N 3.19Å; K166-E176 WeakPolarHBondContact CE-OE1 3.43Å; K166-E176 HydrophobicContact CG-CG 4.34Å; K166-E176 IonicContact NZ-OE1 3.35Å; K166-E176 PolarHBondContact NZ-OE1 2.94Å; Y167-E176 HydrophobicContact CD1-CB 4.22Å; Y167-E176 HydrophobicContact CE1-CB 4.16Å; Y167-E176 HydrophobicContact CE1-CG 4.29Å; E176-R178 HydrophobicContact CG-CG 4.32Å; E176-R178 WeakPolarHBondContact OE1-CD 3.23Å
177	V	96	Very high	91.8	Very high	1 Å²	1	62.4 Å²	62.4	1%	0.006	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	134.3	179.6	-173.1	0	0	0	0	111.3	I107 F108 V109 F125 I162 V163 K166 H168	I107-V177 HydrophobicContact CB-CG1 3.92Å; I107-V177 HydrophobicContact CD1-CG1 3.85Å; I107-V177 HydrophobicContact CG1-CG1 4.42Å; I107-V177 HydrophobicContact CG2-CG1 4.13Å; F108-V177 WeakPolarHBondContact O-CA 3.38Å; V109-V177 HydrophobicContact CG1-CG2 4.25Å; V109-V177 HydrophobicContact CG2-CG2 4.32Å; F125-V177 HydrophobicContact CE1-CG2 4.27Å; F125-V177 HydrophobicContact CZ-CG2 3.95Å; I162-V177 HydrophobicContact CG2-CB 4.1Å; I162-V177 HydrophobicContact CG2-CG1 3.46Å; I162-V177 VanDerWaalsContact CG2-CG1 3.46Å; I162-V177 HydrophobicContact CG2-CG2 4.49Å; V163-V177 HydrophobicContact CG1-CG1 4.49Å; K166-V177 PolarHBondContact O-N 3.33Å; H168-V177 HydrophobicContact CB-CG2 4.32Å; H168-V177 WeakPolarHBondContact CD2-CG2 3.14Å
178	R	93.7	Very high	91.1	Very high	97 Å²	97	60.5 Å²	60.5	37%	0.366	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	159.7	-179.7	-62.6	176.8	64.8	166.1	-3.3	110.5	I107 F108 E176 A180	I107-R178 CarbonylContact C-O 3.47Å; I107-R178 WeakPolarHBondContact CA-O 3.39Å; F108-R178 PolarHBondContact N-O 3.33Å; F108-R178 PolarHBondContact O-N 3.36Å; E176-R178 HydrophobicContact CG-CG 4.32Å; E176-R178 WeakPolarHBondContact OE1-CD 3.23Å; R178-A180 PolarHBondContact O-N 3.46Å
179	K	95.5	Very high	90.1	Very high	24 Å²	24	61.3 Å²	61.3	10%	0.104	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	129.5	166.4	-70.9	-170.8	172.6	-174.7	0	109.5	A100 L102 V104 V159 D160 V163 L181	A100-K179 PolarHBondContact O-NZ 2.75Å; L102-K179 PolarHBondContact O-NZ 2.9Å; V104-K179 HydrophobicContact CG2-CB 3.73Å; V104-K179 HydrophobicContact CG2-CD 3.95Å; V104-K179 HydrophobicContact CG2-CG 3.78Å; V159-K179 HydrophobicContact CG1-CG 3.92Å; D160-K179 WeakPolarHBondContact OD1-CE 3.41Å; D160-K179 IonicContact OD1-NZ 2.99Å; D160-K179 PolarHBondContact OD1-NZ 2.85Å; V163-K179 HydrophobicContact CG1-CG 4.03Å; V163-K179 HydrophobicContact CG2-CG 4.29Å; K179-L181 PolarHBondContact O-N 2.87Å
180	A	94.6	Very high	88.7	Confident	11 Å²	11	60.5 Å²	60.5	9%	0.091	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-73.3	122.5	177	0	0	0	0	0	109.5	K106 F150 R178	K106-A180 HydrophobicContact CB-CB 3.93Å; K106-A180 HydrophobicContact CD-CB 4.28Å; K106-A180 HydrophobicContact CG-CB 3.74Å; K106-A180 VanDerWaalsContact O-CB 3.24Å; K106-A180 WeakPolarHBondContact O-CB 2.99Å; K106-A180 PolarHBondContact O-N 2.67Å; F150-A180 HydrophobicContact CD1-CB 3.84Å; F150-A180 HydrophobicContact CE1-CB 3.9Å; R178-A180 PolarHBondContact O-N 3.46Å
181	L	90.8	Very high	87	Confident	30 Å²	30	64.1 Å²	64.1	16%	0.157	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-94.3	143.6	174.2	-60.5	-178.6	0	0	0	109.5	P98 L102 K179 E185 M186 A189	P98-L181 HydrophobicContact CB-CD1 4.46Å; L102-L181 HydrophobicContact CD1-CD2 3.64Å; K179-L181 PolarHBondContact O-N 2.87Å; L181-E185 HydrophobicContact CB-CB 3.9Å; L181-E185 HydrophobicContact CD2-CB 4.41Å; L181-M186 HydrophobicContact CB-CG 3.68Å; L181-A189 HydrophobicContact CD1-CB 4.48Å
182	S	86.8	Confident	85.2	Confident	54 Å²	54	65.2 Å²	65.2	38%	0.378	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-60.9	161.3	168.6	68.8	0	0	0	0	110.7	Q184 E185 M186	S182-Q184 PolarHBondContact O-N 2.8Å; S182-E185 WeakPolarHBondContact CB-OE2 3.25Å; S182-E185 PolarHBondContact N-OE2 3.01Å; S182-E185 PolarHBondContact O-N 3.2Å; S182-E185 VanDerWaalsContact O-N 3.13Å; S182-E185 WeakPolarHBondContact OG-CB 3.33Å; S182-E185 VanDerWaalsContact OG-CD 3.28Å; S182-E185 VanDerWaalsContact OG-CG 3.26Å; S182-E185 WeakPolarHBondContact OG-CG 3.39Å; S182-E185 PolarHBondContact OG-N 3.39Å; S182-E185 PolarHBondContact OG-OE2 3.02Å; S182-M186 WeakPolarHBondContact O-CG 3.4Å; S182-M186 PolarHBondContact O-N 3.42Å
183	K	85.4	Confident	83.2	Confident	184 Å²	184	69.5 Å²	69.5	80%	0.8	38%	0.377	S	S	*	.	H	α-helix	trans	-56.3	-36	177.3	-68.4	-179.4	-178.1	173.9	0	112.4	M186 A187	K183-M186 HydrophobicContact CG-CE 4.44Å; K183-A187 WeakPolarHBondContact O-CB 3.06Å; K183-A187 PolarHBondContact O-N 3.35Å
184	Q	84.8	Confident	80.9	Confident	164 Å²	164	78 Å²	78	77%	0.766	41%	0.407	S	S	*	.	H	α-helix	trans	-69.1	-44.6	177.7	-69	178.3	-7	0	0	111.4	S182 M186 A187 S188	S182-Q184 PolarHBondContact O-N 2.8Å; Q184-M186 VanDerWaalsContact C-N 3.34Å; Q184-M186 PolarHBondContact O-N 2.67Å; Q184-A187 PolarHBondContact O-N 3.37Å; Q184-S188 PolarHBondContact O-N 2.96Å; Q184-S188 PolarHBondContact O-OG 3.38Å
185	E	84.3	Confident	78.7	Confident	64 Å²	64	76.5 Å²	76.5	30%	0.299	42%	0.415	S	S	.	.	H	α-helix	trans	-65.7	-35.3	175.9	-70.4	163.6	133.2	0	0	112.4	L102 L181 S182 S188 A189	L102-E185 VanDerWaalsContact CD1-OE1 3.29Å; L102-E185 WeakPolarHBondContact CD1-OE1 3.29Å; L181-E185 HydrophobicContact CB-CB 3.9Å; L181-E185 HydrophobicContact CD2-CB 4.41Å; S182-E185 WeakPolarHBondContact CB-OE2 3.25Å; S182-E185 PolarHBondContact N-OE2 3.01Å; S182-E185 PolarHBondContact O-N 3.2Å; S182-E185 VanDerWaalsContact O-N 3.13Å; S182-E185 WeakPolarHBondContact OG-CB 3.33Å; S182-E185 VanDerWaalsContact OG-CD 3.28Å; S182-E185 VanDerWaalsContact OG-CG 3.26Å; S182-E185 WeakPolarHBondContact OG-CG 3.39Å; S182-E185 PolarHBondContact OG-N 3.39Å; S182-E185 PolarHBondContact OG-OE2 3.02Å; E185-S188 WeakPolarHBondContact CA-OG 3.35Å; E185-S188 PolarHBondContact O-OG 3.35Å; E185-A189 WeakPolarHBondContact O-CB 3.24Å; E185-A189 PolarHBondContact O-N 3.07Å
186	M	82.4	Confident	76.5	Confident	92 Å²	92	87.2 Å²	87.2	45%	0.453	46%	0.455	S	S	.	.	H	α-helix	trans	-66.5	-40.5	172.6	-73.1	-161.2	-68.4	0	0	112.2	L181 S182 K183 Q184 S190	L181-M186 HydrophobicContact CB-CG 3.68Å; S182-M186 WeakPolarHBondContact O-CG 3.4Å; S182-M186 PolarHBondContact O-N 3.42Å; K183-M186 HydrophobicContact CG-CE 4.44Å; Q184-M186 VanDerWaalsContact C-N 3.34Å; Q184-M186 PolarHBondContact O-N 2.67Å; M186-S190 WeakPolarHBondContact O-CB 3.35Å; M186-S190 PolarHBondContact O-N 3.14Å; M186-S190 PolarHBondContact O-OG 3.18Å
187	A	84.9	Confident	73.9	Confident	63 Å²	63	89.7 Å²	89.7	52%	0.521	48%	0.479	S	S	.	.	H	α-helix	trans	-65.2	-44	177.4	0	0	0	0	0	111.2	K183 Q184 S190 S191	K183-A187 WeakPolarHBondContact O-CB 3.06Å; K183-A187 PolarHBondContact O-N 3.35Å; Q184-A187 PolarHBondContact O-N 3.37Å; A187-S190 PolarHBondContact O-N 3.09Å; A187-S191 PolarHBondContact O-N 3.36Å
188	S	80	Confident	71.1	Confident	69 Å²	69	93.5 Å²	93.5	48%	0.483	52%	0.518	S	S	.	.	H	α-helix	trans	-66.8	-43.1	176.8	64.4	0	0	0	0	111.8	Q184 E185 S190 S191 S192	Q184-S188 PolarHBondContact O-N 2.96Å; Q184-S188 PolarHBondContact O-OG 3.38Å; E185-S188 WeakPolarHBondContact CA-OG 3.35Å; E185-S188 PolarHBondContact O-OG 3.35Å; S188-S190 VanDerWaalsContact C-N 3.3Å; S188-S190 PolarHBondContact O-N 3.32Å; S188-S191 PolarHBondContact O-N 3.47Å; S188-S191 PolarHBondContact O-OG 2.66Å; S188-S192 PolarHBondContact O-N 3.26Å
189	A	75	Confident	68.7	Low	16 Å²	16	94.7 Å²	94.7	13%	0.132	54%	0.541	C	S	.	.	H	α-helix	trans	-62.4	-33.8	175.6	0	0	0	0	0	113.4	P98 L181 E185 S192	P98-A189 HydrophobicContact CB-CB 3.54Å; P98-A189 HydrophobicContact CG-CB 3.85Å; L181-A189 HydrophobicContact CD1-CB 4.48Å; E185-A189 WeakPolarHBondContact O-CB 3.24Å; E185-A189 PolarHBondContact O-N 3.07Å; A189-S192 PolarHBondContact O-OG 3.21Å
190	S	66.6	Low	66.1	Low	71 Å²	71	96.2 Å²	96.2	50%	0.497	56%	0.564	S	S	.	*	H	α-helix	trans	-76.8	-32	177.5	-58.4	0	0	0	0	112.2	M186 A187 S188 Q193 R194	M186-S190 WeakPolarHBondContact O-CB 3.35Å; M186-S190 PolarHBondContact O-N 3.14Å; M186-S190 PolarHBondContact O-OG 3.18Å; A187-S190 PolarHBondContact O-N 3.09Å; S188-S190 VanDerWaalsContact C-N 3.3Å; S188-S190 PolarHBondContact O-N 3.32Å; S190-Q193 PolarHBondContact O-N 2.85Å; S190-R194 PolarHBondContact O-N 3.13Å
191	S	60.1	Low	63.5	Low	78 Å²	78	103.3 Å²	103.3	55%	0.545	60%	0.6	S	S	.	*	H	α-helix	trans	-68.4	-33.5	178.1	72.8	0	0	0	0	112.7	A187 S188 Q193 R194 G195	A187-S191 PolarHBondContact O-N 3.36Å; S188-S191 PolarHBondContact O-N 3.47Å; S188-S191 PolarHBondContact O-OG 2.66Å; S191-Q193 VanDerWaalsContact C-N 3.31Å; S191-Q193 PolarHBondContact O-N 3.34Å; S191-R194 PolarHBondContact O-N 3.17Å; S191-G195 PolarHBondContact O-N 2.73Å
192	S	54.8	Low	61.1	Low	77 Å²	77	111.6 Å²	111.6	54%	0.538	64%	0.635	S	S	.	*	H	α-helix	trans	-72.2	-22.2	178.5	58.7	0	0	0	0	113.5	S188 A189	S188-S192 PolarHBondContact O-N 3.26Å; A189-S192 PolarHBondContact O-OG 3.21Å
193	Q	51.4	Low	58.9	Low	159 Å²	159	112.1 Å²	112.1	74%	0.743	65%	0.649	S	S	*	*	H	α-helix	trans	-86	-25.5	173.8	-75.5	-174.4	-29.8	0	0	113.9	S190 S191	S190-Q193 PolarHBondContact O-N 2.85Å; S191-Q193 VanDerWaalsContact C-N 3.31Å; S191-Q193 PolarHBondContact O-N 3.34Å
194	R	46.3	Very low	56.9	Low	226 Å²	226	106.8 Å²	106.8	85%	0.853	65%	0.646	S	S	*	*	H	α-helix	trans	-86.3	-10.5	176.2	-81.8	-176.2	174.7	166.2	-0.9	114.6	S190 S191	S190-R194 PolarHBondContact O-N 3.13Å; S191-R194 PolarHBondContact O-N 3.17Å
195	G	48.1	Very low	54.6	Low	68 Å²	68	102.7 Å²	102.7	70%	0.701	65%	0.648	S	S	*	*	S	Bend	trans	-86	-5	-179	0	0	0	0	0	116.4	S191	S191-G195 PolarHBondContact O-N 2.73Å
196	R	49.9	Very low	52.6	Low	227 Å²	227	111.4 Å²	111.4	86%	0.857	68%	0.678	S	S	*	*	S	Bend	trans	-109.7	6.8	-172.1	-142.1	173.1	-174.4	175.6	1.1	115.3
197	S	40.8	Very low	50.4	Low	109 Å²	109	111.3 Å²	111.3	76%	0.762	70%	0.701	S	S	*	*	S	Bend	trans	-140.5	104.7	171.7	-169.9	0	0	0	0	109.2
198	G	36.7	Very low	48.2	Very low	81 Å²	81	112 Å²	112	84%	0.835	72%	0.715	S	S	*	*			trans	87.7	70.4	166.9	0	0	0	0	0	116.6
199	S	44.7	Very low	46.1	Very low	121 Å²	121	111.7 Å²	111.7	85%	0.846	72%	0.722	S	S	*	*			trans	-119.7	82.4	143.6	-173.4	0	0	0	0	107.3	N201	S199-N201 PolarHBondContact O-N 3.46Å
200	G	40.2	Very low	44.4	Very low	56 Å²	56	121.6 Å²	121.6	58%	0.577	76%	0.762	S	S	*	*			trans	-58.7	127.2	161.4	0	0	0	0	0	107.8	F202	G200-F202 PolarHBondContact O-N 3.18Å
201	N	38.7	Very low	43.2	Very low	160 Å²	160	122 Å²	122	86%	0.856	78%	0.777	S	S	*	*			trans	-64	74.5	179.5	-166	75.4	0	0	0	110.6	S199 G203	S199-N201 PolarHBondContact O-N 3.46Å; N201-G203 PolarHBondContact O-N 2.84Å
202	F	40.8	Very low	42.3	Very low	205 Å²	205	121.8 Å²	121.8	90%	0.899	79%	0.787	S	S	*	*			trans	-88.8	71.1	163.4	-83	-82.4	0	0	0	108.4	G200 G204	G200-F202 PolarHBondContact O-N 3.18Å; F202-G204 PolarHBondContact O-N 2.97Å; F202-G204 VanDerWaalsContact O-N 3.15Å
203	G	42	Very low	41.5	Very low	64 Å²	64	125.1 Å²	125.1	66%	0.66	80%	0.8	S	S	*	*			trans	-66.3	104.3	159.6	0	0	0	0	0	108.1	N201	N201-G203 PolarHBondContact O-N 2.84Å
204	G	43.6	Very low	41.2	Very low	73 Å²	73	124.3 Å²	124.3	75%	0.753	80%	0.8	S	S	*	*			trans	-52.8	140.3	177.5	0	0	0	0	0	112.5	F202	F202-G204 PolarHBondContact O-N 2.97Å; F202-G204 VanDerWaalsContact O-N 3.15Å
205	G	35.7	Very low	40.9	Very low	78 Å²	78	120.4 Å²	120.4	80%	0.804	80%	0.796	S	S	*	*			trans	-60.4	143.7	-173.4	0	0	0	0	0	114.4
206	R	41.6	Very low	40.6	Very low	247 Å²	247	127.1 Å²	127.1	93%	0.932	81%	0.807	S	S	*	*			trans	-139.9	113.5	153.7	-79.6	-173.5	175.6	179.7	-1.7	108.4
207	G	37.2	Very low	40.1	Very low	89 Å²	89	119.5 Å²	119.5	92%	0.918	80%	0.799	S	S	*	*			trans	43.7	114.9	146.5	0	0	0	0	0	119.8
208	G	38.7	Very low	40.1	Very low	79 Å²	79	126.9 Å²	126.9	81%	0.814	81%	0.81	S	S	*	*			trans	-165.9	112.2	157.2	0	0	0	0	0	109.5
209	G	36.1	Very low	40.3	Very low	62 Å²	62	127 Å²	127	64%	0.639	81%	0.811	S	S	*	*			trans	-78.3	-165.8	178.7	0	0	0	0	0	113.8
210	F	39.3	Very low	40	Very low	224 Å²	224	124.6 Å²	124.6	98%	0.982	81%	0.805	S	S	*	*			trans	77.3	125.8	-176.7	-44.1	-74.5	0	0	0	112.9
211	G	41	Very low	40	Very low	78 Å²	78	128.7 Å²	128.7	80%	0.804	81%	0.814	S	S	*	*			cis	166.1	161.6	8.6	0	0	0	0	0	107.7
212	G	40.6	Very low	40.2	Very low	74 Å²	74	129.8 Å²	129.8	76%	0.763	81%	0.811	S	S	*	*			trans	93.6	107.4	171.2	0	0	0	0	0	114.3
213	N	37.9	Very low	40.3	Very low	148 Å²	148	125.3 Å²	125.3	79%	0.791	81%	0.805	S	S	*	*				46.3	118	85.5	-111.9	51.2	0	0	0	111.3
214	D	45.6	Very low	40.3	Very low	142 Å²	142	125.6 Å²	125.6	76%	0.759	81%	0.808	S	S	*	*				-162.4	162.8	66.1	-75.2	-56.2	0	0	0	114
215	N	39.4	Very low	40.2	Very low	144 Å²	144	134.4 Å²	134.4	77%	0.77	82%	0.819	S	S	*	*			trans	-61.3	-178.1	-176.7	-106	-32.9	0	0	0	117.4
216	F	41.5	Very low	40.4	Very low	209 Å²	209	134.6 Å²	134.6	92%	0.917	82%	0.821	S	S	*	*			trans	93.5	119.1	169.4	-51.5	-73.5	0	0	0	114.2
217	G	39.5	Very low	40.4	Very low	67 Å²	67	126.2 Å²	126.2	69%	0.691	81%	0.812	S	S	*	*			cis	135.5	139.9	15.5	0	0	0	0	0	108.8
218	R	41.3	Very low	40.6	Very low	264 Å²	264	132.3 Å²	132.3	100%	0.996	81%	0.813	S	S	*	*			trans	81.3	131.6	-179	-51.4	-177.1	-174.5	-141.8	2.6	114.2
219	G	39.9	Very low	40.7	Very low	83 Å²	83	132.5 Å²	132.5	86%	0.856	82%	0.815	S	S	*	*			cis	152.8	151.6	14.1	0	0	0	0	0	104.9
220	G	40.1	Very low	41	Very low	71 Å²	71	132.9 Å²	132.9	73%	0.732	82%	0.819	S	S	*	*			cis	-167.5	172.3	-4.2	0	0	0	0	0	109.5
221	N	40.4	Very low	41	Very low	141 Å²	141	128 Å²	128	75%	0.754	81%	0.813	S	S	*	*			trans	40.1	125.9	154.8	-68.2	-1.7	0	0	0	121.6
222	F	42.1	Very low	41	Very low	183 Å²	183	136.2 Å²	136.2	80%	0.803	82%	0.819	S	S	*	*				-174.1	126.6	85.4	-102.4	-85.2	0	0	0	111.6
223	S	42.6	Very low	41.1	Very low	111 Å²	111	136.5 Å²	136.5	78%	0.776	82%	0.822	S	S	*	*			trans	22.1	138.5	145.4	54	0	0	0	0	120.5
224	G	41.9	Very low	41.1	Very low	70 Å²	70	133.7 Å²	133.7	72%	0.722	83%	0.828	S	S	*	*			cis	142.3	146	17.3	0	0	0	0	0	109.7
225	R	42.2	Very low	40.9	Very low	258 Å²	258	130.5 Å²	130.5	97%	0.974	83%	0.829	S	S	*	*			trans	67.7	130	176.1	-90.9	177.4	177.1	-172.2	-0.5	116.6
226	G	40.5	Very low	40.7	Very low	82 Å²	82	127.5 Å²	127.5	85%	0.845	83%	0.833	S	S	*	*			cis	124.4	124.9	16.6	0	0	0	0	0	109.3
227	G	40.8	Very low	40.7	Very low	72 Å²	72	128.3 Å²	128.3	74%	0.742	83%	0.831	S	S	*	*			trans	151.3	85.2	166.7	0	0	0	0	0	119.1
228	F	41.5	Very low	40.6	Very low	217 Å²	217	129.2 Å²	129.2	95%	0.952	84%	0.84	S	S	*	*			trans	17.3	140.2	141.6	-66.3	-87.3	0	0	0	125.2
229	G	41	Very low	40.6	Very low	83 Å²	83	120 Å²	120	86%	0.856	83%	0.827	S	S	*	*			trans	109.5	133.9	141.2	0	0	0	0	0	115.1
230	G	41.2	Very low	40.8	Very low	70 Å²	70	122.3 Å²	122.3	72%	0.722	83%	0.831	S	S	*	*			cis	164.8	138.7	1.4	0	0	0	0	0	109.9
231	S	41.1	Very low	40.9	Very low	120 Å²	120	122 Å²	122	84%	0.839	83%	0.827	S	S	*	*			trans	74.4	144.4	144.7	-57.4	0	0	0	0	123.6
232	R	40.4	Very low	41.1	Very low	251 Å²	251	122 Å²	122	95%	0.947	83%	0.828	S	S	*	*			trans	97.5	121.3	162.3	-54.9	178.6	-172.7	-168.8	2.2	114.5
233	G	41.5	Very low	41	Very low	80 Å²	80	116 Å²	116	83%	0.825	82%	0.817	S	S	*	*			cis	120.8	104.2	9.7	0	0	0	0	0	111.2
234	G	39.4	Very low	41	Very low	89 Å²	89	119.6 Å²	119.6	92%	0.918	82%	0.815	S	S	*	*			trans	83	131.8	147.8	0	0	0	0	0	119.7
235	G	40	Very low	40.9	Very low	75 Å²	75	123 Å²	123	77%	0.773	82%	0.817	S	S	*	*			trans	149.2	90.2	157.2	0	0	0	0	0	114.6
236	G	35.1	Very low	40.7	Very low	82 Å²	82	113.7 Å²	113.7	85%	0.845	80%	0.801	S	S	*	*			trans	-93.2	152.3	168.2	0	0	0	0	0	112.2
237	Y	41.9	Very low	40.7	Very low	225 Å²	225	119.6 Å²	119.6	88%	0.882	80%	0.804	S	S	*	*			trans	-147.4	127.5	163.4	46.1	-89.2	0	0	0	108.9
238	G	37.9	Very low	40.6	Very low	86 Å²	86	119.9 Å²	119.9	89%	0.887	81%	0.807	S	S	*	*			trans	-107.8	163.6	169.8	0	0	0	0	0	111.3
239	G	42	Very low	40.5	Very low	70 Å²	70	117.4 Å²	117.4	72%	0.722	80%	0.803	S	S	*	*			trans	174.3	105	169.4	0	0	0	0	0	108.4
240	S	43	Very low	40.5	Very low	133 Å²	133	121.2 Å²	121.2	93%	0.93	80%	0.804	S	S	*	*				57.8	108.9	94.3	-85.5	0	0	0	0	112.8
241	G	43	Very low	40.4	Very low	64 Å²	64	120.8 Å²	120.8	66%	0.66	80%	0.8	S	S	*	*				123.1	152	90.3	0	0	0	0	0	106.4
242	D	44	Very low	40.3	Very low	142 Å²	142	120.6 Å²	120.6	76%	0.759	80%	0.799	S	S	*	*			cis	-161.6	-176.4	7.3	-81.6	-62.1	0	0	0	107.6	Y244	D242-Y244 VanDerWaalsContact CB-OH 3.32Å; D242-Y244 WeakPolarHBondContact CB-OH 3.31Å
243	G	39.8	Very low	40	Very low	57 Å²	57	115.2 Å²	115.2	59%	0.588	79%	0.789	S	S	*	*			trans	-51	-170.8	-176	0	0	0	0	0	117.5
244	Y	42.6	Very low	39.9	Very low	185 Å²	185	120.9 Å²	120.9	73%	0.725	79%	0.791	S	S	*	*			cis	-169.4	148.9	45.5	-44.7	-88.5	0	0	0	111	D242	D242-Y244 VanDerWaalsContact CB-OH 3.32Å; D242-Y244 WeakPolarHBondContact CB-OH 3.31Å
245	N	40.3	Very low	39.6	Very low	142 Å²	142	120.5 Å²	120.5	76%	0.759	79%	0.787	S	S	*	*			trans	66.4	124.8	147.1	-51.5	-27.8	0	0	0	119.4
246	G	38.3	Very low	39.4	Very low	63 Å²	63	120.9 Å²	120.9	65%	0.649	79%	0.791	S	S	*	*				80.7	113.9	53.2	0	0	0	0	0	108.1
247	F	40.7	Very low	39.3	Very low	205 Å²	205	120.4 Å²	120.4	90%	0.899	79%	0.786	S	S	*	*				-168.1	146.1	78.5	-75.9	-81.8	0	0	0	111
248	G	38.4	Very low	38.8	Very low	78 Å²	78	113.4 Å²	113.4	80%	0.804	78%	0.782	S	S	*	*			trans	-84.3	165.7	167.3	0	0	0	0	0	112.8
249	N	39.5	Very low	38.7	Very low	165 Å²	165	114.3 Å²	114.3	88%	0.882	78%	0.775	S	S	*	*			trans	-149.4	120.6	154.5	-152.8	3.9	0	0	0	110.6
250	D	39.6	Very low	38.5	Very low	164 Å²	164	121.7 Å²	121.7	88%	0.877	78%	0.783	S	S	*	*			trans	-68.8	158.7	164.1	-107	-72	0	0	0	110.4
251	G	40.2	Very low	38.4	Very low	61 Å²	61	121.7 Å²	121.7	63%	0.629	77%	0.772	S	S	*	*			trans	153.1	91.6	160.7	0	0	0	0	0	117.5
252	S	38.7	Very low	38.1	Very low	116 Å²	116	125.9 Å²	125.9	81%	0.811	78%	0.779	S	S	*	*			trans	53.4	105.8	133.4	55.4	0	0	0	0	120.7
253	N	34.3	Very low	38	Very low	138 Å²	138	126.2 Å²	126.2	74%	0.738	77%	0.774	S	S	*	*				22.8	119.2	118.1	-156.4	25	0	0	0	117.6
254	F	38.8	Very low	37.9	Very low	199 Å²	199	126.1 Å²	126.1	87%	0.873	77%	0.773	S	S	*	*				175.5	119.7	128.9	-98.8	-72.8	0	0	0	110.8
255	G	33.7	Very low	37.4	Very low	81 Å²	81	124.1 Å²	124.1	84%	0.835	78%	0.775	S	S	*	*			trans	69.5	119.8	141.4	0	0	0	0	0	119.5
256	G	34.6	Very low	37.1	Very low	82 Å²	82	126.7 Å²	126.7	85%	0.845	78%	0.775	S	S	*	*			trans	156.6	109.8	151.7	0	0	0	0	0	116.1
257	G	34.9	Very low	37	Very low	73 Å²	73	129.9 Å²	129.9	75%	0.753	78%	0.777	S	S	*	*			trans	83.3	92	141.8	0	0	0	0	0	117	S259	G257-S259 PolarHBondContact O-N 2.83Å; G257-S259 VanDerWaalsContact O-N 3.16Å
258	G	30.7	Very low	37	Very low	78 Å²	78	126.7 Å²	126.7	80%	0.804	77%	0.77	S	S	*	*			trans	-60.6	113.7	160.3	0	0	0	0	0	110.4
259	S	35.8	Very low	36.9	Very low	104 Å²	104	132.2 Å²	132.2	73%	0.727	78%	0.775	S	S	*	*			trans	-112.9	99.8	171.3	-146.4	0	0	0	0	107.6	G257 N261	G257-S259 PolarHBondContact O-N 2.83Å; G257-S259 VanDerWaalsContact O-N 3.16Å; S259-N261 PolarHBondContact O-N 2.83Å
260	Y	37.8	Very low	36.9	Very low	226 Å²	226	129 Å²	129	89%	0.886	77%	0.765	S	S	*	*			trans	-79.2	91.8	174.5	-73.1	-88.1	0	0	0	108.9
261	N	40.4	Very low	36.7	Very low	133 Å²	133	126.4 Å²	126.4	71%	0.711	76%	0.76	S	S	*	*			trans	-123.7	76.6	164	-73.9	-34.1	0	0	0	107.9	S259	S259-N261 PolarHBondContact O-N 2.83Å
262	D	37.5	Very low	36.6	Very low	151 Å²	151	131.3 Å²	131.3	81%	0.807	77%	0.772	S	S	*	*			trans	-126.8	75.7	169.2	-149.6	-22.9	0	0	0	108.4	G264	D262-G264 PolarHBondContact O-N 2.92Å
263	F	41.3	Very low	36.5	Very low	150 Å²	150	136.5 Å²	136.5	66%	0.658	78%	0.78	S	S	*	*			trans	-80.5	108	165.2	-80.2	-77.2	0	0	0	107.6	N265	F263-N265 PolarHBondContact O-N 3.37Å
264	G	36.7	Very low	36.7	Very low	54 Å²	54	133 Å²	133	56%	0.557	78%	0.777	S	S	*	*			trans	-41.7	123.8	-171.4	0	0	0	0	0	114.8	D262 Y266	D262-G264 PolarHBondContact O-N 2.92Å; G264-Y266 PolarHBondContact O-N 2.59Å
265	N	32.8	Very low	36.8	Very low	143 Å²	143	129.1 Å²	129.1	77%	0.765	77%	0.771	S	S	*	*			trans	-57.1	107.5	164.3	-162.1	-6.3	0	0	0	109.7	F263 N267	F263-N265 PolarHBondContact O-N 3.37Å; N265-N267 VanDerWaalsContact C-N 3.29Å; N265-N267 PolarHBondContact O-N 3.16Å
266	Y	35.1	Very low	37	Very low	196 Å²	196	133.9 Å²	133.9	77%	0.769	77%	0.774	S	S	*	*			trans	-72.4	85.1	169	-87.6	-92.8	0	0	0	108.9	G264	G264-Y266 PolarHBondContact O-N 2.59Å
267	N	36	Very low	37.2	Very low	130 Å²	130	140 Å²	140	70%	0.695	78%	0.777	S	S	*	*			trans	-111.1	111.6	167.9	-138.8	-2.6	0	0	0	110.7	N265 Q269	N265-N267 VanDerWaalsContact C-N 3.29Å; N265-N267 PolarHBondContact O-N 3.16Å; N267-Q269 PolarHBondContact O-N 3.11Å; N267-Q269 VanDerWaalsContact O-N 3.17Å
268	N	39.9	Very low	37.3	Very low	138 Å²	138	140.5 Å²	140.5	74%	0.738	78%	0.783	S	S	*	*			trans	-16.3	104.2	157.7	-119.9	-55.7	0	0	0	113.7
269	Q	36.2	Very low	38.2	Very low	194 Å²	194	140.4 Å²	140.4	91%	0.907	78%	0.782	S	S	*	*			trans	-94.1	91.3	157.6	-80.7	-175.6	-29.2	0	0	107.9	N267 S271	N267-Q269 PolarHBondContact O-N 3.11Å; N267-Q269 VanDerWaalsContact O-N 3.17Å; Q269-S271 PolarHBondContact O-N 3.4Å
270	S	40.9	Very low	38.2	Very low	98 Å²	98	143 Å²	143	69%	0.685	79%	0.787	S	S	*	*			trans	-69.4	121.7	158.6	62	0	0	0	0	108.1	N272	S270-N272 PolarHBondContact O-N 3.19Å
271	S	34.4	Very low	38.5	Very low	110 Å²	110	142.1 Å²	142.1	77%	0.769	79%	0.789	S	S	*	*			trans	-45	123.5	159	47.8	0	0	0	0	110.9	Q269	Q269-S271 PolarHBondContact O-N 3.4Å
272	N	37.8	Very low	38.4	Very low	164 Å²	164	139.3 Å²	139.3	88%	0.877	79%	0.791	S	S	*	*			trans	-154.8	104.9	148.7	-120.2	15	0	0	0	110.8	S270	S270-N272 PolarHBondContact O-N 3.19Å
273	F	38.1	Very low	38.6	Very low	225 Å²	225	135.9 Å²	135.9	99%	0.987	79%	0.791	S	S	*	*			trans	-72.9	124.1	164.8	-145.7	-96.1	0	0	0	107.4
274	G	37.3	Very low	38.5	Very low	65 Å²	65	140.6 Å²	140.6	67%	0.67	81%	0.805	S	S	*	*			trans	175.5	142.5	173.5	0	0	0	0	0	112.7
275	P	41.9	Very low	38.6	Very low	116 Å²	116	143.3 Å²	143.3	75%	0.753	82%	0.815	S	S	*	*			trans	-117.8	178.9	-132.8	33	-16.7	0	0	0	115.1
276	M	36.8	Very low	39.2	Very low	181 Å²	181	142.1 Å²	142.1	89%	0.892	82%	0.818	S	S	*	*			trans	90.5	114.2	157	-52.2	-176.7	159.5	0	0	118.4
277	K	39.8	Very low	39.6	Very low	211 Å²	211	135.9 Å²	135.9	92%	0.917	81%	0.814	S	S	*	*				-166.6	133.2	109	-130.4	176.5	176.3	179.5	0	111.5
278	G	37	Very low	39.9	Very low	84 Å²	84	135.8 Å²	135.8	87%	0.866	82%	0.82	S	S	*	*			trans	-74.2	156.2	-174	0	0	0	0	0	115.2
279	G	48.4	Very low	40.1	Very low	76 Å²	76	139.7 Å²	139.7	78%	0.784	83%	0.826	S	S	*	*			trans	-129.6	116.5	164.9	0	0	0	0	0	108.8
280	N	36.5	Very low	40.3	Very low	157 Å²	157	134.2 Å²	134.2	84%	0.84	82%	0.821	S	S	*	*			trans	-81.9	115.3	-177.7	179.2	79	0	0	0	110.2
281	F	43.4	Very low	40.3	Very low	209 Å²	209	133.7 Å²	133.7	92%	0.917	83%	0.831	S	S	*	*			trans	-129.9	112.9	163.1	-89.9	-84.7	0	0	0	109.3
282	G	38.8	Very low	40.6	Very low	74 Å²	74	132.6 Å²	132.6	76%	0.763	84%	0.837	S	S	*	*			trans	-78.4	145.5	172.1	0	0	0	0	0	111.4
283	G	41.6	Very low	40.9	Very low	79 Å²	79	127.7 Å²	127.7	81%	0.814	83%	0.825	S	S	*	*			trans	-175.9	109.7	177.5	0	0	0	0	0	110.4
284	R	38.9	Very low	41	Very low	249 Å²	249	125.6 Å²	125.6	94%	0.94	82%	0.819	S	S	*	*			trans	-65.3	147	-170.2	-61.8	159.5	176.4	-169.7	-2.8	113.6
285	S	40.2	Very low	41.4	Very low	111 Å²	111	133 Å²	133	78%	0.776	83%	0.828	S	S	*	*				125.3	124.6	121.7	-161.2	0	0	0	0	117.9
286	S	45	Very low	41.5	Very low	117 Å²	117	137.1 Å²	137.1	82%	0.818	84%	0.835	S	S	*	*			trans	68.3	115.2	147.7	70.7	0	0	0	0	122.1
287	G	41.8	Very low	41.9	Very low	66 Å²	66	133.2 Å²	133.2	68%	0.68	83%	0.831	S	S	*	*			trans	156.6	105.3	143.6	0	0	0	0	0	113.9
288	P	43.9	Very low	42.1	Very low	127 Å²	127	132.8 Å²	132.8	83%	0.825	83%	0.829	S	S	*	*			trans	-115.6	131.3	166.9	35.1	-21.5	0	0	0	112.6
289	Y	43.3	Very low	42.8	Very low	221 Å²	221	134.1 Å²	134.1	87%	0.867	82%	0.822	S	S	*	*			trans	-160.1	132.8	161.2	42.2	-95.7	0	0	0	105.1
290	G	41.4	Very low	42.7	Very low	78 Å²	78	141.3 Å²	141.3	80%	0.804	83%	0.826	S	S	*	*			cis	134.2	107.4	12.8	0	0	0	0	0	108.2
291	G	40.8	Very low	43	Very low	87 Å²	87	140.4 Å²	140.4	90%	0.897	82%	0.821	S	S	*	*			trans	85.1	132.8	166.7	0	0	0	0	0	116
292	G	40	Very low	43.2	Very low	87 Å²	87	139.4 Å²	139.4	90%	0.897	82%	0.819	S	S	*	*			cis	116.5	111.7	16.7	0	0	0	0	0	110
293	G	44.4	Very low	43.3	Very low	61 Å²	61	139.7 Å²	139.7	63%	0.629	82%	0.822	S	S	*	*			trans	159.6	97	170.3	0	0	0	0	0	115.2
294	Q	40.3	Very low	43.4	Very low	182 Å²	182	138.6 Å²	138.6	85%	0.85	81%	0.811	S	S	*	*			trans	-98.1	137.4	170.3	-63.5	174.8	4	0	0	109.6
295	Y	46	Very low	43.8	Very low	220 Å²	220	137.9 Å²	137.9	86%	0.863	81%	0.81	S	S	*	*			trans	-141.1	143.3	162.1	-42.4	-78.3	0	0	0	111.5
296	F	43.8	Very low	44	Very low	203 Å²	203	136.2 Å²	136.2	89%	0.89	81%	0.81	S	S	*	*			trans	-73	157.2	-168.5	-86.5	-122.1	0	0	0	115.3
297	A	43.8	Very low	44	Very low	99 Å²	99	133.8 Å²	133.8	82%	0.818	80%	0.804	S	S	*	*				143.3	113.7	118.6	0	0	0	0	0	114.5
298	K	44.4	Very low	44.2	Very low	202 Å²	202	136.3 Å²	136.3	88%	0.878	81%	0.811	S	S	*	*			trans	-97.3	162.1	146.4	-83.3	-175.4	176.8	179.8	0	106.4
299	P	52.6	Low	44.3	Very low	111 Å²	111	135.3 Å²	135.3	72%	0.721	81%	0.807	S	S	*	*			cis	-159.1	-169.2	47.9	41.7	-17.7	0	0	0	118
300	R	45.2	Very low	44.4	Very low	228 Å²	228	130.1 Å²	130.1	86%	0.86	80%	0.803	S	S	*	*			trans	73.8	122.2	153.6	-86.6	-179.6	165.2	174.1	-4.5	118.1
301	N	42.9	Very low	44.7	Very low	138 Å²	138	131.8 Å²	131.8	74%	0.738	80%	0.802	S	S	*	*				104.1	148.7	58.3	-168.5	19.6	0	0	0	110.3
302	Q	47.5	Very low	45	Very low	187 Å²	187	132.6 Å²	132.6	87%	0.874	79%	0.794	S	S	*	*			trans	92	129.1	-175.4	-55.9	176.7	47.8	0	0	113.5
303	G	42.3	Very low	45.3	Very low	80 Å²	80	132.7 Å²	132.7	83%	0.825	78%	0.781	S	S	*	*			cis	160.8	153.6	4.7	0	0	0	0	0	109.4
304	G	42.3	Very low	45.6	Very low	56 Å²	56	139.7 Å²	139.7	58%	0.577	79%	0.79	S	S	*	*			trans	125.2	104.7	156.2	0	0	0	0	0	116.4
305	Y	47.8	Very low	46.1	Very low	235 Å²	235	134.5 Å²	134.5	92%	0.922	79%	0.786	S	S	*	*				70.7	132.3	88.7	74.3	-111.2	0	0	0	112.5
306	G	44.4	Very low	46.3	Very low	76 Å²	76	130.4 Å²	130.4	78%	0.784	79%	0.789	S	S	*	*			cis	171.2	167.7	0.3	0	0	0	0	0	110.7
307	G	44.1	Very low	46.9	Very low	66 Å²	66	124.7 Å²	124.7	68%	0.68	79%	0.787	S	S	*	*			trans	83.4	113.4	153.9	0	0	0	0	0	118.2
308	S	47.2	Very low	47.5	Very low	119 Å²	119	130.9 Å²	130.9	83%	0.832	79%	0.789	S	S	*	*				76	138.6	77.2	63	0	0	0	0	112.6
309	S	45.6	Very low	48	Very low	106 Å²	106	131.5 Å²	131.5	74%	0.741	79%	0.786	S	S	*	*			cis	168.5	146.3	1.4	41.5	0	0	0	0	106.1
310	S	46.5	Very low	48.6	Very low	112 Å²	112	139.6 Å²	139.6	78%	0.783	81%	0.811	S	S	*	*			trans	135.8	118.8	155.3	66.1	0	0	0	0	111.6
311	S	47.2	Very low	48.7	Very low	113 Å²	113	135.2 Å²	135.2	79%	0.79	81%	0.808	S	S	*	*			cis	78.9	102.8	39.5	79.1	0	0	0	0	116.4
312	S	45.9	Very low	49	Very low	104 Å²	104	135 Å²	135	73%	0.727	81%	0.812	S	S	*	*			trans	164.7	113.2	146.8	51.6	0	0	0	0	108.7
313	S	48.1	Very low	49.1	Very low	88 Å²	88	132.1 Å²	132.1	62%	0.615	81%	0.808	S	S	*	*				46.1	129.3	80	-158.2	0	0	0	0	111.7
314	Y	50.2	Low	49.5	Very low	208 Å²	208	135.2 Å²	135.2	82%	0.816	81%	0.807	S	S	*	*				-167.2	146.9	63.3	-58.3	-84.3	0	0	0	110
315	G	49.4	Very low	50	Low	74 Å²	74	140.1 Å²	140.1	76%	0.763	82%	0.822	S	S	*	*				92.3	101.5	109.6	0	0	0	0	0	114.8
316	S	51.1	Low	50.1	Low	133 Å²	133	133.8 Å²	133.8	93%	0.93	82%	0.815	S	S	*	*				59.7	112.5	91.7	171.7	0	0	0	0	115.6
317	G	56	Low	50.5	Low	83 Å²	83	137.9 Å²	137.9	86%	0.856	82%	0.817	S	S	*	*			trans	-175.9	115.5	165.3	0	0	0	0	0	112.8
318	R	56.4	Low	51	Low	229 Å²	229	143.5 Å²	143.5	86%	0.864	83%	0.828	S	S	*	*			trans	-113.5	158.9	-169.5	-161.4	-167.2	-85.5	-173	-6.7	109
319	R	55.3	Low	51.3	Low	215 Å²	215	145.5 Å²	145.5	81%	0.811	83%	0.827	S	S	*	*			trans	87.4	130.6	167.1	-56	174.2	164.4	173	-5.6	114.1
320	F	64.4	Low	51.9	Low	281 Å²	281	149.1 Å²	149.1	100%	1.232	84%	0.835	S	S	*	*			cis	-119.5	0	39.4	-73.1	-95.4	0	0	0	115.1

Retrieved 320 of 320 residues in 620.7 ms (Link to these results)

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